0 B11R0.148 C#CCCCCCCCC(O)=O Amb22388895 [0,0,0,0,0,0|0,0,2]=2 1 B11R0.148 CC(=O)OCCCCCCC=O Amb22364796 [0,0,0,0,0,0|3,0,1]=4 2 B11R0.148 CC(C)CCCCCCCCO Amb22055759 [0,0,0,0,0,0|3,0,1]=4 3 B11R0.148 CCCC=CCCCCC(O)=O Amb24063196 [0,0,0,0,0,0|0,0,2]=2 4 B11R0.148 CCCCC=CCCCC(O)=O Amb24062906 [0,0,0,0,0,0|0,0,2]=2 5 B11R0.148 CCCCCC=CCCC(O)=O Amb24079160 [0,0,0,0,0,0|0,0,2]=2 6 B11R0.148 CCCCCCCCC=C(C)C Amb22899462 [0,0,0,0,0,0|2,0,1]=3 7 B11R0.148 CCCCCCCCCC(C)C Amb22043228 [0,0,0,0,0,0|2,0,1]=3 8 B11R0.148 CCCCCCCCCC([O-])=O Amb22733551 [0,0,0,0,0,0|0,0,1]=1 9 B11R0.148 CCCCCCCCCN(C)C Amb22360719 [0,0,0,0,0,0|3,0,0]=3 10 B11R0.148 CCCCCCCCC[13C](O)=O Amb22353426 [0,0,0,0,0,0|0,0,0]=0 11 B11R0.148 CCCCCCCCC[C@H](C)O Amb20240616 [0,0,0,0,0,0|1,0,1]=2 12 B11R0.148 CCCCCCCCNC(=O)C Amb10562300 [0,0,0,0,0,0|2,0,0]=2 13 B11R0.148 CCCCCCCCNC(=S)N Amb1152183 [0,0,0,0,0,0|2,1,0]=3 14 B11R0.148 CCCCCCCCNC(N)=N Amb22338463 [0,0,0,0,0,0|3,0,0]=3 15 B11R0.148 CCCCCCCCOC([S-])=S Amb22334140 [0,0,0,0,0,0|1,2,0]=3 16 B11R0.148 CCCCCCCC[13CH2][13C](O)=O Amb22054843 [0,0,0,0,0,0|0,0,0]=0 17 B11R0.148 CCCCCCCNCC(O)=O Amb19373457 [0,0,0,0,0,0|1,0,0]=1 18 B11R0.148 CCCCCCC\C=C\B(O)O Amb2456042 [0,0,0,0,0,0|1,0,3]=4 19 B11R0.148 CCCCCC\C=C\CC(=O)O Amb10807476 [0,0,0,0,0,0|0,0,2]=2 20 B11R0.148 CCCCC\C=C\CCC(=O)O Amb17594266 [0,0,0,0,0,0|0,0,2]=2 21 B11R0.148 CCCCOCCOCC(C)O Amb18808894 [0,0,0,0,0,0|3,0,1]=4 22 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [0,0,0,0,0,0|1,0,0]=1 23 B11R0.148 CCC\C=C\CCCCC(O)=O Amb22411539 [0,0,0,0,0,0|0,0,2]=2 24 B11R0.148 CCNCCOCCCC(O)=O Amb18110845 [0,0,0,0,0,0|2,0,0]=2 25 B11R0.148 CCOCCCNCCC(=S)N Amb17315344 [0,0,0,0,0,0|3,1,0]=4 26 B11R0.148 CN(C)CCCCCCCCN Amb24117500 [0,0,0,0,0,0|4,0,0]=4 27 B11R0.148 CN(C)CCCCCCCCO Amb22733872 [0,0,0,0,0,0|4,0,0]=4 28 B11R0.148 N#CCCCSCCCC(=O)O Amb17504253 [0,0,0,0,0,0|2,0,1]=3 29 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [0,0,0,0,0,0|2,0,0]=2 30 B11R0.148 NCCOCCOCCC(O)=O Amb18111401 [0,0,0,0,0,0|3,0,0]=3 31 B11R0.148 OC(=O)CCCCCCCC=O Amb17939414 [0,0,0,0,0,0|1,0,1]=2 32 B11R0.148 OC(=O)CCOCCOCCBr Amb24057758 [0,0,0,0,0,0|3,0,0]=3 33 B11R0.148 OC(=O)CCOCCOCCS Amb24058079 [0,0,0,0,0,0|3,0,0]=3 34 B11R0.148 OCCOCCOCCC(O)=O Amb24057823 [0,0,0,0,0,0|3,0,0]=3 35 B11R0.148 [13CH3]CCCCCCCCC(O)=O Amb22367552 [0,0,0,0,0,0|0,0,0]=0 36 B11R0.148 [N-]=[N+]=NCCCCCCC(O)=O Amb22407009 [0,0,0,0,0,0|3,0,0]=3 37 B10R0.4 C#CCSCCCCC(=O)O Amb17503766 [1,0,0,0,0,0|1,0,2]=4 38 B10R0.4 CC(=O)NCCCCCCO Amb24113372 [1,0,0,0,0,0|3,0,0]=4 39 B10R0.4 CC(=O)OCCCCCCBr Amb24063174 [1,0,0,0,0,0|3,0,0]=4 40 B10R0.4 CCC#CCCCCC(C)=O Amb24766880 [1,0,0,0,0,0|1,0,2]=4 41 B10R0.4 CCCCCC#CCC(O)=O Amb25384153 [1,0,0,0,0,0|0,0,2]=3 42 B10R0.4 CCCCCCCCB(O)O Amb2456044 [1,0,0,0,0,0|1,0,1]=3 43 B10R0.4 CCCCCCCCC(C)Br Amb22731670 [1,0,0,0,0,0|2,0,1]=4 44 B10R0.4 CCCCCCCCC(C)C Amb20241015 [1,0,0,0,0,0|2,0,1]=4 45 B10R0.4 CCCCCCCCC([O-])=O Amb22729912 [1,0,0,0,0,0|0,0,1]=2 46 B10R0.4 CCCCCCCCS(=O)C Amb10553782 [1,0,0,0,0,0|2,0,0]=3 47 B10R0.4 CCCCCCCC[C@@H](C)O Amb19929333 [1,0,0,0,0,0|1,0,1]=3 48 B10R0.4 CCCCCCCC[C@@H](O)C Amb10068518 [1,0,0,0,0,0|1,0,1]=3 49 B10R0.4 CCCCCCCC[N+]([O-])=O Amb17672610 [1,0,0,0,0,0|1,0,1]=3 50 B10R0.4 CCCCCCCC[S@@+](C)[O-] Amb17779184 [1,0,0,0,0,0|2,0,1]=4 51 B10R0.4 CCCCCCCC[SiH](C)C Amb19893982 [1,0,0,0,0,0|2,1,0]=4 52 B10R0.4 CCCCCCCC[SiH](Cl)Cl Amb19893977 [1,0,0,0,0,0|2,1,0]=4 53 B10R0.4 CCCCCCCC[Sn](O)=O Amb22729697 [1,0,0,0,0,0|1,0,0]=2 54 B10R0.4 CCCCCCCNC(N)=O Amb17939018 [1,0,0,0,0,0|2,0,0]=3 55 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [1,0,0,0,0,0|2,0,0]=3 56 B10R0.4 CCCCCCCOC([S-])=S Amb22334105 [1,0,0,0,0,0|1,2,0]=4 57 B10R0.4 CCCCCCCSC(N)=N Amb22487432 [1,0,0,0,0,0|3,0,0]=4 58 B10R0.4 CCCCCCNCC(=C)C Amb17308745 [1,0,0,0,0,0|3,0,0]=4 59 B10R0.4 CCCCCC\C=C\C(C)=O Amb22052629 [1,0,0,0,0,0|1,0,2]=4 60 B10R0.4 CCCCC\C=C\CC(=O)O Amb17593915 [1,0,0,0,0,0|0,0,2]=3 61 B10R0.4 CCCNCCCOC(C)=O Amb18924647 [1,0,0,0,0,0|3,0,0]=4 62 B10R0.4 CCNCCOCCC(C)=O Amb18630736 [1,0,0,0,0,0|3,0,0]=4 63 B10R0.4 CCOCCCC#CC(O)=O Amb25384938 [1,0,0,0,0,0|1,0,2]=4 64 B10R0.4 CCOCCCCCC(O)=O Amb22234334 [1,0,0,0,0,0|1,0,0]=2 65 B10R0.4 CNCCOCCCC(O)=O Amb18106300 [1,0,0,0,0,0|2,0,0]=3 66 B10R0.4 COCCCOCCC(O)=O Amb18180046 [1,0,0,0,0,0|2,0,0]=3 67 B10R0.4 N#CCCNCCCC(=O)O Amb17315317 [1,0,0,0,0,0|2,0,1]=4 68 B10R0.4 N#CCCSCCCC(=O)O Amb17502410 [1,0,0,0,0,0|2,0,1]=4 69 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [1,0,0,0,0,0|1,0,0]=2 70 B10R0.4 NCCCCCCCC(O)=O Amb19929586 [1,0,0,0,0,0|1,0,0]=2 71 B10R0.4 NCCCCCCNC(O)=O Amb22494605 [1,0,0,0,0,0|2,0,0]=3 72 B10R0.4 NCCCOCCCC(O)=O Amb18111568 [1,0,0,0,0,0|2,0,0]=3 73 B10R0.4 NCCCSCCCC(=O)O Amb17500719 [1,0,0,0,0,0|2,0,0]=3 74 B10R0.4 NCCOCCOCC(=O)O Amb10602483 [1,0,0,0,0,0|3,0,0]=4 75 B10R0.4 NCCOCCOCC(=O)O Amb16232535 [1,0,0,0,0,0|3,0,0]=4 76 B10R0.4 OC(=O)C#CCCCCCCl Amb25386237 [1,0,0,0,0,0|1,0,2]=4 77 B10R0.4 OC(=O)CCCCCCCS Amb22353760 [1,0,0,0,0,0|1,0,0]=2 78 B10R0.4 OCC#CCCCCC(O)=O Amb25385233 [1,0,0,0,0,0|1,0,2]=4 79 B10R0.4 OCCCSCCCC(=O)O Amb17502860 [1,0,0,0,0,0|2,0,0]=3 80 B10R0.4 OCCOCCOCC(O)=O Amb24057830 [1,0,0,0,0,0|3,0,0]=4 81 B10R0.4 [N-]=[N+]=NCCCCCC(O)=O Amb19516608 [1,0,0,0,0,0|3,0,0]=4 82 B10R0.4 [O-]C(=O)CCCCCCCBr Amb22015198 [1,0,0,0,0,0|1,0,1]=3 83 B10R0.71 C=CCCCCCCCC=C Amb22729808 [1,0,0,0,0,0|1,0,2]=4 84 B10R0.71 C=CCCCCCCCC=O Amb22734770 [1,0,0,0,0,0|0,0,2]=3 85 B10R0.71 C=CCCCCCCCCCl Amb22898754 [1,0,0,0,0,0|2,0,0]=3 86 B10R0.71 CCCCCCCC#CCO Amb17774678 [1,0,0,0,0,0|0,0,3]=4 87 B10R0.71 CCCCCCCCCNC Amb10609826 [1,0,0,0,0,0|2,0,0]=3 88 B10R0.71 CCCCCCCCCOC Amb2582537 [1,0,0,0,0,0|2,0,0]=3 89 B10R0.71 CCCCCCCCCSC Amb22230926 [1,0,0,0,0,0|2,0,0]=3 90 B10R0.71 CCCCCCCCC[Mg]Br Amb22000598 [1,0,0,0,0,0|2,0,0]=3 91 B10R0.71 CCCCCCCCC[Zn]Br Amb22000508 [1,0,0,0,0,0|2,0,0]=3 92 B10R0.71 CCCCCCCCOC=O Amb22231360 [1,0,0,0,0,0|1,0,0]=2 93 B10R0.71 CCCCCCCCOCBr Amb22733274 [1,0,0,0,0,0|2,0,1]=4 94 B10R0.71 CCCCCCCCOCCl Amb22230404 [1,0,0,0,0,0|2,0,1]=4 95 B10R0.71 CCCCCCCCSC#N Amb17939432 [1,0,0,0,0,0|2,0,1]=4 96 B10R0.71 CCCCCCCCSCC Amb17672979 [1,0,0,0,0,0|2,0,1]=4 97 B10R0.71 CCCCCCC\C=C/CO Amb10563790 [1,0,0,0,0,0|0,0,3]=4 98 B10R0.71 CCCCCCNCCCN Amb17315272 [1,0,0,0,0,0|2,0,1]=4 99 B10R0.71 CCCCCC\C=C\CCO Amb22641690 [1,0,0,0,0,0|0,0,3]=4 100 B10R0.71 CCCCCNCCCCC Amb22359459 [1,0,0,0,0,0|2,0,1]=4 101 B10R0.71 CCCCCNCCCCC Amb22366791 [1,0,0,0,0,0|2,0,1]=4 102 B10R0.71 CCCCCSCCCCN Amb17500943 [1,0,0,0,0,0|2,0,1]=4 103 B10R0.71 CCCCC\C=C\CCC=O Amb10071527 [1,0,0,0,0,0|0,0,2]=3 104 B10R0.71 CCCCC\C=C\CCCO Amb10807437 [1,0,0,0,0,0|0,0,3]=4 105 B10R0.71 CCCCNCCCCCO Amb17334477 [1,0,0,0,0,0|1,0,1]=3 106 B10R0.71 CCNCCCNCCCO Amb20171980 [1,0,0,0,0,0|2,0,1]=4 107 B10R0.71 CC\C=C\CCCCCCO Amb22231682 [1,0,0,0,0,0|0,0,3]=4 108 B10R0.71 COCCCCCCCCO Amb17617052 [1,0,0,0,0,0|1,0,1]=3 109 B10R0.71 COCCCNCCCCO Amb17334530 [1,0,0,0,0,0|2,0,1]=4 110 B10R0.71 ICCCCCCCCCI Amb20242392 [1,0,0,0,0,0|2,0,1]=4 111 B10R0.71 N#CCCCCCCCCO Amb22641582 [1,0,0,0,0,0|1,0,2]=4 112 B10R0.71 O=CCCCCC\C=C/CC Amb10807429 [1,0,0,0,0,0|0,0,2]=3 113 B10R0.71 OCCCCCCCCC#C Amb16231465 [1,0,0,0,0,0|0,0,3]=4 114 B10R0.71 OCCCCCCCCCCl Amb16234125 [1,0,0,0,0,0|1,0,1]=3 115 B10R0.71 OCCCCNCCCCO Amb21858890 [1,0,0,0,0,0|2,0,1]=4 116 B10R0.71 OCCCCOCCCCO Amb21960124 [1,0,0,0,0,0|2,0,1]=4 117 B12R0.4 CC(=O)CC(=O)OCCCCCC Amb22230211 [0,1,0,0,0,0|2,0,1]=4 118 B12R0.4 CCCCCCCC(=O)CC(O)=O Amb24273367 [0,1,0,0,0,0|0,0,1]=2 119 B12R0.4 CCCCCCCC(C)OC(C)=O Amb22734609 [0,1,0,0,0,0|2,0,0]=3 120 B12R0.4 CCCCCCCC(O)CC(O)=O Amb19071697 [0,1,0,0,0,0|0,0,0]=1 121 B12R0.4 CCCCCCOC(C)NC(C)=O Amb24096324 [0,1,0,0,0,0|3,0,0]=4 122 B12R0.4 CCCCC\C=C\C(O)CC(O)=O Amb22831933 [0,1,0,0,0,0|0,0,2]=3 123 B12R0.4 CC\C=C/CCCC(O)CC(O)=O Amb22831934 [0,1,0,0,0,0|0,0,2]=3 124 B12R0.119 CCCCCCCCCP(=O)(C)C Amb16204351 [0,1,0,0,0,0|2,0,0]=3 125 B12R0.119 CCCCCCCCCP(O)(O)=O Amb22388781 [0,1,0,0,0,0|1,0,0]=2 126 B12R0.119 CCCCCCCCCS(=O)(=O)Cl Amb22387375 [0,1,0,0,0,0|1,0,1]=3 127 B12R0.119 CCCCCCCCC[Si](Cl)(Cl)Cl Amb22732053 [0,1,0,0,0,0|2,1,0]=4 128 B12R0.119 CCCCCCCCOS(C)(=O)=O Amb25311967 [0,1,0,0,0,0|2,0,1]=4 129 B12R0.119 CCCCCCCCOS([O-])(=O)=O Amb22047379 [0,1,0,0,0,0|2,0,1]=4 130 B12R0.119 CCCCCCCCSS(=O)(=O)C Amb17618843 [0,1,0,0,0,0|2,0,1]=4 131 B12R0.119 [2H]C([2H])(O)CCCCCCCCC Amb21928615 [0,1,0,0,0,0|1,0,1]=3 132 B12R0.184 CCC(=O)NCCCCCC(=O)O Amb1137874 [0,1,0,0,0,0|1,0,1]=3 133 B12R0.184 ClCC(=O)NCCCCCC(=O)O Amb2282836 [0,1,0,0,0,0|2,0,1]=4 134 B12R0.233 CCCCCC(C)CCCC(O)=O Amb24062978 [0,1,0,0,0,0|0,0,0]=1 135 B12R0.233 CCCCCC(CCCC(C)C)C Amb10069381 [0,1,0,0,0,0|2,0,1]=4 136 B12R0.233 CCCCCC(O)CCCC([O-])=O Amb22352105 [0,1,0,0,0,0|0,0,1]=2 137 B12R0.233 CCCCNC(=O)CCCC(=O)O Amb1837519 [0,1,0,0,0,0|1,0,1]=3 138 B12R0.233 CCCCNC(=O)COCC(=O)O Amb1888825 [0,1,0,0,0,0|2,0,1]=4 139 B12R0.233 CCCSCC(=O)NCCC(O)=O Amb24769289 [0,1,0,0,0,0|2,0,1]=4 140 B12R0.233 CSCCCC(=O)NCCC(O)=O Amb18411874 [0,1,0,0,0,0|2,0,1]=4 141 B12R0.234 C=CCCCCCCCCC(=O)[O-] Amb10843808 [0,1,0,0,0,0|0,0,2]=3 142 B12R0.234 C=CCCCCCCCCC(O)=O Amb22353389 [0,1,0,0,0,0|0,0,1]=2 143 B12R0.234 C=CCCCCCCCCC(O)=O Amb22731323 [0,1,0,0,0,0|0,0,1]=2 144 B12R0.234 CC(=O)NCCCCNCCCN Amb22731369 [0,1,0,0,0,0|3,0,0]=4 145 B12R0.234 CC(=O)NCCCNCCCCN Amb22641893 [0,1,0,0,0,0|3,0,0]=4 146 B12R0.234 CC(=O)OCCCCCCCC=C Amb22733550 [0,1,0,0,0,0|1,0,2]=4 147 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [0,1,0,0,0,0|2,0,0]=3 148 B12R0.234 CC(C)CCCCCCCCCO Amb22055860 [0,1,0,0,0,0|2,0,1]=4 149 B12R0.234 CCCCCCCC/C=C/C(O)=O Amb17942922 [0,1,0,0,0,0|0,0,1]=2 150 B12R0.234 CCCCCCCCCCB(O)O Amb19958787 [0,1,0,0,0,0|1,0,1]=3 151 B12R0.234 CCCCCCCCCCC(C)Br Amb22338800 [0,1,0,0,0,0|2,0,1]=4 152 B12R0.234 CCCCCCCCCCC(C)C Amb22228876 [0,1,0,0,0,0|2,0,1]=4 153 B12R0.234 CCCCCCCCCC[SiH](C)C Amb19893766 [0,1,0,0,0,0|2,1,0]=4 154 B12R0.234 CCCCCCCCCOC(=O)Cl Amb22732385 [0,1,0,0,0,0|1,0,0]=2 155 B12R0.234 CCCCCCCCCOC([S-])=S Amb19748280 [0,1,0,0,0,0|0,2,0]=3 156 B12R0.234 CCCCCCC\C=C\CC(C)=O Amb21963229 [0,1,0,0,0,0|1,0,1]=3 157 B12R0.234 CCCCCC\C=C\COC(C)=O Amb22231667 [0,1,0,0,0,0|1,0,2]=4 158 B12R0.234 CC\C=C/CCCCCOC(C)=O Amb22734451 [0,1,0,0,0,0|1,0,2]=4 159 B12R0.234 CNCCOCCOCCC(O)=O Amb24057901 [0,1,0,0,0,0|2,0,0]=3 160 B12R0.234 COCCCOCCCOC(C)=O Amb22347959 [0,1,0,0,0,0|3,0,0]=4 161 B12R0.234 COCCOCCOCCC(=O)O Amb16184341 [0,1,0,0,0,0|2,0,0]=3 162 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [0,1,0,0,0,0|0,0,0]=1 163 B12R0.234 NCCOCCOCCCC(=O)O Amb16184328 [0,1,0,0,0,0|2,0,0]=3 164 B12R0.234 NCCOCCSCCCC(=O)O Amb17502011 [0,1,0,0,0,0|2,0,0]=3 165 B12R0.234 OCCOCCOCCC[Si](O)=O Amb22351667 [0,1,0,0,0,0|2,1,0]=4 166 B12R0.248 CCCCCCCCC[14C](=O)O[Na] Amb22352051 [0,1,0,0,0,0|0,0,0]=1 167 B12R0.248 CCCCCCCCC[C@@H](O)CCl Amb22736721 [0,1,0,0,0,0|1,0,1]=3 168 B12R0.248 CCCCCCCCC[C@H](O)CCl Amb22736722 [0,1,0,0,0,0|1,0,1]=3 169 B12R0.248 CCCCCCCCC\C(\N)=N\O Amb19046143 [0,1,0,0,0,0|1,0,0]=2 170 B12R0.248 CCCCCCCCNC(=O)CBr Amb17329848 [0,1,0,0,0,0|2,0,0]=3 171 B12R0.248 CCCCCCCCNC(=O)CN Amb24115163 [0,1,0,0,0,0|2,0,0]=3 172 B12R0.248 CCCCCCCCOC(=O)CS Amb22735097 [0,1,0,0,0,0|1,1,0]=3 173 B12R0.248 CCCCCCCCOC(=O)C[NH3+] Amb22049491 [0,1,0,0,0,0|2,0,0]=3 174 B12R0.248 CCCCCCCCSC(=S)NN Amb10553164 [0,1,0,0,0,0|2,1,0]=4 175 B12R0.248 CCCCC\C=C/CCC(=O)OC Amb24093816 [0,1,0,0,0,0|0,0,2]=3 176 B12R0.248 CCCCOCCCNC(=O)CBr Amb17329849 [0,1,0,0,0,0|3,0,0]=4 177 B12R0.248 CCCCOCCCNC(=O)CN Amb24115103 [0,1,0,0,0,0|3,0,0]=4 178 B12R0.248 CNCCCCCCCC(=O)OC Amb24331961 [0,1,0,0,0,0|1,0,0]=2 179 B12R0.248 COC(=O)CCCOCCNCC Amb18107249 [0,1,0,0,0,0|2,0,0]=3 180 B12R0.248 NCCCCSCCCC(=O)OC Amb17500973 [0,1,0,0,0,0|2,0,0]=3 181 B12R0.248 OCCCCCCCCC(=O)OC Amb17616943 [0,1,0,0,0,0|1,0,0]=2 182 B12R0.248 OCCCCCCCCC(CO)O Amb10069452 [0,1,0,0,0,0|1,0,2]=4 183 B12R0.251 CCCCCCCCC(=C(F)F)F Amb10840896 [0,1,0,0,0,0|2,0,1]=4 184 B12R0.251 CCCCCCCCC(Br)C(O)=O Amb22347926 [0,1,0,0,0,0|0,0,0]=1 185 B12R0.251 CCCCCCCCC(C)C(O)=O Amb19058533 [0,1,0,0,0,0|0,0,0]=1 186 B12R0.251 CCCCCCCCN(C)C(C)=O Amb24096791 [0,1,0,0,0,0|2,0,0]=3 187 B12R0.251 CCCCCCCC[C@@H](N)C(O)=O Amb22745440 [0,1,0,0,0,0|0,0,0]=1 188 B12R0.251 CCCCCCCOC(C(=O)O)C Amb2445106 [0,1,0,0,0,0|1,0,0]=2 189 B12R0.251 CCCCCCSC[C@H](N)C(O)=O Amb22451174 [0,1,0,0,0,0|1,0,0]=2 190 B12R0.255 CCCCCCC(Br)CCC(N)=O Amb24065437 [0,1,0,0,0,0|1,0,0]=2 191 B12R0.255 CCCCCCC(O)CCC(O)=O Amb19071689 [0,1,0,0,0,0|0,0,0]=1 192 B12R0.255 CCCCCCC(O)CCC([O-])=O Amb19149307 [0,1,0,0,0,0|0,0,1]=2 193 B12R0.255 CCCCCNC(=O)CCC(=O)Cl Amb17143340 [0,1,0,0,0,0|2,0,1]=4 194 B12R0.255 CCCCCNC(=O)CCC(=O)N Amb17143033 [0,1,0,0,0,0|2,0,1]=4 195 B12R0.255 CCCCOCC(O)CNC(C)=O Amb24072149 [0,1,0,0,0,0|3,0,0]=4 196 B12R0.255 COCCCNC(=O)CCC(=O)O Amb2102010 [0,1,0,0,0,0|2,0,1]=4 197 B12R0.255 CSCCCCC(=O)NCC(O)=O Amb24769713 [0,1,0,0,0,0|2,0,1]=4 198 B12R0.255 CSCCCNC(=O)CCC(O)=O Amb24768850 [0,1,0,0,0,0|2,0,1]=4 199 B12R0.268 C=C(F)CCCCCCCC(O)=O Amb22641501 [0,1,0,0,0,0|0,0,2]=3 200 B12R0.268 CC(C)CCCCCCCC(O)=O Amb24117911 [0,1,0,0,0,0|0,0,0]=1 201 B12R0.268 OC(=O)CCCCCCCC(O)=O Amb22336282 [0,1,0,0,0,0|1,0,1]=3 202 B12R0.268 [O-]C(=O)CCCCCCCC(=O)[O-] Amb10559705 [0,1,0,0,0,0|1,0,2]=4 203 B12R0.277 CCCC(=O)NCCSCC(O)=O Amb24769295 [0,1,0,0,0,0|2,0,1]=4 204 B12R0.277 CSCC(=O)NCCCCC(O)=O Amb24768858 [0,1,0,0,0,0|2,0,1]=4 205 B12R1.7 CCCC#CCC1CCC(=O)O1 Amb22172847 [0,0,0,1,0,0|0,0,2]=3 206 B12R1.7 CCCCCCC1NC(=O)CS1 Amb22442619 [0,0,0,1,0,0|2,0,0]=3 207 B12R1.7 CCCCCC[C@@H]1CCC(=O)O1 Amb18511855 [0,0,0,1,0,0|0,0,0]=1 208 B12R1.7 CC\C=C/CCC1CCC(=O)O1 Amb22353125 [0,0,0,1,0,0|0,0,2]=3 209 B12R1.28 CC#CCCC1CC(=O)CCC1 Amb25767922 [0,0,0,1,0,0|1,0,2]=4 210 B12R1.28 CCCCNC=1CCCC(=O)C1 Amb25258387 [0,0,0,1,0,0|2,0,1]=4 211 B12R1.28 CC\C=C/CC1CCCC(=O)O1 Amb21520399 [0,0,0,1,0,0|0,0,2]=3 212 B12R1.28 CC\C=C\CC1CCCC(=O)O1 Amb25227687 [0,0,0,1,0,0|0,0,2]=3 213 B12R1.28 C\C=C\CCC1CCCC(=O)O1 Amb22731235 [0,0,0,1,0,0|0,0,2]=3 214 B12R1.75 C=CC1CCCCC1CC(O)=O Amb24423935 [0,0,0,1,0,0|0,0,2]=3 215 B12R1.75 C=C[C@H]1CCCC[C@@H]1CC(O)=O Amb24617762 [0,0,0,1,0,0|0,0,2]=3 216 B12R1.75 CC(=C)CC1CCCCC1CO Amb25158150 [0,0,0,1,0,0|3,0,0]=4 217 B12R1.75 CC(=O)CC/1CCCC\C1=C/C Amb25066362 [0,0,0,1,0,0|1,0,2]=4 218 B12R1.75 CC(=O)CC1CCCCC1C=O Amb18647006 [0,0,0,1,0,0|2,0,1]=4 219 B12R1.75 CC(=O)CC1NCCCC1OC Amb18647523 [0,0,0,1,0,0|3,0,0]=4 220 B12R1.75 CC(=O)CN1CCCCC1CO Amb18806940 [0,0,0,1,0,0|3,0,0]=4 221 B12R1.75 CC(=O)C[C@@H]1NCCC[C@H]1OC Amb24627940 [0,0,0,1,0,0|3,0,0]=4 222 B12R1.75 CC(=O)C[C@H]1NCCC[C@@H]1OC Amb24519510 [0,0,0,1,0,0|3,0,0]=4 223 B12R1.75 CC(=O)C[C@H]1NCCC[C@H]1OC Amb24519289 [0,0,0,1,0,0|3,0,0]=4 224 B12R1.75 CC(=O)NC1CCCCC1CBr Amb25036201 [0,0,0,1,0,0|3,0,0]=4 225 B12R1.75 CC(=O)NC1CCCCC1CCl Amb25036202 [0,0,0,1,0,0|3,0,0]=4 226 B12R1.75 CC(=O)N[C@@H]1CCCC[C@H]1CO Amb25216727 [0,0,0,1,0,0|3,0,0]=4 227 B12R1.75 CC(=O)OC1CCCCC1CN Amb25159282 [0,0,0,1,0,0|3,0,0]=4 228 B12R1.75 CC(=O)OC1CCCC[C@H]1CN Amb25152601 [0,0,0,1,0,0|3,0,0]=4 229 B12R1.75 CC(N)CC1CCCCC1CC Amb24428578 [0,0,0,1,0,0|2,0,1]=4 230 B12R1.75 CC(O)CC1CCCCC1OC Amb24403815 [0,0,0,1,0,0|2,0,1]=4 231 B12R1.75 CC(O)CC1CCCCN1CC Amb25057829 [0,0,0,1,0,0|2,0,1]=4 232 B12R1.75 CC(O)CN1CCCCC1CC Amb18794118 [0,0,0,1,0,0|2,0,1]=4 233 B12R1.75 CC(O)C[C@H]1CCCC[C@@H]1OC Amb25333413 [0,0,0,1,0,0|2,0,1]=4 234 B12R1.75 CCC1=CCCCC1CC(O)=O Amb25363222 [0,0,0,1,0,0|0,0,2]=3 235 B12R1.75 CCC1CCCCC1=CC(O)=O Amb25152411 [0,0,0,1,0,0|0,0,2]=3 236 B12R1.75 CCC1CCCCC1CC(O)=O Amb25152261 [0,0,0,1,0,0|0,0,0]=1 237 B12R1.75 CCC1CCCCC1NC(C)=N Amb25712483 [0,0,0,1,0,0|3,0,0]=4 238 B12R1.75 CCC1CCCCC1NC(N)=N Amb18801548 [0,0,0,1,0,0|3,0,0]=4 239 B12R1.75 CCC1CCCCC1NC(N)=O Amb18801890 [0,0,0,1,0,0|2,0,0]=3 240 B12R1.75 CCC1CCCCC1NC(N)=S Amb19058801 [0,0,0,1,0,0|2,1,0]=4 241 B12R1.75 CCC1CCCCN1CC(=C)Cl Amb24354155 [0,0,0,1,0,0|3,0,0]=4 242 B12R1.75 CCC1CCCCN1CC(=O)Cl Amb17143064 [0,0,0,1,0,0|2,0,0]=3 243 B12R1.75 CCC1CCCCN1CC(=O)N Amb17142913 [0,0,0,1,0,0|2,0,0]=3 244 B12R1.75 CCC1CNCCC1CC(=O)Cl Amb24398670 [0,0,0,1,0,0|2,0,0]=3 245 B12R1.75 CCC1COCCN1CC(N)=O Amb18802914 [0,0,0,1,0,0|3,0,0]=4 246 B12R1.75 CCC1NCCCC1CC(O)=O Amb24753781 [0,0,0,1,0,0|1,0,0]=2 247 B12R1.75 CCN1CCCCC1CC(O)=O Amb18979527 [0,0,0,1,0,0|1,0,0]=2 248 B12R1.75 CC[C@@H]1NCCC[C@H]1CC(O)=O Amb18198537 [0,0,0,1,0,0|1,0,0]=2 249 B12R1.75 CNC1CCCCC1CC(C)=C Amb25781418 [0,0,0,1,0,0|3,0,0]=4 250 B12R1.75 CNC1CCCCC1NC(C)=O Amb21862533 [0,0,0,1,0,0|3,0,0]=4 251 B12R1.75 COC1CCCCC1=CC(O)=O Amb25281532 [0,0,0,1,0,0|1,0,2]=4 252 B12R1.75 COC1CCCCC1CC(C)=O Amb25112608 [0,0,0,1,0,0|2,0,0]=3 253 B12R1.75 COC1CCCCC1CC(O)=O Amb18647650 [0,0,0,1,0,0|1,0,0]=2 254 B12R1.75 COC1CCCCC1NC(=O)Cl Amb25159590 [0,0,0,1,0,0|3,0,0]=4 255 B12R1.75 COC1CCCOC1CC(O)=O Amb25101656 [0,0,0,1,0,0|2,0,0]=3 256 B12R1.75 COC1CCOCC1CC(O)=O Amb18197607 [0,0,0,1,0,0|2,0,0]=3 257 B12R1.75 COC1CCSCC1CC(O)=O Amb18190928 [0,0,0,1,0,0|2,0,0]=3 258 B12R1.75 COC1COCCC1CC(O)=O Amb18197629 [0,0,0,1,0,0|2,0,0]=3 259 B12R1.75 COC1CSCCC1CC(O)=O Amb18189240 [0,0,0,1,0,0|2,0,0]=3 260 B12R1.75 COC1OCCCC1CC(O)=O Amb18197635 [0,0,0,1,0,0|2,0,0]=3 261 B12R1.75 CO[C@@H]1CCCC[C@H]1NC(C)=O Amb25220849 [0,0,0,1,0,0|3,0,0]=4 262 B12R1.75 CO[C@H]1CCCC[C@@H]1CC(O)=O Amb24710034 [0,0,0,1,0,0|1,0,0]=2 263 B12R1.75 CS[C@H]1CCCC[C@@H]1NC(C)=O Amb24668924 [0,0,0,1,0,0|3,0,0]=4 264 B12R1.75 C[C@@H](O)CN1CCCCC1CC Amb25803989 [0,0,0,1,0,0|2,0,1]=4 265 B12R1.75 C\C=C/1\CCCCC1CC(O)=O Amb24741726 [0,0,0,1,0,0|0,0,2]=3 266 B12R1.75 N#CC1CCCCC1CC(O)=O Amb18827227 [0,0,0,1,0,0|1,0,1]=3 267 B12R1.75 N#CC1OCCCC1CC(O)=O Amb25804164 [0,0,0,1,0,0|2,0,1]=4 268 B12R1.75 N#C[C@@H]1OCCC[C@@H]1CC(O)=O Amb25201017 [0,0,0,1,0,0|2,0,1]=4 269 B12R1.75 NC(=O)CN1CCCCC1CO Amb18807367 [0,0,0,1,0,0|3,0,0]=4 270 B12R1.75 NC(=O)CN1CCCC[C@@H]1CO Amb25816799 [0,0,0,1,0,0|3,0,0]=4 271 B12R1.75 NC(=O)CN1CCCC[C@H]1CO Amb24703411 [0,0,0,1,0,0|3,0,0]=4 272 B12R1.75 NC(=O)NC1CCCCC1CO Amb24440539 [0,0,0,1,0,0|3,0,0]=4 273 B12R1.75 NC(=O)OC1CCCCC1CBr Amb24703160 [0,0,0,1,0,0|3,0,0]=4 274 B12R1.75 NCC1CCCCC1CC(=O)O Amb10843836 [0,0,0,1,0,0|1,0,0]=2 275 B12R1.75 NCC1CCCCN1CC(O)=O Amb18982971 [0,0,0,1,0,0|2,0,0]=3 276 B12R1.75 OC(=O)CC1CCCCN1C=O Amb18281873 [0,0,0,1,0,0|2,0,1]=4 277 B12R1.75 OC(=O)CC1CCCCN1N=O Amb25772840 [0,0,0,1,0,0|3,0,0]=4 278 B12R1.75 OC(=O)CN1CCCCC1CBr Amb21860454 [0,0,0,1,0,0|2,0,0]=3 279 B12R1.75 OC(=O)CN1CCCCC1CCl Amb21860333 [0,0,0,1,0,0|2,0,0]=3 280 B12R1.75 OC(=O)CN1CCCCC1CI Amb21860478 [0,0,0,1,0,0|2,0,0]=3 281 B12R1.75 OC(=O)C[C@H]1CCCC[C@@H]1C=O Amb24595748 [0,0,0,1,0,0|1,0,1]=3 282 B12R1.75 OCC1CCCCN1CC(O)=O Amb18294605 [0,0,0,1,0,0|2,0,0]=3 283 B12R1.75 OCC1CSCCN1CC(O)=O Amb24552619 [0,0,0,1,0,0|3,0,0]=4 284 B12R1.75 OC[C@H]1CCCCN1CC(O)=O Amb24397069 [0,0,0,1,0,0|2,0,0]=3 285 B12R1.81 CC(=O)NCC1CCCC1CN Amb25706075 [0,0,0,1,0,0|3,0,0]=4 286 B12R1.81 CC(=O)NCC1CCCC1CO Amb25108434 [0,0,0,1,0,0|3,0,0]=4 287 B12R1.81 CCC1CCCC1NNC(N)=O Amb24390905 [0,0,0,1,0,0|3,0,0]=4 288 B12R1.81 CCC1CCCN1\C=C\C(O)=O Amb25828616 [0,0,0,1,0,0|1,0,2]=4 289 B12R1.81 CCC1OCCC1CNC(C)=O Amb24631270 [0,0,0,1,0,0|3,0,0]=4 290 B12R1.81 CCN1CCCC1CNC(=O)N Amb1134496 [0,0,0,1,0,0|3,0,0]=4 291 B12R1.81 COC1CCCC1CNC(C)=O Amb25236798 [0,0,0,1,0,0|3,0,0]=4 292 B12R1.81 COC1CCCC1NCC(N)=O Amb18807414 [0,0,0,1,0,0|3,0,0]=4 293 B12R1.81 COC1CCCC1NCC(O)=O Amb18807777 [0,0,0,1,0,0|2,0,0]=3 294 B12R1.81 NC(=O)NCC1CCCC1CO Amb25699368 [0,0,0,1,0,0|3,0,0]=4 295 B12R1.81 NCC1CCCC1CNC(N)=O Amb25044736 [0,0,0,1,0,0|3,0,0]=4 296 B12R1.125 C=C1CCCCC1CCC(O)=O Amb25700911 [0,0,0,1,0,0|0,0,2]=3 297 B12R1.125 CC(=C)CCC1CCCCC1Br Amb25675013 [0,0,0,1,0,0|3,0,0]=4 298 B12R1.125 CC(=C)CCC1CCCCC1Cl Amb24524721 [0,0,0,1,0,0|3,0,0]=4 299 B12R1.125 CC(=C)CNC1CCCCC1C Amb17309025 [0,0,0,1,0,0|3,0,0]=4 300 B12R1.125 CC(=O)CCC1=CCCCC1C Amb24424925 [0,0,0,1,0,0|1,0,2]=4 301 B12R1.125 CC(=O)CCC1CCCCC1=O Amb25313248 [0,0,0,1,0,0|2,0,1]=4 302 B12R1.125 CC(=O)CCC1CCCCC1O Amb25027519 [0,0,0,1,0,0|2,0,0]=3 303 B12R1.125 CC(=O)CCC1CCCCN1C Amb25034626 [0,0,0,1,0,0|2,0,0]=3 304 B12R1.125 CC(=O)CC[C@H]1CCCO[C@H]1O Amb24631643 [0,0,0,1,0,0|3,0,0]=4 305 B12R1.125 CC(=O)CC[C@H]1OCCC[C@@H]1O Amb25262767 [0,0,0,1,0,0|3,0,0]=4 306 B12R1.125 CC(=O)NCC1CCCCC1Br Amb24387175 [0,0,0,1,0,0|3,0,0]=4 307 B12R1.125 CC(=O)NCC1CCCCC1Cl Amb25674324 [0,0,0,1,0,0|3,0,0]=4 308 B12R1.125 CC(=O)NC[C@@H]1CCCC[C@@H]1O Amb24513152 [0,0,0,1,0,0|3,0,0]=4 309 B12R1.125 CC(=O)NC[C@@H]1CCCC[C@H]1O Amb24586348 [0,0,0,1,0,0|3,0,0]=4 310 B12R1.125 CC(=O)OCC1CCCCC1Cl Amb24373904 [0,0,0,1,0,0|3,0,0]=4 311 B12R1.125 CC(=O)OCC1CCCCN1C Amb24705172 [0,0,0,1,0,0|3,0,0]=4 312 B12R1.125 CC1CCCCC1=NCC(O)=O Amb24580502 [0,0,0,1,0,0|1,0,1]=3 313 B12R1.125 CC1CCCCC1CCC(C)=O Amb25730309 [0,0,0,1,0,0|1,0,0]=2 314 B12R1.125 CC1CCCCC1CCC(C)Cl Amb25336794 [0,0,0,1,0,0|2,0,1]=4 315 B12R1.125 CC1CCCCC1CCC(C)N Amb24511375 [0,0,0,1,0,0|2,0,1]=4 316 B12R1.125 CC1CCCCC1CCC(O)=O Amb18647427 [0,0,0,1,0,0|0,0,0]=1 317 B12R1.125 CC1CCCCC1CNC(C)=N Amb25302991 [0,0,0,1,0,0|3,0,0]=4 318 B12R1.125 CC1CCCCC1CNC(C)=O Amb25294550 [0,0,0,1,0,0|2,0,0]=3 319 B12R1.125 CC1CCCCC1CNC(N)=N Amb18801523 [0,0,0,1,0,0|3,0,0]=4 320 B12R1.125 CC1CCCCC1CNC(N)=O Amb18793749 [0,0,0,1,0,0|2,0,0]=3 321 B12R1.125 CC1CCCCC1CNC(N)=S Amb19058811 [0,0,0,1,0,0|2,1,0]=4 322 B12R1.125 CC1CCCCC1NCC(=C)Br Amb25115191 [0,0,0,1,0,0|3,0,0]=4 323 B12R1.125 CC1CCCCC1NCC(=C)Cl Amb18329823 [0,0,0,1,0,0|3,0,0]=4 324 B12R1.125 CC1CCCCC1NC[C@@H](C)O Amb25796756 [0,0,0,1,0,0|2,0,1]=4 325 B12R1.125 CC1CCCCC1NC[N+]([O-])=O Amb25855657 [0,0,0,1,0,0|2,0,1]=4 326 B12R1.125 CC1CCCCC1NNC(N)=O Amb25279559 [0,0,0,1,0,0|3,0,0]=4 327 B12R1.125 CC1CCCCC1OCC(=C)Br Amb25275807 [0,0,0,1,0,0|3,0,0]=4 328 B12R1.125 CC1CCCCC1OCC(C)O Amb18807458 [0,0,0,1,0,0|2,0,1]=4 329 B12R1.125 CC1CCCCC1OCC(N)=O Amb18802286 [0,0,0,1,0,0|2,0,0]=3 330 B12R1.125 CC1CCCCC1\C=C\C(O)=O Amb24546661 [0,0,0,1,0,0|0,0,2]=3 331 B12R1.125 CC1CCCCN1CCC(C)O Amb18807060 [0,0,0,1,0,0|2,0,1]=4 332 B12R1.125 CC1CCCCN1CCC(O)=O Amb21953915 [0,0,0,1,0,0|1,0,0]=2 333 B12R1.125 CC1CCCCN1CC[N+]([O-])=O Amb25154570 [0,0,0,1,0,0|2,0,1]=4 334 B12R1.125 CC1CCNCC1CNC(C)=O Amb24446285 [0,0,0,1,0,0|3,0,0]=4 335 B12R1.125 CC1CNCCC1NCC(N)=O Amb24724471 [0,0,0,1,0,0|3,0,0]=4 336 B12R1.125 CC1CNCCN1CCC(C)=O Amb25036388 [0,0,0,1,0,0|3,0,0]=4 337 B12R1.125 CC1CNCCN1CCC(N)=O Amb18996093 [0,0,0,1,0,0|3,0,0]=4 338 B12R1.125 CC1CNCCN1CCC(O)=O Amb18300045 [0,0,0,1,0,0|2,0,0]=3 339 B12R1.125 CC1COCCC1C#CC(O)=O Amb24416197 [0,0,0,1,0,0|1,0,2]=4 340 B12R1.125 CC1COCCC1CNC(C)=O Amb25681090 [0,0,0,1,0,0|3,0,0]=4 341 B12R1.125 CC1COCCC1CNC(N)=O Amb25154711 [0,0,0,1,0,0|3,0,0]=4 342 B12R1.125 CC1COCCC1NCC(N)=O Amb25140778 [0,0,0,1,0,0|3,0,0]=4 343 B12R1.125 CC1COCCC1NCC(O)=O Amb25693455 [0,0,0,1,0,0|2,0,0]=3 344 B12R1.125 CC1COCCN1CCC(N)=O Amb18789695 [0,0,0,1,0,0|3,0,0]=4 345 B12R1.125 CC1CSCCN1CCC(C)=O Amb25784377 [0,0,0,1,0,0|3,0,0]=4 346 B12R1.125 CC1CSCCN1CCC(N)=O Amb24694743 [0,0,0,1,0,0|3,0,0]=4 347 B12R1.125 CC1NCCCC1NCC(N)=O Amb24617552 [0,0,0,1,0,0|3,0,0]=4 348 B12R1.125 CC1NCCCC1NCC(O)=O Amb25302143 [0,0,0,1,0,0|2,0,0]=3 349 B12R1.125 CC1SCCCC1OCC(O)=O Amb25117392 [0,0,0,1,0,0|2,0,0]=3 350 B12R1.125 CC=1CCCCC1CCC(N)=O Amb25808766 [0,0,0,1,0,0|1,0,2]=4 351 B12R1.125 CN1CCCCC1CCC(N)=N Amb25056341 [0,0,0,1,0,0|3,0,0]=4 352 B12R1.125 CN1CCCCC1CNC(N)=O Amb18806982 [0,0,0,1,0,0|3,0,0]=4 353 B12R1.125 CN1CCCN=C1CCC(O)=O Amb18825637 [0,0,0,1,0,0|2,0,1]=4 354 B12R1.125 C[C@@H]1COCCN1CCC(C)=O Amb25833951 [0,0,0,1,0,0|3,0,0]=4 355 B12R1.125 C[C@H]1CCCC[C@@H]1CCC(C)=O Amb24689550 [0,0,0,1,0,0|1,0,0]=2 356 B12R1.125 ClC(=O)CCN1CCCCC1C Amb17143073 [0,0,0,1,0,0|2,0,0]=3 357 B12R1.125 NC(=O)CCC1CCCCC1=O Amb21951694 [0,0,0,1,0,0|2,0,1]=4 358 B12R1.125 NC(=O)CCN1CCCCC1C Amb17142919 [0,0,0,1,0,0|2,0,0]=3 359 B12R1.125 NC(=O)CNC1CCCCC1C Amb1112866 [0,0,0,1,0,0|2,0,0]=3 360 B12R1.125 NC(=O)CNC1CCCCC1O Amb18989227 [0,0,0,1,0,0|3,0,0]=4 361 B12R1.125 NC(=O)CN[C@H]1CCCC[C@@H]1O Amb25113874 [0,0,0,1,0,0|3,0,0]=4 362 B12R1.125 NC(=O)CSC1CCCCC1O Amb24361082 [0,0,0,1,0,0|3,0,0]=4 363 B12R1.125 NC(=O)CS[C@@H]1CCCC[C@H]1O Amb25244861 [0,0,0,1,0,0|3,0,0]=4 364 B12R1.125 NC(=O)CS[C@H]1CCCC[C@@H]1O Amb25143206 [0,0,0,1,0,0|3,0,0]=4 365 B12R1.125 NC1CCCCC1CNC(N)=O Amb24692354 [0,0,0,1,0,0|3,0,0]=4 366 B12R1.125 NC1CCCCC1NCC(O)=O Amb25714554 [0,0,0,1,0,0|2,0,0]=3 367 B12R1.125 NC1CCCCC1OCC(N)=O Amb25848466 [0,0,0,1,0,0|3,0,0]=4 368 B12R1.125 NC1CCCCC1OCC(O)=O Amb24488516 [0,0,0,1,0,0|2,0,0]=3 369 B12R1.125 N[C@@H]1CCCC[C@H]1NCC(O)=O Amb24512945 [0,0,0,1,0,0|2,0,0]=3 370 B12R1.125 N[C@@H]1CCCC[C@H]1OCC(O)=O Amb24069129 [0,0,0,1,0,0|2,0,0]=3 371 B12R1.125 N[C@H]1CCCC[C@@H]1CCC(O)=O Amb25302248 [0,0,0,1,0,0|1,0,0]=2 372 B12R1.125 N[C@H]1CCCC[C@@H]1OCC(O)=O Amb24069130 [0,0,0,1,0,0|2,0,0]=3 373 B12R1.125 N[C@H]1CCCC[C@H]1CCC(O)=O Amb25295431 [0,0,0,1,0,0|1,0,0]=2 374 B12R1.125 OC(=O)CCC1CCCCN1C Amb10607785 [0,0,0,1,0,0|1,0,0]=2 375 B12R1.125 OC(=O)CCC1CCCCN1C Amb13949149 [0,0,0,1,0,0|1,0,0]=2 376 B12R1.125 OC(=O)CCC1CCCSC1=O Amb24513624 [0,0,0,1,0,0|2,0,1]=4 377 B12R1.125 OC(=O)CCC1CCOCC1=O Amb18198355 [0,0,0,1,0,0|2,0,1]=4 378 B12R1.125 OC(=O)CCC1CCSCC1=O Amb18820771 [0,0,0,1,0,0|2,0,1]=4 379 B12R1.125 OC(=O)CCC1CNCCC1=O Amb24379504 [0,0,0,1,0,0|2,0,1]=4 380 B12R1.125 OC(=O)CCC1COCCC1=O Amb18198354 [0,0,0,1,0,0|2,0,1]=4 381 B12R1.125 OC(=O)CCC1CSCCC1=O Amb18820772 [0,0,0,1,0,0|2,0,1]=4 382 B12R1.125 OC(=O)COC1CCCCC1F Amb24496996 [0,0,0,1,0,0|2,0,0]=3 383 B12R1.125 OC(=O)CSC1CCCCC1C Amb17594900 [0,0,0,1,0,0|1,0,0]=2 384 B12R1.125 OC(=O)CSC1CCCCC1O Amb10808762 [0,0,0,1,0,0|2,0,0]=3 385 B12R1.125 OC1CCCCC1NCC(O)=O Amb18990895 [0,0,0,1,0,0|2,0,0]=3 386 B12R1.125 OC1CCCCC1OCC(O)=O Amb24465502 [0,0,0,1,0,0|2,0,0]=3 387 B12R1.125 OC1CCCCN1CCC(O)=O Amb25848698 [0,0,0,1,0,0|2,0,0]=3 388 B12R1.125 OC1CCCNC1CCC(O)=O Amb25258833 [0,0,0,1,0,0|2,0,0]=3 389 B12R1.125 O[C@H]1CCCC[C@@H]1CCC(O)=O Amb25179269 [0,0,0,1,0,0|1,0,0]=2 390 B12R1.125 O[C@H]1CCCC[C@@H]1SCC(O)=O Amb25286930 [0,0,0,1,0,0|2,0,0]=3 391 B12R1.130 CC1CCCN1CCNC(C)=O Amb24421421 [0,0,0,1,0,0|3,0,0]=4 392 B12R1.130 CC1CCCN1C\C=C\C(O)=O Amb18296455 [0,0,0,1,0,0|1,0,2]=4 393 B12R1.130 CN1CCCC1CNCC(O)=O Amb22226811 [0,0,0,1,0,0|2,0,0]=3 394 B12R1.130 CN1CCCC1COCC(O)=O Amb21861056 [0,0,0,1,0,0|2,0,0]=3 395 B12R1.130 CN1CCC[C@H]1CNCC(O)=O Amb22226852 [0,0,0,1,0,0|2,0,0]=3 396 B12R1.130 CN1CCC[C@H]1COCC(O)=O Amb22224778 [0,0,0,1,0,0|2,0,0]=3 397 B12R1.130 OC(=O)CCCN1CCCC1=O Amb1130787 [0,0,0,1,0,0|2,0,1]=4 398 B12R1.130 OC(=O)CCSC1CCCC1=O Amb16230793 [0,0,0,1,0,0|2,0,1]=4 399 B12R1.130 OC(=O)CCS[C@@H]1CCCC1=O Amb24181926 [0,0,0,1,0,0|2,0,1]=4 400 B12R1.141 C=C1CC(=O)CCCCCCC1 Amb25834396 [0,0,0,1,0,0|1,0,2]=4 401 B12R1.141 CC1CC(=O)CCCCCCC1 Amb25373271 [0,0,0,1,0,0|1,0,0]=2 402 B12R1.141 CC=1CC(=O)CCCCCCC1 Amb25233680 [0,0,0,1,0,0|1,0,2]=4 403 B12R1.141 OC1CCCCCCCC(Cl)=C1 Amb24705886 [0,0,0,1,0,0|3,0,0]=4 404 B12R1.170 CCCC1CCCCCC(=O)N1 Amb25035234 [0,0,0,1,0,0|1,0,0]=2 405 B12R1.170 CNCC1CC(=O)CCCCC1 Amb24638922 [0,0,0,1,0,0|2,0,0]=3 406 B12R1.170 NCCC1CCCCCC(=O)N1 Amb25701693 [0,0,0,1,0,0|2,0,0]=3 407 B12R1.210 CC(=C)CC1CCCCCC1Br Amb25114498 [0,0,0,1,0,0|3,0,0]=4 408 B12R1.210 CC(=C)CC1CCCCCC1Cl Amb25104125 [0,0,0,1,0,0|3,0,0]=4 409 B12R1.210 CC(=C)CC1CCCCCC1N Amb25684471 [0,0,0,1,0,0|3,0,0]=4 410 B12R1.210 CC(=C)CC1CCCCCC1O Amb18805991 [0,0,0,1,0,0|3,0,0]=4 411 B12R1.210 CC(=O)CC1CCCCCC1=O Amb24535501 [0,0,0,1,0,0|2,0,1]=4 412 B12R1.210 CC(=O)CC1CCCCCC1O Amb25134615 [0,0,0,1,0,0|2,0,0]=3 413 B12R1.210 CC(=O)NC1CCCCCC1Cl Amb25798846 [0,0,0,1,0,0|3,0,0]=4 414 B12R1.210 CC(=O)NC1CCCCCC1O Amb25715202 [0,0,0,1,0,0|3,0,0]=4 415 B12R1.210 CC(=O)N[C@H]1CCCCC[C@@H]1O Amb24512924 [0,0,0,1,0,0|3,0,0]=4 416 B12R1.210 CC(=O)N[C@H]1CCCCC[C@H]1O Amb25239351 [0,0,0,1,0,0|3,0,0]=4 417 B12R1.210 CC(=O)O[C@@H]1CCCCC[C@H]1O Amb24575280 [0,0,0,1,0,0|3,0,0]=4 418 B12R1.210 CC(=O)O[C@H]1CCCCC[C@H]1O Amb25225943 [0,0,0,1,0,0|3,0,0]=4 419 B12R1.210 CC(O)CC1CCCCCC1O Amb24447360 [0,0,0,1,0,0|2,0,1]=4 420 B12R1.210 CC1C=CCCCC1CC(C)=O Amb24706709 [0,0,0,1,0,0|1,0,2]=4 421 B12R1.210 CC1CCCCCC1NC(C)=N Amb24483654 [0,0,0,1,0,0|3,0,0]=4 422 B12R1.210 CC1CCCCCC1NC(N)=O Amb24483653 [0,0,0,1,0,0|2,0,0]=3 423 B12R1.210 CC1CCCCCN1CC(=C)Cl Amb25098309 [0,0,0,1,0,0|3,0,0]=4 424 B12R1.210 CC1CCCCCN1CC(C)=O Amb25836787 [0,0,0,1,0,0|2,0,0]=3 425 B12R1.210 CC1CCCCCN1CC(C)O Amb24674071 [0,0,0,1,0,0|2,0,1]=4 426 B12R1.210 CC1CCCCCN1CC(N)=N Amb25104733 [0,0,0,1,0,0|3,0,0]=4 427 B12R1.210 CC1CCCCCN1CC(O)=O Amb25247054 [0,0,0,1,0,0|1,0,0]=2 428 B12R1.210 CC1CCSCCN1CC(C)=O Amb24746982 [0,0,0,1,0,0|3,0,0]=4 429 B12R1.210 C[C@@H]1NCCCC[C@H]1CC(O)=O Amb18198536 [0,0,0,1,0,0|1,0,0]=2 430 B12R1.210 OC(=O)CC1CCCCCC1=O Amb18825694 [0,0,0,1,0,0|1,0,1]=3 431 B12R1.210 OC(=O)CC1CCNCCC1=O Amb24667785 [0,0,0,1,0,0|2,0,1]=4 432 B12R1.210 OC1CCCCCC1CC(O)=O Amb18198284 [0,0,0,1,0,0|1,0,0]=2 433 B12R1.212 C=C1CCCCCCC1C(O)=O Amb24634098 [0,0,0,1,0,0|0,0,2]=3 434 B12R1.212 CC(=O)C1CCCCCCC1=C Amb25723824 [0,0,0,1,0,0|1,0,2]=4 435 B12R1.212 CC(=O)C1CCCCCCC1=O Amb25318904 [0,0,0,1,0,0|2,0,1]=4 436 B12R1.212 CC(=O)C1CCCCCCC1N Amb24737955 [0,0,0,1,0,0|2,0,0]=3 437 B12R1.212 CN1CCCCCCC1C(O)=O Amb25816705 [0,0,0,1,0,0|1,0,0]=2 438 B12R1.212 NC(=O)C1CCCCCCC1=O Amb25335143 [0,0,0,1,0,0|2,0,1]=4 439 B12R1.212 NC(=O)[C@@H]1CCCCCC[C@H]1O Amb24512072 [0,0,0,1,0,0|2,0,0]=3 440 B12R1.212 NC1C=CCCCCC1C(O)=O Amb22352790 [0,0,0,1,0,0|1,0,2]=4 441 B12R1.212 NC1C=CCCCCC1C(O)=O Amb24648325 [0,0,0,1,0,0|1,0,2]=4 442 B12R1.212 NC1CCCCCCC1C(O)=O Amb20667806 [0,0,0,1,0,0|1,0,0]=2 443 B12R1.212 NC1CCCCCCC1C(O)=O Amb22059713 [0,0,0,1,0,0|1,0,0]=2 444 B12R1.212 NC=1CCCCCCC1C(O)=O Amb24722108 [0,0,0,1,0,0|1,0,2]=4 445 B12R1.212 N[C@@H]1CCC=CCC[C@@H]1C(=O)O Amb1993856 [0,0,0,1,0,0|1,0,2]=4 446 B12R1.212 N[C@@H]1CCC=CCC[C@@H]1C(=O)O Amb1994008 [0,0,0,1,0,0|1,0,2]=4 447 B12R1.212 N[C@H]1CCC=CCC[C@H]1C(=O)O Amb1993855 [0,0,0,1,0,0|1,0,2]=4 448 B12R1.212 N[C@H]1CCCCCC[C@@H]1C(O)=O Amb25245343 [0,0,0,1,0,0|1,0,0]=2 449 B12R1.212 OC(=O)C1CCC=CCCC1Cl Amb25784085 [0,0,0,1,0,0|1,0,2]=4 450 B12R1.212 OC(=O)C1CCCCCNC1=O Amb24578643 [0,0,0,1,0,0|2,0,1]=4 451 B12R1.212 OC(=O)C=1CCCCCCC1Cl Amb24650994 [0,0,0,1,0,0|1,0,2]=4 452 B12R1.212 OC(=O)[C@@H]1CCCCCC[C@@H]1N Amb1993854 [0,0,0,1,0,0|1,0,0]=2 453 B12R1.212 OC(=O)[C@H]1CCCCCC[C@H]1N Amb1993853 [0,0,0,1,0,0|1,0,0]=2 454 B12R1.212 O[C@@H]1CCCCCC[C@@H]1C(O)=O Amb24692827 [0,0,0,1,0,0|1,0,0]=2 455 B12R1.212 O[C@H]1CCC=CCC[C@@H]1C(O)=O Amb25211244 [0,0,0,1,0,0|1,0,2]=4 456 B12R1.212 O[C@H]1CCCCCC[C@H]1C(O)=O Amb24739651 [0,0,0,1,0,0|1,0,0]=2 457 B12R1.215 ClC1CCCCCCCCCC1 Amb24634227 [0,0,0,1,0,0|2,0,1]=4 458 B12R1.215 O=C1CC=CCCCCCCC1 Amb25112664 [0,0,0,1,0,0|1,0,2]=4 459 B12R1.215 O=C1CCC=CCCCCCC1 Amb25713005 [0,0,0,1,0,0|1,0,2]=4 460 B12R1.215 O=C1CCCCCCCCC#C1 Amb25706996 [0,0,0,1,0,0|1,0,1]=3 461 B12R1.215 O=C1CCCCCCCCCO1 Amb22732305 [0,0,0,1,0,0|0,0,0]=1 462 B12R1.215 O=C1CCCCCCNCCN1 Amb25784699 [0,0,0,1,0,0|2,0,0]=3 463 B12R1.215 O=C1CCNCCCCCCN1 Amb25704380 [0,0,0,1,0,0|2,0,0]=3 464 B12R1.215 OC1CCCCCCCCCC1 Amb24497641 [0,0,0,1,0,0|1,0,1]=3 465 B12R1.215 OC1CCCCCCCCCO1 Amb24352243 [0,0,0,1,0,0|0,0,2]=3 466 B12R1.215 OC1CCCCNCCCCC1 Amb24615660 [0,0,0,1,0,0|2,0,1]=4 467 B12R1.215 S=C1CCCCCCCCCN1 Amb24399743 [0,0,0,1,0,0|1,1,0]=3 468 B12R1.252 CC(=N)NCCC1CCCCC1 Amb25702080 [0,0,0,1,0,0|3,0,0]=4 469 B12R1.252 CC(=O)CCOC1CCCCO1 Amb17620506 [0,0,0,1,0,0|3,0,0]=4 470 B12R1.252 CC(=O)NCCC1CCCCN1 Amb1085850 [0,0,0,1,0,0|3,0,0]=4 471 B12R1.252 CC(=O)NCCC1CCCCN1 Amb21960668 [0,0,0,1,0,0|3,0,0]=4 472 B12R1.252 CC(=O)NCCC1CCNCC1 Amb1080251 [0,0,0,1,0,0|3,0,0]=4 473 B12R1.252 CC(=O)NCCC1CCNCC1 Amb21960405 [0,0,0,1,0,0|3,0,0]=4 474 B12R1.252 CC(=O)NCCC1CCOCC1 Amb25798637 [0,0,0,1,0,0|3,0,0]=4 475 B12R1.252 CC(=O)NCCC1CNCCC1 Amb18982294 [0,0,0,1,0,0|3,0,0]=4 476 B12R1.252 CC(=O)NCCC1CNCCC1 Amb21960598 [0,0,0,1,0,0|3,0,0]=4 477 B12R1.252 CC(=O)NCCN1CCCCC1 Amb25712371 [0,0,0,1,0,0|3,0,0]=4 478 B12R1.252 CC(=O)OCCC1CCCCC1 Amb22336360 [0,0,0,1,0,0|2,0,0]=3 479 B12R1.252 CC(=O)OCCC1CCCCN1 Amb21956156 [0,0,0,1,0,0|3,0,0]=4 480 B12R1.252 CC(=O)OCCC1CCNCC1 Amb21956158 [0,0,0,1,0,0|3,0,0]=4 481 B12R1.252 CC(=O)OCCC1CNCCC1 Amb21956159 [0,0,0,1,0,0|3,0,0]=4 482 B12R1.252 CC(=O)SCCN1CCCCC1 Amb10810343 [0,0,0,1,0,0|3,0,0]=4 483 B12R1.252 CC(=O)\C=C\CC1CCCCC1 Amb24424879 [0,0,0,1,0,0|1,0,2]=4 484 B12R1.252 CC(CNCC1CCCCC1)O Amb2119399 [0,0,0,1,0,0|2,0,1]=4 485 B12R1.252 NC(=N)CCCN1CCCCC1 Amb13951455 [0,0,0,1,0,0|3,0,0]=4 486 B12R1.252 NC(=N)CCOC1CCCCC1 Amb10610331 [0,0,0,1,0,0|3,0,0]=4 487 B12R1.252 NC(=N)NCCC1CCCCC1 Amb18801549 [0,0,0,1,0,0|3,0,0]=4 488 B12R1.252 NC(=O)CCCN1CCCCC1 Amb17142921 [0,0,0,1,0,0|2,0,0]=3 489 B12R1.252 NC(=O)CNCC1CCCCC1 Amb1113547 [0,0,0,1,0,0|2,0,0]=3 490 B12R1.252 NC(=O)COCC1CCNCC1 Amb17083678 [0,0,0,1,0,0|3,0,0]=4 491 B12R1.252 NC(=O)NCCC1CCCCC1 Amb18801889 [0,0,0,1,0,0|2,0,0]=3 492 B12R1.252 NC(=O)NCCC1CCCCO1 Amb25755516 [0,0,0,1,0,0|3,0,0]=4 493 B12R1.252 NC(=O)NCCC1CCNCC1 Amb18292812 [0,0,0,1,0,0|3,0,0]=4 494 B12R1.252 NC(=O)NCCC1CCOCC1 Amb25221570 [0,0,0,1,0,0|3,0,0]=4 495 B12R1.252 NC(=O)NCCC1CNCCC1 Amb24710799 [0,0,0,1,0,0|3,0,0]=4 496 B12R1.252 NC(=O)NCCN1CCCCC1 Amb18794079 [0,0,0,1,0,0|3,0,0]=4 497 B12R1.252 NC(=S)NCCC1CCCCC1 Amb19058785 [0,0,0,1,0,0|2,1,0]=4 498 B12R1.252 O=C(Cl)NCCN1CCCCC1 Amb25113947 [0,0,0,1,0,0|3,0,0]=4 499 B12R1.252 OB(O)CCCC1CCCCC1 Amb21927851 [0,0,0,1,0,0|1,0,1]=3 500 B12R1.252 OC(=O)C#CCC1CCCCO1 Amb24373906 [0,0,0,1,0,0|1,0,2]=4 501 B12R1.252 OC(=O)CCC=C1CCCCC1 Amb18647035 [0,0,0,1,0,0|0,0,2]=3 502 B12R1.252 OC(=O)CCCC1CCCCC1 Amb22360661 [0,0,0,1,0,0|0,0,0]=1 503 B12R1.252 OC(=O)CCCC1CCCCN1 Amb1101084 [0,0,0,1,0,0|1,0,0]=2 504 B12R1.252 OC(=O)CCCC1CCCCN1 Amb22284114 [0,0,0,1,0,0|1,0,0]=2 505 B12R1.252 OC(=O)CCCC1CCNCC1 Amb1101085 [0,0,0,1,0,0|1,0,0]=2 506 B12R1.252 OC(=O)CCCN1CCNCC1 Amb17479003 [0,0,0,1,0,0|2,0,0]=3 507 B12R1.252 OC(=O)CCCN1CCOCC1 Amb21954071 [0,0,0,1,0,0|2,0,0]=3 508 B12R1.252 OC(=O)CCN=C1CCCCC1 Amb24405347 [0,0,0,1,0,0|1,0,1]=3 509 B12R1.252 OC(=O)CCNC1=NCCCC1 Amb10976585 [0,0,0,1,0,0|2,0,1]=4 510 B12R1.252 OC(=O)CCNC1CCNCC1 Amb24271198 [0,0,0,1,0,0|2,0,0]=3 511 B12R1.252 OC(=O)CCOC1CCCCO1 Amb24120644 [0,0,0,1,0,0|2,0,0]=3 512 B12R1.252 OC(=O)CCOC1CCOCC1 Amb18790274 [0,0,0,1,0,0|2,0,0]=3 513 B12R1.252 OC(=O)CNN=C1CCCCC1 Amb25834155 [0,0,0,1,0,0|2,0,1]=4 514 B12R1.252 OC(=O)\C=C/SC1CCCCC1 Amb24571677 [0,0,0,1,0,0|1,0,2]=4 515 B12R1.252 OC(=O)\C=C\CC1CCNCC1 Amb24677696 [0,0,0,1,0,0|1,0,2]=4 516 B12R1.252 OC(=O)\C=C\CN1CCCCC1 Amb18988789 [0,0,0,1,0,0|1,0,2]=4 517 B12R1.252 OC(=O)\C=C\NC1CCCCC1 Amb24658894 [0,0,0,1,0,0|1,0,2]=4 518 B12R1.252 OC(=O)\C=C\OC1CCCCC1 Amb18647362 [0,0,0,1,0,0|1,0,2]=4 519 B12R1.252 OC(=O)\C=C\SC1CCCCC1 Amb25693595 [0,0,0,1,0,0|1,0,2]=4 520 B12R1.252 [O-]C(=O)CCCC1CCCCC1 Amb10601869 [0,0,0,1,0,0|0,0,1]=2 521 B12R1.252 [O-]C(=O)CCCC1CCCCC1 Amb22053703 [0,0,0,1,0,0|0,0,1]=2 522 B12R1.255 CC(=O)CCCCC1OCCO1 Amb25726520 [0,0,0,1,0,0|3,0,0]=4 523 B12R1.255 CC(=O)NCCSC1CCCC1 Amb23366057 [0,0,0,1,0,0|3,0,0]=4 524 B12R1.255 CC(O)CNCCC1CCCC1 Amb18794142 [0,0,0,1,0,0|2,0,1]=4 525 B12R1.255 OC(=O)C#CCCC1CCCC1 Amb25089799 [0,0,0,1,0,0|0,0,2]=3 526 B12R1.255 OC(=O)CCCCC1SSCC1 Amb1152511 [0,0,0,1,0,0|2,0,0]=3 527 B12R1.255 OC(=O)CCCCN1CCCC1 Amb10610408 [0,0,0,1,0,0|1,0,0]=2 528 B12R1.255 OC(=O)CCCC[C@@H]1SSCC1 Amb17616537 [0,0,0,1,0,0|2,0,0]=3 529 B12R1.255 OC(=O)CCCNC1CCCC1 Amb1110062 [0,0,0,1,0,0|1,0,0]=2 530 B12R1.255 OC(=O)CCC\N=C\1/CCCN1 Amb21878946 [0,0,0,1,0,0|2,0,1]=4 531 B12R1.255 OC(=O)CSCCN1CCCC1 Amb13949167 [0,0,0,1,0,0|2,0,0]=3 532 B12R1.255 OC(=O)\C=C\NCC1CCCC1 Amb25805743 [0,0,0,1,0,0|1,0,2]=4 533 B12R1.255 O[13C](=O)[13CH2]CC[13CH2][13CH]1CCSS1 Amb22353982 [0,0,0,1,0,0|2,0,0]=3 534 B12R1.255 [O-]C(=O)CCCCC1CCSS1 Amb22168392 [0,0,0,1,0,0|2,0,1]=4 535 B12R1.283 BrCCC1CCCCN1C(=O)C Amb17103917 [0,0,0,1,0,0|3,0,0]=4 536 B12R1.283 C#CCC1CCCCC1C(O)=O Amb24685505 [0,0,0,1,0,0|0,0,2]=3 537 B12R1.283 C#CCN1CCCCC1C(=O)O Amb2372169 [0,0,0,1,0,0|1,0,2]=4 538 B12R1.283 C#CC[C@@H]1CCCC[C@H]1C(N)=O Amb24512880 [0,0,0,1,0,0|1,0,2]=4 539 B12R1.283 C=CCC1CCCCC1C(O)=O Amb18646999 [0,0,0,1,0,0|0,0,2]=3 540 B12R1.283 C=CCN1CCCCC1C(=O)O Amb13886181 [0,0,0,1,0,0|1,0,2]=4 541 B12R1.283 C=CCN1CCCCC1C(=O)O Amb2382768 [0,0,0,1,0,0|1,0,2]=4 542 B12R1.283 C=CC[C@@H]1CCCC[C@H]1C(O)=O Amb25227522 [0,0,0,1,0,0|0,0,2]=3 543 B12R1.283 CC#CC1CCCCC1C(C)=O Amb24378384 [0,0,0,1,0,0|1,0,2]=4 544 B12R1.283 CC(=O)C/1CCCC\C1=C\CC Amb25179560 [0,0,0,1,0,0|1,0,2]=4 545 B12R1.283 CC(=O)C1CCCC=C1CCC Amb24723974 [0,0,0,1,0,0|1,0,2]=4 546 B12R1.283 CC(=O)C1CCCCC1CC#N Amb24564899 [0,0,0,1,0,0|2,0,1]=4 547 B12R1.283 CC(=O)C1CCCCC1CC=C Amb25730117 [0,0,0,1,0,0|1,0,2]=4 548 B12R1.283 CC(=O)C1CCCCC1CC=O Amb25318044 [0,0,0,1,0,0|2,0,1]=4 549 B12R1.283 CC(=O)C1CCCCN1CCF Amb25067265 [0,0,0,1,0,0|3,0,0]=4 550 B12R1.283 CC(=O)C1CCCCN1CCO Amb25148422 [0,0,0,1,0,0|3,0,0]=4 551 B12R1.283 CC(=O)N1CCCC[C@@H]1CCO Amb25295318 [0,0,0,1,0,0|3,0,0]=4 552 B12R1.283 CC(=O)N1CCCC[C@H]1CCO Amb25700843 [0,0,0,1,0,0|3,0,0]=4 553 B12R1.283 CC(=O)[C@@H]1CCCC[C@H]1CC#C Amb25273888 [0,0,0,1,0,0|1,0,2]=4 554 B12R1.283 CC(=O)[C@@H]1CCCC[C@H]1CC=C Amb24655982 [0,0,0,1,0,0|1,0,2]=4 555 B12R1.283 CC(=O)[C@H]1CCCC[C@H]1CC=C Amb24512760 [0,0,0,1,0,0|1,0,2]=4 556 B12R1.283 CC(O)C1CCCCC1COC Amb24354304 [0,0,0,1,0,0|2,0,1]=4 557 B12R1.283 CC(O)[C@@H]1CCCC[C@H]1COC Amb25261817 [0,0,0,1,0,0|2,0,1]=4 558 B12R1.283 CCCC1CC=CCC1C(O)=O Amb24415893 [0,0,0,1,0,0|0,0,2]=3 559 B12R1.283 CCCC1CCCCN1C(C)=N Amb25340739 [0,0,0,1,0,0|3,0,0]=4 560 B12R1.283 CCCC1CCCCN1C(C)=O Amb25758684 [0,0,0,1,0,0|2,0,0]=3 561 B12R1.283 CCCC1NCCCC1C(N)=O Amb25790873 [0,0,0,1,0,0|2,0,0]=3 562 B12R1.283 CCCC1OCCCC1C(=O)O Amb10609660 [0,0,0,1,0,0|1,0,0]=2 563 B12R1.283 CCCC1OCCCC1C(N)=O Amb24350049 [0,0,0,1,0,0|2,0,0]=3 564 B12R1.283 CCCN1CCCCC1C(=O)O Amb10609773 [0,0,0,1,0,0|1,0,0]=2 565 B12R1.283 CCCN1CCCCC1C(=O)O Amb1110568 [0,0,0,1,0,0|1,0,0]=2 566 B12R1.283 CCCN1CCNCC1C(N)=O Amb25669678 [0,0,0,1,0,0|3,0,0]=4 567 B12R1.283 CCCN1CCNCC1C(O)=O Amb18825347 [0,0,0,1,0,0|2,0,0]=3 568 B12R1.283 CCCN1CCSCC1C(N)=O Amb24496007 [0,0,0,1,0,0|3,0,0]=4 569 B12R1.283 CCC[C@H]1CCCCN1C(C)=O Amb25707921 [0,0,0,1,0,0|2,0,0]=3 570 B12R1.283 CCC[C@H]1CCCCN1C(N)=N Amb24537670 [0,0,0,1,0,0|3,0,0]=4 571 B12R1.283 CCNC1CCCCC1C(O)=O Amb24426291 [0,0,0,1,0,0|1,0,0]=2 572 B12R1.283 CCN[C@@H]1CCCC[C@@H]1C(O)=O Amb24512176 [0,0,0,1,0,0|1,0,0]=2 573 B12R1.283 CCSC1CCCCC1C(O)=O Amb18303075 [0,0,0,1,0,0|1,0,0]=2 574 B12R1.283 CNCC1CCCCC1C(O)=O Amb24436013 [0,0,0,1,0,0|1,0,0]=2 575 B12R1.283 CNCC1CCCCN1C(C)=O Amb21860339 [0,0,0,1,0,0|3,0,0]=4 576 B12R1.283 COCC1CCCCN1C(N)=O Amb25053496 [0,0,0,1,0,0|3,0,0]=4 577 B12R1.283 COC[C@H]1CC=CC[C@H]1C(O)=O Amb24550084 [0,0,0,1,0,0|1,0,2]=4 578 B12R1.283 C\C=C\C1CCCCC1C(C)=O Amb25282802 [0,0,0,1,0,0|1,0,2]=4 579 B12R1.283 ClCCC1CCCCN1C(=O)C Amb17103644 [0,0,0,1,0,0|3,0,0]=4 580 B12R1.283 NC(=O)C1CCCCN1CCF Amb25845032 [0,0,0,1,0,0|3,0,0]=4 581 B12R1.283 NC(=O)C1CCCCN1CCI Amb24440142 [0,0,0,1,0,0|3,0,0]=4 582 B12R1.283 NCCC1CCCCN1C(=O)C Amb17046292 [0,0,0,1,0,0|3,0,0]=4 583 B12R1.283 NCCN1CCCCC1C(N)=O Amb18295527 [0,0,0,1,0,0|3,0,0]=4 584 B12R1.283 NCCN1CCCCC1C(O)=O Amb24740282 [0,0,0,1,0,0|2,0,0]=3 585 B12R1.283 NCCN1CCOCC1C(O)=O Amb25275851 [0,0,0,1,0,0|3,0,0]=4 586 B12R1.283 NCCN1CCSCC1C(O)=O Amb24492980 [0,0,0,1,0,0|3,0,0]=4 587 B12R1.283 OC(=O)C1CCCCC1CCF Amb25202422 [0,0,0,1,0,0|1,0,0]=2 588 B12R1.283 OC(=O)C1CCCCC1N=C=S Amb25751592 [0,0,0,1,0,0|2,0,1]=4 589 B12R1.283 OC(=O)C1CCCCC1NC=O Amb18647485 [0,0,0,1,0,0|2,0,1]=4 590 B12R1.283 OC(=O)C1CCCCN1CCF Amb24626977 [0,0,0,1,0,0|2,0,0]=3 591 B12R1.283 OC(=O)N1CCCCC1CCCl Amb24089605 [0,0,0,1,0,0|2,0,0]=3 592 B12R1.283 OC(=O)[C@@H]1CCCC[C@@H]1NC=O Amb25339572 [0,0,0,1,0,0|2,0,1]=4 593 B12R1.283 OC(=O)[C@H]1CCCC[C@H]1NC=O Amb24739635 [0,0,0,1,0,0|2,0,1]=4 594 B12R1.283 OCCN1CCNCC1C(O)=O Amb25040387 [0,0,0,1,0,0|3,0,0]=4 595 B12R1.289 C#CCN1CCCC1CC(O)=O Amb18977153 [0,0,0,1,0,0|1,0,2]=4 596 B12R1.289 CC(=O)C[C@H]1CCC[C@H]1CC#N Amb24736193 [0,0,0,1,0,0|2,0,1]=4 597 B12R1.289 CC(=O)NC1CCCC1CCO Amb24431715 [0,0,0,1,0,0|3,0,0]=4 598 B12R1.289 CCSC1CCCC1NC(C)=O Amb24357774 [0,0,0,1,0,0|3,0,0]=4 599 B12R1.289 COCC1CCCN1CC(O)=O Amb21860507 [0,0,0,1,0,0|2,0,0]=3 600 B12R1.289 N#CCN1CCCC1CC(O)=O Amb18977159 [0,0,0,1,0,0|2,0,1]=4 601 B12R1.321 C#CCCC1CC(=O)CCCC1 Amb24683333 [0,0,0,1,0,0|1,0,2]=4 602 B12R1.321 CC#CCC1CC(=O)CCCC1 Amb25152531 [0,0,0,1,0,0|1,0,2]=4 603 B12R1.321 CCCCC1CC(=O)C=CCC1 Amb25273116 [0,0,0,1,0,0|1,0,2]=4 604 B12R1.321 CCCCC1CC(=O)NCCC1 Amb25785211 [0,0,0,1,0,0|2,0,0]=3 605 B12R1.321 CCCCC1CCCCC(=N)N1 Amb24636858 [0,0,0,1,0,0|2,0,0]=3 606 B12R1.321 CCCCC1CCCCC(=O)O1 Amb22230135 [0,0,0,1,0,0|0,0,0]=1 607 B12R1.321 CCCCC1CCCCC(O)C1 Amb24435562 [0,0,0,1,0,0|1,0,1]=3 608 B12R1.321 CCCCC=1CCCCC(=O)C1 Amb24723928 [0,0,0,1,0,0|1,0,1]=3 609 B12R1.321 CCCCC=1CCCCC(O)C1 Amb24419713 [0,0,0,1,0,0|1,0,2]=4 610 B12R1.321 CCCC[C@@H]1CC(=O)CCCC1 Amb24584524 [0,0,0,1,0,0|1,0,0]=2 611 B12R1.321 CCCOC1CC(=O)NCCC1 Amb25139505 [0,0,0,1,0,0|3,0,0]=4 612 B12R1.321 CCOCC1CCCCC(O)C1 Amb25282350 [0,0,0,1,0,0|2,0,1]=4 613 B12R1.321 CSCCC1CC(=O)CCCC1 Amb25760530 [0,0,0,1,0,0|2,0,0]=3 614 B12R1.321 CSCCC=1CCCCC(=O)C1 Amb25691060 [0,0,0,1,0,0|2,0,1]=4 615 B12R1.321 NCCCC1CCCCC(=N)N1 Amb24545390 [0,0,0,1,0,0|3,0,0]=4 616 B12R1.321 NCCCC1CCCCC(=O)N1 Amb18825523 [0,0,0,1,0,0|2,0,0]=3 617 B12R1.321 OCCCC1CCCCC(=O)N1 Amb18825414 [0,0,0,1,0,0|2,0,0]=3 618 B12R1.384 CCCCC1CCCCC1(C)N Amb24743474 [0,0,0,1,0,0|2,0,1]=4 619 B12R1.384 CCCCN1CCCCS1(=O)=O Amb25080809 [0,0,0,1,0,0|2,0,1]=4 620 B12R1.386 CC#CCN1CCCC1C(O)=O Amb19001437 [0,0,0,1,0,0|1,0,2]=4 621 B12R1.386 CC(=O)C/1CCC\C1=C\CCC Amb24621312 [0,0,0,1,0,0|1,0,2]=4 622 B12R1.386 CCNCC1CCCN1C(C)=O Amb21861191 [0,0,0,1,0,0|3,0,0]=4 623 B12R1.386 CCNC[C@@H]1CCCN1C(C)=O Amb22227515 [0,0,0,1,0,0|3,0,0]=4 624 B12R1.386 CC\C=C\N1CCCC1C(O)=O Amb24694047 [0,0,0,1,0,0|1,0,2]=4 625 B12R1.386 COCCN1CSCC1C(O)=O Amb21965045 [0,0,0,1,0,0|3,0,0]=4 626 B12R1.386 C\C=C\CN1CCC[C@H]1C(O)=O Amb25751621 [0,0,0,1,0,0|1,0,2]=4 627 B12R1.386 N#CCCN1CCCC1C(O)=O Amb19001546 [0,0,0,1,0,0|2,0,1]=4 628 B12R1.386 N#CCCN1CCC[C@H]1C(O)=O Amb25774338 [0,0,0,1,0,0|2,0,1]=4 629 B12R1.386 OC(=O)C1CCCC1CNC=O Amb25328443 [0,0,0,1,0,0|2,0,1]=4 630 B12R1.386 OC(=O)[C@@H]1CCC[C@@H]1CNC=O Amb25775419 [0,0,0,1,0,0|2,0,1]=4 631 B12R1.405 C=CC1CCCCCC1C(O)=O Amb24358015 [0,0,0,1,0,0|0,0,2]=3 632 B12R1.405 C=C[C@H]1CCCCC[C@@H]1C(O)=O Amb25269439 [0,0,0,1,0,0|0,0,2]=3 633 B12R1.405 CC(=O)N1CCCCCC1CCl Amb25679977 [0,0,0,1,0,0|3,0,0]=4 634 B12R1.405 CC(=O)N1CCCCCC1CN Amb24671055 [0,0,0,1,0,0|3,0,0]=4 635 B12R1.405 CC(=O)N1CCCCCC1CO Amb24715625 [0,0,0,1,0,0|3,0,0]=4 636 B12R1.405 CCC1CCCCCC1C(O)=O Amb25336577 [0,0,0,1,0,0|0,0,0]=1 637 B12R1.405 CCC1CCCCCN1C(=O)Cl Amb24454511 [0,0,0,1,0,0|2,0,0]=3 638 B12R1.405 CCC1CCCCCN1C(C)=N Amb25100190 [0,0,0,1,0,0|3,0,0]=4 639 B12R1.405 CCC1CCCCCN1C(C)=O Amb25035126 [0,0,0,1,0,0|2,0,0]=3 640 B12R1.405 CCC1CCCCCN1C(N)=S Amb24731434 [0,0,0,1,0,0|2,1,0]=4 641 B12R1.405 CCN1CCCCCC1C(O)=O Amb23585538 [0,0,0,1,0,0|1,0,0]=2 642 B12R1.405 CC[C@@H]1CCCCC[C@@H]1C(C)=O Amb25373139 [0,0,0,1,0,0|1,0,0]=2 643 B12R1.405 CC[C@@H]1NCCCC[C@H]1C(O)=O Amb18198539 [0,0,0,1,0,0|1,0,0]=2 644 B12R1.405 COC1CCCCC=C1C(O)=O Amb25101634 [0,0,0,1,0,0|1,0,2]=4 645 B12R1.405 COC1CCCCCN1C(C)=O Amb24429885 [0,0,0,1,0,0|3,0,0]=4 646 B12R1.405 CO[C@@H]1CCCCC[C@@H]1C(O)=O Amb25361094 [0,0,0,1,0,0|1,0,0]=2 647 B12R1.405 CO[C@@H]1CCCCC[C@H]1C(O)=O Amb24656000 [0,0,0,1,0,0|1,0,0]=2 648 B12R1.405 CSC1CCCCCC1C(O)=O Amb18967402 [0,0,0,1,0,0|1,0,0]=2 649 B12R1.405 N#CC1CCCCCC1C(O)=O Amb25761465 [0,0,0,1,0,0|1,0,1]=3 650 B12R1.405 NC(=O)N1CCCCCC1CO Amb24446697 [0,0,0,1,0,0|3,0,0]=4 651 B12R1.405 OC(=O)C1CCCCCN1C=O Amb25151019 [0,0,0,1,0,0|2,0,1]=4 652 B12R1.405 OC(=O)C1CCCCCN1N=O Amb25700981 [0,0,0,1,0,0|3,0,0]=4 653 B12R1.405 OCC1CCCCCC1C(O)=O Amb25799614 [0,0,0,1,0,0|1,0,0]=2 654 B12R1.407 C=CC1CC(=O)CCCCCC1 Amb25319948 [0,0,0,1,0,0|1,0,2]=4 655 B12R1.407 CC1CCCCCCC(CO)O1 Amb25120091 [0,0,0,1,0,0|2,0,1]=4 656 B12R1.407 COC1CC(=O)CCCCCC1 Amb25718358 [0,0,0,1,0,0|2,0,0]=3 657 B12R1.407 C[C@@H]1CCCCCC[C@H](CO)O1 Amb25357643 [0,0,0,1,0,0|2,0,1]=4 658 B12R1.407 OCC1CC=CCCCC(=O)O1 Amb24387772 [0,0,0,1,0,0|1,0,2]=4 659 B12R1.522 CC#CCCC1CCC1C(O)=O Amb25795809 [0,0,0,1,0,0|0,0,2]=3 660 B12R1.522 CC#CCNC1CCC1C(O)=O Amb25342773 [0,0,0,1,0,0|1,0,2]=4 661 B12R1.1335 CC(=O)C1CCCC=CCCC1 Amb25834384 [0,0,0,1,0,0|1,0,2]=4 662 B12R1.1335 CC(=O)N1CCCCCCCC1 Amb25169087 [0,0,0,1,0,0|2,0,0]=3 663 B12R1.1335 CC(O)C1CCCCCCCC1 Amb25092009 [0,0,0,1,0,0|1,0,1]=3 664 B12R1.1335 NC(=N)N1CCCCCCCC1 Amb25087293 [0,0,0,1,0,0|3,0,0]=4 665 B12R1.1335 NC(=O)C1CCCCCCCC1 Amb25685314 [0,0,0,1,0,0|1,0,0]=2 666 B12R1.1335 NC(=O)N1CCCCCCCC1 Amb25087978 [0,0,0,1,0,0|2,0,0]=3 667 B12R1.1335 OC(=O)C1CCCCCCCC1 Amb25034740 [0,0,0,1,0,0|0,0,0]=1 668 B12R1.1335 OC(=O)C1CCCCCCNN1 Amb24574710 [0,0,0,1,0,0|2,0,0]=3 669 B12R1.1343 C=C(Cl)CNC1CCCCCC1 Amb19077092 [0,0,0,1,0,0|3,0,0]=4 670 B12R1.1343 CC(=C)CCC1CNCCCC1 Amb25721572 [0,0,0,1,0,0|3,0,0]=4 671 B12R1.1343 CC(=C)CNC1CCCCCC1 Amb17308835 [0,0,0,1,0,0|3,0,0]=4 672 B12R1.1343 CC(=O)CCN1CCCCCC1 Amb1136685 [0,0,0,1,0,0|2,0,0]=3 673 B12R1.1343 CC(=O)CCN1CCCNCC1 Amb18984849 [0,0,0,1,0,0|3,0,0]=4 674 B12R1.1343 CC(=O)CCN1CCCOCC1 Amb18806959 [0,0,0,1,0,0|3,0,0]=4 675 B12R1.1343 CC(=O)CCN1CCCSCC1 Amb18329758 [0,0,0,1,0,0|3,0,0]=4 676 B12R1.1343 CC(=O)COC1CCCCCC1 Amb18793663 [0,0,0,1,0,0|2,0,0]=3 677 B12R1.1343 CC(Br)CCC1CCCCCC1 Amb25099682 [0,0,0,1,0,0|2,0,1]=4 678 B12R1.1343 CC(N)CCC1CCCCCC1 Amb25115183 [0,0,0,1,0,0|2,0,1]=4 679 B12R1.1343 CC(O)CCN1CCCCCC1 Amb18807064 [0,0,0,1,0,0|2,0,1]=4 680 B12R1.1343 CC(O)COC1CCCCCC1 Amb18807455 [0,0,0,1,0,0|2,0,1]=4 681 B12R1.1343 CS(=O)CCC1CCCCCN1 Amb24538992 [0,0,0,1,0,0|3,0,0]=4 682 B12R1.1343 CS(=O)CCC1CNCCCC1 Amb24569234 [0,0,0,1,0,0|3,0,0]=4 683 B12R1.1343 CS(=O)CCN1CCCCCC1 Amb24721303 [0,0,0,1,0,0|3,0,0]=4 684 B12R1.1343 C[C@@H](O)CNC1CCCCCC1 Amb25723595 [0,0,0,1,0,0|2,0,1]=4 685 B12R1.1343 ClC(=O)CCN1CCCCCC1 Amb17143075 [0,0,0,1,0,0|2,0,0]=3 686 B12R1.1343 NC(=N)COC1CCCCCC1 Amb18793708 [0,0,0,1,0,0|3,0,0]=4 687 B12R1.1343 NC(=O)CCC1CCCCCC1 Amb25061418 [0,0,0,1,0,0|1,0,0]=2 688 B12R1.1343 NC(=O)CCN1CCCCCC1 Amb17142920 [0,0,0,1,0,0|2,0,0]=3 689 B12R1.1343 NC(=O)CCN1CCCCCC1 Amb22469065 [0,0,0,1,0,0|2,0,0]=3 690 B12R1.1343 NC(=O)CCN1CCCOCC1 Amb18807418 [0,0,0,1,0,0|3,0,0]=4 691 B12R1.1343 NC(=O)CCN1CCCSCC1 Amb19071979 [0,0,0,1,0,0|3,0,0]=4 692 B12R1.1343 NC(=O)CNC1CCCCCC1 Amb1114001 [0,0,0,1,0,0|2,0,0]=3 693 B12R1.1343 NC(=O)CNC1CCCOCC1 Amb24485711 [0,0,0,1,0,0|3,0,0]=4 694 B12R1.1343 NC(=O)COC1CCCCCC1 Amb18802288 [0,0,0,1,0,0|2,0,0]=3 695 B12R1.1343 NC(=O)\C=C/C1CCCCCC1 Amb25076691 [0,0,0,1,0,0|1,0,2]=4 696 B12R1.1343 NC(=S)COC1CCCCCC1 Amb19059515 [0,0,0,1,0,0|2,1,0]=4 697 B12R1.1343 OC(=O)C#CC1CCCCCC1 Amb24556561 [0,0,0,1,0,0|0,0,2]=3 698 B12R1.1343 OC(=O)CCC1CCCCCC1 Amb18825578 [0,0,0,1,0,0|0,0,0]=1 699 B12R1.1343 OC(=O)CCC1CCCCCN1 Amb18198528 [0,0,0,1,0,0|1,0,0]=2 700 B12R1.1343 OC(=O)CCC1CCCCSS1 Amb25326088 [0,0,0,1,0,0|2,0,0]=3 701 B12R1.1343 OC(=O)CCC1CCCNCC1 Amb18198557 [0,0,0,1,0,0|1,0,0]=2 702 B12R1.1343 OC(=O)CCC1CCCOCC1 Amb18825358 [0,0,0,1,0,0|1,0,0]=2 703 B12R1.1343 OC(=O)CCC1CCCSCC1 Amb18820668 [0,0,0,1,0,0|1,0,0]=2 704 B12R1.1343 OC(=O)CCC=1CCCCCC1 Amb25209946 [0,0,0,1,0,0|0,0,2]=3 705 B12R1.1343 OC(=O)CCN1CCCOCC1 Amb19000940 [0,0,0,1,0,0|2,0,0]=3 706 B12R1.1343 OC(=O)CCN1CCCSCC1 Amb18977928 [0,0,0,1,0,0|2,0,0]=3 707 B12R1.1343 OC(=O)CNC1=NCCCCC1 Amb1083417 [0,0,0,1,0,0|2,0,1]=4 708 B12R1.1343 OC(=O)CNC1COCCOC1 Amb24633885 [0,0,0,1,0,0|3,0,0]=4 709 B12R1.1343 OC(=O)CNN1CCCCCC1 Amb25111269 [0,0,0,1,0,0|2,0,0]=3 710 B12R1.1343 OC(=O)COC1CCCCCC1 Amb18972071 [0,0,0,1,0,0|1,0,0]=2 711 B12R1.1343 OC(=O)CSC1CCCCCC1 Amb24493198 [0,0,0,1,0,0|1,0,0]=2 712 B12R1.1343 OC(=O)C\N=C\1/CCCCCN1 Amb22081473 [0,0,0,1,0,0|2,0,1]=4 713 B12R1.1343 OC(=O)\C=C\C1CCCCCC1 Amb24715822 [0,0,0,1,0,0|0,0,2]=3 714 B12R1.1343 [O-][N+](=O)CCN1CCCCCC1 Amb24593707 [0,0,0,1,0,0|2,0,1]=4 715 B12R1.1392 BrC(Br)=CC1CCCCCCC1 Amb24494606 [0,0,0,1,0,0|2,0,1]=4 716 B12R1.1392 C=C(Cl)CN1CCCCCCC1 Amb25086269 [0,0,0,1,0,0|3,0,0]=4 717 B12R1.1392 CC(=C)CC1CCCCCCC1 Amb24488603 [0,0,0,1,0,0|2,0,0]=3 718 B12R1.1392 CC(=O)CC1CCCCCC=C1 Amb25796709 [0,0,0,1,0,0|1,0,2]=4 719 B12R1.1392 CC(=O)CC=1CCCCCCC1 Amb24532525 [0,0,0,1,0,0|1,0,2]=4 720 B12R1.1392 CC(=O)NC1CCCNCCC1 Amb24532713 [0,0,0,1,0,0|3,0,0]=4 721 B12R1.1392 CC(O)CN1CCCCCCC1 Amb18794132 [0,0,0,1,0,0|2,0,1]=4 722 B12R1.1392 C[C@@H](N)CC1CCCCCCC1 Amb25361985 [0,0,0,1,0,0|2,0,1]=4 723 B12R1.1392 C[C@@H](O)CN1CCCCCCC1 Amb25035065 [0,0,0,1,0,0|2,0,1]=4 724 B12R1.1392 C[C@H](N)CC1CCCCCCC1 Amb25700859 [0,0,0,1,0,0|2,0,1]=4 725 B12R1.1392 NC(=N)NC1CCCCCCC1 Amb18801546 [0,0,0,1,0,0|3,0,0]=4 726 B12R1.1392 NC(=O)CC1CCCCCCC1 Amb25798922 [0,0,0,1,0,0|1,0,0]=2 727 B12R1.1392 NC(=O)CN1CCCCCCC1 Amb18806561 [0,0,0,1,0,0|2,0,0]=3 728 B12R1.1392 OC(=O)CC1CCCCCC=C1 Amb25059238 [0,0,0,1,0,0|0,0,2]=3 729 B12R1.1392 OC(=O)CC=1CCCCCCC1 Amb25751340 [0,0,0,1,0,0|0,0,2]=3 730 B12R1.1755 CCCCCC[C@@H]1C[C@H]1B(O)O Amb24329634 [0,0,0,1,0,0|1,0,1]=3 731 B9R0.2 BrCCCCCCC(=O)O Amb10071514 [2,0,0,0,0,0|1,0,0]=3 732 B9R0.2 C#CCCCCCC(O)=O Amb22232010 [2,0,0,0,0,0|0,0,2]=4 733 B9R0.2 C=NCCCCCC(O)=O Amb25111950 [2,0,0,0,0,0|1,0,1]=4 734 B9R0.2 CC(=O)CCCCCCBr Amb24436166 [2,0,0,0,0,0|2,0,0]=4 735 B9R0.2 CC(=O)CCCCCCF Amb25050277 [2,0,0,0,0,0|2,0,0]=4 736 B9R0.2 CC(=O)CCCCCCN Amb25147578 [2,0,0,0,0,0|2,0,0]=4 737 B9R0.2 CC(=O)CCCCCCO Amb25728037 [2,0,0,0,0,0|2,0,0]=4 738 B9R0.2 CCCCCCCB(O)O Amb13890611 [2,0,0,0,0,0|1,0,1]=4 739 B9R0.2 CCCCCCCC(=O)S Amb10561702 [2,0,0,0,0,0|0,1,0]=3 740 B9R0.2 CCCCCCCC(O)=O Amb22352272 [2,0,0,0,0,0|0,0,0]=2 741 B9R0.2 CCCCCCCC(O)=O Amb22353407 [2,0,0,0,0,0|0,0,0]=2 742 B9R0.2 CCCCCCCC([O-])=O Amb22045472 [2,0,0,0,0,0|0,0,1]=3 743 B9R0.2 CCCCCCCC([O-])=O Amb22731641 [2,0,0,0,0,0|0,0,1]=3 744 B9R0.2 CCCCCCCC([O-])=O Amb22732291 [2,0,0,0,0,0|0,0,1]=3 745 B9R0.2 CCCCCCCC([O-])=O Amb22732747 [2,0,0,0,0,0|0,0,1]=3 746 B9R0.2 CCCCCCC[13C](O)=O Amb20243497 [2,0,0,0,0,0|0,0,0]=2 747 B9R0.2 CCCCCCC[13C]([O-])=O Amb22366893 [2,0,0,0,0,0|0,0,1]=3 748 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [2,0,0,0,0,0|1,0,1]=4 749 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [2,0,0,0,0,0|1,0,1]=4 750 B9R0.2 CCCCCCC[N+]([O-])=O Amb17672611 [2,0,0,0,0,0|1,0,1]=4 751 B9R0.2 CCCCCCNC(N)=O Amb23569596 [2,0,0,0,0,0|2,0,0]=4 752 B9R0.2 CCCCCCNC(O)=S Amb24375451 [2,0,0,0,0,0|1,1,0]=4 753 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [2,0,0,0,0,0|2,0,0]=4 754 B9R0.2 CCCCCCOC(N)=O Amb22495526 [2,0,0,0,0,0|2,0,0]=4 755 B9R0.2 CCCCCCSC(N)=O Amb25765687 [2,0,0,0,0,0|2,0,0]=4 756 B9R0.2 CCCCCC[13CH2]C(O)=O Amb22367410 [2,0,0,0,0,0|0,0,0]=2 757 B9R0.2 CCCCCC[13CH2][13C](O)=O Amb22367490 [2,0,0,0,0,0|0,0,0]=2 758 B9R0.2 CCCCCNCC(=O)Cl Amb25248398 [2,0,0,0,0,0|2,0,0]=4 759 B9R0.2 CCCCCOCC(N)=O Amb25770302 [2,0,0,0,0,0|2,0,0]=4 760 B9R0.2 CCCCCSCC(N)=O Amb24524402 [2,0,0,0,0,0|2,0,0]=4 761 B9R0.2 CCCCSCCC(=O)O Amb1032992 [2,0,0,0,0,0|1,0,0]=3 762 B9R0.2 CCCCSCCC(N)=O Amb18798040 [2,0,0,0,0,0|2,0,0]=4 763 B9R0.2 CCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22351826 [2,0,0,0,0,0|0,0,0]=2 764 B9R0.2 CCCNCCCC(=O)O Amb1109953 [2,0,0,0,0,0|1,0,0]=3 765 B9R0.2 CCCNCCCC(N)=O Amb24513695 [2,0,0,0,0,0|2,0,0]=4 766 B9R0.2 CCC\C=C\CCC(O)=O Amb25378821 [2,0,0,0,0,0|0,0,2]=4 767 B9R0.2 CCNCCCCC(O)=O Amb24385094 [2,0,0,0,0,0|1,0,0]=3 768 B9R0.2 CCNCCNCC(O)=O Amb24568313 [2,0,0,0,0,0|2,0,0]=4 769 B9R0.2 CCNCCOCC(O)=O Amb18111801 [2,0,0,0,0,0|2,0,0]=4 770 B9R0.2 CCSCCNCC(O)=O Amb24652163 [2,0,0,0,0,0|2,0,0]=4 771 B9R0.2 CCSCCOCC(O)=O Amb24716269 [2,0,0,0,0,0|2,0,0]=4 772 B9R0.2 CC\C=C\CCCC(O)=O Amb18643886 [2,0,0,0,0,0|0,0,2]=4 773 B9R0.2 CNCCCCCC(C)=O Amb25728176 [2,0,0,0,0,0|2,0,0]=4 774 B9R0.2 CNCCCCCC(O)=O Amb25704769 [2,0,0,0,0,0|1,0,0]=3 775 B9R0.2 CNCCCNCC(O)=O Amb25292252 [2,0,0,0,0,0|2,0,0]=4 776 B9R0.2 CNCCOCCC(O)=O Amb18111840 [2,0,0,0,0,0|2,0,0]=4 777 B9R0.2 COCCCCCC(=O)O Amb10607872 [2,0,0,0,0,0|1,0,0]=3 778 B9R0.2 COCCCOCC(O)=O Amb25304314 [2,0,0,0,0,0|2,0,0]=4 779 B9R0.2 COCCCSCC(O)=O Amb18798347 [2,0,0,0,0,0|2,0,0]=4 780 B9R0.2 CONCCCCC(O)=O Amb25694999 [2,0,0,0,0,0|2,0,0]=4 781 B9R0.2 CSCCNCCC(O)=O Amb25055507 [2,0,0,0,0,0|2,0,0]=4 782 B9R0.2 CSCCOCCC(O)=O Amb25173504 [2,0,0,0,0,0|2,0,0]=4 783 B9R0.2 CSCCSCCC(O)=O Amb25798868 [2,0,0,0,0,0|2,0,0]=4 784 B9R0.2 CSSCCCCC(O)=O Amb24429106 [2,0,0,0,0,0|2,0,0]=4 785 B9R0.2 C[13CH2]CCCCCC(O)=O Amb22367488 [2,0,0,0,0,0|0,0,0]=2 786 B9R0.2 C\C=C\CCCCC(O)=O Amb18643887 [2,0,0,0,0,0|0,0,2]=4 787 B9R0.2 ClCCCCCCC(=O)O Amb17594087 [2,0,0,0,0,0|1,0,0]=3 788 B9R0.2 N#CCCCCCC(O)=O Amb18643705 [2,0,0,0,0,0|1,0,1]=4 789 B9R0.2 NCCCCCCC(=O)O Amb1151254 [2,0,0,0,0,0|1,0,0]=3 790 B9R0.2 NCCCCCCC(=O)O Amb16232099 [2,0,0,0,0,0|1,0,0]=3 791 B9R0.2 NCCCCSCC(=O)O Amb17500919 [2,0,0,0,0,0|2,0,0]=4 792 B9R0.2 NCCCOCCC(O)=O Amb18111494 [2,0,0,0,0,0|2,0,0]=4 793 B9R0.2 NCCCSCCC(O)=O Amb24496605 [2,0,0,0,0,0|2,0,0]=4 794 B9R0.2 NCCOCCCC(O)=O Amb18111467 [2,0,0,0,0,0|2,0,0]=4 795 B9R0.2 NCCSCCCC(=O)O Amb17500468 [2,0,0,0,0,0|2,0,0]=4 796 B9R0.2 NOCCCCCC(=O)O Amb10975958 [2,0,0,0,0,0|2,0,0]=4 797 B9R0.2 O=C(Cl)CCCCCCCl Amb24703296 [2,0,0,0,0,0|2,0,0]=4 798 B9R0.2 OC(=O)CCCCCCF Amb25132501 [2,0,0,0,0,0|1,0,0]=3 799 B9R0.2 OC(=O)CCCCCCS Amb24710334 [2,0,0,0,0,0|1,0,0]=3 800 B9R0.2 OC(=O)CCCNCCF Amb25312142 [2,0,0,0,0,0|2,0,0]=4 801 B9R0.2 OC(=O)CCOCCCBr Amb25207601 [2,0,0,0,0,0|2,0,0]=4 802 B9R0.2 OC(=O)CCOCCCF Amb25794478 [2,0,0,0,0,0|2,0,0]=4 803 B9R0.2 OC(=O)CNCCCCCl Amb24505281 [2,0,0,0,0,0|2,0,0]=4 804 B9R0.2 OC(=O)CNCCCCF Amb24588093 [2,0,0,0,0,0|2,0,0]=4 805 B9R0.2 OCCCCSCC(O)=O Amb18798269 [2,0,0,0,0,0|2,0,0]=4 806 B9R0.2 OCCCOCCC(O)=O Amb24476864 [2,0,0,0,0,0|2,0,0]=4 807 B9R0.2 ONCCCCCC(O)=O Amb25354224 [2,0,0,0,0,0|2,0,0]=4 808 B9R0.2 [13CH3]CCCCCCC(O)=O Amb22367137 [2,0,0,0,0,0|0,0,0]=2 809 B9R0.2 [13CH3][13CH2]CCCCCC(O)=O Amb22367489 [2,0,0,0,0,0|0,0,0]=2 810 B9R0.45 C#CCCCCCCC=O Amb25300437 [2,0,0,0,0,0|0,0,2]=4 811 B9R0.45 C=CCCCCCCCBr Amb19895211 [2,0,0,0,0,0|1,0,1]=4 812 B9R0.45 C=CCCCCCCCN Amb24763980 [2,0,0,0,0,0|1,0,1]=4 813 B9R0.45 C=CCCCCCCCO Amb22733549 [2,0,0,0,0,0|0,0,2]=4 814 B9R0.45 CCCCC#CCCCO Amb21962548 [2,0,0,0,0,0|0,0,2]=4 815 B9R0.45 CCCCC=NCCCO Amb24735221 [2,0,0,0,0,0|1,0,1]=4 816 B9R0.45 CCCCCC=NCCO Amb25769358 [2,0,0,0,0,0|1,0,1]=4 817 B9R0.45 CCCCCCC#CC=O Amb25227346 [2,0,0,0,0,0|0,0,2]=4 818 B9R0.45 CCCCCCC=CC=O Amb24061310 [2,0,0,0,0,0|0,0,2]=4 819 B9R0.45 CCCCCCCC=NO Amb25207893 [2,0,0,0,0,0|1,0,1]=4 820 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [2,0,0,0,0,0|1,0,0]=3 821 B9R0.45 CCCCCCCCNN Amb22552570 [2,0,0,0,0,0|2,0,0]=4 822 B9R0.45 CCCCCCCCSC Amb10553780 [2,0,0,0,0,0|1,0,1]=4 823 B9R0.45 CCCCCCCCSCl Amb25226772 [2,0,0,0,0,0|2,0,0]=4 824 B9R0.45 CCCCCCCCS[Au] Amb22354036 [2,0,0,0,0,0|2,0,0]=4 825 B9R0.45 CCCCCCCC[13C]#[13CH] Amb22338942 [2,0,0,0,0,0|0,0,2]=4 826 B9R0.45 CCCCCCCC[Hg]Cl Amb22359875 [2,0,0,0,0,0|2,0,0]=4 827 B9R0.45 CCCCCCCC[Mg]Br Amb22363181 [2,0,0,0,0,0|2,0,0]=4 828 B9R0.45 CCCCCCCC[Mg]Cl Amb22349193 [2,0,0,0,0,0|2,0,0]=4 829 B9R0.45 CCCCCCCOC=C Amb25817973 [2,0,0,0,0,0|1,0,1]=4 830 B9R0.45 CCCCCCCOCCl Amb25709280 [2,0,0,0,0,0|2,0,0]=4 831 B9R0.45 CCCCCCC\C=C\Cl Amb25322197 [2,0,0,0,0,0|1,0,1]=4 832 B9R0.45 CCCCCCC\C=C\I Amb24708038 [2,0,0,0,0,0|1,0,1]=4 833 B9R0.45 CCCCCCNCCF Amb25676977 [2,0,0,0,0,0|2,0,0]=4 834 B9R0.45 CCCCCCNCCS Amb24692640 [2,0,0,0,0,0|1,1,0]=4 835 B9R0.45 CCCCCCOCC=C Amb17933923 [2,0,0,0,0,0|1,0,1]=4 836 B9R0.45 CCCCCCSCC=C Amb22733767 [2,0,0,0,0,0|1,0,1]=4 837 B9R0.45 CCCCCCSCCCl Amb22228746 [2,0,0,0,0,0|2,0,0]=4 838 B9R0.45 CCCCCC\C=C/CO Amb10807383 [2,0,0,0,0,0|0,0,2]=4 839 B9R0.45 CCCCCC\C=C\CO Amb22168300 [2,0,0,0,0,0|0,0,2]=4 840 B9R0.45 CCCCCNCCCCl Amb24733861 [2,0,0,0,0,0|2,0,0]=4 841 B9R0.45 CCCCCNCCCI Amb24747725 [2,0,0,0,0,0|2,0,0]=4 842 B9R0.45 CCCCCNCCCN Amb17315271 [2,0,0,0,0,0|2,0,0]=4 843 B9R0.45 CCCCCOCCCS Amb25730351 [2,0,0,0,0,0|1,1,0]=4 844 B9R0.45 CCCCCSCCC=C Amb25120497 [2,0,0,0,0,0|1,0,1]=4 845 B9R0.45 CCCCCSCCCBr Amb24675807 [2,0,0,0,0,0|2,0,0]=4 846 B9R0.45 CCCCCSCCCC Amb25119856 [2,0,0,0,0,0|1,0,1]=4 847 B9R0.45 CCCCCSCCCN Amb17500694 [2,0,0,0,0,0|2,0,0]=4 848 B9R0.45 CCCCCSCCCO Amb17502837 [2,0,0,0,0,0|1,0,0]=3 849 B9R0.45 CCCCC\C=C/CC=O Amb22731181 [2,0,0,0,0,0|0,0,2]=4 850 B9R0.45 CCCCNCCCCCl Amb25349351 [2,0,0,0,0,0|2,0,0]=4 851 B9R0.45 CCCCNCCCCN Amb17334221 [2,0,0,0,0,0|2,0,0]=4 852 B9R0.45 CCCCOCCCC=C Amb25662912 [2,0,0,0,0,0|1,0,1]=4 853 B9R0.45 CCCCOCCCCCl Amb18798377 [2,0,0,0,0,0|2,0,0]=4 854 B9R0.45 CCCCOCCCCO Amb19375051 [2,0,0,0,0,0|1,0,0]=3 855 B9R0.45 CCCCOCOCCO Amb24414113 [2,0,0,0,0,0|2,0,0]=4 856 B9R0.45 CCCCSCCCC=C Amb24482054 [2,0,0,0,0,0|1,0,1]=4 857 B9R0.45 CCCCSCCCCCl Amb18184911 [2,0,0,0,0,0|2,0,0]=4 858 B9R0.45 CCCC[SnH2]CCCCN Amb22504059 [2,0,0,0,0,0|2,0,0]=4 859 B9R0.45 CCCC\C=C/CCC=O Amb24477003 [2,0,0,0,0,0|0,0,2]=4 860 B9R0.45 CCCNCCCCCCl Amb24472566 [2,0,0,0,0,0|2,0,0]=4 861 B9R0.45 CCCNCCCCCO Amb17334254 [2,0,0,0,0,0|1,0,0]=3 862 B9R0.45 CCCNCCNCCO Amb24644910 [2,0,0,0,0,0|2,0,0]=4 863 B9R0.45 CCCOCCCCCS Amb24475512 [2,0,0,0,0,0|1,1,0]=4 864 B9R0.45 CCCOCCOCCO Amb22351569 [2,0,0,0,0,0|2,0,0]=4 865 B9R0.45 CCCONCCCCO Amb24398863 [2,0,0,0,0,0|2,0,0]=4 866 B9R0.45 CCCSCCCCCN Amb18792401 [2,0,0,0,0,0|2,0,0]=4 867 B9R0.45 CCCSCCCCCO Amb18800675 [2,0,0,0,0,0|1,0,0]=3 868 B9R0.45 CCCSCCOCCO Amb18792609 [2,0,0,0,0,0|2,0,0]=4 869 B9R0.45 CCNCCCCCCCl Amb24613632 [2,0,0,0,0,0|2,0,0]=4 870 B9R0.45 CCNCCCCCCF Amb25686439 [2,0,0,0,0,0|2,0,0]=4 871 B9R0.45 CCNCCCCCCI Amb24481103 [2,0,0,0,0,0|2,0,0]=4 872 B9R0.45 CCNCCCCCCN Amb25855319 [2,0,0,0,0,0|2,0,0]=4 873 B9R0.45 CCNCCCCCCO Amb24683613 [2,0,0,0,0,0|1,0,0]=3 874 B9R0.45 CCNCCCOCCO Amb25687058 [2,0,0,0,0,0|2,0,0]=4 875 B9R0.45 CCNCCOCCCO Amb25320517 [2,0,0,0,0,0|2,0,0]=4 876 B9R0.45 CCNCCSCCCO Amb25046236 [2,0,0,0,0,0|2,0,0]=4 877 B9R0.45 CCOCCCCCC=O Amb25724799 [2,0,0,0,0,0|1,0,0]=3 878 B9R0.45 CCOCCCCCCBr Amb25299496 [2,0,0,0,0,0|2,0,0]=4 879 B9R0.45 CCOCCCCCCCl Amb18800872 [2,0,0,0,0,0|2,0,0]=4 880 B9R0.45 CCOCCCCCCI Amb25085906 [2,0,0,0,0,0|2,0,0]=4 881 B9R0.45 CCOCCCCCCN Amb24388111 [2,0,0,0,0,0|2,0,0]=4 882 B9R0.45 CCOCCCCCCO Amb25074993 [2,0,0,0,0,0|1,0,0]=3 883 B9R0.45 CCSCCCCCC=O Amb25205442 [2,0,0,0,0,0|1,0,0]=3 884 B9R0.45 CCSCCCCCCBr Amb25822578 [2,0,0,0,0,0|2,0,0]=4 885 B9R0.45 CCSCCCCCCCl Amb18186755 [2,0,0,0,0,0|2,0,0]=4 886 B9R0.45 CCSCCCCCCN Amb24482109 [2,0,0,0,0,0|2,0,0]=4 887 B9R0.45 CCSCCCNCCO Amb24380672 [2,0,0,0,0,0|2,0,0]=4 888 B9R0.45 CCSCCCSCCO Amb24376336 [2,0,0,0,0,0|2,0,0]=4 889 B9R0.45 CCSCCOCCC=O Amb24526413 [2,0,0,0,0,0|2,0,0]=4 890 B9R0.45 CNCCCCCCCCl Amb25809475 [2,0,0,0,0,0|2,0,0]=4 891 B9R0.45 CNCCCNCCCO Amb20171918 [2,0,0,0,0,0|2,0,0]=4 892 B9R0.45 CNCCCSCCCO Amb25110847 [2,0,0,0,0,0|2,0,0]=4 893 B9R0.45 CNCCNCCCCO Amb25785280 [2,0,0,0,0,0|2,0,0]=4 894 B9R0.45 COCCCCCCCBr Amb25122735 [2,0,0,0,0,0|2,0,0]=4 895 B9R0.45 COCCCCCCCO Amb25315004 [2,0,0,0,0,0|1,0,0]=3 896 B9R0.45 COCCCCCNC=O Amb24688397 [2,0,0,0,0,0|2,0,0]=4 897 B9R0.45 COCCCCSCCO Amb25841523 [2,0,0,0,0,0|2,0,0]=4 898 B9R0.45 COCCCNCCCO Amb17308606 [2,0,0,0,0,0|2,0,0]=4 899 B9R0.45 COCCCOCCC=O Amb25742389 [2,0,0,0,0,0|2,0,0]=4 900 B9R0.45 COCCCOCCCO Amb20242414 [2,0,0,0,0,0|2,0,0]=4 901 B9R0.45 COCCCSCCCO Amb25041322 [2,0,0,0,0,0|2,0,0]=4 902 B9R0.45 COCCNCCCCO Amb17334271 [2,0,0,0,0,0|2,0,0]=4 903 B9R0.45 COCOCCCCC=O Amb24333716 [2,0,0,0,0,0|2,0,0]=4 904 B9R0.45 CSCCCCCCCCl Amb25032475 [2,0,0,0,0,0|2,0,0]=4 905 B9R0.45 CSCCCCCCCO Amb24378634 [2,0,0,0,0,0|1,0,0]=3 906 B9R0.45 CSCCCCNCCO Amb24423555 [2,0,0,0,0,0|2,0,0]=4 907 B9R0.45 CSCCCSCCC=O Amb24441129 [2,0,0,0,0,0|2,0,0]=4 908 B9R0.45 CSCCNCCCCO Amb25703017 [2,0,0,0,0,0|2,0,0]=4 909 B9R0.45 CSCCSCCCCO Amb24356155 [2,0,0,0,0,0|2,0,0]=4 910 B9R0.45 C\C=C/CCCCCC=O Amb25289217 [2,0,0,0,0,0|0,0,2]=4 911 B9R0.45 C\C=C\CCCCCC=O Amb24681796 [2,0,0,0,0,0|0,0,2]=4 912 B9R0.45 C\C=C\CCCCCCC Amb22730483 [2,0,0,0,0,0|1,0,1]=4 913 B9R0.45 FCCCCCCCCF Amb22641491 [2,0,0,0,0,0|2,0,0]=4 914 B9R0.45 ICCCCCCCCI Amb20242379 [2,0,0,0,0,0|2,0,0]=4 915 B9R0.45 NCCCCCCCCBr Amb24744173 [2,0,0,0,0,0|2,0,0]=4 916 B9R0.45 NCCCCCCCCCl Amb25147234 [2,0,0,0,0,0|2,0,0]=4 917 B9R0.45 NCCCCCCCCF Amb25063266 [2,0,0,0,0,0|2,0,0]=4 918 B9R0.45 NCCCCCCCCO Amb24116967 [2,0,0,0,0,0|1,0,0]=3 919 B9R0.45 NCCCCCCCCS Amb25757074 [2,0,0,0,0,0|1,1,0]=4 920 B9R0.45 NCCCCCOCCO Amb24456752 [2,0,0,0,0,0|2,0,0]=4 921 B9R0.45 NCCCCSCCCO Amb17500966 [2,0,0,0,0,0|2,0,0]=4 922 B9R0.45 NCCCNCCCCO Amb24561165 [2,0,0,0,0,0|2,0,0]=4 923 B9R0.45 NCCCSCCCCO Amb24546562 [2,0,0,0,0,0|2,0,0]=4 924 B9R0.45 NCCOCCCCCO Amb24433692 [2,0,0,0,0,0|2,0,0]=4 925 B9R0.45 NCCSCCCCCO Amb18183510 [2,0,0,0,0,0|2,0,0]=4 926 B9R0.45 O=CCCCCCCCF Amb25075653 [2,0,0,0,0,0|1,0,0]=3 927 B9R0.45 O=CCCCC\C=C/CC Amb10844749 [2,0,0,0,0,0|0,0,2]=4 928 B9R0.45 O=COCCCCCCBr Amb25074988 [2,0,0,0,0,0|2,0,0]=4 929 B9R0.45 OCCCCCCCC#C Amb10563785 [2,0,0,0,0,0|0,0,2]=4 930 B9R0.45 OCCCCCCCC=O Amb25765567 [2,0,0,0,0,0|1,0,0]=3 931 B9R0.45 OCCCCCCCCF Amb25330666 [2,0,0,0,0,0|1,0,0]=3 932 B9R0.45 OCCCCCCNC=O Amb24452880 [2,0,0,0,0,0|2,0,0]=4 933 B9R0.45 OCCCCCNCCF Amb25697650 [2,0,0,0,0,0|2,0,0]=4 934 B9R0.45 OCCCCCSCCS Amb25682475 [2,0,0,0,0,0|2,0,0]=4 935 B9R0.45 OCCCCC\C=C/CC Amb10807384 [2,0,0,0,0,0|0,0,2]=4 936 B9R0.45 OCCCCNCCCF Amb25065751 [2,0,0,0,0,0|2,0,0]=4 937 B9R0.45 OCCNCCCCCO Amb25771811 [2,0,0,0,0,0|2,0,0]=4 938 B9R0.45 OCCOCCCCCCl Amb25368354 [2,0,0,0,0,0|2,0,0]=4 939 B9R0.45 OCCSCCCCCF Amb25800644 [2,0,0,0,0,0|2,0,0]=4 940 B9R0.45 OCCSCCCCCO Amb18800854 [2,0,0,0,0,0|2,0,0]=4 941 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [2,0,0,0,0,0|2,0,0]=4 942 B11R0.2 CCCCCCC(C)OC(=O)Cl Amb24061311 [1,1,0,0,0,0|2,0,0]=4 943 B11R0.2 CCCCCCC(CC(=O)O)N Amb2229636 [1,1,0,0,0,0|0,0,0]=2 944 B11R0.2 CCCCCCC(O)CC(O)=O Amb18803982 [1,1,0,0,0,0|0,0,0]=2 945 B11R0.2 CCCCCCN(C)CC(O)=O Amb19373387 [1,1,0,0,0,0|1,0,0]=3 946 B11R0.2 CCCC\C=C\C(O)CC(O)=O Amb22831931 [1,1,0,0,0,0|0,0,2]=4 947 B11R0.2 CC\C=C/CCC(O)CC(O)=O Amb22831932 [1,1,0,0,0,0|0,0,2]=4 948 B11R0.30 CC(=O)CCCCCCC(C)=O Amb21962685 [1,1,0,0,0,0|1,0,1]=4 949 B11R0.30 CC(=O)SCCCCCC(O)=O Amb22337829 [1,1,0,0,0,0|1,0,1]=4 950 B11R0.30 CC(C)CCNCCCC(O)=O Amb24271192 [1,1,0,0,0,0|1,0,0]=3 951 B11R0.30 OC(=O)CCCCCNC(=O)C Amb1208026 [1,1,0,0,0,0|1,0,1]=4 952 B11R0.40 CCCCCCCCC(C)C=O Amb22730336 [1,1,0,0,0,0|1,0,1]=4 953 B11R0.40 CCCCCCCCC(O)CC Amb18803155 [1,1,0,0,0,0|1,0,1]=4 954 B11R0.40 CCCCCCCCS(=O)C=C Amb1032994 [1,1,0,0,0,0|2,0,0]=4 955 B11R0.40 CCCCCCCC[C@@H](O)CCl Amb22736715 [1,1,0,0,0,0|1,0,1]=4 956 B11R0.40 CCCCCCCC[C@H](O)CCl Amb22736716 [1,1,0,0,0,0|1,0,1]=4 957 B11R0.40 CCCCCCCNC(=O)CBr Amb17323631 [1,1,0,0,0,0|2,0,0]=4 958 B11R0.40 CCCCCCCNC(=O)CCl Amb17329833 [1,1,0,0,0,0|2,0,0]=4 959 B11R0.40 CCCCCCCNC(=O)CN Amb24115161 [1,1,0,0,0,0|2,0,0]=4 960 B11R0.40 CCCCCCCOC(=O)C=C Amb17934060 [1,1,0,0,0,0|2,0,0]=4 961 B11R0.40 CCCCCCOCC(=O)NN Amb19960388 [1,1,0,0,0,0|2,0,0]=4 962 B11R0.40 CCCCC\C=C\CC(=O)OC Amb10807478 [1,1,0,0,0,0|0,0,2]=4 963 B11R0.40 COC(=O)CCCCCCCBr Amb24063235 [1,1,0,0,0,0|1,0,0]=3 964 B11R0.40 COC(=O)CCCCCCCN Amb20669115 [1,1,0,0,0,0|1,0,0]=3 965 B11R0.40 COC(=O)CCCCCCCN Amb24331924 [1,1,0,0,0,0|1,0,0]=3 966 B11R0.40 COC(=O)CCCOCCCN Amb18111569 [1,1,0,0,0,0|2,0,0]=4 967 B11R0.40 COC(=O)CCCOCCNC Amb18624289 [1,1,0,0,0,0|2,0,0]=4 968 B11R0.40 COC(=O)NCCCCCCO Amb24095886 [1,1,0,0,0,0|2,0,0]=4 969 B11R0.40 NCCCSCCCC(=O)OC Amb17500720 [1,1,0,0,0,0|2,0,0]=4 970 B11R0.40 OCCCSCCCC(=O)OC Amb17502861 [1,1,0,0,0,0|2,0,0]=4 971 B11R0.42 C=CCCCCC[C@@H](N)C(O)=O Amb22745701 [1,1,0,0,0,0|0,0,2]=4 972 B11R0.42 CCCCCCCC(=O)C(O)=O Amb22904309 [1,1,0,0,0,0|0,0,1]=3 973 B11R0.42 CCCCCCCC(Br)C(O)=O Amb21520353 [1,1,0,0,0,0|0,0,0]=2 974 B11R0.42 CCCCCCCC(C(=O)O)N Amb2229635 [1,1,0,0,0,0|0,0,0]=2 975 B11R0.42 CCCCCCCC(C)C(O)=O Amb18794410 [1,1,0,0,0,0|0,0,0]=2 976 B11R0.42 CCCCCCCC(O)C(O)=O Amb18790307 [1,1,0,0,0,0|0,0,0]=2 977 B11R0.42 CCCCCCC[C@@H](N)C(O)=O Amb22747720 [1,1,0,0,0,0|0,0,0]=2 978 B11R0.42 CCCCCSC[C@H](N)C(O)=O Amb22451173 [1,1,0,0,0,0|1,0,0]=3 979 B11R0.42 CCCCSCC[C@H](C(=O)O)N Amb17610162 [1,1,0,0,0,0|1,0,0]=3 980 B11R0.42 CCNCCCCC(C(=O)O)N Amb17614099 [1,1,0,0,0,0|1,0,0]=3 981 B11R0.42 CCOCCNCC(C(=O)O)C Amb13952381 [1,1,0,0,0,0|2,0,0]=4 982 B11R0.42 CCOCCSC[C@@H](N)C(O)=O Amb19132222 [1,1,0,0,0,0|2,0,0]=4 983 B11R0.42 C\C(=C\CCCCCC)\C(O)=O Amb22359372 [1,1,0,0,0,0|0,0,2]=4 984 B11R0.46 CCCCCC(CCC(=O)O)C Amb10807482 [1,1,0,0,0,0|0,0,0]=2 985 B11R0.46 CCCCCC(\C=C\C(=O)O)O Amb10549834 [1,1,0,0,0,0|0,0,2]=4 986 B11R0.46 CCCCNC(=O)CCC(=O)O Amb1785994 [1,1,0,0,0,0|1,0,1]=4 987 B11R0.46 CCCCOC(=O)CCC(O)=O Amb19888684 [1,1,0,0,0,0|1,0,1]=4 988 B11R0.111 CCC(C)CCCCCC(O)=O Amb22232340 [1,1,0,0,0,0|0,0,0]=2 989 B11R0.111 COC(=O)CCCCCC(=O)O Amb13887311 [1,1,0,0,0,0|1,0,1]=4 990 B11R0.111 OC(=O)CCCCCC(F)CBr Amb22547633 [1,1,0,0,0,0|1,0,0]=3 991 B11R0.147 CCCCN(CCCC(=O)Cl)C Amb17143107 [1,1,0,0,0,0|2,0,0]=4 992 B11R0.147 CCCNC(=O)CCCC(=O)O Amb1841483 [1,1,0,0,0,0|1,0,1]=4 993 B11R0.159 CCCCCCCCP(C)(C)=O Amb22733619 [1,1,0,0,0,0|2,0,0]=4 994 B11R0.159 CCCCCCCCP(Cl)(Cl)=O Amb17674003 [1,1,0,0,0,0|2,0,0]=4 995 B11R0.159 CCCCCCCCP(O)(O)=O Amb19515959 [1,1,0,0,0,0|1,0,0]=3 996 B11R0.159 CCCCCCCCS(=O)(=O)C Amb10553781 [1,1,0,0,0,0|1,0,1]=4 997 B11R0.159 CCCCCCCCS(O)(=O)=O Amb22228001 [1,1,0,0,0,0|1,0,0]=3 998 B11R0.176 OC(=O)CCCC[C@@H](S)CCS Amb24099064 [1,1,0,0,0,0|1,0,0]=3 999 B11R0.176 SCCC(CCCCC(=O)O)S Amb17595596 [1,1,0,0,0,0|1,0,0]=3 1000 B11R0.3 C=CCCCCCCCCC=C Amb19944679 [1,1,0,0,0,0|1,0,1]=4 1001 B11R0.3 C=CCCCCCCCC[Mg]Br Amb22897280 [1,1,0,0,0,0|2,0,0]=4 1002 B11R0.3 C=CCCCCCCCC[Zn]Br Amb22898142 [1,1,0,0,0,0|2,0,0]=4 1003 B11R0.3 CCCCCCCCCCCF Amb17939015 [1,1,0,0,0,0|1,0,1]=4 1004 B11R0.3 CCCCCCCCCCCS Amb22366963 [1,1,0,0,0,0|0,1,1]=4 1005 B11R0.3 CCCCCCCCCCOC Amb21520322 [1,1,0,0,0,0|0,0,1]=3 1006 B11R0.3 CCCCCCCCCC[13CH]=[13CH2] Amb22351201 [1,1,0,0,0,0|1,0,0]=3 1007 B11R0.3 CCCCCCCCCC[Hg]Cl Amb22359876 [1,1,0,0,0,0|1,0,1]=4 1008 B11R0.3 CCCCCCCCCC[Mg]Br Amb22363113 [1,1,0,0,0,0|1,0,1]=4 1009 B11R0.3 CCCCCCCCCC[Mg]Cl Amb22737569 [1,1,0,0,0,0|1,0,1]=4 1010 B11R0.3 CCCCCCCCCN=C=O Amb22336763 [1,1,0,0,0,0|0,0,1]=3 1011 B11R0.3 CCCCCCCCCSCC Amb22359735 [1,1,0,0,0,0|1,0,1]=4 1012 B11R0.3 CCCCCCCCNCCN Amb18794624 [1,1,0,0,0,0|1,0,1]=4 1013 B11R0.3 CCCCCCCCNCCN Amb22358941 [1,1,0,0,0,0|1,0,1]=4 1014 B11R0.3 CCCCCCCCOCC=O Amb18807440 [1,1,0,0,0,0|0,0,0]=2 1015 B11R0.3 CCCCCCCCSCC#N Amb10669578 [1,1,0,0,0,0|1,0,1]=4 1016 B11R0.3 CCCCCCCCSCCO Amb1032988 [1,1,0,0,0,0|0,0,1]=3 1017 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [1,1,0,0,0,0|0,0,1]=3 1018 B11R0.3 CCCCCCCC\C=C\CO Amb22052644 [1,1,0,0,0,0|0,0,1]=3 1019 B11R0.3 CCCCCCCNCCCN Amb18794637 [1,1,0,0,0,0|1,0,1]=4 1020 B11R0.3 CCCCCNCCCCOC Amb18808137 [1,1,0,0,0,0|1,0,1]=4 1021 B11R0.3 CCCCCOCCOCCO Amb22366805 [1,1,0,0,0,0|1,0,1]=4 1022 B11R0.3 CC\C=C/CCCCCCC=O Amb10807471 [1,1,0,0,0,0|0,0,1]=3 1023 B11R0.3 CNCCCCCCCCNC Amb22336315 [1,1,0,0,0,0|2,0,0]=4 1024 B11R0.3 CNCCNCCCCCCC Amb20140578 [1,1,0,0,0,0|2,0,0]=4 1025 B11R0.3 COCCCCCCCCOC Amb21618846 [1,1,0,0,0,0|1,0,1]=4 1026 B11R0.3 C\C=C\CCCCCCCCO Amb22641580 [1,1,0,0,0,0|0,0,2]=4 1027 B11R0.3 ICCCCCCCCCCI Amb10071532 [1,1,0,0,0,0|1,0,1]=4 1028 B11R0.3 NCCCCCCCCCCBr Amb17609917 [1,1,0,0,0,0|1,0,1]=4 1029 B11R0.3 NCCCCCCCCCCN Amb22732919 [1,1,0,0,0,0|1,0,1]=4 1030 B11R0.3 NCCCCCCCCCCO Amb17607975 [1,1,0,0,0,0|0,0,1]=3 1031 B11R0.3 O=CCCCCCCCCCBr Amb21963218 [1,1,0,0,0,0|0,0,0]=2 1032 B11R0.3 OCCCCCCCCC#CC Amb10605931 [1,1,0,0,0,0|0,0,2]=4 1033 B11R0.3 OCCCCCCCCCCCl Amb10844747 [1,1,0,0,0,0|0,0,1]=3 1034 B11R0.4 CCCCCCCC(O)CCC Amb18803156 [1,1,0,0,0,0|1,0,1]=4 1035 B11R0.4 CCCCCCC[C@@H](C)N=C=O Amb22042696 [1,1,0,0,0,0|1,0,1]=4 1036 B11R0.4 CCCCCCC[C@H](C)N=C=O Amb22045306 [1,1,0,0,0,0|1,0,1]=4 1037 B11R0.81 CCCCC(O)CCCCCC Amb22045161 [1,1,0,0,0,0|1,0,1]=4 1038 B11R0.140 CCCCCC(CCCCC)Br Amb10553280 [1,1,0,0,0,0|1,0,1]=4 1039 B13R0.274 CCCCCCCC(=O)CC(=O)OC Amb17617713 [0,2,0,0,0,0|0,0,1]=3 1040 B13R0.274 CCCCCCCC(C)NC(=O)CCl Amb22345953 [0,2,0,0,0,0|2,0,0]=4 1041 B13R0.274 CCCCCCCC(O)CC(=O)OC Amb21928817 [0,2,0,0,0,0|0,0,0]=2 1042 B13R0.274 CCCCCCC[C@H](CC(=O)OC)O Amb17615271 [0,2,0,0,0,0|0,0,0]=2 1043 B13R0.274 CCCCCCNC(C)CC(=O)OC Amb20673380 [0,2,0,0,0,0|1,0,0]=3 1044 B13R0.335 CCCCCCCCC(O)CC(O)=O Amb21928763 [0,2,0,0,0,0|0,0,0]=2 1045 B13R0.335 CCCCCCCNC(C)CC(N)=O Amb20090477 [0,2,0,0,0,0|1,0,0]=3 1046 B13R0.335 CCCCCC\C=C\C(O)CC(O)=O Amb22831935 [0,2,0,0,0,0|0,0,1]=3 1047 B13R0.335 CC\C=C/CCCCC(O)CC(O)=O Amb22831936 [0,2,0,0,0,0|0,0,1]=3 1048 B13R0.71 CCC(C)CN(C)CCCCC(O)=O Amb24770113 [0,2,0,0,0,0|1,0,0]=3 1049 B13R0.182 CN(CCC(=O)O)CCCOC(C)C Amb17337973 [0,2,0,0,0,0|2,0,0]=4 1050 B13R0.188 CCCCNC(=O)CSCCC(O)=O Amb22269137 [0,2,0,0,0,0|1,0,1]=4 1051 B13R0.188 CSCCCC(=O)NCCCC(O)=O Amb18411872 [0,2,0,0,0,0|1,0,1]=4 1052 B13R0.300 CCCCN(CCCCC(O)=O)CC Amb24770066 [0,2,0,0,0,0|1,0,0]=3 1053 B13R0.345 CCCCC(C)C(=O)NCCC(O)=O Amb25386909 [0,2,0,0,0,0|1,0,1]=4 1054 B13R0.456 CCCCS(=O)(=O)NCCCC(=O)O Amb1109633 [0,2,0,0,0,0|2,0,0]=4 1055 B13R0.280 CCCCCCCCCCP(=O)(C)C Amb1239581 [0,2,0,0,0,0|2,0,0]=4 1056 B13R0.280 CCCCCCCCCCS(O)(=O)=O Amb22348234 [0,2,0,0,0,0|1,0,0]=3 1057 B13R0.280 CCCCCCCCCOS(C)(=O)=O Amb24664290 [0,2,0,0,0,0|1,0,1]=4 1058 B13R0.280 CCCCCCCCCOS([O-])(=O)=O Amb22045176 [0,2,0,0,0,0|1,0,1]=4 1059 B13R0.1215 CCCCCCCCOS(=O)(=O)O[Na] Amb22352581 [0,2,0,0,0,0|2,0,0]=4 1060 B13R0.88 COCC(=O)NCCCCCC(=O)O Amb1131616 [0,2,0,0,0,0|1,0,1]=4 1061 B13R0.180 OC(=O)CCCCCNC(=O)C(C)C Amb1127947 [0,2,0,0,0,0|1,0,1]=4 1062 B13R0.204 CCC(=O)NCCCC[C@@H](N)C(O)=O Amb24184174 [0,2,0,0,0,0|1,0,1]=4 1063 B13R0.291 CCS(=O)(=O)NCCCCCC(=O)O Amb1124665 [0,2,0,0,0,0|2,0,0]=4 1064 B13R0.1 CCCCCCC(O)C\C=C\C(O)=O Amb22545321 [0,2,0,0,0,0|0,0,1]=3 1065 B13R0.1 CCCCCNC(=O)NCCC(=O)O Amb17042891 [0,2,0,0,0,0|1,0,1]=4 1066 B13R0.1 COCCCCC(=O)NCCC(O)=O Amb25387598 [0,2,0,0,0,0|1,0,1]=4 1067 B13R0.1 CSCCCCC(=O)NCCC(O)=O Amb25387540 [0,2,0,0,0,0|1,0,1]=4 1068 B13R0.139 CCCCCC(=O)N(C)CCC(O)=O Amb19049303 [0,2,0,0,0,0|1,0,1]=4 1069 B13R0.139 CCSCCC(C)N(C)CCC(O)=O Amb25387473 [0,2,0,0,0,0|2,0,0]=4 1070 B13R0.339 CCCCCC(=O)NCC(C)C(O)=O Amb19087936 [0,2,0,0,0,0|1,0,1]=4 1071 B13R0.1259 CCCCCS(=O)(=O)NCCC(O)=O Amb25387552 [0,2,0,0,0,0|2,0,0]=4 1072 B13R0.1259 NCCCCS(=O)(=O)CCCC(=O)O Amb17501090 [0,2,0,0,0,0|2,0,0]=4 1073 B13R0.1398 CC(CCNC(=O)CCCC(=O)O)C Amb1887695 [0,2,0,0,0,0|1,0,1]=4 1074 B13R0.54 BrCCCCCCCCCCC(=O)N Amb16207966 [0,2,0,0,0,0|1,0,0]=3 1075 B13R0.54 C=CCCCCCCCCOC(=O)C Amb10563791 [0,2,0,0,0,0|1,0,1]=4 1076 B13R0.54 CCCCCCCCCC=CC(=O)O Amb13952752 [0,2,0,0,0,0|0,0,0]=2 1077 B13R0.54 CCCCCCCCCCCC(=C)Br Amb19886460 [0,2,0,0,0,0|2,0,0]=4 1078 B13R0.54 CCCCCCCCCCCC(=N)N Amb10568321 [0,2,0,0,0,0|2,0,0]=4 1079 B13R0.54 CCCCCCCCCCCC(=S)N Amb13953232 [0,2,0,0,0,0|1,1,0]=4 1080 B13R0.54 CCCCCCCCCCCC(C)=C Amb19886457 [0,2,0,0,0,0|2,0,0]=4 1081 B13R0.54 CCCCCCCCCCCC(O)=O Amb22348404 [0,2,0,0,0,0|0,0,0]=2 1082 B13R0.54 CCCCCCCCCCCC(O)=O Amb22730643 [0,2,0,0,0,0|0,0,0]=2 1083 B13R0.54 CCCCCCCCCCCC([O-])=O Amb17942849 [0,2,0,0,0,0|0,0,1]=3 1084 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22729066 [0,2,0,0,0,0|0,0,1]=3 1085 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730602 [0,2,0,0,0,0|0,0,1]=3 1086 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730786 [0,2,0,0,0,0|0,0,1]=3 1087 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731774 [0,2,0,0,0,0|0,0,1]=3 1088 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731775 [0,2,0,0,0,0|0,0,1]=3 1089 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22733752 [0,2,0,0,0,0|0,0,1]=3 1090 B13R0.54 CCCCCCCCCCC[13C](O)=O Amb21928681 [0,2,0,0,0,0|0,0,0]=2 1091 B13R0.54 CCCCCCCCCCC[14C](O)=O Amb22349630 [0,2,0,0,0,0|0,0,0]=2 1092 B13R0.54 CCCCCCCCCCNC(=O)N Amb2228230 [0,2,0,0,0,0|1,0,0]=3 1093 B13R0.54 CCCCCCCCCCOC(=O)Cl Amb22337976 [0,2,0,0,0,0|1,0,0]=3 1094 B13R0.54 CCCCCCCCCCOC([S-])=S Amb22334119 [0,2,0,0,0,0|0,2,0]=4 1095 B13R0.54 CCCCCCCCCCOP(O)O Amb22049477 [0,2,0,0,0,0|1,0,1]=4 1096 B13R0.54 CCCCCCCCCC[13CH2]C(O)=O Amb22353612 [0,2,0,0,0,0|0,0,0]=2 1097 B13R0.54 CCCCCCCCCC[13CH2][13C](O)=O Amb22353611 [0,2,0,0,0,0|0,0,0]=2 1098 B13R0.54 CCCCCCCCSCCC(=O)N Amb10669601 [0,2,0,0,0,0|1,0,0]=3 1099 B13R0.54 CCCCCCCCSCCC(=O)O Amb1038994 [0,2,0,0,0,0|0,0,0]=2 1100 B13R0.54 CCCCCCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22353609 [0,2,0,0,0,0|0,0,0]=2 1101 B13R0.54 CCCCCCC\C=C\COC(C)=O Amb22730835 [0,2,0,0,0,0|1,0,1]=4 1102 B13R0.54 CCCCCC\C=C/CCCC(O)=O Amb20672025 [0,2,0,0,0,0|0,0,0]=2 1103 B13R0.54 CCCCSCCCCCCC(=O)O Amb1036584 [0,2,0,0,0,0|0,0,0]=2 1104 B13R0.54 CCCC\C=C\CCCCOC(C)=O Amb22731600 [0,2,0,0,0,0|1,0,1]=4 1105 B13R0.54 CC\C=C/CCCCCCOC(=O)C Amb10563792 [0,2,0,0,0,0|1,0,1]=4 1106 B13R0.54 CC\C=C\CCCCCCOC(C)=O Amb22729861 [0,2,0,0,0,0|1,0,1]=4 1107 B13R0.54 N#CCCCCCCCCCC(O)=O Amb22547629 [0,2,0,0,0,0|0,0,0]=2 1108 B13R0.54 NC(=[NH2+])SCCCCCCCCCO Amb22054616 [0,2,0,0,0,0|2,0,0]=4 1109 B13R0.54 NCCCCCCCCCCC(=O)Cl Amb17143769 [0,2,0,0,0,0|1,0,0]=3 1110 B13R0.54 NCCCCCCCCCCC([O-])=O Amb22353821 [0,2,0,0,0,0|0,0,1]=3 1111 B13R0.54 OCCCCCCCCCCC(=O)O Amb1814707 [0,2,0,0,0,0|0,0,0]=2 1112 B13R0.54 [13CH3]CCCCCCCCCCC(O)=O Amb22353502 [0,2,0,0,0,0|0,0,0]=2 1113 B13R0.54 [13CH3]CCCCCCCCCC[13C](O)=O Amb22353610 [0,2,0,0,0,0|0,0,0]=2 1114 B13R0.147 C#CCCCCCCCCC(=O)NO Amb1625635 [0,2,0,0,0,0|0,0,1]=3 1115 B13R0.147 CC#CCCCCCCCC(=O)OC Amb22641576 [0,2,0,0,0,0|0,0,1]=3 1116 B13R0.147 CCCCCCCCC#CC(=O)OC Amb22228923 [0,2,0,0,0,0|0,0,1]=3 1117 B13R0.147 CCCCCCCCCCC(=O)C=O Amb24084923 [0,2,0,0,0,0|0,0,1]=3 1118 B13R0.147 CCCCCCCCCCC(O)CC Amb22229414 [0,2,0,0,0,0|1,0,1]=4 1119 B13R0.147 CCCCCCCCCCC(O)CO Amb22002456 [0,2,0,0,0,0|0,0,2]=4 1120 B13R0.147 CCCCCCCCCNC(=O)CCl Amb17797886 [0,2,0,0,0,0|1,0,0]=3 1121 B13R0.147 CCCCCCCCCOC(=O)C=C Amb20670989 [0,2,0,0,0,0|1,0,0]=3 1122 B13R0.147 CCCCCCCCCOC(=O)CS Amb22369347 [0,2,0,0,0,0|0,1,0]=3 1123 B13R0.147 CCCCCCCNCCC(=O)NN Amb20171959 [0,2,0,0,0,0|1,0,0]=3 1124 B13R0.147 CCCCCCCNCC\C(\N)=N/O Amb19981286 [0,2,0,0,0,0|1,0,0]=3 1125 B13R0.147 CCCCCCC\C=C\CC(=O)CC Amb21963232 [0,2,0,0,0,0|1,0,1]=4 1126 B13R0.147 CCCCCCOCCOC(=O)C=C Amb17934068 [0,2,0,0,0,0|2,0,0]=4 1127 B13R0.147 CNC(=O)CCNCCCCCCC Amb18333360 [0,2,0,0,0,0|1,0,0]=3 1128 B13R0.147 C\C=C\CCCCCCCC(=O)OC Amb22641574 [0,2,0,0,0,0|0,0,1]=3 1129 B13R0.147 NCCCCCCCCNC(=O)CBr Amb19981082 [0,2,0,0,0,0|2,0,0]=4 1130 B13R0.147 NCCOCCSCCCC(=O)OC Amb17502012 [0,2,0,0,0,0|2,0,0]=4 1131 B13R0.147 OCCCCCCCCCC(=O)OC Amb13887310 [0,2,0,0,0,0|0,0,0]=2 1132 B13R0.150 CC(=C)C(=O)OCCCCCCCC Amb22730596 [0,2,0,0,0,0|2,0,0]=4 1133 B13R0.150 CC(CCCCCCCCO)C(O)=O Amb20246737 [0,2,0,0,0,0|0,0,0]=2 1134 B13R0.150 CCCCCCCCCC(C)C(O)=O Amb18320092 [0,2,0,0,0,0|0,0,0]=2 1135 B13R0.150 CCCCCCCCCC(O)C(O)=O Amb22224801 [0,2,0,0,0,0|0,0,0]=2 1136 B13R0.150 CCCCCCCCNC(=O)C(Br)C Amb17327670 [0,2,0,0,0,0|2,0,0]=4 1137 B13R0.150 CCCCCCCCNC(=O)C(C)O Amb22346363 [0,2,0,0,0,0|1,0,0]=3 1138 B13R0.150 CCCCCCCCNC(=O)C(Cl)C Amb17329451 [0,2,0,0,0,0|2,0,0]=4 1139 B13R0.150 CCCCCCCCOC(=O)C(C)C Amb22336265 [0,2,0,0,0,0|2,0,0]=4 1140 B13R0.154 CCCCCCCC(=O)COC(=O)C Amb10562376 [0,2,0,0,0,0|1,0,1]=4 1141 B13R0.154 CCCCCCCC(O)CCC(O)=O Amb22058992 [0,2,0,0,0,0|0,0,0]=2 1142 B13R0.154 CCCCCCCC(O)CCC([O-])=O Amb19148937 [0,2,0,0,0,0|0,0,1]=3 1143 B13R0.154 CCCCCCNC(=O)CCC(=O)N Amb17143236 [0,2,0,0,0,0|1,0,1]=4 1144 B13R0.179 CC(C)CCCCCCCCC(O)=O Amb21928890 [0,2,0,0,0,0|0,0,0]=2 1145 B13R0.179 CC(CCCCCCCCC(=O)O)N Amb2229643 [0,2,0,0,0,0|0,0,0]=2 1146 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22264826 [0,2,0,0,0,0|0,0,1]=3 1147 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22351881 [0,2,0,0,0,0|0,0,1]=3 1148 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22369048 [0,2,0,0,0,0|0,0,1]=3 1149 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22168122 [0,2,0,0,0,0|0,0,2]=4 1150 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22730286 [0,2,0,0,0,0|0,0,2]=4 1151 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22733850 [0,2,0,0,0,0|0,0,2]=4 1152 B13R0.202 CCC(C)CCCCCCCC(O)=O Amb21928874 [0,2,0,0,0,0|0,0,0]=2 1153 B13R0.202 CCC(CCCCCCCC(=O)O)N Amb2229644 [0,2,0,0,0,0|0,0,0]=2 1154 B13R0.202 COC(=O)CCCCCCCC(=O)O Amb2099653 [0,2,0,0,0,0|0,0,1]=3 1155 B13R0.202 COC(=O)CCCCCCCC(C)C Amb22503804 [0,2,0,0,0,0|0,0,0]=2 1156 B13R0.202 OC(=O)CCCCCCCC(F)CBr Amb22547613 [0,2,0,0,0,0|0,0,0]=2 1157 B13R0.2 CCCCCCCCCC(=O)OC=C Amb17672564 [0,2,0,0,0,0|0,0,0]=2 1158 B13R0.2 CCCCCCCCCC(O)CCC Amb22229885 [0,2,0,0,0,0|1,0,1]=4 1159 B13R0.2 CCCCCCCCCC(O)CCO Amb24081769 [0,2,0,0,0,0|0,0,2]=4 1160 B13R0.2 CCCCCCCCNC(=O)CC#N Amb1103425 [0,2,0,0,0,0|2,0,0]=4 1161 B13R0.2 CCCCCCCCNC(=O)CCCl Amb17327381 [0,2,0,0,0,0|2,0,0]=4 1162 B13R0.2 CCCCCCCCOC(=O)CC#N Amb16232993 [0,2,0,0,0,0|2,0,0]=4 1163 B13R0.2 CCCCCCCCOC(=O)CCC Amb22043399 [0,2,0,0,0,0|2,0,0]=4 1164 B13R0.2 CCCCCCNCCC(=O)OCC Amb18334458 [0,2,0,0,0,0|1,0,0]=3 1165 B13R0.2 CCCCC\C=C\CCC(=O)OCC Amb22052631 [0,2,0,0,0,0|0,0,2]=4 1166 B13R0.2 CCOC(=O)CCCCCCCCBr Amb21520303 [0,2,0,0,0,0|1,0,0]=3 1167 B13R0.2 CCOC(=O)\C=C\CCCCCCC Amb22035135 [0,2,0,0,0,0|0,0,2]=4 1168 B13R0.2 CCOCCCCOCC(=O)OCC Amb24103488 [0,2,0,0,0,0|2,0,0]=4 1169 B13R0.2 CNCC(=O)NCCCCCCCC Amb24115165 [0,2,0,0,0,0|2,0,0]=4 1170 B13R0.2 OCCCCCCCCC(=O)OCC Amb17613857 [0,2,0,0,0,0|1,0,0]=3 1171 B13R0.340 CCCCCCCCC(F)[C@@H](O)CO Amb24122594 [0,2,0,0,0,0|0,0,2]=4 1172 B13R0.340 CCCCCCCCC(O)C(=O)OC Amb21928816 [0,2,0,0,0,0|0,0,0]=2 1173 B13R0.340 CCCCCCCOC(C(=O)OC)C Amb2445105 [0,2,0,0,0,0|1,0,0]=3 1174 B13R0.340 CCCCCCNCC(C)C(=O)OC Amb20673379 [0,2,0,0,0,0|1,0,0]=3 1175 B13R0.412 CCCCCCCCCC(OC)OC Amb22168244 [0,2,0,0,0,0|0,0,2]=4 1176 B13R0.61 CCCCCCCCC(CC)C(O)=O Amb18320093 [0,2,0,0,0,0|0,0,0]=2 1177 B13R0.413 CCSCCNCCC(C)(C)C(O)=O Amb25387165 [0,2,0,0,0,0|2,0,0]=4 1178 B13R0.413 [2H]C([2H])(CCCCCCCC)C(O)=O Amb21928613 [0,2,0,0,0,0|0,0,0]=2 1179 B11R1.24 CCCCC1=CC(=O)CCC1 Amb17593800 [1,0,0,1,0,0|1,0,1]=4 1180 B11R1.24 CCCCC1CC(=O)CCC1 Amb24485994 [1,0,0,1,0,0|1,0,0]=3 1181 B11R1.24 CCCCC1CC(=O)CCN1 Amb24183850 [1,0,0,1,0,0|2,0,0]=4 1182 B11R1.24 CCCCC1CC(=O)CCO1 Amb24415155 [1,0,0,1,0,0|2,0,0]=4 1183 B11R1.24 CCCCC1CC(=O)CCS1 Amb24486265 [1,0,0,1,0,0|2,0,0]=4 1184 B11R1.24 CCCCC1CCCC(=O)O1 Amb10807434 [1,0,0,1,0,0|0,0,0]=2 1185 B11R1.24 CCCCC1CCCC(O)C1 Amb24704856 [1,0,0,1,0,0|1,0,1]=4 1186 B11R1.24 CCCCC1CCCC(O)O1 Amb25686218 [1,0,0,1,0,0|0,0,2]=4 1187 B11R1.24 CCCCC1CCNC(=O)N1 Amb24560997 [1,0,0,1,0,0|2,0,0]=4 1188 B11R1.24 CCCCC1CNCC(=O)N1 Amb25233143 [1,0,0,1,0,0|2,0,0]=4 1189 B11R1.24 CCCCC1COCC(=O)N1 Amb24631709 [1,0,0,1,0,0|2,0,0]=4 1190 B11R1.24 CCCC[C@@H]1CCC[C@@H](O)O1 Amb24618777 [1,0,0,1,0,0|0,0,2]=4 1191 B11R1.24 CCCC[C@@H]1CCC[C@H](O)O1 Amb24515589 [1,0,0,1,0,0|0,0,2]=4 1192 B11R1.24 CCCC[C@H]1CC(=O)CCC1 Amb24722780 [1,0,0,1,0,0|1,0,0]=3 1193 B11R1.24 CCCC[C@H]1CCCC(=O)N1 Amb24376413 [1,0,0,1,0,0|1,0,0]=3 1194 B11R1.24 CCCC[C@H]1CCNC(=O)N1 Amb24470814 [1,0,0,1,0,0|2,0,0]=4 1195 B11R1.24 CCCOC1CC(=O)CCC1 Amb25345496 [1,0,0,1,0,0|2,0,0]=4 1196 B11R1.24 CCCSC1CC(=O)CCC1 Amb24509264 [1,0,0,1,0,0|2,0,0]=4 1197 B11R1.24 COCCC1CCCC(=O)N1 Amb25077282 [1,0,0,1,0,0|2,0,0]=4 1198 B11R1.24 NCCCC1CCCC(=O)N1 Amb18200144 [1,0,0,1,0,0|2,0,0]=4 1199 B11R1.24 OCCCC1CC(=O)CCC1 Amb24485794 [1,0,0,1,0,0|2,0,0]=4 1200 B11R1.24 OCCCC1CCCC(=O)N1 Amb18199970 [1,0,0,1,0,0|2,0,0]=4 1201 B11R1.27 CCCCCC1C=CC(=O)O1 Amb24766300 [1,0,0,1,0,0|0,0,2]=4 1202 B11R1.27 CCCCCC1CC(=O)CC1 Amb24106993 [1,0,0,1,0,0|1,0,0]=3 1203 B11R1.27 CCCCCC1CC(=O)CO1 Amb24766911 [1,0,0,1,0,0|2,0,0]=4 1204 B11R1.27 CCCCCC1CCC(=O)N1 Amb17940081 [1,0,0,1,0,0|1,0,0]=3 1205 B11R1.27 CCCCCC1CCC(=S)N1 Amb17845330 [1,0,0,1,0,0|1,1,0]=4 1206 B11R1.27 CCCCCC1NC(=O)CS1 Amb25384627 [1,0,0,1,0,0|2,0,0]=4 1207 B11R1.27 CCCCCC1OCC(=C)O1 Amb24763039 [1,0,0,1,0,0|2,0,0]=4 1208 B11R1.27 CCCCC[C@@H]1CCC(=O)N1 Amb25385733 [1,0,0,1,0,0|1,0,0]=3 1209 B11R1.27 CCCCC[C@@H]1CC[C@@H](O)C1 Amb25384687 [1,0,0,1,0,0|1,0,1]=4 1210 B11R1.27 CCCCC[C@@H]1CC[C@H](O)C1 Amb25384688 [1,0,0,1,0,0|1,0,1]=4 1211 B11R1.27 CCCCC[C@@H]1COC(=O)N1 Amb24765069 [1,0,0,1,0,0|2,0,0]=4 1212 B11R1.27 CCCCC[C@H]1CCC(=O)O1 Amb22348365 [1,0,0,1,0,0|0,0,0]=2 1213 B11R1.27 CCCCC[C@H]1CC[C@@H](O)C1 Amb25384689 [1,0,0,1,0,0|1,0,1]=4 1214 B11R1.27 CCCCC[C@H]1CC[C@H](O)C1 Amb25384690 [1,0,0,1,0,0|1,0,1]=4 1215 B11R1.27 CCCCNC1CC(=O)CC1 Amb25383691 [1,0,0,1,0,0|2,0,0]=4 1216 B11R1.27 CCCCOC1CC(=O)CC1 Amb25380438 [1,0,0,1,0,0|2,0,0]=4 1217 B11R1.27 CCCCOC1CCC(=O)N1 Amb25384421 [1,0,0,1,0,0|2,0,0]=4 1218 B11R1.27 CCCCSC1CCC(=O)N1 Amb24765408 [1,0,0,1,0,0|2,0,0]=4 1219 B11R1.27 CCCNCC1CCC(=O)N1 Amb25382477 [1,0,0,1,0,0|2,0,0]=4 1220 B11R1.27 CCCSCC1CCC(=O)N1 Amb24766533 [1,0,0,1,0,0|2,0,0]=4 1221 B11R1.27 CC\C=C\CC1CCC(=O)O1 Amb25233581 [1,0,0,1,0,0|0,0,2]=4 1222 B11R1.27 O=CCCCC1CCC(=O)O1 Amb25385739 [1,0,0,1,0,0|1,0,1]=4 1223 B11R1.53 C#C[C@H]1CCCC[C@H]1C(O)=O Amb24538775 [1,0,0,1,0,0|0,0,2]=4 1224 B11R1.53 C=CC1CCCCC1C(O)=O Amb18644639 [1,0,0,1,0,0|0,0,2]=4 1225 B11R1.53 C=C[C@H]1CCCC[C@@H]1C(O)=O Amb25302272 [1,0,0,1,0,0|0,0,2]=4 1226 B11R1.53 CC(=O)C1CCCCC1CBr Amb24398756 [1,0,0,1,0,0|2,0,0]=4 1227 B11R1.53 CC(=O)C1CCCCC1CN Amb24488210 [1,0,0,1,0,0|2,0,0]=4 1228 B11R1.53 CC(O)C1CCCCC1CC Amb25145792 [1,0,0,1,0,0|1,0,1]=4 1229 B11R1.53 CCC1CC=CCC1C(O)=O Amb25700917 [1,0,0,1,0,0|0,0,2]=4 1230 B11R1.53 CCC1CCCCC1B(O)O Amb21927861 [1,0,0,1,0,0|1,0,1]=4 1231 B11R1.53 CCC1CCCCC1C(C)=O Amb25097208 [1,0,0,1,0,0|1,0,0]=3 1232 B11R1.53 CCC1CCCCC1C(N)=N Amb25145793 [1,0,0,1,0,0|2,0,0]=4 1233 B11R1.53 CCC1CCCCC1C(N)=S Amb25055516 [1,0,0,1,0,0|1,1,0]=4 1234 B11R1.53 CCC1CCCCN1C(=O)Cl Amb17563073 [1,0,0,1,0,0|2,0,0]=4 1235 B11R1.53 CCC1CCNCC1C(O)=O Amb18199964 [1,0,0,1,0,0|1,0,0]=3 1236 B11R1.53 CCC1NCCCC1C(N)=O Amb25344118 [1,0,0,1,0,0|2,0,0]=4 1237 B11R1.53 CCC1NCCOC1C(O)=O Amb22496550 [1,0,0,1,0,0|2,0,0]=4 1238 B11R1.53 CCC1SCCSC1C(O)=O Amb25282389 [1,0,0,1,0,0|2,0,0]=4 1239 B11R1.53 CCC=1CCCCC1C(O)=O Amb18644662 [1,0,0,1,0,0|0,0,2]=4 1240 B11R1.53 CCN1CCCCC1C(=O)O Amb10603421 [1,0,0,1,0,0|1,0,0]=3 1241 B11R1.53 CCN1CCCCC1C(C)=O Amb24665055 [1,0,0,1,0,0|2,0,0]=4 1242 B11R1.53 CCN1CCCCC1C(N)=O Amb25120557 [1,0,0,1,0,0|2,0,0]=4 1243 B11R1.53 CCN1CCNCC1C(O)=O Amb18199893 [1,0,0,1,0,0|2,0,0]=4 1244 B11R1.53 CCN1CCOCC1C(O)=O Amb22059744 [1,0,0,1,0,0|2,0,0]=4 1245 B11R1.53 CCN1CCSCC1C(O)=O Amb18197102 [1,0,0,1,0,0|2,0,0]=4 1246 B11R1.53 CC[C@@H]1CCCC[C@H]1C(C)=O Amb25232533 [1,0,0,1,0,0|1,0,0]=3 1247 B11R1.53 CC[C@@H]1NCCC[C@H]1C(O)=O Amb18199984 [1,0,0,1,0,0|1,0,0]=3 1248 B11R1.53 CC[C@@H]1OCCC[C@@H]1C(N)=O Amb24340007 [1,0,0,1,0,0|2,0,0]=4 1249 B11R1.53 CC[C@H]1CCCCN1C(C)=O Amb25115875 [1,0,0,1,0,0|2,0,0]=4 1250 B11R1.53 CC[C@H]1CCCC[C@@H]1C(O)=O Amb25258056 [1,0,0,1,0,0|0,0,0]=2 1251 B11R1.53 CNC1CCCCC1C(N)=O Amb25255322 [1,0,0,1,0,0|2,0,0]=4 1252 B11R1.53 CNC1CCOCC1C(O)=O Amb24695892 [1,0,0,1,0,0|2,0,0]=4 1253 B11R1.53 CN[C@@H]1CCCC[C@@H]1C(O)=O Amb24519490 [1,0,0,1,0,0|1,0,0]=3 1254 B11R1.53 CN[C@H]1CCCC[C@@H]1C(N)=O Amb24611030 [1,0,0,1,0,0|2,0,0]=4 1255 B11R1.53 COC1CCCCC1C(=O)Cl Amb25124892 [1,0,0,1,0,0|2,0,0]=4 1256 B11R1.53 COC1CCCCC1C(O)=O Amb18967398 [1,0,0,1,0,0|1,0,0]=3 1257 B11R1.53 CO[C@@H]1CCCC[C@@H]1C(O)=O Amb24652410 [1,0,0,1,0,0|1,0,0]=3 1258 B11R1.53 CSC1CCCCC1C(O)=O Amb18288578 [1,0,0,1,0,0|1,0,0]=3 1259 B11R1.53 ClCC1CCCCC1C(=O)C Amb17594421 [1,0,0,1,0,0|2,0,0]=4 1260 B11R1.53 N#CC1CCCCC1C(O)=O Amb18125545 [1,0,0,1,0,0|1,0,1]=4 1261 B11R1.53 N#C[C@@H]1CCCC[C@@H]1C(O)=O Amb25295486 [1,0,0,1,0,0|1,0,1]=4 1262 B11R1.53 N#C[C@H]1CCCC[C@@H]1C(O)=O Amb25377785 [1,0,0,1,0,0|1,0,1]=4 1263 B11R1.53 N#C[C@H]1CCCC[C@H]1C(O)=O Amb25235571 [1,0,0,1,0,0|1,0,1]=4 1264 B11R1.53 NC(=O)C1CCCCC1CCl Amb24564378 [1,0,0,1,0,0|2,0,0]=4 1265 B11R1.53 NC(=O)[C@H]1CCCC[C@@H]1CCl Amb24739718 [1,0,0,1,0,0|2,0,0]=4 1266 B11R1.53 NC(=O)[C@H]1CCCC[C@@H]1CO Amb22388549 [1,0,0,1,0,0|2,0,0]=4 1267 B11R1.53 NC(=O)[C@H]1CCCC[C@H]1CO Amb25362020 [1,0,0,1,0,0|2,0,0]=4 1268 B11R1.53 NCC1CCCCC1C(O)=O Amb18126060 [1,0,0,1,0,0|1,0,0]=3 1269 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(O)=O Amb22901093 [1,0,0,1,0,0|1,0,0]=3 1270 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(O)=O Amb24602383 [1,0,0,1,0,0|1,0,0]=3 1271 B11R1.53 NC[C@@H]1CCCC[C@H]1C(O)=O Amb24740766 [1,0,0,1,0,0|1,0,0]=3 1272 B11R1.53 O=C(Cl)C1CCCCC1CCl Amb25233402 [1,0,0,1,0,0|2,0,0]=4 1273 B11R1.53 OC(=O)C1CCCCC1C=O Amb24442969 [1,0,0,1,0,0|1,0,1]=4 1274 B11R1.53 OC(=O)C1CCCCC1CBr Amb18658502 [1,0,0,1,0,0|1,0,0]=3 1275 B11R1.53 OC(=O)C1CCCCC1CF Amb20668097 [1,0,0,1,0,0|1,0,0]=3 1276 B11R1.53 OC(=O)[C@H]1CCCCC1C=O Amb24563437 [1,0,0,1,0,0|1,0,1]=4 1277 B11R1.53 OC(=O)[C@H]1CCCC[C@@H]1C=O Amb25176135 [1,0,0,1,0,0|1,0,1]=4 1278 B11R1.53 OC(=O)[C@H]1CCCC[C@H]1C=O Amb25686106 [1,0,0,1,0,0|1,0,1]=4 1279 B11R1.53 OCC1CCCCC1C(O)=O Amb24484407 [1,0,0,1,0,0|1,0,0]=3 1280 B11R1.53 OC[C@@H]1CCCC[C@@H]1C(O)=O Amb24615220 [1,0,0,1,0,0|1,0,0]=3 1281 B11R1.53 OC[C@@H]1CCCC[C@H]1C(=O)N Amb16233807 [1,0,0,1,0,0|2,0,0]=4 1282 B11R1.53 OC[C@@H]1NCCC[C@H]1C(O)=O Amb18199870 [1,0,0,1,0,0|2,0,0]=4 1283 B11R1.53 OC[C@H]1CCCC[C@@H]1C(O)=O Amb25326727 [1,0,0,1,0,0|1,0,0]=3 1284 B11R1.53 OC[C@H]1CCCC[C@H]1C(O)=O Amb24554835 [1,0,0,1,0,0|1,0,0]=3 1285 B11R1.57 CC(=O)CC1CCCC1CCl Amb24741030 [1,0,0,1,0,0|2,0,0]=4 1286 B11R1.57 CC(=O)C[C@H]1CCC[C@H]1CCl Amb25347179 [1,0,0,1,0,0|2,0,0]=4 1287 B11R1.57 CCC1CCCC1=CC(O)=O Amb25296695 [1,0,0,1,0,0|0,0,2]=4 1288 B11R1.57 CCC1CCCC1CC(O)=O Amb18125992 [1,0,0,1,0,0|0,0,0]=2 1289 B11R1.57 CCC1CCCC1NC(C)=O Amb25225827 [1,0,0,1,0,0|2,0,0]=4 1290 B11R1.57 CCC1CCCC1NC(N)=O Amb24474777 [1,0,0,1,0,0|2,0,0]=4 1291 B11R1.57 CCC1CCCN1CC(C)=O Amb18791674 [1,0,0,1,0,0|2,0,0]=4 1292 B11R1.57 CCC1CCCN1CC(N)=O Amb18797013 [1,0,0,1,0,0|2,0,0]=4 1293 B11R1.57 CCC1CCCN1CC(O)=O Amb18971987 [1,0,0,1,0,0|1,0,0]=3 1294 B11R1.57 CCC1NCCC1CC(O)=O Amb24390544 [1,0,0,1,0,0|1,0,0]=3 1295 B11R1.57 CCN1CCCC1CC(=O)O Amb17504530 [1,0,0,1,0,0|1,0,0]=3 1296 B11R1.57 CCN1CCCC1CC(N)=O Amb24363296 [1,0,0,1,0,0|2,0,0]=4 1297 B11R1.57 CCN1CCCC1CC(O)=O Amb20622924 [1,0,0,1,0,0|1,0,0]=3 1298 B11R1.57 CC[C@@H]1CCC[C@@H]1CC(O)=O Amb24603943 [1,0,0,1,0,0|0,0,0]=2 1299 B11R1.57 CC[C@@H]1COC[C@@H]1CC(C)=O Amb24631661 [1,0,0,1,0,0|2,0,0]=4 1300 B11R1.57 CC[C@@H]1NCC[C@H]1CC(O)=O Amb18199980 [1,0,0,1,0,0|1,0,0]=3 1301 B11R1.57 COC1CCCC1CC(C)=O Amb25751036 [1,0,0,1,0,0|2,0,0]=4 1302 B11R1.57 COC1CCCC1CC(O)=O Amb18199909 [1,0,0,1,0,0|1,0,0]=3 1303 B11R1.57 N#CC1CCCC1CC(O)=O Amb18201141 [1,0,0,1,0,0|1,0,1]=4 1304 B11R1.57 NCC1CCCC1CC(O)=O Amb25311074 [1,0,0,1,0,0|1,0,0]=3 1305 B11R1.57 NC[C@@H]1CCCN1CC(O)=O Amb24737565 [1,0,0,1,0,0|2,0,0]=4 1306 B11R1.57 NC[C@H]1CCCN1CC(O)=O Amb25314232 [1,0,0,1,0,0|2,0,0]=4 1307 B11R1.57 NC[C@H]1CCC[C@H]1CC(O)=O Amb25267777 [1,0,0,1,0,0|1,0,0]=3 1308 B11R1.57 OC(=O)CC1CCCC1C=O Amb18644793 [1,0,0,1,0,0|1,0,1]=4 1309 B11R1.57 OC(=O)CC1CCC[C@H]1C=O Amb25772836 [1,0,0,1,0,0|1,0,1]=4 1310 B11R1.57 OC(=O)CN1CCCC1CBr Amb21861250 [1,0,0,1,0,0|2,0,0]=4 1311 B11R1.57 OC(=O)CN1CCCC1CCl Amb21861115 [1,0,0,1,0,0|2,0,0]=4 1312 B11R1.57 OC(=O)CN1CCCC1CI Amb21861275 [1,0,0,1,0,0|2,0,0]=4 1313 B11R1.57 OCC1CCCC1CC(O)=O Amb25694766 [1,0,0,1,0,0|1,0,0]=3 1314 B11R1.57 OCC1CCCN1CC(O)=O Amb18984550 [1,0,0,1,0,0|2,0,0]=4 1315 B11R1.57 OC[C@@H]1CCCN1CC(=O)O Amb10067045 [1,0,0,1,0,0|2,0,0]=4 1316 B11R1.57 OC[C@H]1CCCN1CC(=O)O Amb10067044 [1,0,0,1,0,0|2,0,0]=4 1317 B11R1.86 C=C1CCCCC1CC(O)=O Amb18125767 [1,0,0,1,0,0|0,0,2]=4 1318 B11R1.86 CC(=O)CC1CCCCC1N Amb24582661 [1,0,0,1,0,0|2,0,0]=4 1319 B11R1.86 CC(=O)C[C@@H]1CCCC[C@H]1Cl Amb25362130 [1,0,0,1,0,0|2,0,0]=4 1320 B11R1.86 CC(=O)C[C@H]1CCCCN1C Amb25188595 [1,0,0,1,0,0|2,0,0]=4 1321 B11R1.86 CC(=O)C[C@H]1CCCC[C@@H]1O Amb24573530 [1,0,0,1,0,0|2,0,0]=4 1322 B11R1.86 CC(=O)C[NH+]1CCCCC1C Amb16224767 [1,0,0,1,0,0|2,0,0]=4 1323 B11R1.86 CC/1CCCC\C1=C/C(O)=O Amb22339342 [1,0,0,1,0,0|0,0,2]=4 1324 B11R1.86 CC1=CCCCC1CC(O)=O Amb24634335 [1,0,0,1,0,0|0,0,2]=4 1325 B11R1.86 CC1C=CCCC1CC(O)=O Amb25796450 [1,0,0,1,0,0|0,0,2]=4 1326 B11R1.86 CC1CCCCC1CC(=C)Br Amb25313178 [1,0,0,1,0,0|2,0,0]=4 1327 B11R1.86 CC1CCCCC1CC(O)=O Amb22339306 [1,0,0,1,0,0|0,0,0]=2 1328 B11R1.86 CC1CCCCC1OC(N)=O Amb25242471 [1,0,0,1,0,0|2,0,0]=4 1329 B11R1.86 CC1CCCCN1CC(O)=O Amb21955230 [1,0,0,1,0,0|1,0,0]=3 1330 B11R1.86 CC1CCCNC1CC(C)=O Amb25683413 [1,0,0,1,0,0|2,0,0]=4 1331 B11R1.86 CC1CCCNC1CC(N)=O Amb24501854 [1,0,0,1,0,0|2,0,0]=4 1332 B11R1.86 CC1COCCC1CC(O)=O Amb24484704 [1,0,0,1,0,0|1,0,0]=3 1333 B11R1.86 CN1CCCC[C@H]1CC(O)=O Amb25723356 [1,0,0,1,0,0|1,0,0]=3 1334 B11R1.86 CN1CCNCC1CC(O)=O Amb18199894 [1,0,0,1,0,0|2,0,0]=4 1335 B11R1.86 CN1CCOCC1CC(O)=O Amb18199876 [1,0,0,1,0,0|2,0,0]=4 1336 B11R1.86 C[C@@H]1C=CCC[C@H]1CC(O)=O Amb24552872 [1,0,0,1,0,0|0,0,2]=4 1337 B11R1.86 C[C@@H]1CCCC[C@H]1NC(C)=O Amb25256700 [1,0,0,1,0,0|2,0,0]=4 1338 B11R1.86 C[C@@H]1CCCN[C@@H]1CC(C)=O Amb24743575 [1,0,0,1,0,0|2,0,0]=4 1339 B11R1.86 C[C@@H]1CCCN[C@H]1CC(C)=O Amb24519267 [1,0,0,1,0,0|2,0,0]=4 1340 B11R1.86 C[C@H]1CCCC[C@H]1CC(O)=O Amb25241512 [1,0,0,1,0,0|0,0,0]=2 1341 B11R1.86 C[C@H]1CNCCN1CC(O)=O Amb25843322 [1,0,0,1,0,0|2,0,0]=4 1342 B11R1.86 ClC(=O)CN1CCCCC1C Amb17142954 [1,0,0,1,0,0|2,0,0]=4 1343 B11R1.86 NC(=O)CC1CCCCC1O Amb25700984 [1,0,0,1,0,0|2,0,0]=4 1344 B11R1.86 NC(=O)C[C@@H]1CCCC[C@@H]1O Amb25232566 [1,0,0,1,0,0|2,0,0]=4 1345 B11R1.86 NC(=O)C[C@@H]1CCCC[C@H]1O Amb25226892 [1,0,0,1,0,0|2,0,0]=4 1346 B11R1.86 NC(=O)C[C@H]1CCCC[C@@H]1O Amb24339775 [1,0,0,1,0,0|2,0,0]=4 1347 B11R1.86 NC(=O)C[NH+]1CCCCC1C Amb16224760 [1,0,0,1,0,0|2,0,0]=4 1348 B11R1.86 NC(=O)NC1CCCCC1C Amb1105317 [1,0,0,1,0,0|2,0,0]=4 1349 B11R1.86 NC1CCCCC1CC(N)=O Amb18964457 [1,0,0,1,0,0|2,0,0]=4 1350 B11R1.86 NC1CCCCC1CC(O)=O Amb24509773 [1,0,0,1,0,0|1,0,0]=3 1351 B11R1.86 NC1CCCCN1CC(O)=O Amb25152865 [1,0,0,1,0,0|2,0,0]=4 1352 B11R1.86 NC1CCCC[C@@H]1CC(O)=O Amb24426265 [1,0,0,1,0,0|1,0,0]=3 1353 B11R1.86 N[C@H]1CCCC[C@H]1CC(N)=O Amb24513039 [1,0,0,1,0,0|2,0,0]=4 1354 B11R1.86 N[C@H]1CCCC[C@H]1CC(O)=O Amb24561031 [1,0,0,1,0,0|1,0,0]=3 1355 B11R1.86 OC(=O)CC1CCCCC1=O Amb18125947 [1,0,0,1,0,0|1,0,1]=4 1356 B11R1.86 OC(=O)CC1CCCCC1F Amb24697602 [1,0,0,1,0,0|1,0,0]=3 1357 B11R1.86 OC(=O)CC1CCCCN1C Amb1076959 [1,0,0,1,0,0|1,0,0]=3 1358 B11R1.86 OC(=O)CC1CCCCN1C Amb13885783 [1,0,0,1,0,0|1,0,0]=3 1359 B11R1.86 OC(=O)CC1CCNCC1F Amb25242841 [1,0,0,1,0,0|2,0,0]=4 1360 B11R1.86 OC(=O)CC1CCOCC1F Amb24559540 [1,0,0,1,0,0|2,0,0]=4 1361 B11R1.86 OC(=O)C[C@@H]1CCCC[C@H]1F Amb25168843 [1,0,0,1,0,0|1,0,0]=3 1362 B11R1.86 OC1CCCC[C@@H]1CC(O)=O Amb25233444 [1,0,0,1,0,0|1,0,0]=3 1363 B11R1.86 OC1CCCOC1CC(O)=O Amb25764417 [1,0,0,1,0,0|2,0,0]=4 1364 B11R1.86 OC1CCOCC1CC(O)=O Amb18199848 [1,0,0,1,0,0|2,0,0]=4 1365 B11R1.86 OC1CCSCC1CC(O)=O Amb18196579 [1,0,0,1,0,0|2,0,0]=4 1366 B11R1.86 OC1CNCCC1CC(O)=O Amb24101098 [1,0,0,1,0,0|2,0,0]=4 1367 B11R1.86 OC1COCCC1CC(O)=O Amb18199849 [1,0,0,1,0,0|2,0,0]=4 1368 B11R1.86 OC1CSCCC1CC(O)=O Amb18196580 [1,0,0,1,0,0|2,0,0]=4 1369 B11R1.86 O[C@@H]1CCCCC1CC(O)=O Amb25792260 [1,0,0,1,0,0|1,0,0]=3 1370 B11R1.86 O[C@H]1CCCC[C@@H]1CC(O)=O Amb25274080 [1,0,0,1,0,0|1,0,0]=3 1371 B11R1.86 O[C@H]1CCCC[C@H]1CC(O)=O Amb25210705 [1,0,0,1,0,0|1,0,0]=3 1372 B11R1.86 O[C@H]1CCSC[C@H]1CC(O)=O Amb24552908 [1,0,0,1,0,0|2,0,0]=4 1373 B11R1.90 CC(=O)CCC1CCCN1C Amb25145698 [1,0,0,1,0,0|2,0,0]=4 1374 B11R1.90 CC1CCCC1C#CC(O)=O Amb25779879 [1,0,0,1,0,0|0,0,2]=4 1375 B11R1.90 CC1CCCC1CCC(N)=O Amb25242796 [1,0,0,1,0,0|1,0,0]=3 1376 B11R1.90 CC1CCCC1CCC(O)=O Amb18644848 [1,0,0,1,0,0|0,0,0]=2 1377 B11R1.90 CC1CCCC1CNC(N)=O Amb24393298 [1,0,0,1,0,0|2,0,0]=4 1378 B11R1.90 CC1CCCC1NCC(N)=O Amb24477639 [1,0,0,1,0,0|2,0,0]=4 1379 B11R1.90 CC1CCCC1NCC(O)=O Amb25713954 [1,0,0,1,0,0|1,0,0]=3 1380 B11R1.90 CC1CCCN1CCC(C)=O Amb18179609 [1,0,0,1,0,0|2,0,0]=4 1381 B11R1.90 CC1CCCN1CCC(N)=O Amb18182113 [1,0,0,1,0,0|2,0,0]=4 1382 B11R1.90 CC1CCCN1CCC(O)=O Amb18290255 [1,0,0,1,0,0|1,0,0]=3 1383 B11R1.90 CC1CCOC1CCC(C)=O Amb24662411 [1,0,0,1,0,0|2,0,0]=4 1384 B11R1.90 CC=1CCCC1CCC(O)=O Amb24373821 [1,0,0,1,0,0|0,0,2]=4 1385 B11R1.90 C[C@@H]1CCC[C@@H]1CNC(C)=O Amb25685467 [1,0,0,1,0,0|2,0,0]=4 1386 B11R1.90 C[C@@H]1CCC[C@H]1CNC(C)=O Amb25274431 [1,0,0,1,0,0|2,0,0]=4 1387 B11R1.90 C[C@H]1CCC[C@@H]1CCC(N)=O Amb24552880 [1,0,0,1,0,0|1,0,0]=3 1388 B11R1.90 OC(=O)CCC1CCCC1=O Amb17400002 [1,0,0,1,0,0|1,0,1]=4 1389 B11R1.90 OC(=O)CCC1CCCN1C Amb17504569 [1,0,0,1,0,0|1,0,0]=3 1390 B11R1.90 OC(=O)CNC1CCCC1F Amb25275634 [1,0,0,1,0,0|2,0,0]=4 1391 B11R1.90 OC1CCCC1CCC(O)=O Amb25828867 [1,0,0,1,0,0|1,0,0]=3 1392 B11R1.90 OC1CCCC1NCC(O)=O Amb18289477 [1,0,0,1,0,0|2,0,0]=4 1393 B11R1.90 OC1CCCC1SCC(O)=O Amb18292041 [1,0,0,1,0,0|2,0,0]=4 1394 B11R1.90 O[C@@H]1CCN[C@@H]1CCC(O)=O Amb24744778 [1,0,0,1,0,0|2,0,0]=4 1395 B11R1.90 O[C@H]1CCN[C@@H]1CCC(O)=O Amb24617811 [1,0,0,1,0,0|2,0,0]=4 1396 B11R1.91 CC(=O)CCC1CCNCC1 Amb24377330 [1,0,0,1,0,0|2,0,0]=4 1397 B11R1.91 CC(=O)CCC1CCOCC1 Amb18182100 [1,0,0,1,0,0|2,0,0]=4 1398 B11R1.91 CC(=O)CCC1CNCCC1 Amb25041564 [1,0,0,1,0,0|2,0,0]=4 1399 B11R1.91 CC(=O)CCN1CCCCC1 Amb1130395 [1,0,0,1,0,0|2,0,0]=4 1400 B11R1.91 CC(=O)CSC1CCCCC1 Amb18807608 [1,0,0,1,0,0|2,0,0]=4 1401 B11R1.91 CC(=O)NCC1CCCCC1 Amb23166899 [1,0,0,1,0,0|2,0,0]=4 1402 B11R1.91 CC(=O)OCC1CCCCC1 Amb24323616 [1,0,0,1,0,0|2,0,0]=4 1403 B11R1.91 CC(=O)SCC1CCCCC1 Amb22353260 [1,0,0,1,0,0|2,0,0]=4 1404 B11R1.91 CC(O)CCC1CCCCC1 Amb18799747 [1,0,0,1,0,0|1,0,1]=4 1405 B11R1.91 ClC(=O)CCN1CCCCC1 Amb17142958 [1,0,0,1,0,0|2,0,0]=4 1406 B11R1.91 NC(=N)CCC1CCCCC1 Amb24392724 [1,0,0,1,0,0|2,0,0]=4 1407 B11R1.91 NC(=O)CCC1CCCCN1 Amb18295940 [1,0,0,1,0,0|2,0,0]=4 1408 B11R1.91 NC(=O)CCC1CCCCO1 Amb24554623 [1,0,0,1,0,0|2,0,0]=4 1409 B11R1.91 NC(=O)CCC1CCCNC1 Amb10607788 [1,0,0,1,0,0|2,0,0]=4 1410 B11R1.91 NC(=O)CCC1CCCNC1 Amb13949150 [1,0,0,1,0,0|2,0,0]=4 1411 B11R1.91 NC(=O)COC1CCCCC1 Amb18791809 [1,0,0,1,0,0|2,0,0]=4 1412 B11R1.91 NC(=O)CSC1CCCCC1 Amb18808042 [1,0,0,1,0,0|2,0,0]=4 1413 B11R1.91 NC(=S)CCC1CCCCC1 Amb18627059 [1,0,0,1,0,0|1,1,0]=4 1414 B11R1.91 NC(O)CCC1CCCCC1 Amb25248437 [1,0,0,1,0,0|1,0,1]=4 1415 B11R1.91 N[C@H](O)CCC1CCCCC1 Amb25250856 [1,0,0,1,0,0|1,0,1]=4 1416 B11R1.91 O=C(Cl)CCC1CCNCC1 Amb25040684 [1,0,0,1,0,0|2,0,0]=4 1417 B11R1.91 O=C(Cl)COC1CCCCC1 Amb25851355 [1,0,0,1,0,0|2,0,0]=4 1418 B11R1.91 O=C(Cl)OCC1CCCCC1 Amb25140788 [1,0,0,1,0,0|2,0,0]=4 1419 B11R1.91 OC(=O)C#CC1CCCCC1 Amb21963916 [1,0,0,1,0,0|0,0,2]=4 1420 B11R1.91 OC(=O)CC=C1CCCCC1 Amb18644654 [1,0,0,1,0,0|0,0,2]=4 1421 B11R1.91 OC(=O)CCC1CCCC=C1 Amb18644636 [1,0,0,1,0,0|0,0,2]=4 1422 B11R1.91 OC(=O)CCC1CCCCN1 Amb1102729 [1,0,0,1,0,0|1,0,0]=3 1423 B11R1.91 OC(=O)CCC1CCCCO1 Amb17506864 [1,0,0,1,0,0|1,0,0]=3 1424 B11R1.91 OC(=O)CCC1CCCNC1 Amb10576190 [1,0,0,1,0,0|1,0,0]=3 1425 B11R1.91 OC(=O)CCC1CCCNC1 Amb1101056 [1,0,0,1,0,0|1,0,0]=3 1426 B11R1.91 OC(=O)CCC1CCNCC1 Amb10609864 [1,0,0,1,0,0|1,0,0]=3 1427 B11R1.91 OC(=O)CCC1CCNCC1 Amb10609915 [1,0,0,1,0,0|1,0,0]=3 1428 B11R1.91 OC(=O)CCC1CCOCC1 Amb18990337 [1,0,0,1,0,0|1,0,0]=3 1429 B11R1.91 OC(=O)CCC1CCSCC1 Amb18197511 [1,0,0,1,0,0|1,0,0]=3 1430 B11R1.91 OC(=O)CCC1CNCCN1 Amb22229402 [1,0,0,1,0,0|2,0,0]=4 1431 B11R1.91 OC(=O)CCC1CNCCO1 Amb18061965 [1,0,0,1,0,0|2,0,0]=4 1432 B11R1.91 OC(=O)CCC1COCCC1 Amb18199907 [1,0,0,1,0,0|1,0,0]=3 1433 B11R1.91 OC(=O)CCC1COCCN1 Amb10603708 [1,0,0,1,0,0|2,0,0]=4 1434 B11R1.91 OC(=O)CCC1CSCCC1 Amb18825218 [1,0,0,1,0,0|1,0,0]=3 1435 B11R1.91 OC(=O)CCC1SCCCS1 Amb24509109 [1,0,0,1,0,0|2,0,0]=4 1436 B11R1.91 OC(=O)CCC=1CCCCC1 Amb25775024 [1,0,0,1,0,0|0,0,2]=4 1437 B11R1.91 OC(=O)CCN1CCCCC1 Amb10609748 [1,0,0,1,0,0|1,0,0]=3 1438 B11R1.91 OC(=O)CCN1CCCCN1 Amb24586014 [1,0,0,1,0,0|2,0,0]=4 1439 B11R1.91 OC(=O)CCN1CCCCO1 Amb13949096 [1,0,0,1,0,0|2,0,0]=4 1440 B11R1.91 OC(=O)CCN1CCNCC1 Amb10609986 [1,0,0,1,0,0|2,0,0]=4 1441 B11R1.91 OC(=O)CCN1CCNCC1 Amb10610059 [1,0,0,1,0,0|2,0,0]=4 1442 B11R1.91 OC(=O)CCN1CCOCC1 Amb1098976 [1,0,0,1,0,0|2,0,0]=4 1443 B11R1.91 OC(=O)CCN1CCOCC1 Amb1294360 [1,0,0,1,0,0|2,0,0]=4 1444 B11R1.91 OC(=O)CCN1CCOCC1 Amb22504586 [1,0,0,1,0,0|2,0,0]=4 1445 B11R1.91 OC(=O)CC[S+]1CCCCC1 Amb25706418 [1,0,0,1,0,0|1,0,0]=3 1446 B11R1.91 OC(=O)CN=C1CCCCC1 Amb25258353 [1,0,0,1,0,0|1,0,1]=4 1447 B11R1.91 OC(=O)CNC1CCCCC1 Amb19263851 [1,0,0,1,0,0|1,0,0]=3 1448 B11R1.91 OC(=O)CNC1CCNCC1 Amb18289709 [1,0,0,1,0,0|2,0,0]=4 1449 B11R1.91 OC(=O)CNC1CCNCC1 Amb24271155 [1,0,0,1,0,0|2,0,0]=4 1450 B11R1.91 OC(=O)CNC1CNCCC1 Amb18293207 [1,0,0,1,0,0|2,0,0]=4 1451 B11R1.91 OC(=O)CNC1COCCC1 Amb25827250 [1,0,0,1,0,0|2,0,0]=4 1452 B11R1.91 OC(=O)CNC1CSCCC1 Amb18301750 [1,0,0,1,0,0|2,0,0]=4 1453 B11R1.91 OC(=O)CNN1CCCCC1 Amb24451443 [1,0,0,1,0,0|2,0,0]=4 1454 B11R1.91 OC(=O)COC1CCCNC1 Amb13783632 [1,0,0,1,0,0|2,0,0]=4 1455 B11R1.91 OC(=O)COC1CCNCC1 Amb10603194 [1,0,0,1,0,0|2,0,0]=4 1456 B11R1.91 OC(=O)COC1CCNCC1 Amb21960053 [1,0,0,1,0,0|2,0,0]=4 1457 B11R1.91 OC(=O)COC1CCOCC1 Amb18975304 [1,0,0,1,0,0|2,0,0]=4 1458 B11R1.91 OC(=O)COC1CSCCC1 Amb25117929 [1,0,0,1,0,0|2,0,0]=4 1459 B11R1.91 OC(=O)CSC1CCNCC1 Amb17502143 [1,0,0,1,0,0|2,0,0]=4 1460 B11R1.91 OC(=O)CSC1CCOCC1 Amb18302590 [1,0,0,1,0,0|2,0,0]=4 1461 B11R1.91 OC(=O)CSC1COCCC1 Amb25150533 [1,0,0,1,0,0|2,0,0]=4 1462 B11R1.91 OC(=O)CSN1CCCCC1 Amb25134616 [1,0,0,1,0,0|2,0,0]=4 1463 B11R1.91 OC(=O)\C=C\C1CCCCC1 Amb18960079 [1,0,0,1,0,0|0,0,2]=4 1464 B11R1.99 CCCCCCCCC1CO1 Amb17771534 [1,0,0,1,0,0|1,0,1]=4 1465 B11R1.101 O=C1NCCCCCCCO1 Amb24443710 [1,0,0,1,0,0|1,0,0]=3 1466 B11R1.101 OC1CCCCCCCCC1 Amb22008249 [1,0,0,1,0,0|1,0,1]=4 1467 B11R1.107 CC=1CCCCCCC(=O)C1 Amb25188731 [1,0,0,1,0,0|1,0,1]=4 1468 B11R1.107 C[C@H]1CC(=O)CCCCCC1 Amb25059721 [1,0,0,1,0,0|1,0,0]=3 1469 B11R1.110 CCCC1CC(=O)CCCC1 Amb25090747 [1,0,0,1,0,0|1,0,0]=3 1470 B11R1.110 CCCC1CC(=O)NCCC1 Amb24484588 [1,0,0,1,0,0|2,0,0]=4 1471 B11R1.110 CCCC1CCCCC(=N)N1 Amb24724900 [1,0,0,1,0,0|2,0,0]=4 1472 B11R1.110 CCCC1CCCCC(=O)N1 Amb2229640 [1,0,0,1,0,0|1,0,0]=3 1473 B11R1.110 CCCC1CCCCC(O)C1 Amb24641013 [1,0,0,1,0,0|1,0,1]=4 1474 B11R1.110 CCCC1CNCCC(=O)N1 Amb24709673 [1,0,0,1,0,0|2,0,0]=4 1475 B11R1.110 CCCC1CSCCC(=O)N1 Amb24680242 [1,0,0,1,0,0|2,0,0]=4 1476 B11R1.110 CCC[C@H]1CSCCC(=O)N1 Amb24378109 [1,0,0,1,0,0|2,0,0]=4 1477 B11R1.110 CCOC1CC(=O)CCCC1 Amb25373377 [1,0,0,1,0,0|2,0,0]=4 1478 B11R1.110 CCOC1CCCCC(=O)N1 Amb25075622 [1,0,0,1,0,0|2,0,0]=4 1479 B11R1.110 CNCC1CC(=O)CCCC1 Amb25778201 [1,0,0,1,0,0|2,0,0]=4 1480 B11R1.110 NCCC1CCCCC(=O)N1 Amb19515432 [1,0,0,1,0,0|2,0,0]=4 1481 B11R1.110 OCCC1CCCCC(=O)N1 Amb24383114 [1,0,0,1,0,0|2,0,0]=4 1482 B11R1.143 CC(=O)C1CCCCCC1Cl Amb24694170 [1,0,0,1,0,0|2,0,0]=4 1483 B11R1.143 CC(=O)[C@H]1CCCCC[C@@H]1Cl Amb25326781 [1,0,0,1,0,0|2,0,0]=4 1484 B11R1.143 CC1CCCCCC1C(O)=O Amb25361762 [1,0,0,1,0,0|0,0,0]=2 1485 B11R1.143 CC1CCCCCN1C(C)=O Amb25323036 [1,0,0,1,0,0|2,0,0]=4 1486 B11R1.143 CN1CCCNCC1C(O)=O Amb24415159 [1,0,0,1,0,0|2,0,0]=4 1487 B11R1.143 C[C@@H]1NCCCC[C@H]1C(O)=O Amb18199981 [1,0,0,1,0,0|1,0,0]=3 1488 B11R1.143 NC(=O)C1CCCCCC1O Amb25760752 [1,0,0,1,0,0|2,0,0]=4 1489 B11R1.143 NC(=O)[C@@H]1CCCCC[C@@H]1O Amb24594978 [1,0,0,1,0,0|2,0,0]=4 1490 B11R1.143 NC1CCCCCC1C(N)=O Amb20668797 [1,0,0,1,0,0|2,0,0]=4 1491 B11R1.143 NC1CCCCCC1C(N)=O Amb22059737 [1,0,0,1,0,0|2,0,0]=4 1492 B11R1.143 OC(=O)C1CCCCCC1S Amb18949212 [1,0,0,1,0,0|1,0,0]=3 1493 B11R1.143 OC(=O)C1CCSCCC1F Amb24754165 [1,0,0,1,0,0|2,0,0]=4 1494 B11R1.143 OC(=O)[C@@H]1CCCCC[C@@H]1N Amb1993850 [1,0,0,1,0,0|1,0,0]=3 1495 B11R1.143 OC(=O)[C@@H]1CCCCC[C@@H]1N Amb1994003 [1,0,0,1,0,0|1,0,0]=3 1496 B11R1.143 OC(=O)[C@H]1CCCCC[C@H]1N Amb1993851 [1,0,0,1,0,0|1,0,0]=3 1497 B11R1.143 OC(=O)[C@H]1CCCCC[C@H]1N Amb1994004 [1,0,0,1,0,0|1,0,0]=3 1498 B11R1.143 OC1CCCCCC1C(O)=O Amb18280963 [1,0,0,1,0,0|1,0,0]=3 1499 B11R1.161 CC1CCN1CCCC(O)=O Amb24761790 [1,0,0,1,0,0|1,0,0]=3 1500 B11R1.161 CN1CCC1CCCC(O)=O Amb25385623 [1,0,0,1,0,0|1,0,0]=3 1501 B11R1.161 CN1CCC1COCC(O)=O Amb25385512 [1,0,0,1,0,0|2,0,0]=4 1502 B11R1.172 CC(=O)CCCC1COCC1 Amb24766743 [1,0,0,1,0,0|2,0,0]=4 1503 B11R1.172 CC(=O)CCOC1CCCC1 Amb24751245 [1,0,0,1,0,0|2,0,0]=4 1504 B11R1.172 CC(=O)CCSC1CCCC1 Amb24750773 [1,0,0,1,0,0|2,0,0]=4 1505 B11R1.172 ClC(=O)CCCN1CCCC1 Amb17142960 [1,0,0,1,0,0|2,0,0]=4 1506 B11R1.172 NC(=O)CCCC1CCCC1 Amb24766123 [1,0,0,1,0,0|1,0,0]=3 1507 B11R1.172 NC(=O)CCCC1CCCN1 Amb25385481 [1,0,0,1,0,0|2,0,0]=4 1508 B11R1.172 NC(=O)CCCC1CNCC1 Amb25385480 [1,0,0,1,0,0|2,0,0]=4 1509 B11R1.172 NC(=O)CCCN1CCCC1 Amb17142881 [1,0,0,1,0,0|2,0,0]=4 1510 B11R1.172 NC(=O)CCOC1CCCC1 Amb18797116 [1,0,0,1,0,0|2,0,0]=4 1511 B11R1.172 NC(=O)NCCC1CCCC1 Amb18182107 [1,0,0,1,0,0|2,0,0]=4 1512 B11R1.172 O=C(Cl)CCCC1CCCC1 Amb25383947 [1,0,0,1,0,0|1,0,0]=3 1513 B11R1.172 OC(=O)CCC=C1CCCC1 Amb24658603 [1,0,0,1,0,0|0,0,2]=4 1514 B11R1.172 OC(=O)CCCC1CCC=C1 Amb25384857 [1,0,0,1,0,0|0,0,2]=4 1515 B11R1.172 OC(=O)CCCC1CCCC1 Amb19149142 [1,0,0,1,0,0|0,0,0]=2 1516 B11R1.172 OC(=O)CCCC1CCCN1 Amb18199969 [1,0,0,1,0,0|1,0,0]=3 1517 B11R1.172 OC(=O)CCCC1CCSS1 Amb22261449 [1,0,0,1,0,0|2,0,0]=4 1518 B11R1.172 OC(=O)CCCC1CNCC1 Amb25384946 [1,0,0,1,0,0|1,0,0]=3 1519 B11R1.172 OC(=O)CCCC1COCC1 Amb24755490 [1,0,0,1,0,0|1,0,0]=3 1520 B11R1.172 OC(=O)CCCC1OCCO1 Amb25090345 [1,0,0,1,0,0|2,0,0]=4 1521 B11R1.172 OC(=O)CCCC=1CCCC1 Amb18125777 [1,0,0,1,0,0|0,0,2]=4 1522 B11R1.172 OC(=O)CCCN1CCCC1 Amb10609669 [1,0,0,1,0,0|1,0,0]=3 1523 B11R1.172 OC(=O)CCC[C@@H]1CCCN1 Amb25385183 [1,0,0,1,0,0|1,0,0]=3 1524 B11R1.172 OC(=O)CCNC1CCCC1 Amb1109669 [1,0,0,1,0,0|1,0,0]=3 1525 B11R1.172 OC(=O)CCNC1CCCC1 Amb13951292 [1,0,0,1,0,0|1,0,0]=3 1526 B11R1.172 OC(=O)CCNC1CNCC1 Amb24755246 [1,0,0,1,0,0|2,0,0]=4 1527 B11R1.172 OC(=O)CCNC1COCC1 Amb25371951 [1,0,0,1,0,0|2,0,0]=4 1528 B11R1.172 OC(=O)CCOC1CNCC1 Amb25385301 [1,0,0,1,0,0|2,0,0]=4 1529 B11R1.172 OC(=O)CNCC1CCCS1 Amb24754604 [1,0,0,1,0,0|2,0,0]=4 1530 B11R1.172 OC(=O)CNC[C@@H]1CCCN1 Amb25384319 [1,0,0,1,0,0|2,0,0]=4 1531 B11R1.172 OC(=O)COCC1CCCC1 Amb21963936 [1,0,0,1,0,0|1,0,0]=3 1532 B11R1.172 OC(=O)COCC1CCCN1 Amb19516849 [1,0,0,1,0,0|2,0,0]=4 1533 B11R1.172 OC(=O)COCC1CCCN1 Amb22587360 [1,0,0,1,0,0|2,0,0]=4 1534 B11R1.172 OC(=O)COCC1CCCO1 Amb1090896 [1,0,0,1,0,0|2,0,0]=4 1535 B11R1.172 OC(=O)COCC1CNCC1 Amb25385516 [1,0,0,1,0,0|2,0,0]=4 1536 B11R1.172 OC(=O)COCC1COCC1 Amb18307774 [1,0,0,1,0,0|2,0,0]=4 1537 B11R1.172 OC(=O)CSCC1CCCC1 Amb18790439 [1,0,0,1,0,0|1,0,0]=3 1538 B11R1.172 OC(=O)CSCC1CCCO1 Amb1130528 [1,0,0,1,0,0|2,0,0]=4 1539 B11R1.172 OC(=O)CSCC1COCC1 Amb18305811 [1,0,0,1,0,0|2,0,0]=4 1540 B11R1.172 OC(=O)C\C=C\C1CCCC1 Amb24473377 [1,0,0,1,0,0|0,0,2]=4 1541 B11R1.193 C=CCC1CCCC1C(O)=O Amb25046024 [1,0,0,1,0,0|0,0,2]=4 1542 B11R1.193 CCCC1CCCC1C(O)=O Amb18644850 [1,0,0,1,0,0|0,0,0]=2 1543 B11R1.193 CCCC1CCCN1C(C)=O Amb25366436 [1,0,0,1,0,0|2,0,0]=4 1544 B11R1.193 CCCC1CCNC1C(O)=O Amb25241187 [1,0,0,1,0,0|1,0,0]=3 1545 B11R1.193 CCCC1NCCC1C(O)=O Amb18118098 [1,0,0,1,0,0|1,0,0]=3 1546 B11R1.193 CCCC1OCCC1C(O)=O Amb25073122 [1,0,0,1,0,0|1,0,0]=3 1547 B11R1.193 CCCN1CCCC1C(=O)O Amb1110656 [1,0,0,1,0,0|1,0,0]=3 1548 B11R1.193 CCCN1CCC[C@@H]1C(N)=O Amb24658398 [1,0,0,1,0,0|2,0,0]=4 1549 B11R1.193 CCC[C@@H]1CCC[C@H]1C(O)=O Amb24726338 [1,0,0,1,0,0|0,0,0]=2 1550 B11R1.193 CCC[C@@H]1CCN[C@@H]1C(O)=O Amb24670482 [1,0,0,1,0,0|1,0,0]=3 1551 B11R1.193 CCC[C@H]1CCN[C@@H]1C(O)=O Amb25198748 [1,0,0,1,0,0|1,0,0]=3 1552 B11R1.193 CCNC1CCCC1C(O)=O Amb24509259 [1,0,0,1,0,0|1,0,0]=3 1553 B11R1.193 CCO[C@@H]1CCC[C@H]1C(O)=O Amb25322175 [1,0,0,1,0,0|1,0,0]=3 1554 B11R1.193 CCSC1CCCC1C(O)=O Amb18303074 [1,0,0,1,0,0|1,0,0]=3 1555 B11R1.193 CNC[C@@H]1CCC[C@@H]1C(O)=O Amb24591293 [1,0,0,1,0,0|1,0,0]=3 1556 B11R1.193 COCC1CCCC1C(O)=O Amb25200900 [1,0,0,1,0,0|1,0,0]=3 1557 B11R1.193 COCC1CNCC1C(O)=O Amb25765890 [1,0,0,1,0,0|2,0,0]=4 1558 B11R1.193 COCC1NCCC1C(O)=O Amb18636257 [1,0,0,1,0,0|2,0,0]=4 1559 B11R1.193 COC[C@@H]1CCC[C@H]1C(O)=O Amb25061611 [1,0,0,1,0,0|1,0,0]=3 1560 B11R1.193 COC[C@H]1CCC[C@H]1C(O)=O Amb25295380 [1,0,0,1,0,0|1,0,0]=3 1561 B11R1.193 N#CCC1CCCC1C(O)=O Amb25366443 [1,0,0,1,0,0|1,0,1]=4 1562 B11R1.193 NCCC1OCCC1C(O)=O Amb24587962 [1,0,0,1,0,0|2,0,0]=4 1563 B11R1.193 NCCN1CCCC1C(O)=O Amb22500314 [1,0,0,1,0,0|2,0,0]=4 1564 B11R1.193 NCCN1CCC[C@H]1C(O)=O Amb25806262 [1,0,0,1,0,0|2,0,0]=4 1565 B11R1.193 OC(=O)C1CCCN1CCF Amb24659975 [1,0,0,1,0,0|2,0,0]=4 1566 B11R1.193 OCCN1CCC[C@@H]1C(O)=O Amb25700707 [1,0,0,1,0,0|2,0,0]=4 1567 B11R1.204 C=CCCC1CCC1C(O)=O Amb24762101 [1,0,0,1,0,0|0,0,2]=4 1568 B11R1.204 CC#CCC1CCC1C(O)=O Amb24452995 [1,0,0,1,0,0|0,0,2]=4 1569 B11R1.204 CCCCC1CCC1C(O)=O Amb24762099 [1,0,0,1,0,0|0,0,0]=2 1570 B11R1.204 CCCCC1CNC1C(O)=O Amb25385838 [1,0,0,1,0,0|1,0,0]=3 1571 B11R1.204 CCCCN1CCC1C(O)=O Amb25385844 [1,0,0,1,0,0|1,0,0]=3 1572 B11R1.204 CCCCN1CC[C@@H]1C(O)=O Amb25383066 [1,0,0,1,0,0|1,0,0]=3 1573 B11R1.204 CCCCN1CC[C@H]1C(O)=O Amb25383032 [1,0,0,1,0,0|1,0,0]=3 1574 B11R1.204 CCCNC1CCC1C(O)=O Amb25381540 [1,0,0,1,0,0|1,0,0]=3 1575 B11R1.204 CCOCC1CCC1C(O)=O Amb24762100 [1,0,0,1,0,0|1,0,0]=3 1576 B11R1.204 OC(=O)C1CCC1NCCF Amb25381866 [1,0,0,1,0,0|2,0,0]=4 1577 B11R1.204 OCCCN1CCC1C(O)=O Amb25383443 [1,0,0,1,0,0|2,0,0]=4 1578 B11R1.204 OCCNC1CCC1C(O)=O Amb25381538 [1,0,0,1,0,0|2,0,0]=4 1579 B11R1.245 CCC1CC(=O)CCCCC1 Amb25151478 [1,0,0,1,0,0|1,0,0]=3 1580 B11R1.245 CCC1CC(=O)NCCCC1 Amb24486135 [1,0,0,1,0,0|2,0,0]=4 1581 B11R1.245 CCC1CCCCCC(=O)N1 Amb25313080 [1,0,0,1,0,0|1,0,0]=3 1582 B11R1.245 CC[C@@H]1CC(=O)CCCCC1 Amb25334919 [1,0,0,1,0,0|1,0,0]=3 1583 B11R1.245 OC[C@H]1CCCCCC(=O)N1 Amb24642522 [1,0,0,1,0,0|2,0,0]=4 1584 B11R1.543 CC1(O)CCCCCCCC1 Amb22342433 [1,0,0,1,0,0|1,0,1]=4 1585 B11R1.706 CC(=O)C1CCCCCCC1 Amb25327542 [1,0,0,1,0,0|1,0,0]=3 1586 B11R1.706 CC(=O)N1CCCCCCC1 Amb2125335 [1,0,0,1,0,0|2,0,0]=4 1587 B11R1.706 C[C@H](O)C1CCCCCCC1 Amb25118573 [1,0,0,1,0,0|1,0,1]=4 1588 B11R1.706 NC(=O)C1CCCCCCC1 Amb24407703 [1,0,0,1,0,0|1,0,0]=3 1589 B11R1.706 NC(=O)C1CCCCCCN1 Amb24433710 [1,0,0,1,0,0|2,0,0]=4 1590 B11R1.706 NC(=S)C1CCCCCCC1 Amb25131467 [1,0,0,1,0,0|1,1,0]=4 1591 B11R1.706 O=C(Cl)C1CCCCCCC1 Amb25760237 [1,0,0,1,0,0|1,0,0]=3 1592 B11R1.706 OB(O)C1CCCCCCC1 Amb25107297 [1,0,0,1,0,0|1,0,1]=4 1593 B11R1.706 OC(=O)C1CC=CCCCC1 Amb25774993 [1,0,0,1,0,0|0,0,2]=4 1594 B11R1.706 OC(=O)C1CCC/C=C\CC1 Amb17779162 [1,0,0,1,0,0|0,0,2]=4 1595 B11R1.706 OC(=O)C1CCCCCCC1 Amb18278612 [1,0,0,1,0,0|0,0,0]=2 1596 B11R1.706 OC(=O)C1CCCCCNN1 Amb25827524 [1,0,0,1,0,0|2,0,0]=4 1597 B11R1.706 OC(=O)C=1CCCCCCC1 Amb25760819 [1,0,0,1,0,0|0,0,2]=4 1598 B11R1.742 CC(=O)CC1CCCCCC1 Amb25094261 [1,0,0,1,0,0|1,0,0]=3 1599 B11R1.742 CC(=O)CC1CCCCCN1 Amb23585599 [1,0,0,1,0,0|2,0,0]=4 1600 B11R1.742 CC(=O)CC1CCCCCO1 Amb25130577 [1,0,0,1,0,0|2,0,0]=4 1601 B11R1.742 CC(=O)CC1COCCCC1 Amb24645362 [1,0,0,1,0,0|2,0,0]=4 1602 B11R1.742 ClC(=O)CN1CCCCCC1 Amb17142956 [1,0,0,1,0,0|2,0,0]=4 1603 B11R1.742 NC(=O)CC1CCCCCC1 Amb24487974 [1,0,0,1,0,0|1,0,0]=3 1604 B11R1.742 NC(=O)CC1CCCCCN1 Amb25209448 [1,0,0,1,0,0|2,0,0]=4 1605 B11R1.742 NC(=O)CC1CCCNCC1 Amb24363656 [1,0,0,1,0,0|2,0,0]=4 1606 B11R1.742 O=C(Cl)CC1CCCCCC1 Amb25224919 [1,0,0,1,0,0|1,0,0]=3 1607 B11R1.742 O=C(F)NC1CCCCCC1 Amb25268800 [1,0,0,1,0,0|2,0,0]=4 1608 B11R1.742 OC(=O)CC1CCCCCN1 Amb18199972 [1,0,0,1,0,0|1,0,0]=3 1609 B11R1.742 OC(=O)CC1CCCNCC1 Amb18199994 [1,0,0,1,0,0|1,0,0]=3 1610 B11R1.742 OC(=O)CC1CCCOCC1 Amb18199912 [1,0,0,1,0,0|1,0,0]=3 1611 B11R1.742 OC(=O)CC1CCCSCC1 Amb18197457 [1,0,0,1,0,0|1,0,0]=3 1612 B11R1.742 OC(=O)CC1CNCCCC1 Amb18199974 [1,0,0,1,0,0|1,0,0]=3 1613 B11R1.742 OC(=O)CC1CNCCCO1 Amb25236359 [1,0,0,1,0,0|2,0,0]=4 1614 B11R1.742 OC(=O)CC=1CCCCCC1 Amb24487852 [1,0,0,1,0,0|0,0,2]=4 1615 B11R1.742 OC(=O)CN1CCCCCC1 Amb2536986 [1,0,0,1,0,0|1,0,0]=3 1616 B11R1.742 OC(=O)CN1CCCOCC1 Amb18288769 [1,0,0,1,0,0|2,0,0]=4 1617 B11R1.742 OC(=O)CN1CCCSCC1 Amb18957006 [1,0,0,1,0,0|2,0,0]=4 1618 B11R1.742 OC(=O)CN1CCNCCC1 Amb13952776 [1,0,0,1,0,0|2,0,0]=4 1619 B11R1.742 OC(=O)C[C@H]1CCCCC=C1 Amb25798948 [1,0,0,1,0,0|0,0,2]=4 1620 B11R1.4 CCCCCCC1CCCN1 Amb17659150 [1,0,0,1,0,0|1,0,1]=4 1621 B11R1.4 CCCCCCC1CCCO1 Amb10558596 [1,0,0,1,0,0|0,0,1]=3 1622 B11R1.4 O=CCCCCC1OCCO1 Amb24359153 [1,0,0,1,0,0|2,0,0]=4 1623 B11R1.4 O=CNCCCC1COCC1 Amb24764274 [1,0,0,1,0,0|2,0,0]=4 1624 B11R1.4 O=COCCCC1CCCO1 Amb22365098 [1,0,0,1,0,0|2,0,0]=4 1625 B11R1.4 OCCCCNC1CCCC1 Amb17334419 [1,0,0,1,0,0|1,0,1]=4 1626 B11R1.4 OCCNCCC1CCCC1 Amb18791847 [1,0,0,1,0,0|1,0,1]=4 1627 B11R1.5 C#CCC1CCCCCC1=O Amb18796640 [1,0,0,1,0,0|0,0,2]=4 1628 B11R1.5 C=CCC1CCCCCC1=O Amb18181756 [1,0,0,1,0,0|0,0,2]=4 1629 B11R1.5 C=CCC1CCCCCC1Br Amb25277926 [1,0,0,1,0,0|2,0,0]=4 1630 B11R1.5 C=CCC1CCCCCC1Cl Amb18185761 [1,0,0,1,0,0|2,0,0]=4 1631 B11R1.5 C=CCC1CCCCCC1N Amb18286582 [1,0,0,1,0,0|2,0,0]=4 1632 B11R1.5 C=CCC1CCCCCC1O Amb18182944 [1,0,0,1,0,0|2,0,0]=4 1633 B11R1.5 CC1CCCCCC1CNC Amb24392715 [1,0,0,1,0,0|2,0,0]=4 1634 B11R1.5 CC1CCCCCC1N=C=O Amb25191196 [1,0,0,1,0,0|1,0,1]=4 1635 B11R1.5 CC1CCCCCC1NC=O Amb25241392 [1,0,0,1,0,0|1,0,0]=3 1636 B11R1.5 CC1CCCCOC1CCO Amb25119972 [1,0,0,1,0,0|1,0,1]=4 1637 B11R1.5 CCCC1CCCCCC1=O Amb18796794 [1,0,0,1,0,0|0,0,0]=2 1638 B11R1.5 CCCC1CCCCCC1N Amb18283601 [1,0,0,1,0,0|1,0,1]=4 1639 B11R1.5 CCCC1CCCCCC1O Amb18799751 [1,0,0,1,0,0|0,0,1]=3 1640 B11R1.5 CCCC1CCCCNC1=O Amb2229639 [1,0,0,1,0,0|1,0,0]=3 1641 B11R1.5 CCCC1CNCCNC1=O Amb24376018 [1,0,0,1,0,0|2,0,0]=4 1642 B11R1.5 CCCN1CCCNCC1=O Amb22549346 [1,0,0,1,0,0|2,0,0]=4 1643 B11R1.5 CCCN1CCNCCC1=O Amb21959306 [1,0,0,1,0,0|2,0,0]=4 1644 B11R1.5 CCCN1CCNCCC1=O Amb22498695 [1,0,0,1,0,0|2,0,0]=4 1645 B11R1.5 CCC[C@@H]1CCCCC[C@H]1O Amb24675468 [1,0,0,1,0,0|0,0,1]=3 1646 B11R1.5 CCNC1CCCCCC1O Amb18950483 [1,0,0,1,0,0|1,0,1]=4 1647 B11R1.5 CCOC1CCCCCC1=O Amb25342823 [1,0,0,1,0,0|1,0,0]=3 1648 B11R1.5 CCOC1CCCCCC1O Amb18183279 [1,0,0,1,0,0|1,0,1]=4 1649 B11R1.5 CCSC1CCCCCC1=O Amb24691772 [1,0,0,1,0,0|1,0,0]=3 1650 B11R1.5 CCSC1CCCCCC1O Amb25742627 [1,0,0,1,0,0|1,0,1]=4 1651 B11R1.5 CCSC1CCCCNC1=O Amb24353895 [1,0,0,1,0,0|2,0,0]=4 1652 B11R1.5 CC\C=C/1\CCCCCC1=O Amb24714877 [1,0,0,1,0,0|0,0,2]=4 1653 B11R1.5 COCC1CCCCCC1=O Amb24671812 [1,0,0,1,0,0|1,0,0]=3 1654 B11R1.5 COCC1CCCCNC1=O Amb25093894 [1,0,0,1,0,0|2,0,0]=4 1655 B11R1.5 C[C@@H]1CCOCC[C@H]1OC=O Amb25257191 [1,0,0,1,0,0|2,0,0]=4 1656 B11R1.5 C[C@H]1CCCCO[C@H]1CCO Amb24735187 [1,0,0,1,0,0|1,0,1]=4 1657 B11R1.5 N#CCC1CCCCCC1=O Amb25735835 [1,0,0,1,0,0|1,0,1]=4 1658 B11R1.5 NCCC1CCCCCC1=O Amb18200342 [1,0,0,1,0,0|1,0,0]=3 1659 B11R1.5 NCCC1CCCCCC1O Amb18199945 [1,0,0,1,0,0|1,0,1]=4 1660 B11R1.5 NCCN1CCCCCC1=O Amb10610308 [1,0,0,1,0,0|2,0,0]=4 1661 B11R1.5 O=C1CCCCCC1CCF Amb24686950 [1,0,0,1,0,0|1,0,0]=3 1662 B11R1.5 O=C1CCCCCN1CCS Amb25105854 [1,0,0,1,0,0|2,0,0]=4 1663 B11R1.5 O=C1NCCCCC1CCF Amb25841520 [1,0,0,1,0,0|2,0,0]=4 1664 B11R1.5 OC1CCCCCC1OC=O Amb24734180 [1,0,0,1,0,0|2,0,0]=4 1665 B11R1.5 O[C@@H]1CCCCC[C@H]1OC=O Amb25257069 [1,0,0,1,0,0|2,0,0]=4 1666 B11R1.17 C#CCCC1CCCCC1=O Amb24385651 [1,0,0,1,0,0|0,0,2]=4 1667 B11R1.17 C=C1CCCCC1CCCO Amb25149747 [1,0,0,1,0,0|2,0,0]=4 1668 B11R1.17 C=CCCC1CCCCC1Cl Amb24395618 [1,0,0,1,0,0|2,0,0]=4 1669 B11R1.17 C=CCCC1CCCCC1N Amb25777121 [1,0,0,1,0,0|2,0,0]=4 1670 B11R1.17 C=CCCC1CCCCC1O Amb25227048 [1,0,0,1,0,0|2,0,0]=4 1671 B11R1.17 CC#CCC1CCCCC1=O Amb18181670 [1,0,0,1,0,0|0,0,2]=4 1672 B11R1.17 CC1CCCCC1CCCC Amb24484363 [1,0,0,1,0,0|1,0,1]=4 1673 B11R1.17 CC1CCCCC1CN=C=O Amb25726494 [1,0,0,1,0,0|1,0,1]=4 1674 B11R1.17 CC1CCCCC1CNC=O Amb24487690 [1,0,0,1,0,0|1,0,0]=3 1675 B11R1.17 CC1CCCCC1OCC=O Amb18183071 [1,0,0,1,0,0|1,0,0]=3 1676 B11R1.17 CC1CCCCC1OCCO Amb18799954 [1,0,0,1,0,0|1,0,1]=4 1677 B11R1.17 CC1CCCCC1\C=C\C=O Amb24513220 [1,0,0,1,0,0|0,0,2]=4 1678 B11R1.17 CC1CCCCN1CCC=C Amb24732856 [1,0,0,1,0,0|2,0,0]=4 1679 B11R1.17 CC1CCCCN1CCC=O Amb18787587 [1,0,0,1,0,0|1,0,0]=3 1680 B11R1.17 CC1CCCNC1CCCO Amb24453388 [1,0,0,1,0,0|1,0,1]=4 1681 B11R1.17 CC1CCCOC1CCCO Amb24719635 [1,0,0,1,0,0|1,0,1]=4 1682 B11R1.17 CC1COCCN1CCC=O Amb18787694 [1,0,0,1,0,0|2,0,0]=4 1683 B11R1.17 CCC#CC1CCCCC1=O Amb24582590 [1,0,0,1,0,0|0,0,2]=4 1684 B11R1.17 CCCC=C1CCCCC1=O Amb24061168 [1,0,0,1,0,0|0,0,2]=4 1685 B11R1.17 CCCCC1=CCCCC1=O Amb25150316 [1,0,0,1,0,0|0,0,2]=4 1686 B11R1.17 CCCCC1C=CCCC1=O Amb25066414 [1,0,0,1,0,0|0,0,2]=4 1687 B11R1.17 CCCCC1CCCCC1Cl Amb25343212 [1,0,0,1,0,0|1,0,1]=4 1688 B11R1.17 CCCCC1CCCCC1N Amb18977609 [1,0,0,1,0,0|1,0,1]=4 1689 B11R1.17 CCCCC1CCCCN1C Amb24501690 [1,0,0,1,0,0|2,0,0]=4 1690 B11R1.17 CCCCC1CCCCN1O Amb25824048 [1,0,0,1,0,0|1,0,0]=3 1691 B11R1.17 CCCCC1CCCC[C@H]1O Amb25686307 [1,0,0,1,0,0|0,0,1]=3 1692 B11R1.17 CCCCC1CNCCC1O Amb24099469 [1,0,0,1,0,0|1,0,1]=4 1693 B11R1.17 CCCCC1COCCC1=O Amb25720690 [1,0,0,1,0,0|1,0,0]=3 1694 B11R1.17 CCCCC1NCCNC1=O Amb18989085 [1,0,0,1,0,0|2,0,0]=4 1695 B11R1.17 CCCCC1OCCCC1=O Amb24456613 [1,0,0,1,0,0|1,0,0]=3 1696 B11R1.17 CCCCC1SCCNC1=O Amb24484716 [1,0,0,1,0,0|2,0,0]=4 1697 B11R1.17 CCCCN1CCCCC1=N Amb18179564 [1,0,0,1,0,0|2,0,0]=4 1698 B11R1.17 CCCCN1CCCCC1=O Amb22394921 [1,0,0,1,0,0|1,0,0]=3 1699 B11R1.17 CCCCN1CCCCC1=S Amb24589190 [1,0,0,1,0,0|1,1,0]=4 1700 B11R1.17 CCCCN1CCNCC1=O Amb10607569 [1,0,0,1,0,0|2,0,0]=4 1701 B11R1.17 CCCC[C@@H]1CCCNC1=O Amb24509566 [1,0,0,1,0,0|1,0,0]=3 1702 B11R1.17 CCCC[C@@H]1NCCNC1=O Amb24470005 [1,0,0,1,0,0|2,0,0]=4 1703 B11R1.17 CCCC[C@H]1CCCCC1=O Amb24725293 [1,0,0,1,0,0|0,0,0]=2 1704 B11R1.17 CCCC[C@H]1CCCCN1C Amb25079621 [1,0,0,1,0,0|2,0,0]=4 1705 B11R1.17 CCCC[C@H]1CCCC[C@H]1O Amb24520172 [1,0,0,1,0,0|0,0,1]=3 1706 B11R1.17 CCCC[C@H]1NCCNC1=O Amb25059217 [1,0,0,1,0,0|2,0,0]=4 1707 B11R1.17 CCCNC1CCCNC1=O Amb18295104 [1,0,0,1,0,0|2,0,0]=4 1708 B11R1.17 CCCN[C@@H]1CCCC[C@@H]1O Amb23263413 [1,0,0,1,0,0|1,0,1]=4 1709 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O Amb10608055 [1,0,0,1,0,0|1,0,1]=4 1710 B11R1.17 CCCN[C@H]1CCCC[C@@H]1O Amb25789989 [1,0,0,1,0,0|1,0,1]=4 1711 B11R1.17 CCCOC1CCCCC1=O Amb25723193 [1,0,0,1,0,0|1,0,0]=3 1712 B11R1.17 CCCOC1CCCCC1O Amb18183283 [1,0,0,1,0,0|1,0,1]=4 1713 B11R1.17 CCCOC1CNCCC1=O Amb24486496 [1,0,0,1,0,0|2,0,0]=4 1714 B11R1.17 CCCO[C@@H]1CCCCC1=O Amb25053086 [1,0,0,1,0,0|1,0,0]=3 1715 B11R1.17 CCCO[C@H]1CCCCC1=O Amb24633429 [1,0,0,1,0,0|1,0,0]=3 1716 B11R1.17 CCCSC1CCCCC1O Amb18180456 [1,0,0,1,0,0|1,0,1]=4 1717 B11R1.17 CCCSC1CCCNC1=O Amb24403562 [1,0,0,1,0,0|2,0,0]=4 1718 B11R1.17 CCCS[C@@H]1CCCC[C@H]1O Amb25699949 [1,0,0,1,0,0|1,0,1]=4 1719 B11R1.17 CCNCC1CCCCC1O Amb18644960 [1,0,0,1,0,0|1,0,1]=4 1720 B11R1.17 CCNC[C@@H]1CCCC[C@@H]1O Amb25328818 [1,0,0,1,0,0|1,0,1]=4 1721 B11R1.17 CCOCC1CCCNC1=O Amb24438130 [1,0,0,1,0,0|2,0,0]=4 1722 B11R1.17 CCSCC1CCCCC1O Amb25027075 [1,0,0,1,0,0|1,0,1]=4 1723 B11R1.17 CC\C=C\C1CCCCC1=O Amb24577841 [1,0,0,1,0,0|0,0,2]=4 1724 B11R1.17 CN1CCCCC1CCCO Amb25846934 [1,0,0,1,0,0|1,0,1]=4 1725 B11R1.17 CN1CCCCC1CNC=O Amb24413257 [1,0,0,1,0,0|2,0,0]=4 1726 B11R1.17 CNCCC1CCCCC1=O Amb18125898 [1,0,0,1,0,0|1,0,0]=3 1727 B11R1.17 CNCCN1CCCCC1=O Amb10607655 [1,0,0,1,0,0|2,0,0]=4 1728 B11R1.17 COCCC1CCCCC1=O Amb18787633 [1,0,0,1,0,0|1,0,0]=3 1729 B11R1.17 COCCC1CCCCC1O Amb18799960 [1,0,0,1,0,0|1,0,1]=4 1730 B11R1.17 COCCC1CSCCC1=O Amb24544652 [1,0,0,1,0,0|2,0,0]=4 1731 B11R1.17 CSCCC1CCCCC1O Amb24488348 [1,0,0,1,0,0|1,0,1]=4 1732 B11R1.17 C[C@H]1CCCC[C@@H]1NCC=C Amb25232515 [1,0,0,1,0,0|2,0,0]=4 1733 B11R1.17 C\C=C/CC1CCCCC1=O Amb24647880 [1,0,0,1,0,0|0,0,2]=4 1734 B11R1.17 C\C=C\CC1CCCCC1=O Amb18177228 [1,0,0,1,0,0|0,0,2]=4 1735 B11R1.17 N#CCC[C@@H]1CCCCC1=O Amb24486236 [1,0,0,1,0,0|1,0,1]=4 1736 B11R1.17 N#CCC[C@H]1CCCCC1=O Amb24621718 [1,0,0,1,0,0|1,0,1]=4 1737 B11R1.17 NCCCC1CCCCC1=O Amb18251486 [1,0,0,1,0,0|1,0,0]=3 1738 B11R1.17 O=C1CCCCC1CCCBr Amb25683472 [1,0,0,1,0,0|1,0,0]=3 1739 B11R1.17 O=C1CCCCC1CCCCl Amb24651080 [1,0,0,1,0,0|1,0,0]=3 1740 B11R1.17 O=C1CCCCC1CCCF Amb24714474 [1,0,0,1,0,0|1,0,0]=3 1741 B11R1.17 O=C1CCCCC1CCCI Amb25785639 [1,0,0,1,0,0|1,0,0]=3 1742 B11R1.17 O=C1CCCCN1CCCS Amb24533643 [1,0,0,1,0,0|2,0,0]=4 1743 B11R1.17 O=C1OCCCC1CCCCl Amb25738330 [1,0,0,1,0,0|2,0,0]=4 1744 B11R1.17 O=CCCC1CCCCC1=O Amb18644640 [1,0,0,1,0,0|1,0,1]=4 1745 B11R1.17 O=CCC[C@@H]1CCCCC1=O Amb24484793 [1,0,0,1,0,0|1,0,1]=4 1746 B11R1.17 O=COCC1CCCCC1Cl Amb25758795 [1,0,0,1,0,0|2,0,0]=4 1747 B11R1.17 OC1CCCCC1CCCF Amb25115046 [1,0,0,1,0,0|1,0,1]=4 1748 B11R1.17 OC1OCCCC1CCC=O Amb25103255 [1,0,0,1,0,0|2,0,0]=4 1749 B11R1.17 OCCCC1CCCOC1=O Amb25851451 [1,0,0,1,0,0|2,0,0]=4 1750 B11R1.17 OCCCC1CNCCC1=O Amb25778442 [1,0,0,1,0,0|2,0,0]=4 1751 B11R1.17 OCCCC1NCCCC1=O Amb18126066 [1,0,0,1,0,0|2,0,0]=4 1752 B11R1.17 O[C@@H]1CCCC[C@H]1CCC=O Amb25245324 [1,0,0,1,0,0|1,0,0]=3 1753 B11R1.17 [C-]#[N+]CCC1CCCCC1C Amb25211958 [1,0,0,1,0,0|2,0,0]=4 1754 B11R1.18 C=CCCC1CCCC1C=O Amb25385699 [1,0,0,1,0,0|0,0,2]=4 1755 B11R1.18 C=CCCC1CCCC1CN Amb24762086 [1,0,0,1,0,0|2,0,0]=4 1756 B11R1.18 C=CCC[C@@H]1CCC[C@H]1C=O Amb24765265 [1,0,0,1,0,0|0,0,2]=4 1757 B11R1.18 CCC1CCCC1NCC=C Amb25381914 [1,0,0,1,0,0|2,0,0]=4 1758 B11R1.18 CCC1CCCC1NCCO Amb24761740 [1,0,0,1,0,0|1,0,1]=4 1759 B11R1.18 CCC1CCCN1CCC=O Amb18787589 [1,0,0,1,0,0|1,0,0]=3 1760 B11R1.18 CCC1CCCN1CCCO Amb18179765 [1,0,0,1,0,0|1,0,1]=4 1761 B11R1.18 CCCCC1CCCC1CN Amb24762087 [1,0,0,1,0,0|1,0,1]=4 1762 B11R1.18 CCCCC1CCCC1NC Amb19015846 [1,0,0,1,0,0|2,0,0]=4 1763 B11R1.18 CCCCC1OCCC1C=O Amb18644843 [1,0,0,1,0,0|1,0,0]=3 1764 B11R1.18 CCCCN1CCCC1C=C Amb25383205 [1,0,0,1,0,0|2,0,0]=4 1765 B11R1.18 CCCCN1CCCC1C=O Amb23586328 [1,0,0,1,0,0|1,0,0]=3 1766 B11R1.18 CCCCN1CCCC1CO Amb18799841 [1,0,0,1,0,0|1,0,1]=4 1767 B11R1.18 CCCCN1CCC[C@@H]1C=O Amb24766697 [1,0,0,1,0,0|1,0,0]=3 1768 B11R1.18 CCCC[C@@H]1CCC[C@H]1CO Amb25384683 [1,0,0,1,0,0|0,0,1]=3 1769 B11R1.18 CCCC[C@H]1OCCC1C=O Amb25385708 [1,0,0,1,0,0|1,0,0]=3 1770 B11R1.18 CCCC[C@H]1OCC[C@@H]1C=O Amb24765269 [1,0,0,1,0,0|1,0,0]=3 1771 B11R1.18 CCCC[C@H]1OCC[C@H]1C=O Amb24765268 [1,0,0,1,0,0|1,0,0]=3 1772 B11R1.18 CCCN[C@@H]1CCC[C@@H]1CO Amb25384097 [1,0,0,1,0,0|1,0,1]=4 1773 B11R1.18 CCN1CCCC1CCCO Amb18183238 [1,0,0,1,0,0|1,0,1]=4 1774 B11R1.18 CC\C=C/[C@@H]1CCC[C@@H]1C=O Amb25840944 [1,0,0,1,0,0|0,0,2]=4 1775 B11R1.18 CC\C=C/[C@@H]1CCC[C@H]1C=O Amb25714571 [1,0,0,1,0,0|0,0,2]=4 1776 B11R1.18 COCCN1CCCC1C=O Amb23586304 [1,0,0,1,0,0|2,0,0]=4 1777 B11R1.18 OCC1CCCN1CCC=O Amb18177533 [1,0,0,1,0,0|2,0,0]=4 1778 B11R1.18 OCCCC1CCCC1CCl Amb25386257 [1,0,0,1,0,0|1,0,1]=4 1779 B11R1.18 OCCCC1CCCN1C=O Amb18183178 [1,0,0,1,0,0|2,0,0]=4 1780 B11R1.26 C#CC1CCCCCCC1=O Amb24690715 [1,0,0,1,0,0|0,0,2]=4 1781 B11R1.26 CC=1CCCCCCC1C=O Amb24435308 [1,0,0,1,0,0|0,0,2]=4 1782 B11R1.26 CCC1CCCCCNC1=O Amb24757672 [1,0,0,1,0,0|1,0,0]=3 1783 B11R1.26 CN1CCCCCCC1CO Amb24632097 [1,0,0,1,0,0|1,0,1]=4 1784 B11R1.26 CN[C@@H]1CCCCCC[C@H]1O Amb24656105 [1,0,0,1,0,0|1,0,1]=4 1785 B11R1.26 COC1CCCCCCC1=O Amb25767104 [1,0,0,1,0,0|1,0,0]=3 1786 B11R1.26 COC1CCCCCCC1O Amb18183277 [1,0,0,1,0,0|1,0,1]=4 1787 B11R1.26 CO[C@@H]1CCCCCC[C@H]1O Amb25176598 [1,0,0,1,0,0|1,0,1]=4 1788 B11R1.26 CSC1CCCCCCC1=O Amb24441911 [1,0,0,1,0,0|1,0,0]=3 1789 B11R1.26 C\C=C\1/CCCCCCC1=O Amb24736302 [1,0,0,1,0,0|0,0,2]=4 1790 B11R1.26 NC[C@@H]1CCCCCC[C@@H]1O Amb24656301 [1,0,0,1,0,0|1,0,1]=4 1791 B11R1.26 O=NC1CCCCCCC1Cl Amb24634076 [1,0,0,1,0,0|2,0,0]=4 1792 B11R1.26 OCC1CCCCCCC1=O Amb25298435 [1,0,0,1,0,0|1,0,0]=3 1793 B11R1.26 OC[C@@H]1CCCCCCC1=O Amb25833647 [1,0,0,1,0,0|1,0,0]=3 1794 B11R1.26 O[C@H]1CCCCCC[C@H]1CO Amb25284276 [1,0,0,1,0,0|1,0,1]=4 1795 B11R1.28 BrCCCCC1CCCCC1 Amb21937167 [1,0,0,1,0,0|1,0,1]=4 1796 B11R1.28 C#CCCCC1CCCCC1 Amb24062905 [1,0,0,1,0,0|1,0,1]=4 1797 B11R1.28 C=CCCCC1CCCCC1 Amb24117204 [1,0,0,1,0,0|1,0,0]=3 1798 B11R1.28 C=CCCCC1COCCC1 Amb25380388 [1,0,0,1,0,0|2,0,0]=4 1799 B11R1.28 C=CCCCC1CSCCC1 Amb25383771 [1,0,0,1,0,0|2,0,0]=4 1800 B11R1.28 C=CCCC[C@@H]1COCCC1 Amb25383939 [1,0,0,1,0,0|2,0,0]=4 1801 B11R1.28 C=CCCC[C@@H]1CSCCC1 Amb25383940 [1,0,0,1,0,0|2,0,0]=4 1802 B11R1.28 C=CCCC[C@H]1COCCC1 Amb25383786 [1,0,0,1,0,0|2,0,0]=4 1803 B11R1.28 C=CCCC[C@H]1CSCCC1 Amb25383944 [1,0,0,1,0,0|2,0,0]=4 1804 B11R1.28 C=CCCNC1CCCCC1 Amb10559348 [1,0,0,1,0,0|2,0,0]=4 1805 B11R1.28 C=CCSCC1CCCCC1 Amb25372143 [1,0,0,1,0,0|2,0,0]=4 1806 B11R1.28 CCCCCC1CNCCC1 Amb22642855 [1,0,0,1,0,0|2,0,0]=4 1807 B11R1.28 CCCCCC1CNCCO1 Amb24761722 [1,0,0,1,0,0|1,0,1]=4 1808 B11R1.28 CCCCC[C@@H]1CCCCN1 Amb25380517 [1,0,0,1,0,0|1,0,1]=4 1809 B11R1.28 CCCCNC1CCCC=C1 Amb24764722 [1,0,0,1,0,0|2,0,0]=4 1810 B11R1.28 CCCNCC1CCC=CO1 Amb18183022 [1,0,0,1,0,0|1,0,1]=4 1811 B11R1.28 CCNCCC1CCCCO1 Amb18312531 [1,0,0,1,0,0|1,0,1]=4 1812 B11R1.28 C[NH2+]CCCC1CCCCC1 Amb20648432 [1,0,0,1,0,0|2,0,0]=4 1813 B11R1.28 ClCCCCC1CCCC=C1 Amb25383945 [1,0,0,1,0,0|2,0,0]=4 1814 B11R1.28 Cl[Mg]CCCC1CCCCC1 Amb22897279 [1,0,0,1,0,0|2,0,0]=4 1815 B11R1.28 Cl[Zn]CCCC1CCCCC1 Amb22897737 [1,0,0,1,0,0|2,0,0]=4 1816 B11R1.28 NCCCCC1CCCCC1 Amb17570025 [1,0,0,1,0,0|1,0,1]=4 1817 B11R1.28 O=CCCCC1CCCCO1 Amb25385814 [1,0,0,1,0,0|1,0,0]=3 1818 B11R1.28 O=CCCCC1OCCCO1 Amb25385749 [1,0,0,1,0,0|2,0,0]=4 1819 B11R1.28 O=CCCCC1SCCCS1 Amb25384730 [1,0,0,1,0,0|2,0,0]=4 1820 B11R1.28 O=CCCCC=1CCCCC1 Amb18125495 [1,0,0,1,0,0|0,0,2]=4 1821 B11R1.28 O=CCCCN1CCOCC1 Amb25385962 [1,0,0,1,0,0|2,0,0]=4 1822 B11R1.28 O=CCCOC1CCCCC1 Amb18787634 [1,0,0,1,0,0|1,0,0]=3 1823 B11R1.28 O=CCCOC1CCOCC1 Amb18177591 [1,0,0,1,0,0|2,0,0]=4 1824 B11R1.28 O=CCCSC1CCCCC1 Amb18178028 [1,0,0,1,0,0|1,0,0]=3 1825 B11R1.28 O=CCCSC1CCOCC1 Amb18178146 [1,0,0,1,0,0|2,0,0]=4 1826 B11R1.28 O=CCOCC1CCCCC1 Amb18797001 [1,0,0,1,0,0|1,0,0]=3 1827 B11R1.28 O=CCOCC1CCCCO1 Amb18799917 [1,0,0,1,0,0|2,0,0]=4 1828 B11R1.28 O=CCOCC1CCOCC1 Amb18797338 [1,0,0,1,0,0|2,0,0]=4 1829 B11R1.28 O=CC\C=C\C1CCCCC1 Amb25240047 [1,0,0,1,0,0|0,0,2]=4 1830 B11R1.28 O=CNCCC1CCCCO1 Amb25767203 [1,0,0,1,0,0|2,0,0]=4 1831 B11R1.28 O=CNCCC1CCOCC1 Amb24746477 [1,0,0,1,0,0|2,0,0]=4 1832 B11R1.28 O=CNCCN1CCCCC1 Amb25728506 [1,0,0,1,0,0|2,0,0]=4 1833 B11R1.28 O=CNCNC1CCCCC1 Amb25323940 [1,0,0,1,0,0|2,0,0]=4 1834 B11R1.28 O=C\C=C\CC1CCCCC1 Amb24513205 [1,0,0,1,0,0|0,0,2]=4 1835 B11R1.28 OCCCCC1CCCCN1 Amb22749320 [1,0,0,1,0,0|1,0,1]=4 1836 B11R1.28 OCCCCC1CCNCC1 Amb21858465 [1,0,0,1,0,0|1,0,1]=4 1837 B11R1.28 OCCCCC1CCNCC1 Amb21858466 [1,0,0,1,0,0|1,0,1]=4 1838 B11R1.28 OCCCCC1CCOCC1 Amb24750759 [1,0,0,1,0,0|1,0,1]=4 1839 B11R1.28 OCCCCC1CNCCC1 Amb22749319 [1,0,0,1,0,0|1,0,1]=4 1840 B11R1.28 OCCCCN1CCCCC1 Amb21955136 [1,0,0,1,0,0|1,0,1]=4 1841 B11R1.28 OCCCSC1CCCCC1 Amb18795506 [1,0,0,1,0,0|1,0,1]=4 1842 B11R1.28 OCCNCC1CCCCC1 Amb2119209 [1,0,0,1,0,0|1,0,1]=4 1843 B11R1.28 OCCOCC1CCCCC1 Amb18182365 [1,0,0,1,0,0|1,0,1]=4 1844 B11R1.41 C=CCC1CCCCC1C=O Amb18125474 [1,0,0,1,0,0|0,0,2]=4 1845 B11R1.41 C=CCC1CCCCC1CN Amb18125613 [1,0,0,1,0,0|2,0,0]=4 1846 B11R1.41 C=CC[C@@H]1CCCC[C@H]1C=O Amb24550707 [1,0,0,1,0,0|0,0,2]=4 1847 B11R1.41 CCC1CCCCC1C=NO Amb25197569 [1,0,0,1,0,0|1,0,1]=4 1848 B11R1.41 CCC1CCCCC1CC=O Amb25196472 [1,0,0,1,0,0|0,0,0]=2 1849 B11R1.41 CCC1CCCCC1CCC Amb24533062 [1,0,0,1,0,0|1,0,1]=4 1850 B11R1.41 CCC1CCCCC1CCCl Amb24444190 [1,0,0,1,0,0|1,0,1]=4 1851 B11R1.41 CCC1CCCCC1CCN Amb25798044 [1,0,0,1,0,0|1,0,1]=4 1852 B11R1.41 CCC1CCCCC1CNC Amb25264380 [1,0,0,1,0,0|2,0,0]=4 1853 B11R1.41 CCC1CCCCC1CNN Amb25049134 [1,0,0,1,0,0|2,0,0]=4 1854 B11R1.41 CCC1CCCCC1NC=O Amb25117142 [1,0,0,1,0,0|1,0,0]=3 1855 B11R1.41 CCC1CCCCN1CC=O Amb18799608 [1,0,0,1,0,0|1,0,0]=3 1856 B11R1.41 CCC1COCCN1CC=O Amb18799791 [1,0,0,1,0,0|2,0,0]=4 1857 B11R1.41 CCCC1CCCCC1C#N Amb24620417 [1,0,0,1,0,0|1,0,1]=4 1858 B11R1.41 CCCC1CCCCC1NC Amb18977610 [1,0,0,1,0,0|2,0,0]=4 1859 B11R1.41 CCCC1CCCCN1C=O Amb24523123 [1,0,0,1,0,0|1,0,0]=3 1860 B11R1.41 CCCC1CCCCN1CO Amb25345080 [1,0,0,1,0,0|1,0,1]=4 1861 B11R1.41 CCCC1OCCCC1CO Amb25169552 [1,0,0,1,0,0|1,0,1]=4 1862 B11R1.41 CCCN1CCCCC1C=O Amb18796904 [1,0,0,1,0,0|1,0,0]=3 1863 B11R1.41 CCCN1CCCCC1CO Amb18179768 [1,0,0,1,0,0|1,0,1]=4 1864 B11R1.41 CCN1CCCCC1CCO Amb18183195 [1,0,0,1,0,0|1,0,1]=4 1865 B11R1.41 CCNC1CCCCC1CO Amb18126082 [1,0,0,1,0,0|1,0,1]=4 1866 B11R1.41 CCN[C@@H]1CCCC[C@H]1CO Amb25201139 [1,0,0,1,0,0|1,0,1]=4 1867 B11R1.41 CCOC1CCCCC1C=O Amb25212289 [1,0,0,1,0,0|1,0,0]=3 1868 B11R1.41 CCOC1CCCCC1CO Amb25032591 [1,0,0,1,0,0|1,0,1]=4 1869 B11R1.41 CCO[C@@H]1CCCC[C@@H]1CO Amb24719718 [1,0,0,1,0,0|1,0,1]=4 1870 B11R1.41 CC[C@@H]1CNCC[C@H]1CCO Amb24594348 [1,0,0,1,0,0|1,0,1]=4 1871 B11R1.41 CC[C@H]1CCCC[C@H]1CCO Amb25285372 [1,0,0,1,0,0|0,0,1]=3 1872 B11R1.41 CNC1CCCCC1CC=C Amb18993613 [1,0,0,1,0,0|2,0,0]=4 1873 B11R1.41 COC1CCCCC1CCO Amb23538340 [1,0,0,1,0,0|1,0,1]=4 1874 B11R1.41 COCC1CCCCC1CO Amb17593966 [1,0,0,1,0,0|1,0,1]=4 1875 B11R1.41 COCN1CCCCC1C=O Amb25784978 [1,0,0,1,0,0|2,0,0]=4 1876 B11R1.41 COC[C@@H]1CCCC[C@@H]1CO Amb24697853 [1,0,0,1,0,0|1,0,1]=4 1877 B11R1.41 COC[C@@H]1CCCC[C@H]1CO Amb17939261 [1,0,0,1,0,0|1,0,1]=4 1878 B11R1.41 COC[C@H]1CCCCN1C=O Amb24334651 [1,0,0,1,0,0|2,0,0]=4 1879 B11R1.41 CO[C@H]1CCCC[C@H]1CCO Amb24592444 [1,0,0,1,0,0|1,0,1]=4 1880 B11R1.41 CSC1CCCCC1NC=O Amb24334907 [1,0,0,1,0,0|2,0,0]=4 1881 B11R1.41 C\C=C/1\CCCCC1CC=O Amb25311203 [1,0,0,1,0,0|0,0,2]=4 1882 B11R1.41 C\C=C\[C@@H]1CCCC[C@H]1C=O Amb25213102 [1,0,0,1,0,0|0,0,2]=4 1883 B11R1.41 C\C=C\[C@H]1CCCC[C@@H]1C=O Amb24536565 [1,0,0,1,0,0|0,0,2]=4 1884 B11R1.41 O=CC1CCCCN1CCF Amb24680554 [1,0,0,1,0,0|2,0,0]=4 1885 B11R1.41 OCC1CCCCC1CCO Amb24412084 [1,0,0,1,0,0|1,0,1]=4 1886 B11R1.41 OCC1CCCCN1CC=O Amb18799800 [1,0,0,1,0,0|2,0,0]=4 1887 B11R1.41 OCCC1CCCCN1C=O Amb18179738 [1,0,0,1,0,0|2,0,0]=4 1888 B11R1.41 OCCN1CCCCC1C=O Amb18797130 [1,0,0,1,0,0|2,0,0]=4 1889 B11R1.41 OC[C@H]1CCCC[C@H]1CCO Amb25345143 [1,0,0,1,0,0|1,0,1]=4 1890 B11R1.47 C=CCNCCCC1CCC1 Amb23570820 [1,0,0,1,0,0|2,0,0]=4 1891 B11R1.47 OCCNCCCC1CCC1 Amb23570824 [1,0,0,1,0,0|1,0,1]=4 1892 B11R1.51 CCC1CCCCCC1NC Amb18283817 [1,0,0,1,0,0|2,0,0]=4 1893 B11R1.51 CCC1CCCCCN1C=O Amb24684550 [1,0,0,1,0,0|1,0,0]=3 1894 B11R1.51 CCN1CCCCCC1CO Amb10817345 [1,0,0,1,0,0|1,0,1]=4 1895 B11R1.51 OCC1CCCCCC1CO Amb24356548 [1,0,0,1,0,0|1,0,1]=4 1896 B11R1.51 OC[C@@H]1CCCCC[C@@H]1CO Amb22356584 [1,0,0,1,0,0|1,0,1]=4 1897 B11R1.51 OC[C@@H]1CCCCC[C@H]1CCl Amb25179255 [1,0,0,1,0,0|1,0,1]=4 1898 B11R1.51 OC[C@@H]1CCCCC[C@H]1CO Amb24741731 [1,0,0,1,0,0|1,0,1]=4 1899 B11R1.85 C=C1CCCCCCCC1=O Amb25092923 [1,0,0,1,0,0|0,0,2]=4 1900 B11R1.85 C=C1CCCCCCCC1O Amb25769379 [1,0,0,1,0,0|2,0,0]=4 1901 B11R1.85 CC1=CCCCCCCC1=O Amb24722806 [1,0,0,1,0,0|0,0,2]=4 1902 B11R1.85 CC1CCCCCCCC1=O Amb25712223 [1,0,0,1,0,0|0,0,0]=2 1903 B11R1.85 CC1CCCCCCNC1=O Amb25287543 [1,0,0,1,0,0|1,0,0]=3 1904 B11R1.85 NC1CCCCCCCC1O Amb24392239 [1,0,0,1,0,0|1,0,1]=4 1905 B11R1.85 N[C@@H]1CCCCCCC[C@H]1O Amb24589620 [1,0,0,1,0,0|1,0,1]=4 1906 B11R1.85 N[C@@H]1CCCCCCNC1=O Amb24558722 [1,0,0,1,0,0|2,0,0]=4 1907 B11R1.85 N[C@H]1CCCCCCC[C@H]1O Amb25179160 [1,0,0,1,0,0|1,0,1]=4 1908 B11R1.85 O=C1CCCCCCCC1Cl Amb24434022 [1,0,0,1,0,0|1,0,0]=3 1909 B11R1.85 O=C1NCCCCCCC1Cl Amb24487901 [1,0,0,1,0,0|2,0,0]=4 1910 B11R1.92 C1CCCC=CCCCCN1 Amb24391264 [1,0,0,1,0,0|2,0,0]=4 1911 B11R1.92 C1CCCCCCCCCC1 Amb25060085 [1,0,0,1,0,0|1,0,1]=4 1912 B11R1.92 C1OCCCCCCCCO1 Amb24434714 [1,0,0,1,0,0|1,0,1]=4 1913 B11R1.109 C=CC[C@H]1CCC[C@@H]1CC=O Amb25385672 [1,0,0,1,0,0|0,0,2]=4 1914 B11R1.109 CCCC1CCCC1CNC Amb24762105 [1,0,0,1,0,0|2,0,0]=4 1915 B11R1.109 CCCC1NCCC1CCO Amb25385582 [1,0,0,1,0,0|1,0,1]=4 1916 B11R1.109 CCNC1CCCC1CC=C Amb19026212 [1,0,0,1,0,0|2,0,0]=4 1917 B11R1.109 CNCC1CCCC1CC=C Amb24762103 [1,0,0,1,0,0|2,0,0]=4 1918 B11R1.109 CSCC1CCCN1CC=O Amb24765934 [1,0,0,1,0,0|2,0,0]=4 1919 B11R1.109 OCC[C@H]1CCC[C@@H]1CCO Amb25384779 [1,0,0,1,0,0|1,0,1]=4 1920 B11R1.117 CCNC1CCCCCC=C1 Amb25141200 [1,0,0,1,0,0|2,0,0]=4 1921 B11R1.117 CNCC1CCCCCCC1 Amb19149347 [1,0,0,1,0,0|2,0,0]=4 1922 B11R1.117 NCCC1CCCCCCC1 Amb10607690 [1,0,0,1,0,0|1,0,1]=4 1923 B11R1.117 O=C=NC1CCCCCCC1 Amb22362664 [1,0,0,1,0,0|1,0,1]=4 1924 B11R1.117 O=CC=C1CCCCCCC1 Amb25040035 [1,0,0,1,0,0|0,0,2]=4 1925 B11R1.117 O=CCC1CCCCCC=C1 Amb25075624 [1,0,0,1,0,0|0,0,2]=4 1926 B11R1.117 O=CCC1CCCCCCC1 Amb24382615 [1,0,0,1,0,0|0,0,0]=2 1927 B11R1.117 O=CCC=1CCCCCCC1 Amb25236943 [1,0,0,1,0,0|0,0,2]=4 1928 B11R1.117 O=CCN1CCCCCCC1 Amb18183003 [1,0,0,1,0,0|1,0,0]=3 1929 B11R1.117 O=COC1CCCCOCC1 Amb22365346 [1,0,0,1,0,0|2,0,0]=4 1930 B11R1.117 OCCC1CCCCCC=C1 Amb24475566 [1,0,0,1,0,0|2,0,0]=4 1931 B11R1.117 OCCC1CCCCCCC1 Amb25145747 [1,0,0,1,0,0|0,0,1]=3 1932 B11R1.117 ON=CC1CCCCCCC1 Amb24674392 [1,0,0,1,0,0|1,0,1]=4 1933 B11R1.180 C#CCCCC1CCCC1=O Amb24676912 [1,0,0,1,0,0|0,0,2]=4 1934 B11R1.180 C=CCCCC1CCCC1O Amb24762973 [1,0,0,1,0,0|2,0,0]=4 1935 B11R1.180 CC#CCCC1CCCC1=O Amb25151472 [1,0,0,1,0,0|0,0,2]=4 1936 B11R1.180 CC1CCCC1NCCCO Amb24750431 [1,0,0,1,0,0|1,0,1]=4 1937 B11R1.180 CC1CCCN1CCCC=C Amb24750971 [1,0,0,1,0,0|2,0,0]=4 1938 B11R1.180 CC1CCCN1CCCCO Amb18179762 [1,0,0,1,0,0|1,0,1]=4 1939 B11R1.180 CCCCCC1CC=CC1=O Amb17843926 [1,0,0,1,0,0|0,0,2]=4 1940 B11R1.180 CCCCCC1CCCC1N Amb19015844 [1,0,0,1,0,0|1,0,1]=4 1941 B11R1.180 CCCCCC1CCCC1O Amb18183110 [1,0,0,1,0,0|0,0,1]=3 1942 B11R1.180 CCCCCC1CSCC1=O Amb24755633 [1,0,0,1,0,0|1,0,0]=3 1943 B11R1.180 CCCCCC1CSCC1O Amb24755618 [1,0,0,1,0,0|1,0,1]=4 1944 B11R1.180 CCCCCN1CCCC1=O Amb20621968 [1,0,0,1,0,0|1,0,0]=3 1945 B11R1.180 CCCCCN1CNCC1=O Amb25379587 [1,0,0,1,0,0|2,0,0]=4 1946 B11R1.180 CCCCC[C@@H]1CCCC1=O Amb24766745 [1,0,0,1,0,0|0,0,0]=2 1947 B11R1.180 CCCCC[C@H]1CCCC1=O Amb24766930 [1,0,0,1,0,0|0,0,0]=2 1948 B11R1.180 CCCCNC1CCCC1O Amb18303638 [1,0,0,1,0,0|1,0,1]=4 1949 B11R1.180 CCCCN[C@H]1CCOC1=O Amb24762672 [1,0,0,1,0,0|2,0,0]=4 1950 B11R1.180 CCCCOC1CCCC1O Amb18799957 [1,0,0,1,0,0|1,0,1]=4 1951 B11R1.180 CCCCSC1CCCC1O Amb18180458 [1,0,0,1,0,0|1,0,1]=4 1952 B11R1.180 CCCCSC1CCNC1=O Amb24755870 [1,0,0,1,0,0|2,0,0]=4 1953 B11R1.180 CCCCSC1CCOC1=O Amb24755871 [1,0,0,1,0,0|2,0,0]=4 1954 B11R1.180 CCCCS[C@@H]1CCC[C@H]1O Amb25382577 [1,0,0,1,0,0|1,0,1]=4 1955 B11R1.180 CCCC\C=C\1/CCCC1=O Amb22552972 [1,0,0,1,0,0|0,0,2]=4 1956 B11R1.180 CCC\C=C\C1CCCC1=O Amb24074269 [1,0,0,1,0,0|0,0,2]=4 1957 B11R1.180 CCNCCN1CCCC1=O Amb19015601 [1,0,0,1,0,0|2,0,0]=4 1958 B11R1.180 CCOCCC1CCCC1=O Amb18177471 [1,0,0,1,0,0|1,0,0]=3 1959 B11R1.180 CCOCCC1CCCC1O Amb18183285 [1,0,0,1,0,0|1,0,1]=4 1960 B11R1.180 CCOCCC1CSCC1=O Amb24755622 [1,0,0,1,0,0|2,0,0]=4 1961 B11R1.180 CN1CCCC1CCCCO Amb24750381 [1,0,0,1,0,0|1,0,1]=4 1962 B11R1.180 CNCCCN1CCCC1=O Amb19015452 [1,0,0,1,0,0|2,0,0]=4 1963 B11R1.180 COCCCC1CCCC1=O Amb18787632 [1,0,0,1,0,0|1,0,0]=3 1964 B11R1.180 COCCCC1CCCC1O Amb18183284 [1,0,0,1,0,0|1,0,1]=4 1965 B11R1.180 COCCCC1CSCC1=O Amb24755636 [1,0,0,1,0,0|2,0,0]=4 1966 B11R1.180 COCCCN1CCCC1=O Amb24064201 [1,0,0,1,0,0|2,0,0]=4 1967 B11R1.180 N#CCCCC1CCCC1=O Amb25717939 [1,0,0,1,0,0|1,0,1]=4 1968 B11R1.180 O=C1CCCN1CCCCCl Amb18184015 [1,0,0,1,0,0|2,0,0]=4 1969 B11R1.180 O=CCCCC1CCCC1=O Amb25383544 [1,0,0,1,0,0|1,0,1]=4 1970 B11R1.180 OC1CCCC1CCCC=O Amb25383522 [1,0,0,1,0,0|1,0,0]=3 1971 B11R1.180 OCCCCC1CSCC1=O Amb24755632 [1,0,0,1,0,0|2,0,0]=4 1972 B11R1.190 CCCCC\C=C/1\CCC1=O Amb24765435 [1,0,0,1,0,0|0,0,2]=4 1973 B11R1.203 BrCCCC1CCCCCC1 Amb25836156 [1,0,0,1,0,0|1,0,1]=4 1974 B11R1.203 C=CCCC1CCCCCN1 Amb24418713 [1,0,0,1,0,0|2,0,0]=4 1975 B11R1.203 C=COCC1CCCCCC1 Amb25125424 [1,0,0,1,0,0|2,0,0]=4 1976 B11R1.203 CCCCC1CCCCCN1 Amb2235485 [1,0,0,1,0,0|1,0,1]=4 1977 B11R1.203 Cl[Zn]CCC1CCCCCC1 Amb22897735 [1,0,0,1,0,0|2,0,0]=4 1978 B11R1.203 NCCCC1CCCCCC1 Amb25113900 [1,0,0,1,0,0|1,0,1]=4 1979 B11R1.203 O=CCCC1CCCCCN1 Amb24710330 [1,0,0,1,0,0|1,0,0]=3 1980 B11R1.203 O=CCCC=1CCCCCC1 Amb25277245 [1,0,0,1,0,0|0,0,2]=4 1981 B11R1.203 O=CCCN1CCCCCC1 Amb18177425 [1,0,0,1,0,0|1,0,0]=3 1982 B11R1.203 O=CCCN1CCCNCC1 Amb18302308 [1,0,0,1,0,0|2,0,0]=4 1983 B11R1.203 O=CCCN1CCCOCC1 Amb18177532 [1,0,0,1,0,0|2,0,0]=4 1984 B11R1.203 O=CCCN1CCCSCC1 Amb18178066 [1,0,0,1,0,0|2,0,0]=4 1985 B11R1.203 O=CCOC1CCCCCC1 Amb18183074 [1,0,0,1,0,0|1,0,0]=3 1986 B11R1.203 O=C\C=C\C1CCCCCC1 Amb25149219 [1,0,0,1,0,0|0,0,2]=4 1987 B11R1.203 OCCCC1CCCCC=C1 Amb24355173 [1,0,0,1,0,0|2,0,0]=4 1988 B11R1.203 OCCCC1CCCCCN1 Amb18199937 [1,0,0,1,0,0|1,0,1]=4 1989 B11R1.203 OCCCC1CCCNCC1 Amb23453247 [1,0,0,1,0,0|1,0,1]=4 1990 B11R1.203 OCCOC1CCCCCC1 Amb18799958 [1,0,0,1,0,0|1,0,1]=4 1991 B11R1.229 CCCCC#CC1CC1C=O Amb25725911 [1,0,0,1,0,0|0,0,2]=4 1992 B11R1.229 CCCCC#C[C@H]1C[C@H]1C=O Amb25366255 [1,0,0,1,0,0|0,0,2]=4 1993 B11R1.248 BrCC1CCCCCCCC1 Amb25780640 [1,0,0,1,0,0|1,0,1]=4 1994 B11R1.248 O=CC=1CCCCCCCC1 Amb25172766 [1,0,0,1,0,0|0,0,2]=4 1995 B11R1.248 OCC1CCCCCCCC1 Amb25083477 [1,0,0,1,0,0|0,0,1]=3 1996 B13R1.27 CCCCCCCC1CCC(=O)O1 Amb1154110 [0,1,0,1,0,0|0,0,0]=2 1997 B13R1.27 OCCCC#CCC1CCC(=O)O1 Amb24404728 [0,1,0,1,0,0|0,0,2]=4 1998 B13R1.27 OCCCCC#CC1CCC(=O)O1 Amb24613448 [0,1,0,1,0,0|0,0,2]=4 1999 B13R1.55 CCCCCC1CC(=O)CC(=O)C1 Amb22230019 [0,1,0,1,0,0|1,0,1]=4 2000 B13R1.55 CCCCCC1CC(O)CC(=O)O1 Amb10549438 [0,1,0,1,0,0|0,0,0]=2 2001 B13R1.55 C\C=C\CC[C@@H]1C[C@@H](O)CC(=O)O1 Amb25333764 [0,1,0,1,0,0|0,0,2]=4 2002 B13R1.55 C\C=C\CC[C@@H]1C[C@H](O)CC(=O)O1 Amb25215871 [0,1,0,1,0,0|0,0,2]=4 2003 B13R1.55 C\C=C\CC[C@H]1C[C@@H](O)CC(=O)O1 Amb24570006 [0,1,0,1,0,0|0,0,2]=4 2004 B13R1.88 CCC1CCCCC1(N)CC(O)=O Amb24415698 [0,1,0,1,0,0|0,0,0]=2 2005 B13R1.88 COC1CCCCC1(N)CC(O)=O Amb25141215 [0,1,0,1,0,0|1,0,0]=3 2006 B13R1.88 COC1COCCC1(N)CC(O)=O Amb25171984 [0,1,0,1,0,0|2,0,0]=4 2007 B13R1.190 CC1CC(=O)OC1CCCCCC Amb22001856 [0,1,0,1,0,0|0,0,0]=2 2008 B13R1.190 CCCCC#CC1OC(=O)CC1O Amb24748376 [0,1,0,1,0,0|0,0,2]=4 2009 B13R1.190 CCCCC#C[C@@H]1OC(=O)C[C@H]1O Amb24632512 [0,1,0,1,0,0|0,0,2]=4 2010 B13R1.201 CC(CC(O)=O)C1CCCCC1=O Amb18129430 [0,1,0,1,0,0|1,0,1]=4 2011 B13R1.201 CC(CC(O)=O)C1OCCCC1O Amb25276213 [0,1,0,1,0,0|2,0,0]=4 2012 B13R1.201 CC1CCCCC1C(O)CC(C)=C Amb24704637 [0,1,0,1,0,0|2,0,0]=4 2013 B13R1.201 CC1CCCCC1N(C)CC(C)=O Amb19057281 [0,1,0,1,0,0|2,0,0]=4 2014 B13R1.201 CC1CCCCC1N(C)CC(O)=O Amb18984568 [0,1,0,1,0,0|1,0,0]=3 2015 B13R1.201 CC1CCCCN1C(=O)CC(O)=O Amb18284943 [0,1,0,1,0,0|1,0,1]=4 2016 B13R1.201 CC1COCCC1N(C)CC(O)=O Amb25699405 [0,1,0,1,0,0|2,0,0]=4 2017 B13R1.201 CC1CSCCN1C(C)CC(O)=O Amb24693780 [0,1,0,1,0,0|2,0,0]=4 2018 B13R1.201 CN(CC(O)=O)C1CCCCC1O Amb18289472 [0,1,0,1,0,0|2,0,0]=4 2019 B13R1.201 C[C@@H]1CCCC[C@H]1C(O)CC(C)=C Amb24520354 [0,1,0,1,0,0|2,0,0]=4 2020 B13R1.201 C[C@@H]1CNCCN1C(C)CC(O)=O Amb25807763 [0,1,0,1,0,0|2,0,0]=4 2021 B13R1.201 C[C@H](CC(O)=O)[C@H]1OCCC[C@@H]1O Amb24710153 [0,1,0,1,0,0|2,0,0]=4 2022 B13R1.282 CN(CC1CCCN1C)CC(O)=O Amb22227405 [0,1,0,1,0,0|2,0,0]=4 2023 B13R1.282 CN(C[C@@H]1CCCN1C)CC(O)=O Amb22227434 [0,1,0,1,0,0|2,0,0]=4 2024 B13R1.348 CC(CC(=O)N)NC1CCCCC1 Amb17234100 [0,1,0,1,0,0|2,0,0]=4 2025 B13R1.348 CN(CC1CCCCC1)CC(N)=O Amb19068866 [0,1,0,1,0,0|2,0,0]=4 2026 B13R1.348 C[C@@H](CC1CCCCC1)NC(C)=O Amb25130944 [0,1,0,1,0,0|2,0,0]=4 2027 B13R1.348 C[C@H](CC1CCCCC1)NC(N)=O Amb25717384 [0,1,0,1,0,0|2,0,0]=4 2028 B13R1.348 NC(CC1CCCCC1)CC(O)=O Amb18822383 [0,1,0,1,0,0|0,0,0]=2 2029 B13R1.348 O=C(CC(=O)O)NC1CCCCC1 Amb17401050 [0,1,0,1,0,0|1,0,1]=4 2030 B13R1.348 OC(=O)CC(O)C=C1CCCCC1 Amb18129429 [0,1,0,1,0,0|0,0,2]=4 2031 B13R1.348 [NH3+]C(CC1CCCCC1)CC([O-])=O Amb22441550 [0,1,0,1,0,0|0,0,1]=3 2032 B13R1.373 COCC1CN(CC(O)=O)CCC1 Amb21865579 [0,1,0,1,0,0|2,0,0]=4 2033 B13R1.775 CC1CCCC=CC(O)CC(=O)O1 Amb25284213 [0,1,0,1,0,0|0,0,2]=4 2034 B13R1.775 CC1CCCCCC(O)CC(=O)O1 Amb24672622 [0,1,0,1,0,0|0,0,0]=2 2035 B13R1.775 C[C@@H]1CC(O)CC=CCCC(=O)O1 Amb24495782 [0,1,0,1,0,0|0,0,2]=4 2036 B13R1.775 C[C@@H]1CCCC=CC(O)CC(=O)O1 Amb24495941 [0,1,0,1,0,0|0,0,2]=4 2037 B13R1.775 C[C@@H]1CCCC=C[C@H](O)CC(=O)O1 Amb25266758 [0,1,0,1,0,0|0,0,2]=4 2038 B13R1.775 C[C@@H]1CCCCCC(O)CC(=O)O1 Amb24618805 [0,1,0,1,0,0|0,0,0]=2 2039 B13R1.775 C[C@@H]1CCCCC[C@@H](O)CC(=O)O1 Amb25302252 [0,1,0,1,0,0|0,0,0]=2 2040 B13R1.775 C[C@@H]1CCCCC[C@H](O)CC(=O)O1 Amb24617262 [0,1,0,1,0,0|0,0,0]=2 2041 B13R1.775 C[C@H]1CC(=O)NCCCCC(=O)O1 Amb24419807 [0,1,0,1,0,0|1,0,1]=4 2042 B13R1.775 C[C@H]1CCCCCC(O)CC(=O)O1 Amb25306486 [0,1,0,1,0,0|0,0,0]=2 2043 B13R1.1107 CC(O)CN1CCCCCCCC1 Amb24749795 [0,1,0,1,0,0|1,0,1]=4 2044 B13R1.1107 C[C@@H](O)CN1CCCCCCCC1 Amb24425026 [0,1,0,1,0,0|1,0,1]=4 2045 B13R1.1107 NC(=S)CN1CCCCCCCC1 Amb25169162 [0,1,0,1,0,0|1,1,0]=4 2046 B13R1.1107 OC(=O)CC1CCCCCCCC1 Amb25279551 [0,1,0,1,0,0|0,0,0]=2 2047 B13R1.1107 OC(=O)CN1CCCCCCCC1 Amb25169064 [0,1,0,1,0,0|0,0,0]=2 2048 B13R1.1107 OC(=O)CN1CCNCCNCC1 Amb21953270 [0,1,0,1,0,0|2,0,0]=4 2049 B13R1.1107 OC(=O)CN1CCNCCNCC1 Amb24740859 [0,1,0,1,0,0|2,0,0]=4 2050 B13R1.2020 CC(=O)OC1(N)CCCCCCC1 Amb25200169 [0,1,0,1,0,0|2,0,0]=4 2051 B13R1.2020 NC1(CC(O)=O)CCCCCCC1 Amb22641941 [0,1,0,1,0,0|0,0,0]=2 2052 B13R1.2433 CCCCCCCC1CC1B(O)O Amb24329636 [0,1,0,1,0,0|1,0,1]=4 2053 B13R1.2897 CC1CCCN(CCN)C1C(O)=O Amb25251969 [0,1,0,1,0,0|2,0,0]=4 2054 B13R1.2897 CC1CCCN(CCO)C1C(O)=O Amb25135073 [0,1,0,1,0,0|2,0,0]=4 2055 B13R1.2897 CC1OCCN(CCC)C1C(O)=O Amb25213461 [0,1,0,1,0,0|2,0,0]=4 2056 B13R1.2897 C\C=C\[C@@H]1CCC[C@@H](O)[C@H]1C(O)=O Amb24710218 [0,1,0,1,0,0|0,0,2]=4 2057 B13R1.3051 CCC1CN(CC(O)=O)CCCO1 Amb24589513 [0,1,0,1,0,0|2,0,0]=4 2058 B13R1.3051 OCC1CN(CC(O)=O)CCCC1 Amb25107476 [0,1,0,1,0,0|2,0,0]=4 2059 B13R1.3773 CC(O)CC1CC=CCCC(=O)O1 Amb24414861 [0,1,0,1,0,0|0,0,2]=4 2060 B13R1.3773 OC(=O)CC1CC(=O)CCCCC1 Amb25701324 [0,1,0,1,0,0|0,0,1]=3 2061 B13R1.3816 CN1CCCCCCCC1C(O)=O Amb25365310 [0,1,0,1,0,0|0,0,0]=2 2062 B13R1.3816 NC1CCCCCCCC1C(O)=O Amb24436959 [0,1,0,1,0,0|0,0,0]=2 2063 B13R1.7456 CC(=C)CC(N)C1CCCCCC1 Amb24526781 [0,1,0,1,0,0|2,0,0]=4 2064 B13R1.7456 CC(=C)CC(O)C1CCCCCC1 Amb25105305 [0,1,0,1,0,0|2,0,0]=4 2065 B13R1.7456 CC(CC(O)=O)C1CCCCCC1 Amb18191560 [0,1,0,1,0,0|0,0,0]=2 2066 B13R1.7456 CC(CC(O)=O)C1CCNCCC1 Amb18822380 [0,1,0,1,0,0|1,0,0]=3 2067 B13R1.7456 CC(CC(O)=O)N1CCCOCC1 Amb19000986 [0,1,0,1,0,0|2,0,0]=4 2068 B13R1.7456 CC(CC(O)=O)N1CCCSCC1 Amb18977930 [0,1,0,1,0,0|2,0,0]=4 2069 B13R1.7456 CC(N1CCCCCC1)CC(=O)N Amb17234102 [0,1,0,1,0,0|2,0,0]=4 2070 B13R1.7456 CC(N1CCCCCC1)CC(=O)O Amb13949208 [0,1,0,1,0,0|1,0,0]=3 2071 B13R1.7456 CN(CC(O)=O)C1CCCNCC1 Amb25274838 [0,1,0,1,0,0|2,0,0]=4 2072 B13R1.7456 C[C@@H](NC(C)=O)C1CCCCCC1 Amb24643250 [0,1,0,1,0,0|2,0,0]=4 2073 B13R1.7456 C[C@H](NC(N)=O)C1CCCCCC1 Amb25032711 [0,1,0,1,0,0|2,0,0]=4 2074 B13R1.7456 NC(CC(N)=O)C1CCCCCC1 Amb25851902 [0,1,0,1,0,0|1,0,0]=3 2075 B13R1.7456 N[C@@H](CC(N)=O)C1CCCCCC1 Amb24377514 [0,1,0,1,0,0|1,0,0]=3 2076 B13R1.7456 N[C@H](CC(N)=O)C1CCCCCC1 Amb24629675 [0,1,0,1,0,0|1,0,0]=3 2077 B13R1.7456 N[C@H](CC(O)=O)C1CCCCCC1 Amb25266526 [0,1,0,1,0,0|0,0,0]=2 2078 B13R1.7456 O=C(N1CCCCCC1)CC(=O)O Amb17401052 [0,1,0,1,0,0|1,0,1]=4 2079 B13R1.7456 OC(=O)CS(=O)C1CCCCCC1 Amb24715054 [0,1,0,1,0,0|1,0,0]=3 2080 B13R1.51 CC1CC(OC)C(CC(O)=O)CC1 Amb18822014 [0,1,0,1,0,0|1,0,0]=3 2081 B13R1.51 CC[C@@H]1NC(=O)CC[C@H]1CC(O)=O Amb18191381 [0,1,0,1,0,0|1,0,1]=4 2082 B13R1.51 CC[C@H]1NC(=O)CC[C@@H]1CC(O)=O Amb24539382 [0,1,0,1,0,0|1,0,1]=4 2083 B13R1.51 COC1CN(C)CCC1CC(O)=O Amb18191132 [0,1,0,1,0,0|2,0,0]=4 2084 B13R1.158 CC1CCCCC1=NOCC(O)=O Amb25707161 [0,1,0,1,0,0|1,0,1]=4 2085 B13R1.158 CC1CCCCC1CCNC(N)=O Amb25246447 [0,1,0,1,0,0|1,0,0]=3 2086 B13R1.158 CC1CCCCN1C\C=C\C(O)=O Amb18296429 [0,1,0,1,0,0|0,0,2]=4 2087 B13R1.158 CC1CSCCN1CCCC(O)=O Amb24768864 [0,1,0,1,0,0|1,0,0]=3 2088 B13R1.158 CN1CCCCC1CNCC(O)=O Amb18313080 [0,1,0,1,0,0|1,0,0]=3 2089 B13R1.158 NC(=S)CCNC1CCCCC1C Amb17315343 [0,1,0,1,0,0|1,1,0]=4 2090 B13R1.158 OC(=O)CCCC1CCCCC1=O Amb17594755 [0,1,0,1,0,0|0,0,1]=3 2091 B13R1.337 CC(=O)CCC#CC1CCCCC1 Amb24370155 [0,1,0,1,0,0|1,0,1]=4 2092 B13R1.337 NC(=O)CNCCC1CCCCC1 Amb13952496 [0,1,0,1,0,0|1,0,0]=3 2093 B13R1.337 OC(=O)CCC=C=C1CCCCC1 Amb25362292 [0,1,0,1,0,0|0,0,2]=4 2094 B13R1.337 OC(=O)CCCCC1CCCCC1 Amb22336378 [0,1,0,1,0,0|0,0,0]=2 2095 B13R1.337 OC(=O)CCCCC1CCSSS1 Amb22056295 [0,1,0,1,0,0|2,0,0]=4 2096 B13R1.337 OC(=O)CCCCN1CCCCC1 Amb19373622 [0,1,0,1,0,0|0,0,0]=2 2097 B13R1.337 OC(=O)CCCCN1CCNCC1 Amb17479004 [0,1,0,1,0,0|1,0,0]=3 2098 B13R1.337 OC(=O)CCCSC1CCNCC1 Amb17502196 [0,1,0,1,0,0|1,0,0]=3 2099 B13R1.337 OC(=O)COCCC1CCCCN1 Amb18628209 [0,1,0,1,0,0|1,0,0]=3 2100 B13R1.337 OC(=O)COCCN1CCNCC1 Amb18108890 [0,1,0,1,0,0|2,0,0]=4 2101 B13R1.337 OC(=O)\C=C\NCC1CCCCC1 Amb25038835 [0,1,0,1,0,0|0,0,2]=4 2102 B13R1.487 CCCCC1CCCCC(O)CC1 Amb24613399 [0,1,0,1,0,0|1,0,1]=4 2103 B13R1.487 CCCC[C@@H]1CCCC[C@@H](O)CC1 Amb25236160 [0,1,0,1,0,0|1,0,1]=4 2104 B13R1.487 CCCC[C@H]1CCCC[C@H](O)C=C1 Amb25176986 [0,1,0,1,0,0|1,0,1]=4 2105 B13R1.568 C#CCCC1CCCC(N1)C(O)=O Amb25788345 [0,1,0,1,0,0|0,0,2]=4 2106 B13R1.568 CCCCN1CC(OCC1)C(O)=O Amb22586094 [0,1,0,1,0,0|2,0,0]=4 2107 B13R1.568 COCCN1CC(CCC1)C(O)=O Amb21954138 [0,1,0,1,0,0|2,0,0]=4 2108 B13R1.803 CN1CCN(CC(O)=O)C(C)CC1 Amb25845842 [0,1,0,1,0,0|2,0,0]=4 2109 B13R1.893 CC1CC(CCC(O)=O)C(=O)CC1 Amb18191663 [0,1,0,1,0,0|1,0,1]=4 2110 B13R1.893 CC1CC(NCC(O)=O)C(C)CC1 Amb25849092 [0,1,0,1,0,0|1,0,0]=3 2111 B13R1.893 CC1CCC(O)CN1CCC(C)=O Amb24568526 [0,1,0,1,0,0|2,0,0]=4 2112 B13R1.893 CC1CCC(O)CN1CCC(N)=O Amb24585873 [0,1,0,1,0,0|2,0,0]=4 2113 B13R1.893 CC1CC[C@@H](O)[C@H](C1)CCC(O)=O Amb25179093 [0,1,0,1,0,0|1,0,0]=3 2114 B13R1.893 CC1CN(CCC(N)=O)C(C)CC1 Amb25130030 [0,1,0,1,0,0|2,0,0]=4 2115 B13R1.893 CC1CN(CCC(O)=O)C(C)CC1 Amb25136470 [0,1,0,1,0,0|1,0,0]=3 2116 B13R1.893 C[C@@H]1CC[C@@H](O)CN1CCC(O)=O Amb24339649 [0,1,0,1,0,0|1,0,0]=3 2117 B13R1.893 C[C@H]1CC[C@H](O)CN1CCC(C)=O Amb24609169 [0,1,0,1,0,0|2,0,0]=4 2118 B13R1.893 C[C@H]1C[C@H](CCC(O)=O)C(=O)CC1 Amb24512200 [0,1,0,1,0,0|1,0,1]=4 2119 B13R1.3501 CC(=C)CCC1CCCCC(Cl)C1 Amb25776715 [0,1,0,1,0,0|2,0,0]=4 2120 B13R1.3501 CC(=O)CCN1CC(F)CCCC1 Amb24412764 [0,1,0,1,0,0|2,0,0]=4 2121 B13R1.3501 CC(C)CCC1CCCCC(O)C1 Amb25049896 [0,1,0,1,0,0|1,0,1]=4 2122 B13R1.3501 CC1CN(CCCO1)CCC(O)=O Amb19002886 [0,1,0,1,0,0|2,0,0]=4 2123 B13R1.3501 CC1COCCN(C1)CCC(O)=O Amb25792072 [0,1,0,1,0,0|2,0,0]=4 2124 B13R1.3501 CS(=O)CCC1CC(=O)CCCC1 Amb24699714 [0,1,0,1,0,0|2,0,0]=4 2125 B13R1.3501 CS(=O)CCC1CCCCC(O)C1 Amb24538995 [0,1,0,1,0,0|2,0,0]=4 2126 B13R1.3501 OC(=O)CCC1CC(=O)CCCC1 Amb24650935 [0,1,0,1,0,0|0,0,1]=3 2127 B13R1.3501 OC(=O)CCC1CCCCC(=O)N1 Amb18191370 [0,1,0,1,0,0|1,0,1]=4 2128 B13R1.3501 OC(=O)CCN1CC(F)CCCC1 Amb24576147 [0,1,0,1,0,0|1,0,0]=3 2129 B13R1.3501 OC(=O)CC[C@@H]1CC(=O)CCCC1 Amb25798856 [0,1,0,1,0,0|0,0,1]=3 2130 B13R1.3501 OC1CNCCN(C1)CCC(O)=O Amb24706104 [0,1,0,1,0,0|2,0,0]=4 2131 B13R1.3501 OC1COCCN(C1)CCC(O)=O Amb24681567 [0,1,0,1,0,0|2,0,0]=4 2132 B13R1.3803 O=C1CCCCC(=O)NCCCC1 Amb24490208 [0,1,0,1,0,0|1,0,1]=4 2133 B13R1.3803 OC1CCCCNC(=O)CCCC1 Amb24694118 [0,1,0,1,0,0|1,0,0]=3 2134 B13R1.4010 CCCN1C(CCC1=O)CC(O)=O Amb22056001 [0,1,0,1,0,0|1,0,1]=4 2135 B13R1.4012 CC1CCCN(C1CCC)C(C)=O Amb24474662 [0,1,0,1,0,0|2,0,0]=4 2136 B13R1.6434 CC1(CCCO)CCCCC(=O)O1 Amb24495814 [0,1,0,1,0,0|1,0,0]=3 2137 B13R1.622 CCC1CCCCC1CS(N)(=O)=O Amb25353935 [0,1,0,1,0,0|1,0,1]=4 2138 B13R1.6268 NS(=O)(=O)CCC1CCCCCC1 Amb24663753 [0,1,0,1,0,0|1,0,1]=4 2139 B13R1.6279 CC(N)(O)CC1CCCCCCC1 Amb25312018 [0,1,0,1,0,0|1,0,1]=4 2140 B13R1.150 CC1C(C)OCCN1CCC(O)=O Amb25120629 [0,1,0,1,0,0|2,0,0]=4 2141 B13R1.150 CC1C(C)SCCN1CCC(O)=O Amb24769395 [0,1,0,1,0,0|2,0,0]=4 2142 B13R1.150 CC1C(N)CCCN1CCC(O)=O Amb24723770 [0,1,0,1,0,0|1,0,0]=3 2143 B13R1.150 CC1C(O)CCCN1CCC(O)=O Amb24557195 [0,1,0,1,0,0|1,0,0]=3 2144 B13R1.150 CC1CCCN(CCC(C)=O)C1C Amb18322721 [0,1,0,1,0,0|2,0,0]=4 2145 B13R1.150 CC1CCCN(CCC(N)=O)C1C Amb19057628 [0,1,0,1,0,0|2,0,0]=4 2146 B13R1.150 CC1CCCN(CCC(O)=O)C1C Amb18986586 [0,1,0,1,0,0|1,0,0]=3 2147 B13R1.150 C[C@@H]1CCC[C@H](CCC(O)=O)C1O Amb24612097 [0,1,0,1,0,0|1,0,0]=3 2148 B13R1.513 CC1CCC(CC1)=CCCC(O)=O Amb18129133 [0,1,0,1,0,0|0,0,2]=4 2149 B13R1.513 CC1CCC(CCNC(C)=O)CC1 Amb25187798 [0,1,0,1,0,0|2,0,0]=4 2150 B13R1.513 CC1CCN(CC1)CCCC(=O)Cl Amb17143297 [0,1,0,1,0,0|2,0,0]=4 2151 B13R1.513 CC1CCN(CC1)CCCC(=O)N Amb17143016 [0,1,0,1,0,0|2,0,0]=4 2152 B13R1.513 CC1CCN(CC1)CCCC(=O)O Amb15741040 [0,1,0,1,0,0|1,0,0]=3 2153 B13R1.513 CN1CCC(CC1)NCCC(=O)O Amb1061217 [0,1,0,1,0,0|2,0,0]=4 2154 B13R1.513 CN1CCC(CC1)NCCC(O)=O Amb22283562 [0,1,0,1,0,0|2,0,0]=4 2155 B13R1.513 CN1CCC(CNCC(O)=O)CC1 Amb19026715 [0,1,0,1,0,0|2,0,0]=4 2156 B13R1.513 CN1CCC(COCC(O)=O)CC1 Amb21860246 [0,1,0,1,0,0|2,0,0]=4 2157 B13R1.513 CN1CCN(CC1)CCCC(=O)O Amb15740927 [0,1,0,1,0,0|2,0,0]=4 2158 B13R1.513 NC1CCN(CCCC(O)=O)CC1 Amb24271268 [0,1,0,1,0,0|1,0,0]=3 2159 B13R1.547 CC(CC)C1CCCCC1C(O)=O Amb25092342 [0,1,0,1,0,0|0,0,0]=2 2160 B13R1.547 CC(CC)C1CCCCN1C(C)=O Amb25725166 [0,1,0,1,0,0|2,0,0]=4 2161 B13R1.547 CC(CC)C1CCCCN1C(N)=O Amb24393585 [0,1,0,1,0,0|2,0,0]=4 2162 B13R1.547 CC(CC)C1CCNCC1C(O)=O Amb18191304 [0,1,0,1,0,0|1,0,0]=3 2163 B13R1.547 CC(CC)C1OCCCC1C(O)=O Amb24406823 [0,1,0,1,0,0|1,0,0]=3 2164 B13R1.547 CC(CC)N1CCCC[C@@H]1C(O)=O Amb24513694 [0,1,0,1,0,0|1,0,0]=3 2165 B13R1.547 CC(CC)N1CCOCC1C(O)=O Amb18191131 [0,1,0,1,0,0|2,0,0]=4 2166 B13R1.547 CC(CC)N1CCSCC1C(O)=O Amb24490983 [0,1,0,1,0,0|2,0,0]=4 2167 B13R1.547 CC(CC)[C@H]1CC=CC[C@H]1C(O)=O Amb24677802 [0,1,0,1,0,0|0,0,2]=4 2168 B13R1.547 CC(OC)C1OCCCC1C(O)=O Amb24753066 [0,1,0,1,0,0|2,0,0]=4 2169 B13R1.547 CCC(=O)C1OCCCC1C(O)=O Amb25723626 [0,1,0,1,0,0|1,0,1]=4 2170 B13R1.547 CCC(=O)N1CCCCC1C(=O)O Amb1116573 [0,1,0,1,0,0|1,0,1]=4 2171 B13R1.547 CCC(=O)[C@@H]1CCCC[C@H]1C(O)=O Amb23558953 [0,1,0,1,0,0|0,0,1]=3 2172 B13R1.547 CCN(C)C1CCCCC1C(O)=O Amb19002549 [0,1,0,1,0,0|1,0,0]=3 2173 B13R1.547 CNC(=O)[C@@H]1CCCC[C@@H]1C(O)=O Amb23441200 [0,1,0,1,0,0|1,0,1]=4 2174 B13R1.547 COC(=O)[C@@H]1CCCC[C@H]1C(O)=O Amb22735906 [0,1,0,1,0,0|1,0,1]=4 2175 B13R1.547 COC(=O)[C@H]1CCCC[C@@H]1C(O)=O Amb24094620 [0,1,0,1,0,0|1,0,1]=4 2176 B13R1.547 NCC(O)[C@@H]1CCCC[C@H]1C(O)=O Amb24739502 [0,1,0,1,0,0|1,0,0]=3 2177 B13R1.643 CCC1CN(CCS1)CCC(O)=O Amb24769388 [0,1,0,1,0,0|2,0,0]=4 2178 B13R1.643 CCN1CC(CCC(O)=O)OCC1 Amb18061909 [0,1,0,1,0,0|2,0,0]=4 2179 B13R1.643 OCC1CCCN(C1)CCC(=O)O Amb1088138 [0,1,0,1,0,0|2,0,0]=4 2180 B13R1.1688 CCC(N)C1CCCCCC(=O)N1 Amb24649957 [0,1,0,1,0,0|1,0,0]=3 2181 B13R1.1868 CCC(C)CC=1CCCCC(=O)C1 Amb24428495 [0,1,0,1,0,0|1,0,1]=4 2182 B13R1.2792 O=C1CCCCCNC(=O)CCO1 Amb25195933 [0,1,0,1,0,0|1,0,1]=4 2183 B13R1.2792 OC1CC=CCCCC(=O)OCC1 Amb24466222 [0,1,0,1,0,0|0,0,2]=4 2184 B13R1.2792 OC1CCOC(=O)CCCCCC1 Amb24462040 [0,1,0,1,0,0|0,0,0]=2 2185 B13R1.3118 C=CC1(O)CCCCC1CC(O)=O Amb25054776 [0,1,0,1,0,0|0,0,2]=4 2186 B13R1.3118 NCC1(O)CCCCC1CC(O)=O Amb25781054 [0,1,0,1,0,0|1,0,0]=3 2187 B13R1.3499 CC1C(CC(O)=O)CCCCN1C Amb24564390 [0,1,0,1,0,0|1,0,0]=3 2188 B13R1.3499 C[C@@H]1[C@@H](CC(O)=O)CCCCN1C Amb18191311 [0,1,0,1,0,0|1,0,0]=3 2189 B13R1.3796 CC1CCCC(CC1)NCC(O)=O Amb25188043 [0,1,0,1,0,0|1,0,0]=3 2190 B13R1.3796 CC1CCCN(CC1)CCC(N)=O Amb24435534 [0,1,0,1,0,0|2,0,0]=4 2191 B13R1.3796 CN1CCCC(CC1)CCC(O)=O Amb18191340 [0,1,0,1,0,0|1,0,0]=3 2192 B13R1.3796 CN1CCCC(CC1)NCC(O)=O Amb25039426 [0,1,0,1,0,0|2,0,0]=4 2193 B13R1.3796 OC(=O)CCC1CCC(=O)NCC1 Amb23453243 [0,1,0,1,0,0|1,0,1]=4 2194 B13R1.3796 OC(=O)CCN1CCCS(=O)CC1 Amb24648962 [0,1,0,1,0,0|2,0,0]=4 2195 B13R1.149 CC1CC(CC#CC(O)=O)CCC1 Amb24740820 [0,1,0,1,0,0|0,0,2]=4 2196 B13R1.149 CC1CC(CCNC(N)=O)CCC1 Amb25721727 [0,1,0,1,0,0|2,0,0]=4 2197 B13R1.149 CC1CCCN(C1)CCCC(=O)Cl Amb17143295 [0,1,0,1,0,0|2,0,0]=4 2198 B13R1.149 CC1CCCN(C1)CCCC(=O)N Amb17143014 [0,1,0,1,0,0|2,0,0]=4 2199 B13R1.149 CC1CN(CCCC(O)=O)CCS1 Amb24769362 [0,1,0,1,0,0|2,0,0]=4 2200 B13R1.149 CN1CC(CNCC(O)=O)CCC1 Amb19026723 [0,1,0,1,0,0|2,0,0]=4 2201 B13R1.149 CN1CC(COCC(O)=O)CCC1 Amb21860244 [0,1,0,1,0,0|2,0,0]=4 2202 B13R1.280 CC(=C)CCC1CCCCCC1Br Amb25274665 [0,1,0,1,0,0|2,0,0]=4 2203 B13R1.280 CC(=C)CCC1CCCCCC1Cl Amb24389910 [0,1,0,1,0,0|2,0,0]=4 2204 B13R1.280 CC(O)CCC1CCCCCC1O Amb24395895 [0,1,0,1,0,0|1,0,1]=4 2205 B13R1.280 CC1CCCCCC1NCC(N)=O Amb24667329 [0,1,0,1,0,0|1,0,0]=3 2206 B13R1.280 CC1CCCCCC1NCC(O)=O Amb24466628 [0,1,0,1,0,0|0,0,0]=2 2207 B13R1.280 CC1CCCCCC1NC[C@@H](C)O Amb25675053 [0,1,0,1,0,0|1,0,1]=4 2208 B13R1.280 CC1CCCCCN1CCC(C)=C Amb24719429 [0,1,0,1,0,0|2,0,0]=4 2209 B13R1.280 CC1CCCCCN1CCC(C)=O Amb24385394 [0,1,0,1,0,0|1,0,0]=3 2210 B13R1.280 CC1CCCCCN1CCC(C)O Amb25340369 [0,1,0,1,0,0|1,0,1]=4 2211 B13R1.280 CC1CCCCCN1CCC(N)=N Amb24460270 [0,1,0,1,0,0|2,0,0]=4 2212 B13R1.280 CC1CCCCCN1CCC(N)=O Amb25098032 [0,1,0,1,0,0|1,0,0]=3 2213 B13R1.280 CC1CCOCCN1CCC(C)=O Amb25058163 [0,1,0,1,0,0|2,0,0]=4 2214 B13R1.280 CC1CCOCCN1CCC(O)=O Amb25356852 [0,1,0,1,0,0|1,0,0]=3 2215 B13R1.280 CC1CCSCCN1CCC(C)=O Amb25284021 [0,1,0,1,0,0|2,0,0]=4 2216 B13R1.280 CC1CCSCCN1CCC(N)=O Amb25057333 [0,1,0,1,0,0|2,0,0]=4 2217 B13R1.280 CC1CCSCCN1CCC(O)=O Amb25204492 [0,1,0,1,0,0|1,0,0]=3 2218 B13R1.280 CC=1CCCCCC1CCC(O)=O Amb24391509 [0,1,0,1,0,0|0,0,1]=3 2219 B13R1.280 CN1CCCCCC1CCC(O)=O Amb18191306 [0,1,0,1,0,0|0,0,0]=2 2220 B13R1.280 CS(=O)CCC1CCCCCC1Br Amb24538787 [0,1,0,1,0,0|2,0,0]=4 2221 B13R1.280 CS(=O)CCC1CCCCCC1N Amb24699696 [0,1,0,1,0,0|2,0,0]=4 2222 B13R1.280 CS(=O)CCC1CCCCCC1O Amb25243805 [0,1,0,1,0,0|2,0,0]=4 2223 B13R1.280 NC(=O)CCC1CCCCCC1=O Amb24680139 [0,1,0,1,0,0|1,0,1]=4 2224 B13R1.280 NC(=O)CNC1CCCCCC1O Amb18970437 [0,1,0,1,0,0|2,0,0]=4 2225 B13R1.280 OC(=O)CCC1CCCCCC1=O Amb18822898 [0,1,0,1,0,0|0,0,1]=3 2226 B13R1.280 OC(=O)CCN1CCCCCC1=O Amb1125181 [0,1,0,1,0,0|1,0,1]=4 2227 B13R1.342 O=C(C1CCCC1)NCCC(=O)O Amb1111626 [0,1,0,1,0,0|1,0,1]=4 2228 B13R1.342 O=C(N1CCCC1)CCCC(=O)O Amb1119271 [0,1,0,1,0,0|1,0,1]=4 2229 B13R1.356 CC1CCC(C(C1)SCC)C(O)=O Amb25711546 [0,1,0,1,0,0|1,0,0]=3 2230 B13R1.658 CC#CCCC1CCC(N1)C(O)=O Amb25755100 [0,1,0,1,0,0|0,0,2]=4 2231 B13R1.658 CCCCCC1N[C@@H](CS1)C(O)=O Amb22460086 [0,1,0,1,0,0|1,0,0]=3 2232 B13R1.658 CCSCCN1CC(CC1)C(O)=O Amb24769160 [0,1,0,1,0,0|2,0,0]=4 2233 B13R1.769 N[C@@H]1CCC[C@H](O)CC[C@@H]1C(O)=O Amb24557761 [0,1,0,1,0,0|1,0,0]=3 2234 B13R1.1988 NC(=O)NCCN1CCCCCC1 Amb25762687 [0,1,0,1,0,0|2,0,0]=4 2235 B13R1.1988 OC(=O)CCCN1CCCCCC1 Amb10072744 [0,1,0,1,0,0|0,0,0]=2 2236 B13R1.1988 OC(=O)CCNC1=NCCCCC1 Amb1052796 [0,1,0,1,0,0|1,0,1]=4 2237 B13R1.1988 OC(=O)\C=C\CN1CCCCCC1 Amb18296443 [0,1,0,1,0,0|0,0,2]=4 2238 B13R1.1988 OC(=O)\C=C\NC1CCCCCC1 Amb24731056 [0,1,0,1,0,0|0,0,2]=4 2239 B13R1.3089 CC1CN(CC(O)=O)C(CO1)CC Amb18979601 [0,1,0,1,0,0|2,0,0]=4 2240 B13R1.3089 CCC1CNC(=O)CC1CC(O)=O Amb18129519 [0,1,0,1,0,0|1,0,1]=4 2241 B13R1.3089 CCN1CCC(N)CC1CC(O)=O Amb24720155 [0,1,0,1,0,0|1,0,0]=3 2242 B13R1.3089 CC[C@@H]1CNC(=O)C[C@H]1CC(O)=O Amb24651008 [0,1,0,1,0,0|1,0,1]=4 2243 B13R1.3089 CC[C@H]1CNC(=O)C[C@@H]1CC(O)=O Amb24578114 [0,1,0,1,0,0|1,0,1]=4 2244 B13R1.3089 COC1CCN(C)CC1CC(O)=O Amb18191133 [0,1,0,1,0,0|2,0,0]=4 2245 B13R1.3787 CC(=O)CCN1C(C)CCCC1C Amb25127019 [0,1,0,1,0,0|2,0,0]=4 2246 B13R1.3787 CC1CCCC(=O)C1CCC(O)=O Amb18129448 [0,1,0,1,0,0|0,0,1]=3 2247 B13R1.3787 CC1CCCC(C1NCC(=O)N)C Amb1117038 [0,1,0,1,0,0|2,0,0]=4 2248 B13R1.3787 CC1CCCC(N1CCC(=O)Cl)C Amb17143289 [0,1,0,1,0,0|2,0,0]=4 2249 B13R1.3787 CC1CCCC(N1CCC(=O)N)C Amb17143008 [0,1,0,1,0,0|2,0,0]=4 2250 B13R1.3787 CC1COCC(C)N1CCC(O)=O Amb24751945 [0,1,0,1,0,0|2,0,0]=4 2251 B13R1.3787 C[C@@H]1CCC[C@H](C)N1CCC(O)=O Amb22757831 [0,1,0,1,0,0|1,0,0]=3 2252 B13R1.5134 OC(=O)C#CCC1(O)CCCCC1 Amb25363234 [0,1,0,1,0,0|0,0,2]=4 2253 B13R1.5134 OC(=O)\C=C\CC1(O)CCCCC1 Amb18648910 [0,1,0,1,0,0|0,0,2]=4 2254 B13R1.6 CCCCC#CC1CC(=O)CCC1 Amb25112538 [0,1,0,1,0,0|1,0,1]=4 2255 B13R1.6 CC\C=C/CCC1CCCC(=O)O1 Amb22734229 [0,1,0,1,0,0|0,0,1]=3 2256 B13R1.90 CC(=O)NCC1CCCCC1CBr Amb25815718 [0,1,0,1,0,0|2,0,0]=4 2257 B13R1.90 CC(=O)NCC1CCCCC1CCl Amb25092213 [0,1,0,1,0,0|2,0,0]=4 2258 B13R1.90 CC(=O)NCC1CCCCC1CN Amb25315794 [0,1,0,1,0,0|2,0,0]=4 2259 B13R1.90 CC(=O)NCC1CCCCC1CO Amb24400354 [0,1,0,1,0,0|2,0,0]=4 2260 B13R1.90 CCC1CCCCC1NNC(N)=O Amb25060729 [0,1,0,1,0,0|2,0,0]=4 2261 B13R1.90 CCC1CCCCC1\C=C\C(C)=O Amb25197461 [0,1,0,1,0,0|1,0,1]=4 2262 B13R1.90 CCC1CCCCN1CCC(=O)Cl Amb17143287 [0,1,0,1,0,0|1,0,0]=3 2263 B13R1.90 CCC1CCCCN1CCC(O)=O Amb21955365 [0,1,0,1,0,0|0,0,0]=2 2264 B13R1.90 COC1CCCCC1CNC(C)=O Amb25092700 [0,1,0,1,0,0|2,0,0]=4 2265 B13R1.90 NC(=O)NCC1CCCCC1CO Amb24400446 [0,1,0,1,0,0|2,0,0]=4 2266 B13R1.90 OCC1CCCCN1CCC(O)=O Amb19076440 [0,1,0,1,0,0|1,0,0]=3 2267 B13R1.103 CCC1CCCC1N\C=C\C(O)=O Amb24601524 [0,1,0,1,0,0|0,0,2]=4 2268 B13R1.167 CC1CCCC1CN\C=C\C(O)=O Amb25303472 [0,1,0,1,0,0|0,0,2]=4 2269 B13R1.224 C#CCC1CCCCCC1C(O)=O Amb25369715 [0,1,0,1,0,0|0,0,1]=3 2270 B13R1.224 CC(=O)N1CCCCCC1CCO Amb25077814 [0,1,0,1,0,0|2,0,0]=4 2271 B13R1.224 CCCC1CCCCCC1C(O)=O Amb24377494 [0,1,0,1,0,0|0,0,0]=2 2272 B13R1.224 CCSC1CCCCCC1C(O)=O Amb18303070 [0,1,0,1,0,0|0,0,0]=2 2273 B13R1.224 OC(=O)C1CCCCCC1NC=O Amb24442240 [0,1,0,1,0,0|1,0,1]=4 2274 B13R1.226 OCCC1CCCCCCC(=O)O1 Amb25284567 [0,1,0,1,0,0|0,0,0]=2 2275 B13R1.279 O=C1CCCCCCCCCCC1 Amb1935123 [0,1,0,1,0,0|1,0,0]=3 2276 B13R1.279 O=C1CCCCCCCCCCN1 Amb22011853 [0,1,0,1,0,0|1,0,0]=3 2277 B13R1.279 O=C1NCCCCCCCCCN1 Amb24616274 [0,1,0,1,0,0|1,0,0]=3 2278 B13R1.279 OC1CCCCCCCCCCO1 Amb24495296 [0,1,0,1,0,0|0,0,2]=4 2279 B13R1.283 CC(=O)N[C@@H]1CCCCCC[C@H]1O Amb24656143 [0,1,0,1,0,0|2,0,0]=4 2280 B13R1.283 CC(=O)O[C@@H]1CCCCCC[C@@H]1O Amb25366144 [0,1,0,1,0,0|2,0,0]=4 2281 B13R1.283 OC(=O)CC1CCCCCCC1=O Amb25187867 [0,1,0,1,0,0|0,0,1]=3 2282 B13R1.343 CC(=O)NCCCCN1CCCC1 Amb13848931 [0,1,0,1,0,0|2,0,0]=4 2283 B13R1.343 NC(=O)CNCCCN1CCCC1 Amb19075351 [0,1,0,1,0,0|2,0,0]=4 2284 B13R1.343 OC(=O)CCCCCC1CCSS1 Amb17614989 [0,1,0,1,0,0|1,0,0]=3 2285 B13R1.343 OC(=O)CCCCCC1OCCO1 Amb25124123 [0,1,0,1,0,0|1,0,0]=3 2286 B13R1.343 OC(=O)CNCCCN1CCCC1 Amb19058449 [0,1,0,1,0,0|1,0,0]=3 2287 B13R1.380 C#CCN1CCCCC1CC(O)=O Amb18971239 [0,1,0,1,0,0|0,0,2]=4 2288 B13R1.380 CC(=O)N[C@@H]1CCCC[C@H]1CCO Amb25287161 [0,1,0,1,0,0|2,0,0]=4 2289 B13R1.380 CCCC1CCCCC1CC(O)=O Amb22339365 [0,1,0,1,0,0|0,0,0]=2 2290 B13R1.380 CCCN1CCCCC1CC(O)=O Amb18304879 [0,1,0,1,0,0|0,0,0]=2 2291 B13R1.380 CCNC1CCCCC1NC(C)=O Amb21862534 [0,1,0,1,0,0|2,0,0]=4 2292 B13R1.380 CCOC1CCCCC1CC(O)=O Amb18191219 [0,1,0,1,0,0|0,0,0]=2 2293 B13R1.380 CCOC1CCCCC1NC(C)=O Amb25366087 [0,1,0,1,0,0|2,0,0]=4 2294 B13R1.380 COCC1CCCCN1CC(O)=O Amb21865524 [0,1,0,1,0,0|1,0,0]=3 2295 B13R1.380 N#CCN1CCCCC1CC(O)=O Amb18971243 [0,1,0,1,0,0|1,0,1]=4 2296 B13R1.380 OC(=O)CC1CCCCC1NC=O Amb24396622 [0,1,0,1,0,0|1,0,1]=4 2297 B13R1.380 OC(=O)C[C@@H]1CCCC[C@@H]1NC=O Amb24601097 [0,1,0,1,0,0|1,0,1]=4 2298 B13R1.380 [N-]=[N+]=NC1CCCCC1CC(O)=O Amb24441552 [0,1,0,1,0,0|2,0,0]=4 2299 B13R1.392 CSCC1CCCN1CCC(O)=O Amb24769710 [0,1,0,1,0,0|1,0,0]=3 2300 B13R1.486 CCCCC1CC(=O)NCCCN1 Amb24632778 [0,1,0,1,0,0|2,0,0]=4 2301 B13R1.486 OCCCC1CCCCCC(=O)N1 Amb18191307 [0,1,0,1,0,0|1,0,0]=3 2302 B13R1.486 OCCCC1CCCCCC(=O)O1 Amb24569922 [0,1,0,1,0,0|0,0,0]=2 2303 B13R1.486 OCCOC1CC(=O)CCCCC1 Amb25226428 [0,1,0,1,0,0|2,0,0]=4 2304 B13R1.572 C=CCNC1CCCCC1C(O)=O Amb22585760 [0,1,0,1,0,0|0,0,2]=4 2305 B13R1.572 CC#CCC1CCCCC1C(O)=O Amb25838065 [0,1,0,1,0,0|0,0,1]=3 2306 B13R1.572 CC#CCN1CCCCC1C(O)=O Amb18297007 [0,1,0,1,0,0|0,0,2]=4 2307 B13R1.572 CCCCN1CCCCC1C(=O)O Amb13886354 [0,1,0,1,0,0|0,0,0]=2 2308 B13R1.572 CCCCN1CCCCC1C(=O)O Amb2382770 [0,1,0,1,0,0|0,0,0]=2 2309 B13R1.572 CCCCN1CCOCC1C(O)=O Amb24271291 [0,1,0,1,0,0|1,0,0]=3 2310 B13R1.572 CCNCC1CCCCN1C(C)=O Amb21860340 [0,1,0,1,0,0|2,0,0]=4 2311 B13R1.572 N#CCCN1CCCCC1C(O)=O Amb19000908 [0,1,0,1,0,0|1,0,1]=4 2312 B13R1.572 N#CCCN1CCCC[C@@H]1C(O)=O Amb24557862 [0,1,0,1,0,0|1,0,1]=4 2313 B13R1.572 OC(=O)C1CCCCC1CNC=O Amb24635051 [0,1,0,1,0,0|1,0,1]=4 2314 B13R1.578 CC#CCN1CCCC1CC(O)=O Amb18185030 [0,1,0,1,0,0|0,0,2]=4 2315 B13R1.578 COCCN1CCCC1CC([O-])=O Amb19514745 [0,1,0,1,0,0|1,0,1]=4 2316 B13R1.610 CC(=C)CC1CCCCCC1CN Amb24715363 [0,1,0,1,0,0|2,0,0]=4 2317 B13R1.610 CC(=O)CN1CCCCCC1CO Amb24417527 [0,1,0,1,0,0|2,0,0]=4 2318 B13R1.610 CC(O)CC1CCCCCN1CC Amb24616222 [0,1,0,1,0,0|1,0,1]=4 2319 B13R1.610 CCC1CCCCCC1NC(=O)C Amb2227899 [0,1,0,1,0,0|1,0,0]=3 2320 B13R1.610 CCC1CCCCCN1CC(=C)Br Amb24548670 [0,1,0,1,0,0|2,0,0]=4 2321 B13R1.610 CCC1CCCCCN1CC(=C)Cl Amb24450900 [0,1,0,1,0,0|2,0,0]=4 2322 B13R1.610 CCC1CCCCCN1CC(N)=N Amb24349457 [0,1,0,1,0,0|2,0,0]=4 2323 B13R1.610 CCC1CCCCCN1CC(N)=O Amb25090150 [0,1,0,1,0,0|1,0,0]=3 2324 B13R1.610 CCC1CCCCCN1CC(O)=O Amb24349311 [0,1,0,1,0,0|0,0,0]=2 2325 B13R1.610 CCN1CCCCCC1CC(C)=O Amb24472004 [0,1,0,1,0,0|1,0,0]=3 2326 B13R1.610 CC[C@@H]1CCCCC[C@@H]1NC(C)=O Amb24560969 [0,1,0,1,0,0|1,0,0]=3 2327 B13R1.610 CC[C@@H]1NCCCC[C@H]1CC(O)=O Amb18191310 [0,1,0,1,0,0|0,0,0]=2 2328 B13R1.610 CNC1CCCCCC1CC(C)=C Amb24619093 [0,1,0,1,0,0|2,0,0]=4 2329 B13R1.610 COC1CCCCCC1CC(O)=O Amb18822015 [0,1,0,1,0,0|0,0,0]=2 2330 B13R1.610 COC1CCCCCC1NC(N)=O Amb24335007 [0,1,0,1,0,0|2,0,0]=4 2331 B13R1.610 C[C@@H](O)CN1CCCCCC1CC Amb25153752 [0,1,0,1,0,0|1,0,1]=4 2332 B13R1.610 C[C@H](O)CN1CCCCCC1CC Amb24617408 [0,1,0,1,0,0|1,0,1]=4 2333 B13R1.610 OCC1CCCCCC1CC(O)=O Amb25101626 [0,1,0,1,0,0|0,0,0]=2 2334 B13R1.610 OCC1CCCCCN1CC(O)=O Amb25696335 [0,1,0,1,0,0|1,0,0]=3 2335 B13R1.614 CCC1CCCCCCC1C(O)=O Amb24710104 [0,1,0,1,0,0|0,0,0]=2 2336 B13R1.614 CNC1CCCCCCC1S(C)=O Amb24394188 [0,1,0,1,0,0|2,0,0]=4 2337 B13R1.659 CCCCCCCCCC[C@@H]1CO1 Amb22353251 [0,1,0,1,0,0|1,0,1]=4 2338 B13R1.670 CC#CCCC1CCCC1C(O)=O Amb24471231 [0,1,0,1,0,0|0,0,1]=3 2339 B13R1.670 CCSCCN1CCCC1C(O)=O Amb24769161 [0,1,0,1,0,0|1,0,0]=3 2340 B13R1.670 CCSCCN1CCC[C@H]1C(O)=O Amb24769158 [0,1,0,1,0,0|1,0,0]=3 2341 B13R1.1009 NC(=O)C1CCCCNCCCC1 Amb24461661 [0,1,0,1,0,0|1,0,0]=3 2342 B13R1.1009 OC(=O)C1CCC=CCCCCC1 Amb25039409 [0,1,0,1,0,0|0,0,1]=3 2343 B13R1.1009 OC(=O)C1CCCCCCCCC1 Amb25061287 [0,1,0,1,0,0|0,0,0]=2 2344 B13R1.1009 OC(=O)C1CCCCNCCCC1 Amb24365928 [0,1,0,1,0,0|0,0,0]=2 2345 B13R1.1009 OC(=O)C=1CCCCCCCCC1 Amb24711230 [0,1,0,1,0,0|0,0,1]=3 2346 B13R1.1022 CC(=C)CNC1CCCCCCC1 Amb17308786 [0,1,0,1,0,0|2,0,0]=4 2347 B13R1.1022 CC(=O)CCC1CCCCCCC1 Amb25120339 [0,1,0,1,0,0|1,0,0]=3 2348 B13R1.1022 CC(=O)NCC1CCCCCCC1 Amb24072669 [0,1,0,1,0,0|1,0,0]=3 2349 B13R1.1022 CC(=O)\C=C\C1CCCCCCC1 Amb24380069 [0,1,0,1,0,0|1,0,1]=4 2350 B13R1.1022 CC(=O)\N=C/C1CCCCCCC1 Amb24073013 [0,1,0,1,0,0|1,0,1]=4 2351 B13R1.1022 CC(O)CCC1CCCCCCC1 Amb25260363 [0,1,0,1,0,0|1,0,1]=4 2352 B13R1.1022 CC(O)CCN1CCCCCCC1 Amb18329034 [0,1,0,1,0,0|1,0,1]=4 2353 B13R1.1022 CS(=O)CCN1CCCCCCC1 Amb25138484 [0,1,0,1,0,0|2,0,0]=4 2354 B13R1.1022 C[C@@H](O)CNC1CCCCCCC1 Amb25038976 [0,1,0,1,0,0|1,0,1]=4 2355 B13R1.1022 NC(=O)CCN1CCCCCCC1 Amb18328558 [0,1,0,1,0,0|1,0,0]=3 2356 B13R1.1022 NC(=O)CNC1CCCCCCC1 Amb1113527 [0,1,0,1,0,0|1,0,0]=3 2357 B13R1.1022 NC(=O)NCC1CCCCCCC1 Amb25163666 [0,1,0,1,0,0|1,0,0]=3 2358 B13R1.1022 NC(=O)\C=C\C1CCCCCCC1 Amb25791108 [0,1,0,1,0,0|1,0,1]=4 2359 B13R1.1022 OC(=O)C#CC1CCCCCCC1 Amb25332789 [0,1,0,1,0,0|0,0,1]=3 2360 B13R1.1022 OC(=O)CCN1CCCCCCC1 Amb21955684 [0,1,0,1,0,0|0,0,0]=2 2361 B13R1.1022 OC(=O)CCN1CCSCCCC1 Amb23596973 [0,1,0,1,0,0|1,0,0]=3 2362 B13R1.1022 OC(=O)CNC1CCCCCC=C1 Amb25277891 [0,1,0,1,0,0|0,0,2]=4 2363 B13R1.1022 OC(=O)CSC1CCCCCC=C1 Amb25075314 [0,1,0,1,0,0|0,0,2]=4 2364 B13R1.1022 OC(=O)CSC1CCCCCCC1 Amb25725888 [0,1,0,1,0,0|0,0,0]=2 2365 B13R1.1022 OC(=O)\C=C\C1CCCCCCC1 Amb24397482 [0,1,0,1,0,0|0,0,1]=3 2366 B13R1.1022 [O-][N+](=O)CCN1CCCCCCC1 Amb25042470 [0,1,0,1,0,0|1,0,1]=4 2367 B13R1.1148 C#CCCCC1CC(=O)CCCC1 Amb25137368 [0,1,0,1,0,0|1,0,1]=4 2368 B13R1.1148 CC#CCCC1CC(=O)CCCC1 Amb24757506 [0,1,0,1,0,0|1,0,1]=4 2369 B13R1.3712 CC1(O)CCCCCCCCC1O Amb25036035 [0,1,0,1,0,0|1,0,1]=4 2370 B13R1.91 CCC(=O)NC1CCCCC1CC Amb25039345 [0,1,0,1,0,0|2,0,0]=4 2371 B13R1.91 CCC1CCCCC1NC(=O)NN Amb18323370 [0,1,0,1,0,0|2,0,0]=4 2372 B13R1.91 CCC1CCCCC1NC(=O)OC Amb25301109 [0,1,0,1,0,0|1,0,0]=3 2373 B13R1.91 CCC1CCCCC1NC(N)=NO Amb18328997 [0,1,0,1,0,0|2,0,0]=4 2374 B13R1.91 CCC1CCCCN1CC(=O)NC Amb25058262 [0,1,0,1,0,0|2,0,0]=4 2375 B13R1.91 CCC1CCCCN1CC(=O)NN Amb24447228 [0,1,0,1,0,0|2,0,0]=4 2376 B13R1.91 CCC1CNCCC1CC(=O)NN Amb24710267 [0,1,0,1,0,0|2,0,0]=4 2377 B13R1.91 COC(=O)CC1CCCCC1OC Amb23538297 [0,1,0,1,0,0|1,0,0]=3 2378 B13R1.91 COC(=O)NC1CCCCC1CN Amb25287998 [0,1,0,1,0,0|2,0,0]=4 2379 B13R1.91 COC(=O)NC1CCCCC1CO Amb25673723 [0,1,0,1,0,0|2,0,0]=4 2380 B13R1.91 COC(=O)N[C@@H]1CCCC[C@H]1CO Amb24386634 [0,1,0,1,0,0|2,0,0]=4 2381 B13R1.91 COC(=O)N[C@H]1CCCC[C@@H]1OC Amb25031688 [0,1,0,1,0,0|2,0,0]=4 2382 B13R1.91 COC1CCCCC1CC(=O)NN Amb23538287 [0,1,0,1,0,0|2,0,0]=4 2383 B13R1.91 COC1CCCCC1NC(=O)CO Amb25817990 [0,1,0,1,0,0|2,0,0]=4 2384 B13R1.91 CO[C@H]1CCCC[C@@H]1NC(=O)CO Amb24473652 [0,1,0,1,0,0|2,0,0]=4 2385 B13R1.91 OCC(=O)NC1CCCCC1CO Amb24347746 [0,1,0,1,0,0|2,0,0]=4 2386 B13R1.203 N[C@@H]1CCCCCCCCC[C@H]1O Amb24553817 [0,1,0,1,0,0|1,0,1]=4 2387 B13R1.203 O=C1CCCCCCCCCC1Cl Amb24561040 [0,1,0,1,0,0|1,0,0]=3 2388 B13R1.203 OC1CCCCCCCCCC1O Amb25680531 [0,1,0,1,0,0|0,0,2]=4 2389 B13R1.382 CCCC1CCCCN1C(=O)C#C Amb25769110 [0,1,0,1,0,0|2,0,0]=4 2390 B13R1.382 CCCN1CCCCC1C(=O)NC Amb25204887 [0,1,0,1,0,0|2,0,0]=4 2391 B13R1.527 CC1CCCCCC1NC(=O)CBr Amb25369097 [0,1,0,1,0,0|2,0,0]=4 2392 B13R1.527 CC1CCCCCC1NC(=O)CC Amb25727411 [0,1,0,1,0,0|2,0,0]=4 2393 B13R1.527 CC1CCCCCC1NC(=O)CS Amb25742603 [0,1,0,1,0,0|1,1,0]=4 2394 B13R1.527 CC1CCCCCC1NC(=O)NN Amb24423708 [0,1,0,1,0,0|2,0,0]=4 2395 B13R1.527 CC1CCCCCC1NC(N)=NO Amb24550962 [0,1,0,1,0,0|2,0,0]=4 2396 B13R1.527 CC1CCCCCN1CC(=O)NN Amb25340807 [0,1,0,1,0,0|2,0,0]=4 2397 B13R1.527 CCC(=O)CC1CCCCCC1O Amb24490006 [0,1,0,1,0,0|2,0,0]=4 2398 B13R1.527 COC(=O)CC1CCCCCC1=O Amb25134202 [0,1,0,1,0,0|1,0,1]=4 2399 B13R1.527 COC(=O)CN1CCCCCC1C Amb24746790 [0,1,0,1,0,0|1,0,0]=3 2400 B13R1.527 COC(=O)CN1CCCOCC1C Amb24414795 [0,1,0,1,0,0|2,0,0]=4 2401 B13R1.527 COC(=O)CN1CCOCCC1C Amb24343298 [0,1,0,1,0,0|2,0,0]=4 2402 B13R1.527 COC(=O)NC1CCCCCC1N Amb25137506 [0,1,0,1,0,0|2,0,0]=4 2403 B13R1.527 COC(=O)OC1CCCCCC1N Amb24441842 [0,1,0,1,0,0|2,0,0]=4 2404 B13R1.527 NNC(=O)CC1CCCCCC1O Amb24464769 [0,1,0,1,0,0|2,0,0]=4 2405 B13R1.527 O[C@@H]1CCCCC[C@H]1NC(=O)CO Amb25801722 [0,1,0,1,0,0|2,0,0]=4 2406 B13R1.528 CC1CCCCC1CNC(=O)C#C Amb25079974 [0,1,0,1,0,0|2,0,0]=4 2407 B13R1.528 CC1CCCCC1CNC(=O)C=C Amb18796494 [0,1,0,1,0,0|2,0,0]=4 2408 B13R1.528 CC1CCCCC1CNC(=O)CBr Amb24632263 [0,1,0,1,0,0|2,0,0]=4 2409 B13R1.528 CC1CCCCC1CNC(=O)CC Amb24723017 [0,1,0,1,0,0|2,0,0]=4 2410 B13R1.528 CC1CCCCC1CNC(=O)CCl Amb25116327 [0,1,0,1,0,0|2,0,0]=4 2411 B13R1.528 CC1CCCCC1CNC(=O)CN Amb18293021 [0,1,0,1,0,0|2,0,0]=4 2412 B13R1.528 CC1CCCCC1CNC(=O)CS Amb25730655 [0,1,0,1,0,0|1,1,0]=4 2413 B13R1.528 CC1CCCCC1CNC(=O)NC Amb25131028 [0,1,0,1,0,0|2,0,0]=4 2414 B13R1.528 CC1CCCCC1CNC(=O)NN Amb19058079 [0,1,0,1,0,0|2,0,0]=4 2415 B13R1.528 CC1CCCCC1CNC(N)=NO Amb18328996 [0,1,0,1,0,0|2,0,0]=4 2416 B13R1.528 CC1CCCCC1OCC(=O)NN Amb24717644 [0,1,0,1,0,0|2,0,0]=4 2417 B13R1.528 CC1CCCCC1\C=C\C(=O)OC Amb25374527 [0,1,0,1,0,0|0,0,2]=4 2418 B13R1.528 CC1CCCCN1CCC(=O)NN Amb25786708 [0,1,0,1,0,0|2,0,0]=4 2419 B13R1.528 CC1CCCCN1CCC(=O)NO Amb24674859 [0,1,0,1,0,0|1,0,0]=3 2420 B13R1.528 CC1COCCC1CNC(=O)CO Amb24362414 [0,1,0,1,0,0|2,0,0]=4 2421 B13R1.528 CNC(=O)CC[C@H]1CCCC[C@@H]1N Amb25302324 [0,1,0,1,0,0|2,0,0]=4 2422 B13R1.528 COC(=O)CCN1CCNCC1C Amb19028082 [0,1,0,1,0,0|2,0,0]=4 2423 B13R1.528 COC(=O)NCC1CCCCC1O Amb24643785 [0,1,0,1,0,0|2,0,0]=4 2424 B13R1.536 COC(=O)C#CCCC1CCCC1 Amb24758508 [0,1,0,1,0,0|0,0,2]=4 2425 B13R1.536 COC(=O)CCOCC1CCNC1 Amb21957248 [0,1,0,1,0,0|2,0,0]=4 2426 B13R1.536 COC(=O)CCSCC1CCCN1 Amb22395581 [0,1,0,1,0,0|2,0,0]=4 2427 B13R1.546 CNC(=O)C1CCCCCCC1N Amb24371924 [0,1,0,1,0,0|2,0,0]=4 2428 B13R1.546 COC(=O)C1CCCCCCC1=O Amb22270247 [0,1,0,1,0,0|1,0,1]=4 2429 B13R1.546 COC(=O)C1CCCCCCC1N Amb20668749 [0,1,0,1,0,0|1,0,0]=3 2430 B13R1.546 COC(=O)C1CCCCCCC1N Amb25114777 [0,1,0,1,0,0|1,0,0]=3 2431 B13R1.546 COC(=O)C1CCCCCCC1O Amb24495767 [0,1,0,1,0,0|1,0,0]=3 2432 B13R1.546 COC(=O)[C@@H]1CCCCCC[C@@H]1O Amb24619178 [0,1,0,1,0,0|1,0,0]=3 2433 B13R1.546 NC1CCCCCCC1C(=O)NN Amb24446158 [0,1,0,1,0,0|2,0,0]=4 2434 B13R1.611 CCC1CCCCCC1C(=O)NC Amb25702392 [0,1,0,1,0,0|1,0,0]=3 2435 B13R1.611 CCC1CCCCCN1C(=O)C#C Amb25130184 [0,1,0,1,0,0|2,0,0]=4 2436 B13R1.611 CCC1CCCCCN1C(=O)CCl Amb24655385 [0,1,0,1,0,0|2,0,0]=4 2437 B13R1.611 CCC1CCCCCN1C(=O)CN Amb25757119 [0,1,0,1,0,0|2,0,0]=4 2438 B13R1.611 CCC1CCCCCN1C(=O)NC Amb25236434 [0,1,0,1,0,0|2,0,0]=4 2439 B13R1.611 CCC1CCCCCN1C(=O)OC Amb25155679 [0,1,0,1,0,0|1,0,0]=3 2440 B13R1.611 COC(=O)N1CCCCCC1CN Amb25778851 [0,1,0,1,0,0|2,0,0]=4 2441 B13R1.718 BrCC(=O)NCCC1CCCCC1 Amb17330356 [0,1,0,1,0,0|2,0,0]=4 2442 B13R1.718 CNC(=O)CCNC1CCCCC1 Amb19033708 [0,1,0,1,0,0|2,0,0]=4 2443 B13R1.718 CNC(=O)NCCC1CCCCC1 Amb24534577 [0,1,0,1,0,0|2,0,0]=4 2444 B13R1.718 COC(=O)CCCC1CCNCC1 Amb22499628 [0,1,0,1,0,0|1,0,0]=3 2445 B13R1.718 COC(=O)CCCN1CCCCC1 Amb22235542 [0,1,0,1,0,0|1,0,0]=3 2446 B13R1.718 COC(=O)CCOC1CCCNC1 Amb21957712 [0,1,0,1,0,0|2,0,0]=4 2447 B13R1.718 COC(=O)CCOC1CCNCC1 Amb21957742 [0,1,0,1,0,0|2,0,0]=4 2448 B13R1.718 COC(=O)CCSC1CCNCC1 Amb22395536 [0,1,0,1,0,0|2,0,0]=4 2449 B13R1.718 COC(=O)CSCC1CCCCN1 Amb22395629 [0,1,0,1,0,0|2,0,0]=4 2450 B13R1.718 COC(=O)CSCC1CCNCC1 Amb22395592 [0,1,0,1,0,0|2,0,0]=4 2451 B13R1.718 COC(=O)CSCC1CNCCC1 Amb22395608 [0,1,0,1,0,0|2,0,0]=4 2452 B13R1.718 COC(=O)NCCN1CCCCC1 Amb22460070 [0,1,0,1,0,0|2,0,0]=4 2453 B13R1.718 ClCC(=O)NCCC1CCCCC1 Amb17325960 [0,1,0,1,0,0|2,0,0]=4 2454 B13R1.718 NC(NCCC1CCCCC1)=NO Amb19075380 [0,1,0,1,0,0|2,0,0]=4 2455 B13R1.718 NNC(=O)CCNC1CCCCC1 Amb20171965 [0,1,0,1,0,0|2,0,0]=4 2456 B13R1.718 NNC(=O)NCCC1CCCCC1 Amb19058051 [0,1,0,1,0,0|2,0,0]=4 2457 B13R1.718 N\C(\CCNC1CCCCC1)=N\O Amb19981290 [0,1,0,1,0,0|2,0,0]=4 2458 B13R1.718 O\N=C(\CCCN1CCCCC1)/N Amb1784602 [0,1,0,1,0,0|2,0,0]=4 2459 B13R1.1689 CCC(=O)N1CCCCCCCC1 Amb25169088 [0,1,0,1,0,0|2,0,0]=4 2460 B13R1.1689 CNC(=O)N1CCCCCCCC1 Amb25361164 [0,1,0,1,0,0|2,0,0]=4 2461 B13R1.1689 COC(=O)N1CCCCCCCC1 Amb25097230 [0,1,0,1,0,0|1,0,0]=3 2462 B13R1.1689 NNC(=O)N1CCCCCCCC1 Amb25169079 [0,1,0,1,0,0|2,0,0]=4 2463 B13R1.1689 O=C(CS)N1CCCCCCCC1 Amb25169119 [0,1,0,1,0,0|1,1,0]=4 2464 B13R1.1711 CNC(=O)COC1CCCCCC1 Amb24529577 [0,1,0,1,0,0|2,0,0]=4 2465 B13R1.1711 CNC(=O)NCC1CCCCCC1 Amb25310322 [0,1,0,1,0,0|2,0,0]=4 2466 B13R1.1711 COC(=O)C#CC1CCCCCC1 Amb25278204 [0,1,0,1,0,0|0,0,2]=4 2467 B13R1.1711 COC(=O)NCC1CCCCCC1 Amb24626429 [0,1,0,1,0,0|1,0,0]=3 2468 B13R1.1711 COC(=O)\C=C\C1CCCCCC1 Amb24702978 [0,1,0,1,0,0|0,0,2]=4 2469 B13R1.1711 NNC(=O)CCN1CCCCCC1 Amb1152580 [0,1,0,1,0,0|2,0,0]=4 2470 B13R1.1711 N\C(\CCN1CCCCCC1)=N\O Amb19981285 [0,1,0,1,0,0|2,0,0]=4 2471 B13R1.1711 N\C(\COC1CCCCCC1)=N/O Amb18323595 [0,1,0,1,0,0|2,0,0]=4 2472 B13R1.1711 O=C(CCl)NCC1CCCCCC1 Amb25123810 [0,1,0,1,0,0|2,0,0]=4 2473 B13R1.1711 OCC(=O)CC=C1CCCCCC1 Amb22363899 [0,1,0,1,0,0|0,0,2]=4 2474 B13R1.1870 CCC(=O)CN1CCCCCCC1 Amb19074506 [0,1,0,1,0,0|2,0,0]=4 2475 B13R1.1870 CNC(=O)CN1CCCCCCC1 Amb24465887 [0,1,0,1,0,0|2,0,0]=4 2476 B13R1.1870 COC(=C)CN1CCCCCCC1 Amb24448819 [0,1,0,1,0,0|2,0,0]=4 2477 B13R1.1870 COC(=O)C=C1CCCCCCC1 Amb25180453 [0,1,0,1,0,0|0,0,2]=4 2478 B13R1.1870 COC(=O)NC1CCCCCCC1 Amb17739564 [0,1,0,1,0,0|1,0,0]=3 2479 B13R1.1870 COC(=O)OC1CCCCCCC1 Amb25782061 [0,1,0,1,0,0|1,0,0]=3 2480 B13R1.1870 ClCC(=O)NC1CCCCCCC1 Amb1150245 [0,1,0,1,0,0|2,0,0]=4 2481 B13R1.1870 NC(NC1CCCCCCC1)=NO Amb19075378 [0,1,0,1,0,0|2,0,0]=4 2482 B13R1.1870 OCC(=O)C=C1CCCCCCC1 Amb25065458 [0,1,0,1,0,0|0,0,2]=4 2483 B13R1.1870 ONC(=O)NC1CCCCCCC1 Amb24453348 [0,1,0,1,0,0|1,0,0]=3 2484 B13R1.1885 CCCCCCC1CC1C(=O)OC Amb24100754 [0,1,0,1,0,0|0,0,0]=2 2485 B13R1.2122 COC1CCCCCCC(O)C1=O Amb24749594 [0,1,0,1,0,0|1,0,1]=4 2486 B13R1.3115 NCC1(O)CCCCCCCCC1 Amb25743744 [0,1,0,1,0,0|1,0,1]=4 2487 B13R1.3819 OC1CCCCCCCC(=O)C1=O Amb25097840 [0,1,0,1,0,0|1,0,1]=4 2488 B13R1.89 CC(C(O)=O)=C1CCCCC1CC Amb24471970 [0,1,0,1,0,0|0,0,2]=4 2489 B13R1.89 CC(C(O)=O)N1CCCCC1CN Amb18294587 [0,1,0,1,0,0|2,0,0]=4 2490 B13R1.89 CC(C(O)=O)N1CCCCC1CO Amb18294606 [0,1,0,1,0,0|2,0,0]=4 2491 B13R1.89 CC(C1CCCCC1CC)C(O)=O Amb24405476 [0,1,0,1,0,0|0,0,0]=2 2492 B13R1.89 CC(C1CCCCC1OC)C(C)=O Amb24737851 [0,1,0,1,0,0|2,0,0]=4 2493 B13R1.89 CCC1CCCCC1=C(F)C(O)=O Amb24591445 [0,1,0,1,0,0|0,0,2]=4 2494 B13R1.89 CCC1CCCCC1C(N)C(O)=O Amb25345376 [0,1,0,1,0,0|0,0,0]=2 2495 B13R1.89 CCC1CCCCC1C(O)C(N)=O Amb24597900 [0,1,0,1,0,0|1,0,0]=3 2496 B13R1.89 CCC1CCCCN1C(C(=O)Cl)C Amb17143284 [0,1,0,1,0,0|2,0,0]=4 2497 B13R1.89 CCC1CCCCN1C(C(=O)N)C Amb17143004 [0,1,0,1,0,0|2,0,0]=4 2498 B13R1.89 COC1CCCCC1C(F)C(O)=O Amb25769755 [0,1,0,1,0,0|1,0,0]=3 2499 B13R1.89 COC1CCCCC1C(N)C(O)=O Amb25740982 [0,1,0,1,0,0|1,0,0]=3 2500 B13R1.89 COC1CCCCC1[C@H](N)C(O)=O Amb24462349 [0,1,0,1,0,0|1,0,0]=3 2501 B13R1.89 COC1COCCC1C(O)C(O)=O Amb24565115 [0,1,0,1,0,0|2,0,0]=4 2502 B13R1.202 CC(CC1CCC=CC1C)C(O)=O Amb25708441 [0,1,0,1,0,0|0,0,2]=4 2503 B13R1.202 CC(CC1CCCCC1=O)C(O)=O Amb18648913 [0,1,0,1,0,0|1,0,1]=4 2504 B13R1.202 CC(CC1CCCCC1F)C(O)=O Amb24514056 [0,1,0,1,0,0|1,0,0]=3 2505 B13R1.202 CC(CC1CCCCC1O)C(O)=O Amb25679394 [0,1,0,1,0,0|1,0,0]=3 2506 B13R1.202 CC(CN1CCCCC1C)C(N)=O Amb24404317 [0,1,0,1,0,0|2,0,0]=4 2507 B13R1.202 CC(CN1CCCCC1C)C(O)=O Amb21959973 [0,1,0,1,0,0|1,0,0]=3 2508 B13R1.202 CC(NC1CCCCC1N)C(O)=O Amb24612023 [0,1,0,1,0,0|2,0,0]=4 2509 B13R1.202 CC(NC1CCCCC1O)C(O)=O Amb19059073 [0,1,0,1,0,0|2,0,0]=4 2510 B13R1.202 CC(NC1CCCNC1C)C(O)=O Amb24561738 [0,1,0,1,0,0|2,0,0]=4 2511 B13R1.202 CC(OC1CCCCC1N)C(O)=O Amb24464563 [0,1,0,1,0,0|2,0,0]=4 2512 B13R1.202 CC1CCCCC1CC(F)C(O)=O Amb25232305 [0,1,0,1,0,0|0,0,0]=2 2513 B13R1.202 CC1CCCCC1CC(N)C(O)=O Amb25310306 [0,1,0,1,0,0|0,0,0]=2 2514 B13R1.202 CC1CCCCC1CC(S)C(O)=O Amb24602088 [0,1,0,1,0,0|0,0,0]=2 2515 B13R1.202 CC1CCCCC1NC(C)C(O)=O Amb19058025 [0,1,0,1,0,0|1,0,0]=3 2516 B13R1.202 CC1CCCCC1N[C@@H](C)C(O)=O Amb24371712 [0,1,0,1,0,0|1,0,0]=3 2517 B13R1.202 CC1CCCCN1CC(=C)C(O)=O Amb25265234 [0,1,0,1,0,0|1,0,1]=4 2518 B13R1.202 CC1CCCCN1CC(Cl)C(O)=O Amb25156163 [0,1,0,1,0,0|1,0,0]=3 2519 B13R1.202 CC1CCCCN1CC(N)C(N)=O Amb18294520 [0,1,0,1,0,0|2,0,0]=4 2520 B13R1.202 CC1CCCCN1CC(N)C(O)=O Amb18981866 [0,1,0,1,0,0|1,0,0]=3 2521 B13R1.202 CC1CCCCN1CC(O)C(O)=O Amb25085334 [0,1,0,1,0,0|1,0,0]=3 2522 B13R1.202 CC1CCNCC1OC(C)C(O)=O Amb25071621 [0,1,0,1,0,0|2,0,0]=4 2523 B13R1.202 CC1COCCN1CC(Cl)C(O)=O Amb25344109 [0,1,0,1,0,0|2,0,0]=4 2524 B13R1.202 CC1COCCN1CC(N)C(O)=O Amb18981878 [0,1,0,1,0,0|2,0,0]=4 2525 B13R1.202 CC1COCCN1CC(O)C(O)=O Amb25353103 [0,1,0,1,0,0|2,0,0]=4 2526 B13R1.202 CC1CSCCN1CC(C)C(O)=O Amb24653097 [0,1,0,1,0,0|2,0,0]=4 2527 B13R1.202 CC1SCCCC1N[C@H](C)C(O)=O Amb24417029 [0,1,0,1,0,0|2,0,0]=4 2528 B13R1.202 C[C@@H]1CNCCN1CC(C)C(O)=O Amb24736601 [0,1,0,1,0,0|2,0,0]=4 2529 B13R1.202 C[C@H](OC1CCCCC1O)C(O)=O Amb24702774 [0,1,0,1,0,0|2,0,0]=4 2530 B13R1.351 NC(CCN1CCCCC1)C(O)=O Amb19036809 [0,1,0,1,0,0|1,0,0]=3 2531 B13R1.1097 CC(O)C1(C)CCCCCCCC1 Amb25346446 [0,1,0,1,0,0|1,0,1]=4 2532 B13R1.1110 N[C@@H](CCCC1OCCO1)C(O)=O Amb24088871 [0,1,0,1,0,0|2,0,0]=4 2533 B13R1.1267 CC1(CCCCN1CCF)C(O)=O Amb25247696 [0,1,0,1,0,0|2,0,0]=4 2534 B13R1.1267 CC1(CCCCN1CCN)C(O)=O Amb25039025 [0,1,0,1,0,0|2,0,0]=4 2535 B13R1.1267 CC1(CCCCN1CCO)C(O)=O Amb25123044 [0,1,0,1,0,0|2,0,0]=4 2536 B13R1.1889 CCCCCOC1CC(C1)C(O)=O Amb23449152 [0,1,0,1,0,0|1,0,0]=3 2537 B13R1.3714 NC1(CCCCCCC1O)C(O)=O Amb25806063 [0,1,0,1,0,0|1,0,0]=3 2538 B13R1.3714 N[C@@]1(CCCCCC[C@@H]1O)C(O)=O Amb24563796 [0,1,0,1,0,0|1,0,0]=3 2539 B13R1.3766 CC(C1CCCCCC1=O)C(O)=O Amb24346986 [0,1,0,1,0,0|1,0,1]=4 2540 B13R1.3766 CC(C1CCCCCC1O)C(O)=O Amb24360355 [0,1,0,1,0,0|1,0,0]=3 2541 B13R1.3766 CC1CCCCCN1C(=O)C(O)=O Amb24493878 [0,1,0,1,0,0|1,0,1]=4 2542 B13R1.3766 CC1CCCCCN1C(C)C(C)=O Amb25113402 [0,1,0,1,0,0|2,0,0]=4 2543 B13R1.3766 CC1CCCCCN1C(C)C(N)=O Amb25795834 [0,1,0,1,0,0|2,0,0]=4 2544 B13R1.3766 CC1CCOCCN1C(C)C(O)=O Amb24551678 [0,1,0,1,0,0|2,0,0]=4 2545 B13R1.3766 CC1COCCCN1C(C)C(O)=O Amb25359526 [0,1,0,1,0,0|2,0,0]=4 2546 B13R1.3766 NC(C1CCCCCC1=O)C(O)=O Amb24346706 [0,1,0,1,0,0|1,0,1]=4 2547 B13R1.3766 N[C@@H]([C@@H]1CCCCCC1=O)C(O)=O Amb24565790 [0,1,0,1,0,0|1,0,1]=4 2548 B13R1.3766 N[C@@H]([C@@H]1CCCCC[C@@H]1O)C(O)=O Amb25288169 [0,1,0,1,0,0|1,0,0]=3 2549 B13R1.3766 N[C@@H]([C@H]1CCCCCC1=O)C(O)=O Amb24565791 [0,1,0,1,0,0|1,0,1]=4 2550 B13R1.3766 N[C@@H]([C@H]1CCCCC[C@@H]1O)C(O)=O Amb24558214 [0,1,0,1,0,0|1,0,0]=3 2551 B13R1.3766 N[C@@H]([C@H]1CCCCC[C@H]1O)C(O)=O Amb24693988 [0,1,0,1,0,0|1,0,0]=3 2552 B13R1.3766 N[C@H](C1CCCCCC1O)C(O)=O Amb24652585 [0,1,0,1,0,0|1,0,0]=3 2553 B13R1.3766 N[C@H]([C@@H]1CCCCC[C@@H]1O)C(O)=O Amb24519519 [0,1,0,1,0,0|1,0,0]=3 2554 B13R1.3766 OC(=O)[C@H](O)[C@@H]1CCCCCC1=O Amb25176353 [0,1,0,1,0,0|1,0,1]=4 2555 B13R1.3807 OC1CCCOCCC(C1)C(O)=O Amb24739844 [0,1,0,1,0,0|1,0,0]=3 2556 B13R1.6161 CC(=C)C(O)C1CCCCCCC1 Amb24575736 [0,1,0,1,0,0|2,0,0]=4 2557 B13R1.6161 CC(=O)C(O)C1CCCCCCC1 Amb24526884 [0,1,0,1,0,0|1,0,0]=3 2558 B13R1.6161 CC(C(N)=O)N1CCCCCCC1 Amb18328559 [0,1,0,1,0,0|2,0,0]=4 2559 B13R1.6161 CC(C(O)=O)=C1CCCCCCC1 Amb25114784 [0,1,0,1,0,0|0,0,2]=4 2560 B13R1.6161 CC(C1CCCCCC=C1)C(O)=O Amb25323845 [0,1,0,1,0,0|0,0,2]=4 2561 B13R1.6161 CC(C1CCCCCCC1)C(O)=O Amb24652377 [0,1,0,1,0,0|0,0,0]=2 2562 B13R1.6161 CN(C1CCCCCCC1)C(N)=O Amb25817988 [0,1,0,1,0,0|2,0,0]=4 2563 B13R1.6161 N[C@@H](C1CCCCCC=C1)C(O)=O Amb25733190 [0,1,0,1,0,0|0,0,2]=4 2564 B13R1.6161 OC(=O)C(F)C1CCCCCCC1 Amb24735487 [0,1,0,1,0,0|0,0,0]=2 2565 B13R1.6192 C=C(CN1CCCCCC1)C(O)=O Amb25843311 [0,1,0,1,0,0|1,0,1]=4 2566 B13R1.6192 CC(=C)C(O)CC1CCCCCC1 Amb25180332 [0,1,0,1,0,0|2,0,0]=4 2567 B13R1.6192 CC(=CC1CCCCCC1)C(O)=O Amb24489531 [0,1,0,1,0,0|0,0,2]=4 2568 B13R1.6192 CC(C(=O)N)CN1CCCCCC1 Amb17234099 [0,1,0,1,0,0|2,0,0]=4 2569 B13R1.6192 CC(C(=O)O)NC1CCCCCC1 Amb17401063 [0,1,0,1,0,0|1,0,0]=3 2570 B13R1.6192 CC(CN1CCCOCC1)C(O)=O Amb19000987 [0,1,0,1,0,0|2,0,0]=4 2571 B13R1.6192 CC(CN1CCCSCC1)C(O)=O Amb18977931 [0,1,0,1,0,0|2,0,0]=4 2572 B13R1.6192 CC(NC1CCCNCC1)C(O)=O Amb25190456 [0,1,0,1,0,0|2,0,0]=4 2573 B13R1.6192 CC(NC1CCOCCC1)C(O)=O Amb25824487 [0,1,0,1,0,0|2,0,0]=4 2574 B13R1.6192 CC(OC1CCCCCC1)C(O)=O Amb18979541 [0,1,0,1,0,0|1,0,0]=3 2575 B13R1.6192 C[C@@H](NC1CCCNCC1)C(O)=O Amb25047782 [0,1,0,1,0,0|2,0,0]=4 2576 B13R1.6192 C[C@@H](OC1CCCCCC1)C(O)=O Amb24358293 [0,1,0,1,0,0|1,0,0]=3 2577 B13R1.6192 C[C@H](NC1CCOCCC1)C(O)=O Amb24589524 [0,1,0,1,0,0|2,0,0]=4 2578 B13R1.6192 C[C@H](OC1CCCCCC1)C(O)=O Amb25721303 [0,1,0,1,0,0|1,0,0]=3 2579 B13R1.6192 NC(=O)N(O)CC1CCCCCC1 Amb25095888 [0,1,0,1,0,0|2,0,0]=4 2580 B13R1.6192 NC(CC1CCCCCC1)C(N)=O Amb25210241 [0,1,0,1,0,0|1,0,0]=3 2581 B13R1.6192 NC(CC=1CCCCCC1)C(O)=O Amb25786554 [0,1,0,1,0,0|0,0,2]=4 2582 B13R1.6192 NC(CN1CCCCCC1)C(N)=O Amb18294523 [0,1,0,1,0,0|2,0,0]=4 2583 B13R1.6192 NC(CN1CCCCCC1)C(O)=O Amb18293703 [0,1,0,1,0,0|1,0,0]=3 2584 B13R1.6192 NC(CN1CCCNCC1)C(O)=O Amb18293706 [0,1,0,1,0,0|2,0,0]=4 2585 B13R1.6192 NC(CN1CCCOCC1)C(O)=O Amb19001018 [0,1,0,1,0,0|2,0,0]=4 2586 B13R1.6192 NC(CN1CCCSCC1)C(O)=O Amb18981883 [0,1,0,1,0,0|2,0,0]=4 2587 B13R1.6192 OC(=O)C(=O)CC1CCCCCC1 Amb24751418 [0,1,0,1,0,0|0,0,1]=3 2588 B13R1.6192 OC(=O)C(Cl)CN1CCCCCC1 Amb25686544 [0,1,0,1,0,0|1,0,0]=3 2589 B13R1.6192 OC(=O)C(F)CC1CCCCCC1 Amb24526765 [0,1,0,1,0,0|0,0,0]=2 2590 B13R1.6192 OC(=O)C(F)OC1CCCCCC1 Amb24489657 [0,1,0,1,0,0|1,0,0]=3 2591 B13R1.6192 OC(CN1CCCNCC1)C(O)=O Amb25303434 [0,1,0,1,0,0|2,0,0]=4 2592 B13R1.6192 OC(CN1CCCSCC1)C(O)=O Amb24623260 [0,1,0,1,0,0|2,0,0]=4 2593 B13R1.45 CC(=CCC(O)=O)C1CCCCC1 Amb24590343 [0,1,0,1,0,0|0,0,2]=4 2594 B13R1.45 CC(CCC(O)=O)N1CCOCC1 Amb21959691 [0,1,0,1,0,0|2,0,0]=4 2595 B13R1.45 CC(N1CCCCC1)CCC(=O)O Amb10608276 [0,1,0,1,0,0|1,0,0]=3 2596 B13R1.45 CC(N1CCCCC1)CCC(=O)O Amb17622173 [0,1,0,1,0,0|1,0,0]=3 2597 B13R1.45 CC(N1CCOCC1)CCC(=O)O Amb10607496 [0,1,0,1,0,0|2,0,0]=4 2598 B13R1.45 CC(\C=C\C(O)=O)C1CCCCC1 Amb24388036 [0,1,0,1,0,0|0,0,2]=4 2599 B13R1.45 CN(C1CCCCC1)CCC(=O)N Amb1098834 [0,1,0,1,0,0|2,0,0]=4 2600 B13R1.45 C\C(=C/CC(O)=O)\C1CCCCC1 Amb24634301 [0,1,0,1,0,0|0,0,2]=4 2601 B13R1.45 NC(=O)NCC(O)C1CCCCC1 Amb25829876 [0,1,0,1,0,0|2,0,0]=4 2602 B13R1.45 NC(CCC(O)=O)C1CCCCC1 Amb23440686 [0,1,0,1,0,0|0,0,0]=2 2603 B13R1.45 O=C(C1CCCCC1)NCC(=O)O Amb1102851 [0,1,0,1,0,0|1,0,1]=4 2604 B13R1.45 O=C(N1CCCCC1)CCC(=O)O Amb1138053 [0,1,0,1,0,0|1,0,1]=4 2605 B13R1.45 OC(=O)COC(=O)C1CCCCC1 Amb22001859 [0,1,0,1,0,0|1,0,1]=4 2606 B13R1.45 OC(C#CC(O)=O)C1CCCCC1 Amb25299434 [0,1,0,1,0,0|0,0,2]=4 2607 B13R1.45 OC(\C=C\C(O)=O)C1CCCCC1 Amb18648916 [0,1,0,1,0,0|0,0,2]=4 2608 B13R1.141 CC1CC(C(O)=O)N(CCO)CC1 Amb25040245 [0,1,0,1,0,0|2,0,0]=4 2609 B13R1.159 CC1(CCC(O)=O)CCCCC1O Amb25137283 [0,1,0,1,0,0|1,0,0]=3 2610 B13R1.159 CC1CCCCC1(C)NCC(N)=O Amb25779443 [0,1,0,1,0,0|2,0,0]=4 2611 B13R1.159 CC1CCCCC1(C)NCC(O)=O Amb25167292 [0,1,0,1,0,0|1,0,0]=3 2612 B13R1.159 C[C@@H]1CCCCC1(O)CCC(N)=O Amb25360864 [0,1,0,1,0,0|1,0,0]=3 2613 B13R1.344 O=C(CC1CCCC1)NCC(=O)O Amb1112497 [0,1,0,1,0,0|1,0,1]=4 2614 B13R1.2135 CC1CCCC(CN)N1CC(O)=O Amb25039351 [0,1,0,1,0,0|2,0,0]=4 2615 B13R1.3688 CCCCCCC1(C)CCC(=O)O1 Amb15693415 [0,1,0,1,0,0|0,0,0]=2 2616 B13R1.3688 CC\C=C/CCC1(C)CCC(=O)O1 Amb22734350 [0,1,0,1,0,0|0,0,2]=4 2617 B13R1.8682 CC(=O)NCC1(C)CCCCCC1 Amb25205244 [0,1,0,1,0,0|2,0,0]=4 2618 B13R1.8682 CC(=O)OCC1(C)CCCCCC1 Amb24412709 [0,1,0,1,0,0|2,0,0]=4 2619 B13R1.8682 CC1(CCC(O)=O)CCCCCC1 Amb24693057 [0,1,0,1,0,0|0,0,0]=2 2620 B13R1.8682 CC1(CCCCCC1)NCC(N)=O Amb24450897 [0,1,0,1,0,0|2,0,0]=4 2621 B13R1.8682 CC1(CCCCCC1)\C=C\C(O)=O Amb24626862 [0,1,0,1,0,0|0,0,2]=4 2622 B13R1.8682 CC1(CNC(N)=O)CCCCCC1 Amb25188524 [0,1,0,1,0,0|2,0,0]=4 2623 B13R1.8682 NC(=O)OCC1(N)CCCCCC1 Amb24726885 [0,1,0,1,0,0|2,0,0]=4 2624 B13R1.8682 NC1(CCC(O)=O)CCCCCC1 Amb18822376 [0,1,0,1,0,0|0,0,0]=2 2625 B13R1.589 CC(=O)C1CCCCC1CC(O)=O Amb25233430 [0,1,0,1,0,0|0,0,1]=3 2626 B13R1.589 CC(=O)CC1CCCCC1C(O)=O Amb18129441 [0,1,0,1,0,0|0,0,1]=3 2627 B13R1.589 CC(=O)CN1CCCCC1C(=O)O Amb17561167 [0,1,0,1,0,0|1,0,1]=4 2628 B13R1.589 CC(=O)C[C@@H]1CCCC[C@H]1C(O)=O Amb25216930 [0,1,0,1,0,0|0,0,1]=3 2629 B13R1.589 CC(=O)N[C@@H]1CCCC[C@@H]1C(O)=O Amb24739466 [0,1,0,1,0,0|1,0,1]=4 2630 B13R1.589 CC(=O)N[C@@H]1CCCC[C@H]1C(O)=O Amb25179071 [0,1,0,1,0,0|1,0,1]=4 2631 B13R1.589 CC(=O)N[C@H]1CCCC[C@@H]1C(O)=O Amb24634006 [0,1,0,1,0,0|1,0,1]=4 2632 B13R1.589 CC(=O)OC1CCCCC1C(O)=O Amb25276247 [0,1,0,1,0,0|1,0,1]=4 2633 B13R1.589 CC(=O)O[C@@H]1CCCC[C@@H]1C(O)=O Amb25322063 [0,1,0,1,0,0|1,0,1]=4 2634 B13R1.589 CC(=O)SC1CCCCC1C(O)=O Amb24669021 [0,1,0,1,0,0|1,0,1]=4 2635 B13R1.589 CC(=O)[C@@H]1CCCC[C@H]1CC(O)=O Amb24688270 [0,1,0,1,0,0|0,0,1]=3 2636 B13R1.589 CC(Br)CC1CCCCN1C(C)=O Amb24363773 [0,1,0,1,0,0|2,0,0]=4 2637 B13R1.589 CC(C)C1CCCCC1OC(C)=O Amb25188505 [0,1,0,1,0,0|2,0,0]=4 2638 B13R1.589 CC(C)C1CNCCN1CC(O)=O Amb25836838 [0,1,0,1,0,0|2,0,0]=4 2639 B13R1.589 CC(C)CC1CCCCC1C(O)=O Amb24676030 [0,1,0,1,0,0|0,0,0]=2 2640 B13R1.589 CC(C)CC1CCCCN1C(C)=O Amb24530068 [0,1,0,1,0,0|2,0,0]=4 2641 B13R1.589 CC(C)CC1CCNCC1C(O)=O Amb18191303 [0,1,0,1,0,0|1,0,0]=3 2642 B13R1.589 CC(C)CC1NCCCC1C(N)=O Amb25743699 [0,1,0,1,0,0|2,0,0]=4 2643 B13R1.589 CC(C)CC1NCCCC1C(O)=O Amb25202050 [0,1,0,1,0,0|1,0,0]=3 2644 B13R1.589 CC(C)CC=1CCCCC1C(O)=O Amb24546019 [0,1,0,1,0,0|0,0,2]=4 2645 B13R1.589 CC(C)CN1CCCCC1C(N)=O Amb24346691 [0,1,0,1,0,0|2,0,0]=4 2646 B13R1.589 CC(C)CN1CCCC[C@H]1C(N)=O Amb24758835 [0,1,0,1,0,0|2,0,0]=4 2647 B13R1.589 CC(C)CN1CCSCC1C(O)=O Amb25728055 [0,1,0,1,0,0|2,0,0]=4 2648 B13R1.589 CC(C)C[C@@H]1CCCCN1C(C)=O Amb25320420 [0,1,0,1,0,0|2,0,0]=4 2649 B13R1.589 CC(C)C[C@@H]1NCCC[C@H]1C(O)=O Amb18191329 [0,1,0,1,0,0|1,0,0]=3 2650 B13R1.589 CC(C)N1CCCCC1CC(C)=O Amb25062751 [0,1,0,1,0,0|2,0,0]=4 2651 B13R1.589 CC(C)N1CCCCC1CC(N)=O Amb25725326 [0,1,0,1,0,0|2,0,0]=4 2652 B13R1.589 CC(C)N1CCCCC1CC(O)=O Amb18971241 [0,1,0,1,0,0|1,0,0]=3 2653 B13R1.589 CC(C)N1CCOCC1CC(O)=O Amb25702095 [0,1,0,1,0,0|2,0,0]=4 2654 B13R1.589 CC(C)N1CCSCC1CC(O)=O Amb24356442 [0,1,0,1,0,0|2,0,0]=4 2655 B13R1.589 CC(C)NC1CCCCC1C(N)=O Amb18129480 [0,1,0,1,0,0|2,0,0]=4 2656 B13R1.589 CC(C)N[C@H]1CCCC[C@@H]1C(N)=O Amb25195848 [0,1,0,1,0,0|2,0,0]=4 2657 B13R1.589 CC(C)SC1CCCCC1C(O)=O Amb19002582 [0,1,0,1,0,0|1,0,0]=3 2658 B13R1.589 CC(C)[C@@H]1CNCCN1CC(O)=O Amb24761413 [0,1,0,1,0,0|2,0,0]=4 2659 B13R1.589 CC(C)[C@@H]1NCCC[C@H]1CC(O)=O Amb18191312 [0,1,0,1,0,0|1,0,0]=3 2660 B13R1.589 CC(C)[C@H]1CNCCN1CC(O)=O Amb24346922 [0,1,0,1,0,0|2,0,0]=4 2661 B13R1.589 CC(CC1CCCCN1C(=O)C)N Amb17594770 [0,1,0,1,0,0|2,0,0]=4 2662 B13R1.589 CC(CN1CCCCC1C(=O)O)C Amb13886180 [0,1,0,1,0,0|1,0,0]=3 2663 B13R1.589 CC(CN1CCCCC1C(=O)O)C Amb2372341 [0,1,0,1,0,0|1,0,0]=3 2664 B13R1.589 CC(Cl)CC1CCCCN1C(C)=O Amb25786045 [0,1,0,1,0,0|2,0,0]=4 2665 B13R1.589 CC(N)C1CCCCN1CC(O)=O Amb25143043 [0,1,0,1,0,0|1,0,0]=3 2666 B13R1.589 CC(N)CC1CCCCN1C(N)=O Amb25703994 [0,1,0,1,0,0|2,0,0]=4 2667 B13R1.589 CC(O)C1CCCCN1CC(O)=O Amb25686757 [0,1,0,1,0,0|1,0,0]=3 2668 B13R1.589 CC(O)C1CNCCC1CC(O)=O Amb25240622 [0,1,0,1,0,0|1,0,0]=3 2669 B13R1.589 CC(O)CC1CCCCN1C(C)=O Amb25064783 [0,1,0,1,0,0|2,0,0]=4 2670 B13R1.589 CC(O)CN1CCCCC1C(C)=O Amb25124594 [0,1,0,1,0,0|2,0,0]=4 2671 B13R1.589 CC(O)CN1CCCCC1C(O)=O Amb18969628 [0,1,0,1,0,0|1,0,0]=3 2672 B13R1.589 CC(O)CN1CCSCC1C(O)=O Amb18176571 [0,1,0,1,0,0|2,0,0]=4 2673 B13R1.589 CN(C)C1CCCCC1CC(O)=O Amb18822385 [0,1,0,1,0,0|1,0,0]=3 2674 B13R1.589 CN(C)C1CCOCC1CC(O)=O Amb18821596 [0,1,0,1,0,0|2,0,0]=4 2675 B13R1.589 CN(C)C1CCSCC1CC(O)=O Amb18176789 [0,1,0,1,0,0|2,0,0]=4 2676 B13R1.589 CN(C)CC1CCCCC1C(O)=O Amb24520735 [0,1,0,1,0,0|1,0,0]=3 2677 B13R1.589 CN(C)[C@@H]1CCCC[C@@H]1CC(O)=O Amb25264058 [0,1,0,1,0,0|1,0,0]=3 2678 B13R1.589 C[C@@H](O)CN1CCNCC1C(O)=O Amb25274543 [0,1,0,1,0,0|2,0,0]=4 2679 B13R1.589 OC(=O)C1CCCCN1CC(F)F Amb18321150 [0,1,0,1,0,0|2,0,0]=4 2680 B13R1.589 OC(=O)CC1CCCCC1C(O)=O Amb18649266 [0,1,0,1,0,0|1,0,1]=4 2681 B13R1.589 OC(=O)CC1CCCCN1C(=O)C Amb13952139 [0,1,0,1,0,0|1,0,1]=4 2682 B13R1.589 OC(=O)C[C@H]1CCCC[C@@H]1C(O)=O Amb24563366 [0,1,0,1,0,0|1,0,1]=4 2683 B13R1.591 CC(C)C[C@@H]1NCC[C@H]1CC(O)=O Amb18191318 [0,1,0,1,0,0|1,0,0]=3 2684 B13R1.591 CN(C)CC1CCCN1CC(O)=O Amb19033953 [0,1,0,1,0,0|2,0,0]=4 2685 B13R1.591 CN(C)C[C@@H]1CCCN1CC(O)=O Amb22224781 [0,1,0,1,0,0|2,0,0]=4 2686 B13R1.1082 CC(=O)[C@H]1CCCCC[C@@H]1C(O)=O Amb25232970 [0,1,0,1,0,0|0,0,1]=3 2687 B13R1.1082 CC(C)C1CCCCCC1C(=O)Cl Amb24399876 [0,1,0,1,0,0|1,0,0]=3 2688 B13R1.1082 CC(C)C1CCCCCC1C(O)=O Amb25774936 [0,1,0,1,0,0|0,0,0]=2 2689 B13R1.1082 CC(C)C1CCCCCN1C(N)=O Amb25058394 [0,1,0,1,0,0|2,0,0]=4 2690 B13R1.1082 CC(C)C1NCCCCC1C(O)=O Amb25287207 [0,1,0,1,0,0|1,0,0]=3 2691 B13R1.1082 CC(C)N1CCCCCC1C(O)=O Amb24665053 [0,1,0,1,0,0|1,0,0]=3 2692 B13R1.1082 CC(C)[C@@H]1NCCCC[C@H]1C(O)=O Amb18191321 [0,1,0,1,0,0|1,0,0]=3 2693 B13R1.1082 CN(C)C1CCCCCC1C(O)=O Amb18967362 [0,1,0,1,0,0|1,0,0]=3 2694 B13R1.1082 CN(C)[C@@H]1CCCCC[C@H]1C(O)=O Amb24670171 [0,1,0,1,0,0|1,0,0]=3 2695 B13R1.1082 CS(=O)N1CCCCCC1C(O)=O Amb24551441 [0,1,0,1,0,0|2,0,0]=4 2696 B13R1.1082 NC(=O)C1CCCCCC1C(O)=O Amb25102713 [0,1,0,1,0,0|1,0,1]=4 2697 B13R1.1082 OC(=O)C1CCCCCC1C(=O)C Amb17594754 [0,1,0,1,0,0|0,0,1]=3 2698 B13R1.1082 OC(=O)C1CCCCCC1C(O)=O Amb25719377 [0,1,0,1,0,0|1,0,1]=4 2699 B13R1.1082 OC(=O)[C@@H]1CCCCC[C@H]1C(O)=O Amb25327872 [0,1,0,1,0,0|1,0,1]=4 2700 B13R1.1082 OC(=O)[C@H]1CCCCC[C@@H]1C(O)=O Amb25366546 [0,1,0,1,0,0|1,0,1]=4 2701 B13R1.1082 OC(=O)[C@H]1CCCCC[C@H]1C(O)=O Amb22356761 [0,1,0,1,0,0|1,0,1]=4 2702 B13R1.3575 CC1(C)CCCCC1C#CC(O)=O Amb24344516 [0,1,0,1,0,0|0,0,2]=4 2703 B13R1.3575 CC1(C)CCCCC1NCC(O)=O Amb25074967 [0,1,0,1,0,0|1,0,0]=3 2704 B13R1.3575 CC1(C)CNCCC1NCC(O)=O Amb24401345 [0,1,0,1,0,0|2,0,0]=4 2705 B13R1.3575 CC1(C)CNCCN1CCC(O)=O Amb24471835 [0,1,0,1,0,0|2,0,0]=4 2706 B13R1.3575 CC1(C)COCCN1CCC(O)=O Amb18292249 [0,1,0,1,0,0|2,0,0]=4 2707 B13R1.3575 CC1(O)CCOCC1SCC(O)=O Amb22439299 [0,1,0,1,0,0|2,0,0]=4 2708 B13R1.3575 CC1(S)CCOCC1NCC(O)=O Amb25855262 [0,1,0,1,0,0|2,0,0]=4 2709 B13R1.3575 OC(=O)CNC1CCCCC1(F)F Amb25368625 [0,1,0,1,0,0|2,0,0]=4 2710 B13R1.3576 CC(=O)NCC1CCCC1C(O)=O Amb25103724 [0,1,0,1,0,0|1,0,1]=4 2711 B13R1.3576 CC(=O)NC[C@@H]1CCC[C@@H]1C(O)=O Amb25126170 [0,1,0,1,0,0|1,0,1]=4 2712 B13R1.3576 CC(CCN1CCCC1C(=O)O)C Amb1109877 [0,1,0,1,0,0|1,0,0]=3 2713 B13R1.3576 CN(C)C1CCCC1CCC(O)=O Amb18191349 [0,1,0,1,0,0|1,0,0]=3 2714 B13R1.3576 CN(C)CCC1CNCC1C(O)=O Amb18191209 [0,1,0,1,0,0|2,0,0]=4 2715 B13R1.8832 OC(=O)CC1CCSCCC1(F)F Amb25364364 [0,1,0,1,0,0|2,0,0]=4 2716 B13R1.113 CCN1C(CCC1=O)CCC(O)=O Amb23541266 [0,1,0,1,0,0|1,0,1]=4 2717 B13R1.115 CC[C@@H]1[C@@H](CC(O)=O)CCCN1C Amb18191313 [0,1,0,1,0,0|1,0,0]=3 2718 B13R1.164 CC1CC(C)C(CC1)NCC(O)=O Amb25738786 [0,1,0,1,0,0|1,0,0]=3 2719 B13R1.164 CC1CC(C)N(CC1)CCC(C)=O Amb19068434 [0,1,0,1,0,0|2,0,0]=4 2720 B13R1.164 CC1CC(C)N(CC1)CCC(N)=O Amb18326406 [0,1,0,1,0,0|2,0,0]=4 2721 B13R1.164 CC1CC(C)N(CC1)CCC(O)=O Amb18990007 [0,1,0,1,0,0|1,0,0]=3 2722 B13R1.164 CC1CN(C)CCC1NCC(O)=O Amb24359332 [0,1,0,1,0,0|2,0,0]=4 2723 B13R1.164 CC1CS(=O)CCN1CCC(O)=O Amb24502922 [0,1,0,1,0,0|2,0,0]=4 2724 B13R1.164 CN1CCN(CCC(O)=O)C(C)C1 Amb25755128 [0,1,0,1,0,0|2,0,0]=4 2725 B13R1.164 C[C@@H]1C[C@H](C)N(CC1)CCC(C)=O Amb24377210 [0,1,0,1,0,0|2,0,0]=4 2726 B13R1.164 C[C@H]1C[C@@H](O)CCN1CCC(C)=O Amb25031728 [0,1,0,1,0,0|2,0,0]=4 2727 B13R1.164 C[C@H]1C[C@@H](O)CCN1CCC(N)=O Amb24680225 [0,1,0,1,0,0|2,0,0]=4 2728 B13R1.467 CCCC(=O)N1CCC[C@@H]1C(O)=O Amb18319022 [0,1,0,1,0,0|1,0,1]=4 2729 B13R1.467 CCCC(=O)[C@@H]1CCC[C@H]1C(O)=O Amb23558962 [0,1,0,1,0,0|0,0,1]=3 2730 B13R1.1462 CC(CCC)C1CC(=O)CCCC1 Amb25783512 [0,1,0,1,0,0|1,0,0]=3 2731 B13R1.1462 CC(COC)C1CC(=O)CCCC1 Amb25089168 [0,1,0,1,0,0|2,0,0]=4 2732 B13R1.1462 CCCC(C)C=1CCCCC(=O)C1 Amb25158352 [0,1,0,1,0,0|1,0,1]=4 2733 B13R1.3506 CC1NC(=O)CCCC1CC(O)=O Amb24558649 [0,1,0,1,0,0|1,0,1]=4 2734 B13R1.3506 C[C@@H]1NC(=O)CCC[C@H]1CC(O)=O Amb18191382 [0,1,0,1,0,0|1,0,1]=4 2735 B13R2.7 CCC1CCCC12CN=C(N)O2 Amb24492844 [0,0,0,2,0,0|2,0,0]=4 2736 B13R2.7 CCC1CCCC12CNC(=O)C2 Amb24601132 [0,0,0,2,0,0|2,0,0]=4 2737 B13R2.7 CCC1CCCC12CNC(=O)O2 Amb25061477 [0,0,0,2,0,0|1,0,0]=3 2738 B13R2.7 CCC1CCCC12COC(=O)N2 Amb25241318 [0,0,0,2,0,0|2,0,0]=4 2739 B13R2.10 NC1=NCC(O1)C2CCCCC2 Amb25234873 [0,0,0,2,0,0|2,0,0]=4 2740 B13R2.10 O=C1CC(CC1)C2CCCCC2 Amb25126145 [0,0,0,2,0,0|1,0,0]=3 2741 B13R2.10 O=C1CC(CC1)C2CCOCC2 Amb24470922 [0,0,0,2,0,0|2,0,0]=4 2742 B13R2.10 O=C1CC(CC1)C2COCCC2 Amb25158169 [0,0,0,2,0,0|2,0,0]=4 2743 B13R2.10 O=C1CC(CN1)C2CCCCC2 Amb22411524 [0,0,0,2,0,0|2,0,0]=4 2744 B13R2.10 O=C1CCC(N1)C2CCCCO2 Amb25255412 [0,0,0,2,0,0|2,0,0]=4 2745 B13R2.10 O=C1CCC(N1)C2CCNCC2 Amb15692167 [0,0,0,2,0,0|2,0,0]=4 2746 B13R2.10 O=C1CCC(O1)C2CCCCN2 Amb25804754 [0,0,0,2,0,0|1,0,0]=3 2747 B13R2.10 O=C1CC[C@@H](N1)C2CCCCC2 Amb24729589 [0,0,0,2,0,0|1,0,0]=3 2748 B13R2.10 O=C1CC[C@H](N1)C2CCCCC2 Amb25691398 [0,0,0,2,0,0|1,0,0]=3 2749 B13R2.10 O=C1CNC(N1)C2CCCCC2 Amb25669985 [0,0,0,2,0,0|2,0,0]=4 2750 B13R2.10 O=C1C[C@H](CC1)C2CCCCC2 Amb24676790 [0,0,0,2,0,0|1,0,0]=3 2751 B13R2.10 O=C1NC(CO1)C2CCCCC2 Amb24422007 [0,0,0,2,0,0|2,0,0]=4 2752 B13R2.10 O=C1NCC(O1)C2CCNCC2 Amb25062500 [0,0,0,2,0,0|2,0,0]=4 2753 B13R2.10 O=C1NC[C@@H](S1)C2CCCCC2 Amb25260449 [0,0,0,2,0,0|1,1,0]=4 2754 B13R2.10 O=C1N[C@H](CO1)C2CCCCC2 Amb24374668 [0,0,0,2,0,0|2,0,0]=4 2755 B13R2.10 OC1CC(CC1)C2CCCCC2 Amb25151015 [0,0,0,2,0,0|1,0,1]=4 2756 B13R2.10 OC1CCC(O1)C2CCCCC2 Amb22752556 [0,0,0,2,0,0|0,0,2]=4 2757 B13R2.10 OC=1NCC(N1)C2CCCCC2 Amb25841065 [0,0,0,2,0,0|2,0,0]=4 2758 B13R2.142 NC1=NCC(CC2CCCC2)O1 Amb25258071 [0,0,0,2,0,0|2,0,0]=4 2759 B13R2.142 O=C1CC(CC2CCCC2)CN1 Amb25064533 [0,0,0,2,0,0|2,0,0]=4 2760 B13R2.142 O=C1CCC(CC2CCCC2)=C1 Amb24731171 [0,0,0,2,0,0|1,0,1]=4 2761 B13R2.142 O=C1CCC(CC2CCCC2)N1 Amb24378831 [0,0,0,2,0,0|1,0,0]=3 2762 B13R2.142 O=C1CCC(CC2CCCO2)N1 Amb24524784 [0,0,0,2,0,0|2,0,0]=4 2763 B13R2.142 O=C1CCC(CC2COCC2)N1 Amb25768844 [0,0,0,2,0,0|2,0,0]=4 2764 B13R2.142 O=C1CCC(N1)OC2CCCC2 Amb24375740 [0,0,0,2,0,0|2,0,0]=4 2765 B13R2.142 O=C1NC(CC2CCCC2)CO1 Amb24600592 [0,0,0,2,0,0|2,0,0]=4 2766 B13R2.143 CC1OC1CCC2CCC(=O)N2 Amb25315249 [0,0,0,2,0,0|2,0,0]=4 2767 B13R2.144 CN1CCC[C@@H]1C2CNC(=O)O2 Amb24542746 [0,0,0,2,0,0|2,0,0]=4 2768 B13R2.259 O=C1C[C@H]2[C@H](CC[C@H]2CC=O)O1 Amb25179872 [0,0,0,2,0,0|1,0,1]=4 2769 B13R2.389 O[C@@H]1CCCC[C@H]2OC(=O)N[C@@H]21 Amb24617752 [0,0,0,2,0,0|2,0,0]=4 2770 B13R2.390 CC1CCCCC=2CCC(=O)C21 Amb24583522 [0,0,0,2,0,0|1,0,1]=4 2771 B13R2.390 OC1CCC2CCCCC(=O)C21 Amb25373244 [0,0,0,2,0,0|2,0,0]=4 2772 B13R2.390 OC1CCCCC2CCC(=O)C21 Amb24706894 [0,0,0,2,0,0|2,0,0]=4 2773 B13R2.390 OC1CCCC[C@@H]2CCC(=O)N21 Amb25816304 [0,0,0,2,0,0|2,0,0]=4 2774 B13R2.390 O[C@H]1CC[C@H]2CCCCC(=O)[C@@H]21 Amb25179626 [0,0,0,2,0,0|2,0,0]=4 2775 B13R2.581 CC[C@H]1CCCC2=CC(=O)CC21 Amb25718288 [0,0,0,2,0,0|1,0,1]=4 2776 B13R2.2974 O=C1CN(CCC2CCC2)CC1 Amb24492922 [0,0,0,2,0,0|2,0,0]=4 2777 B13R2.2974 O=C1NCC(CNC2CCC2)O1 Amb25056534 [0,0,0,2,0,0|2,0,0]=4 2778 B13R2.3672 O=C1C=CC2CCCCCCC12 Amb25735813 [0,0,0,2,0,0|1,0,1]=4 2779 B13R2.3672 O=C1C=C[C@@H]2CCCCCC[C@@H]12 Amb24706770 [0,0,0,2,0,0|1,0,1]=4 2780 B13R2.3672 O=C1CCC=2CCCCCCC21 Amb25767737 [0,0,0,2,0,0|1,0,1]=4 2781 B13R2.3672 O[C@H]1OC[C@@H]2CCCCCC[C@@H]21 Amb25195868 [0,0,0,2,0,0|0,0,2]=4 2782 B13R2.4688 O=C1C=C2CCCCCCC2O1 Amb25111906 [0,0,0,2,0,0|0,0,2]=4 2783 B13R2.4688 O=C1N[C@@H]2CCCCCC[C@@H]2O1 Amb25289252 [0,0,0,2,0,0|1,0,0]=3 2784 B13R2.4688 O=C1N[C@H]2CCCCCC[C@@H]2O1 Amb25343907 [0,0,0,2,0,0|1,0,0]=3 2785 B13R2.4688 OC1CC2CCCCCCC2C1 Amb24362736 [0,0,0,2,0,0|1,0,1]=4 2786 B13R2.4688 OC1CC2CCCCCCC2O1 Amb25686182 [0,0,0,2,0,0|0,0,2]=4 2787 B13R2.5023 CC1CCCCC12CC(=O)CO2 Amb25092913 [0,0,0,2,0,0|2,0,0]=4 2788 B13R2.5023 CC1CCCCC12CNC(=O)O2 Amb24445047 [0,0,0,2,0,0|1,0,0]=3 2789 B13R2.5023 CC1CNCCC12CNC(=O)O2 Amb24394023 [0,0,0,2,0,0|2,0,0]=4 2790 B13R2.5023 O=C1CCCCC12CCC(=O)O2 Amb24721778 [0,0,0,2,0,0|1,0,1]=4 2791 B13R2.5023 O=C1NCC2(CCCCC2Cl)O1 Amb25159288 [0,0,0,2,0,0|2,0,0]=4 2792 B13R2.5023 OC1CCCCC12CCC(=O)N2 Amb25114037 [0,0,0,2,0,0|2,0,0]=4 2793 B13R2.5023 OC1CCCCC12CCC(=O)O2 Amb25332136 [0,0,0,2,0,0|1,0,0]=3 2794 B13R2.13132 O=C1CCC2(CCCCCC2)N1 Amb25844439 [0,0,0,2,0,0|1,0,0]=3 2795 B13R2.13132 O=C1CCC2(CCCNCC2)N1 Amb22173024 [0,0,0,2,0,0|2,0,0]=4 2796 B13R2.13132 O=C1CCC2(CCCNCC2)O1 Amb25305768 [0,0,0,2,0,0|1,0,0]=3 2797 B13R2.13132 O=C1CNC2(N1)CCCCCC2 Amb16192267 [0,0,0,2,0,0|2,0,0]=4 2798 B13R2.13132 O=C1CSC2(N1)CCCCCC2 Amb15695090 [0,0,0,2,0,0|2,0,0]=4 2799 B13R2.13132 O=C1NC2(CS1)CCCCCC2 Amb25824708 [0,0,0,2,0,0|2,0,0]=4 2800 B13R2.13132 O=C1NCC2(C1)CCCCCC2 Amb10608002 [0,0,0,2,0,0|2,0,0]=4 2801 B13R2.13132 O=C1NCC2(CCCCCC2)O1 Amb24456024 [0,0,0,2,0,0|1,0,0]=3 2802 B13R2.13132 O=C1NCC2(CCNCCC2)O1 Amb19516813 [0,0,0,2,0,0|2,0,0]=4 2803 B13R2.13132 O=C1NCC2(N1)CCCCCC2 Amb16192350 [0,0,0,2,0,0|2,0,0]=4 2804 B13R2.13132 OC1CCC2(CCCCCC2)O1 Amb25045803 [0,0,0,2,0,0|0,0,2]=4 2805 B13R2.13 O=C1CC(CCC1)C2CCCO2 Amb24467012 [0,0,0,2,0,0|2,0,0]=4 2806 B13R2.13 O=C1CC(CCC1)C2COCC2 Amb25152573 [0,0,0,2,0,0|2,0,0]=4 2807 B13R2.13 O=C1CC(CCC1)N2CCCC2 Amb25756027 [0,0,0,2,0,0|2,0,0]=4 2808 B13R2.13 O=C1CCCN(C1)C2CCCC2 Amb10603078 [0,0,0,2,0,0|2,0,0]=4 2809 B13R2.13 O=C1CCC[C@H](N1)C2CCCC2 Amb25255432 [0,0,0,2,0,0|1,0,0]=3 2810 B13R2.13 O=C1CNCC(N1)C2CCCC2 Amb24761468 [0,0,0,2,0,0|2,0,0]=4 2811 B13R2.13 O=C1COCC(N1)C2CCCC2 Amb25108479 [0,0,0,2,0,0|2,0,0]=4 2812 B13R2.13 O=C1COC[C@H](N1)C2CCCC2 Amb25710310 [0,0,0,2,0,0|2,0,0]=4 2813 B13R2.24 OCCC1CC12CC(=O)CCC2 Amb25718470 [0,0,0,2,0,0|2,0,0]=4 2814 B13R2.136 COC1CC1C2CC(=O)CCC2 Amb24662446 [0,0,0,2,0,0|2,0,0]=4 2815 B13R2.136 O=CC1CC1C2CCCC(=O)O2 Amb25714312 [0,0,0,2,0,0|1,0,1]=4 2816 B13R2.136 O=C[C@@H]1C[C@H]1[C@H]2CCCC(=O)O2 Amb24646578 [0,0,0,2,0,0|1,0,1]=4 2817 B13R2.136 O=C[C@H]1C[C@@H]1[C@H]2CCCC(=O)O2 Amb24716011 [0,0,0,2,0,0|1,0,1]=4 2818 B13R2.136 OCC1CC1C2CCCC(=O)O2 Amb25316284 [0,0,0,2,0,0|1,0,0]=3 2819 B13R2.270 OCCC1CC2CC1CC(=O)O2 Amb25686181 [0,0,0,2,0,0|1,0,0]=3 2820 B13R2.2409 COCC1CC2CC(=O)C1CC2 Amb25718966 [0,0,0,2,0,0|2,0,0]=4 2821 B13R2.2409 COC[C@@H]1C[C@H]2CC(=O)[C@@H]1CC2 Amb25202716 [0,0,0,2,0,0|2,0,0]=4 2822 B13R2.3021 O=C1CC(CCC1)NC2CCC2 Amb25158243 [0,0,0,2,0,0|2,0,0]=4 2823 B13R2.3021 O=C1CN(CC2CCC2)CCC1 Amb25079622 [0,0,0,2,0,0|2,0,0]=4 2824 B13R2.3473 CC1CCCC12CC(=O)CCO2 Amb24363106 [0,0,0,2,0,0|2,0,0]=4 2825 B13R2.3473 CC1CCOC12CC(=O)CCC2 Amb25717788 [0,0,0,2,0,0|2,0,0]=4 2826 B13R2.3473 C[C@@H]1CCC[C@]12CC(=O)CCC2 Amb24570455 [0,0,0,2,0,0|1,0,0]=3 2827 B13R2.3473 OC1CCCC12CCCC(=O)N2 Amb25132169 [0,0,0,2,0,0|2,0,0]=4 2828 B13R2.3473 O[C@@H]1CCC[C@]12CC(=O)CCC2 Amb24588905 [0,0,0,2,0,0|2,0,0]=4 2829 B13R2.3473 O[C@H]1CCC[C@]12CCCC(=O)N2 Amb24513156 [0,0,0,2,0,0|2,0,0]=4 2830 B13R2.3477 O=C1CC2CCCC(Cl)C1CC2 Amb25159387 [0,0,0,2,0,0|2,0,0]=4 2831 B13R2.3729 O=C1CCC2CCCCCC2N1 Amb25672141 [0,0,0,2,0,0|1,0,0]=3 2832 B13R2.3729 O=C1CC[C@@H]2CCCNC[C@H]2N1 Amb18826475 [0,0,0,2,0,0|2,0,0]=4 2833 B13R2.3729 O=C1CC[C@@H]2CCNCC[C@H]2N1 Amb18826473 [0,0,0,2,0,0|2,0,0]=4 2834 B13R2.3729 O=C1CC[C@@H]2CNCCC[C@H]2N1 Amb18826479 [0,0,0,2,0,0|2,0,0]=4 2835 B13R2.3729 O=C1CN2CCCCCC2CC1 Amb24524898 [0,0,0,2,0,0|2,0,0]=4 2836 B13R2.3729 O=C1C[C@@H]2CCCCC[C@@H]2CC1 Amb25233750 [0,0,0,2,0,0|1,0,0]=3 2837 B13R2.3729 O=C1C[C@H]2CCCCC[C@@H]2CC1 Amb24512411 [0,0,0,2,0,0|1,0,0]=3 2838 B13R2.3729 O=C1NCC2CCCCCC2O1 Amb25378885 [0,0,0,2,0,0|1,0,0]=3 2839 B13R2.3729 O=C1NC[C@@H]2CCCCC[C@@H]2O1 Amb25276457 [0,0,0,2,0,0|1,0,0]=3 2840 B13R2.3729 OC1CC2CCCCCC2CC1 Amb25725466 [0,0,0,2,0,0|1,0,1]=4 2841 B13R2.3729 OC1CC2CCCCC[C@@H]2CC1 Amb24630763 [0,0,0,2,0,0|1,0,1]=4 2842 B13R2.3729 O[C@@H]1C[C@H]2CCCCC[C@@H]2CC1 Amb25234376 [0,0,0,2,0,0|1,0,1]=4 2843 B13R2.3729 O[C@H]1CC2CCCCCC2CC1 Amb25734414 [0,0,0,2,0,0|1,0,1]=4 2844 B13R2.4486 CCOC1CC2CCCC(=O)C21 Amb24736326 [0,0,0,2,0,0|2,0,0]=4 2845 B13R2.4719 C=C1CC2CC(C1)CCCCC2 Amb24627188 [0,0,0,2,0,0|2,0,0]=4 2846 B13R2.4719 O=C1CC2CC(C1)CCCCC2 Amb24400472 [0,0,0,2,0,0|1,0,0]=3 2847 B13R2.4719 O=C1CC2CC(CCCCC2)=C1 Amb25116523 [0,0,0,2,0,0|1,0,1]=4 2848 B13R2.4818 CC1CCCC2CNCC(=O)N21 Amb25360925 [0,0,0,2,0,0|2,0,0]=4 2849 B13R2.4818 CC1CCCC2NCCC(=O)N21 Amb25039181 [0,0,0,2,0,0|2,0,0]=4 2850 B13R2.4818 CN1CCC[C@@H]2CCCC(=O)[C@H]12 Amb25233759 [0,0,0,2,0,0|2,0,0]=4 2851 B13R2.4818 C[C@@H]1CCC[C@@H]2CCCC(=O)[C@@H]21 Amb25179727 [0,0,0,2,0,0|1,0,0]=3 2852 B13R2.4818 C[C@@H]1CCC[C@@H]2CCCC(=O)[C@H]21 Amb24577779 [0,0,0,2,0,0|1,0,0]=3 2853 B13R2.4818 C[C@H]1CCC[C@@H]2CCCC(=O)[C@H]21 Amb24621314 [0,0,0,2,0,0|1,0,0]=3 2854 B13R2.4818 OC1CCCC2CCCC(=O)C21 Amb25059725 [0,0,0,2,0,0|2,0,0]=4 2855 B13R2.4818 OC1CCCC2CCCC(=O)N21 Amb25056857 [0,0,0,2,0,0|2,0,0]=4 2856 B13R2.4818 OC1CCC[C@@H]2CCCC(=O)N21 Amb24353044 [0,0,0,2,0,0|2,0,0]=4 2857 B13R2.4818 O[C@H]1CCC[C@H]2CCCC(=O)[C@@H]21 Amb24608589 [0,0,0,2,0,0|2,0,0]=4 2858 B13R2.4820 O=C1CCCC2CCCCCC12 Amb25370732 [0,0,0,2,0,0|1,0,0]=3 2859 B13R2.4820 O=C1CCCC2CCCCCN12 Amb24596906 [0,0,0,2,0,0|1,0,0]=3 2860 B13R2.4820 O=C1CCC[C@@H]2CCCCC[C@H]12 Amb24698878 [0,0,0,2,0,0|1,0,0]=3 2861 B13R2.4820 O=C1CCOC2CCCCCC12 Amb18826487 [0,0,0,2,0,0|2,0,0]=4 2862 B13R2.4820 OC1CCC[C@@H]2CCCCC[C@@H]21 Amb25215408 [0,0,0,2,0,0|1,0,1]=4 2863 B13R2.5179 CC1CCCC2=CC(=O)CC[C@@H]21 Amb25093749 [0,0,0,2,0,0|1,0,1]=4 2864 B13R2.5179 CC1CCCC2NC(=O)CNC21 Amb24412967 [0,0,0,2,0,0|2,0,0]=4 2865 B13R2.5179 CN1CCC[C@H]2CC(=O)CC[C@H]12 Amb24614300 [0,0,0,2,0,0|2,0,0]=4 2866 B13R2.5179 C[C@H]1CCC[C@@H]2CC(=O)CCN21 Amb25370720 [0,0,0,2,0,0|2,0,0]=4 2867 B13R2.5179 C[C@H]1CCC[C@@H]2NC(=S)CC[C@@H]21 Amb24519307 [0,0,0,2,0,0|1,1,0]=4 2868 B13R2.5179 C[C@H]1NCC[C@H]2CC(=O)CC[C@@H]21 Amb24627930 [0,0,0,2,0,0|2,0,0]=4 2869 B13R2.5179 NC1CCCC2NC(=O)CCC21 Amb23452730 [0,0,0,2,0,0|2,0,0]=4 2870 B13R2.5179 O=C1CCC2C(=C1)CCCC2C Amb17594083 [0,0,0,2,0,0|1,0,1]=4 2871 B13R2.5179 O=C1CCC2C(F)CCCC2N1 Amb24493632 [0,0,0,2,0,0|2,0,0]=4 2872 B13R2.11128 O=C1CC2(CCCCC2)NCC1 Amb18826926 [0,0,0,2,0,0|2,0,0]=4 2873 B13R2.11128 O=C1CC2(CCCCC2)OCC1 Amb18826491 [0,0,0,2,0,0|2,0,0]=4 2874 B13R2.11128 O=C1CC2(CCCCC2)SCC1 Amb18822698 [0,0,0,2,0,0|2,0,0]=4 2875 B13R2.11128 O=C1CC2(CCCCN2)CCC1 Amb25751207 [0,0,0,2,0,0|2,0,0]=4 2876 B13R2.11128 O=C1CC2(CCCCO2)CCC1 Amb25273060 [0,0,0,2,0,0|2,0,0]=4 2877 B13R2.11128 O=C1CC2(CCO1)CCCCC2 Amb24737335 [0,0,0,2,0,0|2,0,0]=4 2878 B13R2.11128 O=C1CCCC2(CCCCC2)N1 Amb25150848 [0,0,0,2,0,0|1,0,0]=3 2879 B13R2.11128 O=C1CCCC2(CCCCO2)N1 Amb22233058 [0,0,0,2,0,0|2,0,0]=4 2880 B13R2.11128 O=C1CCCC2(CCNCC2)N1 Amb24425488 [0,0,0,2,0,0|2,0,0]=4 2881 B13R2.11128 O=C1CCCC2(N1)CCNCC2 Amb10069947 [0,0,0,2,0,0|2,0,0]=4 2882 B13R2.11128 O=C1CCSC2(CCCCC2)N1 Amb25363493 [0,0,0,2,0,0|2,0,0]=4 2883 B13R2.11128 O=C1COCC2(CCCCC2)O1 Amb24060708 [0,0,0,2,0,0|1,0,0]=3 2884 B13R2.11128 O=C1NCCC2(CCNCC2)O1 Amb21964417 [0,0,0,2,0,0|2,0,0]=4 2885 B13R2.11128 O=C1NCCC2(CCNCC2)O1 Amb22727974 [0,0,0,2,0,0|2,0,0]=4 2886 B13R2.11128 O=C1NCCC2(COCCC2)O1 Amb24664520 [0,0,0,2,0,0|2,0,0]=4 2887 B13R2.11128 O=C1NCCC2(CSCCC2)O1 Amb24564764 [0,0,0,2,0,0|2,0,0]=4 2888 B13R2.11128 OC1CC2(CCC1)CCCCC2 Amb24567672 [0,0,0,2,0,0|1,0,1]=4 2889 B13R2.31 O=C1CC(C1)CN2CCCCC2 Amb24645374 [0,0,0,2,0,0|2,0,0]=4 2890 B13R2.31 O=C1CC(C1)OC2CCCCC2 Amb25207571 [0,0,0,2,0,0|2,0,0]=4 2891 B13R2.31 O=C1CN(CC2CCCCC2)C1 Amb25830525 [0,0,0,2,0,0|2,0,0]=4 2892 B13R2.241 O=C1CC(C1)OCC2CCCC2 Amb24537712 [0,0,0,2,0,0|2,0,0]=4 2893 B13R2.4787 O=C1CC2CCCCCCC=C12 Amb25729211 [0,0,0,2,0,0|1,0,1]=4 2894 B13R2.4787 O=C1CC2CCCCCCCC12 Amb24434617 [0,0,0,2,0,0|1,0,0]=3 2895 B13R2.72 CC(=O)C1CCC2CCCCC21 Amb24364161 [0,0,0,2,0,0|1,0,0]=3 2896 B13R2.72 CC(=O)N1CC[C@H]2CCCC[C@@H]12 Amb25303394 [0,0,0,2,0,0|2,0,0]=4 2897 B13R2.72 CC(=O)N1CC[C@H]2CCCC[C@H]12 Amb24700545 [0,0,0,2,0,0|2,0,0]=4 2898 B13R2.72 CC(O)C1CCC2CCCCC21 Amb24675376 [0,0,0,2,0,0|1,0,1]=4 2899 B13R2.72 NC(=O)C1CCC2CCCCC21 Amb25685981 [0,0,0,2,0,0|1,0,0]=3 2900 B13R2.72 NC(=O)C1CCN2CCCCC21 Amb25858041 [0,0,0,2,0,0|2,0,0]=4 2901 B13R2.72 NC(=O)C1CNC2CCCCC12 Amb19515220 [0,0,0,2,0,0|2,0,0]=4 2902 B13R2.72 NC(=O)N1CC[C@H]2CCCC[C@@H]12 Amb24532036 [0,0,0,2,0,0|2,0,0]=4 2903 B13R2.72 OC(=O)C1CCC2CC=CCC21 Amb24453318 [0,0,0,2,0,0|0,0,2]=4 2904 B13R2.72 OC(=O)C1CCC2CCCCN21 Amb23441245 [0,0,0,2,0,0|1,0,0]=3 2905 B13R2.72 OC(=O)C1CCC2CCCNC21 Amb25219595 [0,0,0,2,0,0|1,0,0]=3 2906 B13R2.72 OC(=O)C1CCC2CNCCN21 Amb18825686 [0,0,0,2,0,0|2,0,0]=4 2907 B13R2.72 OC(=O)C1CCC2COCCN21 Amb18198666 [0,0,0,2,0,0|2,0,0]=4 2908 B13R2.72 OC(=O)C1CCC2CSCCN21 Amb18821366 [0,0,0,2,0,0|2,0,0]=4 2909 B13R2.72 OC(=O)C1CCC2NCCCC12 Amb24586076 [0,0,0,2,0,0|1,0,0]=3 2910 B13R2.72 OC(=O)C1CCC2OCOCC21 Amb25352085 [0,0,0,2,0,0|2,0,0]=4 2911 B13R2.72 OC(=O)C1CCN2CCCCC21 Amb25046187 [0,0,0,2,0,0|1,0,0]=3 2912 B13R2.72 OC(=O)C1CCN2CCCC[C@@H]21 Amb18826018 [0,0,0,2,0,0|1,0,0]=3 2913 B13R2.72 OC(=O)C1CCN2CCNCC21 Amb18825633 [0,0,0,2,0,0|2,0,0]=4 2914 B13R2.72 OC(=O)C1CCN2CCOCC21 Amb18198647 [0,0,0,2,0,0|2,0,0]=4 2915 B13R2.72 OC(=O)C1CC[C@@H]2CC=CC[C@H]21 Amb25257986 [0,0,0,2,0,0|0,0,2]=4 2916 B13R2.72 OC(=O)C1COC2CCCCC12 Amb23589677 [0,0,0,2,0,0|1,0,0]=3 2917 B13R2.72 OC(=O)C1NCC2CCCCC21 Amb18826042 [0,0,0,2,0,0|1,0,0]=3 2918 B13R2.72 OC(=O)C1NCC2OCCCC21 Amb24424061 [0,0,0,2,0,0|2,0,0]=4 2919 B13R2.72 OC(=O)C=1CCC2CCCCC12 Amb24710203 [0,0,0,2,0,0|0,0,2]=4 2920 B13R2.72 OC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]21 Amb24580399 [0,0,0,2,0,0|0,0,0]=2 2921 B13R2.72 OC(=O)[C@@H]1NC[C@H]2CCCC[C@@H]21 Amb24514926 [0,0,0,2,0,0|1,0,0]=3 2922 B13R2.72 OC(=O)[C@H]1CN[C@@H]2CCCN[C@@H]21 Amb24624716 [0,0,0,2,0,0|2,0,0]=4 2923 B13R2.72 OC(=O)[C@H]1NCC2CCCCC21 Amb25775907 [0,0,0,2,0,0|1,0,0]=3 2924 B13R2.72 OC(=O)[C@H]1NC[C@@H]2CCCC[C@H]21 Amb24737324 [0,0,0,2,0,0|1,0,0]=3 2925 B13R2.72 OC(=O)[C@H]1NC[C@H]2CCCC[C@@H]21 Amb25373956 [0,0,0,2,0,0|1,0,0]=3 2926 B13R2.163 O=C1CC2CCCCC2CCN1 Amb25159400 [0,0,0,2,0,0|1,0,0]=3 2927 B13R2.163 O=C1CCCC2CCCCC2N1 Amb25123830 [0,0,0,2,0,0|1,0,0]=3 2928 B13R2.163 O=C1CCCC2CCNCC2N1 Amb25159429 [0,0,0,2,0,0|2,0,0]=4 2929 B13R2.163 O=C1CCC[C@@H]2CCNC[C@H]2N1 Amb18826477 [0,0,0,2,0,0|2,0,0]=4 2930 B13R2.163 O=C1CCC[C@@H]2CNCC[C@H]2N1 Amb18826481 [0,0,0,2,0,0|2,0,0]=4 2931 B13R2.163 O=C1COCC2CCCCC2N1 Amb24496518 [0,0,0,2,0,0|2,0,0]=4 2932 B13R2.328 CC1=CC(=O)C[C@@H]2CCCCC12 Amb25712957 [0,0,0,2,0,0|1,0,1]=4 2933 B13R2.328 CC1CC(=O)C2C(S1)CCCC2 Amb1074029 [0,0,0,2,0,0|2,0,0]=4 2934 B13R2.328 CC1CC(=O)C2CCCCC2O1 Amb18199232 [0,0,0,2,0,0|2,0,0]=4 2935 B13R2.328 CC1CC(=O)C2CCCCN2C1 Amb24691788 [0,0,0,2,0,0|2,0,0]=4 2936 B13R2.328 CC1CC(=O)[C@H]2CCCC[C@H]2N1 Amb24519313 [0,0,0,2,0,0|2,0,0]=4 2937 B13R2.328 CC1CC2CCCCC2C(=O)N1 Amb25690389 [0,0,0,2,0,0|1,0,0]=3 2938 B13R2.328 CC1C[C@H]2CCCC[C@@H]2C(=O)C1 Amb25373232 [0,0,0,2,0,0|1,0,0]=3 2939 B13R2.328 CC1NC2CCCCC2C(=O)C1 Amb1042613 [0,0,0,2,0,0|2,0,0]=4 2940 B13R2.328 CC1NC2CCCCC2C(=O)N1 Amb24579777 [0,0,0,2,0,0|2,0,0]=4 2941 B13R2.328 CN1CC2CCCCC2C(=O)C1 Amb25359062 [0,0,0,2,0,0|2,0,0]=4 2942 B13R2.328 CN1C[C@H]2CCCC[C@@H]2C(=O)C1 Amb24736350 [0,0,0,2,0,0|2,0,0]=4 2943 B13R2.328 C[C@@H]1CC(=O)[C@H]2CCCC[C@@H]2N1 Amb22757987 [0,0,0,2,0,0|2,0,0]=4 2944 B13R2.328 C[C@@H]1N[C@@H]2CCCC[C@H]2C(=O)C1 Amb10608650 [0,0,0,2,0,0|2,0,0]=4 2945 B13R2.328 C[C@H]1CC(=O)C[C@H]2CCCCN21 Amb24594694 [0,0,0,2,0,0|2,0,0]=4 2946 B13R2.328 C[C@H]1CC(=O)[C@H]2CCCC[C@H]2O1 Amb24553651 [0,0,0,2,0,0|2,0,0]=4 2947 B13R2.328 C[C@H]1C[C@@H]2CCCC[C@@H]2C(=O)C1 Amb24619668 [0,0,0,2,0,0|1,0,0]=3 2948 B13R2.328 C[C@H]1N[C@@H]2CCCC[C@H]2C(=O)C1 Amb10608385 [0,0,0,2,0,0|2,0,0]=4 2949 B13R2.328 C[C@H]1OC(=O)N[C@H]2CCCC[C@@H]21 Amb25366397 [0,0,0,2,0,0|1,0,0]=3 2950 B13R2.328 O[C@@H]1CC(=O)C[C@H]2CCCC[C@H]21 Amb25205857 [0,0,0,2,0,0|2,0,0]=4 2951 B13R2.545 OC(=O)CC1CCCCC12CC2 Amb18826489 [0,0,0,2,0,0|0,0,0]=2 2952 B13R2.545 OC(=O)CC1CCCCC12CO2 Amb25755509 [0,0,0,2,0,0|1,0,0]=3 2953 B13R2.545 OC(=O)CC1CCNCC12CC2 Amb25267950 [0,0,0,2,0,0|1,0,0]=3 2954 B13R2.545 OC(=O)CC1CCSCC12CC2 Amb18821902 [0,0,0,2,0,0|1,0,0]=3 2955 B13R2.545 OC(=O)C[C@H]1CCCCC12CO2 Amb24374413 [0,0,0,2,0,0|1,0,0]=3 2956 B13R2.545 OC(=O)C[C@H]1CCCC[C@]12CO2 Amb25175717 [0,0,0,2,0,0|1,0,0]=3 2957 B13R2.683 CC(=O)NC12CCC1CCCC2 Amb24497268 [0,0,0,2,0,0|2,0,0]=4 2958 B13R2.683 CC(=O)N[C@@]12CC[C@@H]1CCCC2 Amb24757752 [0,0,0,2,0,0|2,0,0]=4 2959 B13R2.689 CC(=O)NC1[C@@H]2CCC[C@H]1CC2 Amb25121206 [0,0,0,2,0,0|2,0,0]=4 2960 B13R2.689 OC(=O)CC1C2CNCC1CC2 Amb24697034 [0,0,0,2,0,0|1,0,0]=3 2961 B13R2.689 OC(=O)CN1C2CNCC1CC2 Amb25701772 [0,0,0,2,0,0|2,0,0]=4 2962 B13R2.1287 O=C(Cl)CC1CC2CCC1CC2 Amb25101940 [0,0,0,2,0,0|1,0,0]=3 2963 B13R2.1287 O=C(Cl)CC1C[C@H]2CC[C@@H]1CC2 Amb25697065 [0,0,0,2,0,0|1,0,0]=3 2964 B13R2.1287 OC(=O)CC1CC2CCC1C=C2 Amb25138755 [0,0,0,2,0,0|0,0,2]=4 2965 B13R2.1287 OC(=O)CC1CC2CCC1CC2 Amb25262532 [0,0,0,2,0,0|0,0,0]=2 2966 B13R2.1287 OC(=O)CC1CN2CCC1CC2 Amb10777454 [0,0,0,2,0,0|1,0,0]=3 2967 B13R2.2363 CCC12CC(=O)CC1CCCC2 Amb25373435 [0,0,0,2,0,0|1,0,0]=3 2968 B13R2.2363 O=C1CC2CCCCC2(CCl)O1 Amb25694768 [0,0,0,2,0,0|1,0,0]=3 2969 B13R2.2363 O=C1CC2CCCCC2(CI)O1 Amb25036237 [0,0,0,2,0,0|1,0,0]=3 2970 B13R2.2363 OCC12CCCCC1CC(=O)O2 Amb25817439 [0,0,0,2,0,0|1,0,0]=3 2971 B13R2.2363 OC[C@]12CCCC[C@H]1CC(=O)O2 Amb24733380 [0,0,0,2,0,0|1,0,0]=3 2972 B13R2.2377 CCC1C2CC(=O)CC1CCN2 Amb25125294 [0,0,0,2,0,0|2,0,0]=4 2973 B13R2.2377 CCN1C2CC(=O)CC1CCC2 Amb18798931 [0,0,0,2,0,0|2,0,0]=4 2974 B13R2.7016 CC1C2CCCC1C2CC(C)=O Amb24537914 [0,0,0,2,0,0|1,0,0]=3 2975 B13R2.7016 C[C@@H]1[C@@H]2CCC[C@H]1[C@H]2CC(C)=O Amb25319895 [0,0,0,2,0,0|1,0,0]=3 2976 B13R2.7256 COC12CCOCC1C2C(O)=O Amb24701668 [0,0,0,2,0,0|2,0,0]=4 2977 B13R2.210 O=C1CCC2CCCC2CCC1 Amb25707525 [0,0,0,2,0,0|1,0,0]=3 2978 B13R2.210 O=C1CCC2CCCC2CCN1 Amb25324607 [0,0,0,2,0,0|1,0,0]=3 2979 B13R2.430 CC(=O)C1CC2NCCC2CC1 Amb25842704 [0,0,0,2,0,0|2,0,0]=4 2980 B13R2.430 CC(=O)[C@@H]1C[C@@H]2CCC[C@H]2CC1 Amb24706979 [0,0,0,2,0,0|1,0,0]=3 2981 B13R2.430 NC(=O)C1CC2NCCC2CC1 Amb24359483 [0,0,0,2,0,0|2,0,0]=4 2982 B13R2.430 NC(=O)[C@@H]1C[C@@H]2CCC[C@H]2CC1 Amb24641813 [0,0,0,2,0,0|1,0,0]=3 2983 B13R2.430 NC(=O)[C@@H]1C[C@H]2CCC[C@@H]2CC1 Amb24580344 [0,0,0,2,0,0|1,0,0]=3 2984 B13R2.430 NC(=O)[C@H]1C[C@@H]2CCC[C@@H]2CC1 Amb24550500 [0,0,0,2,0,0|1,0,0]=3 2985 B13R2.430 NC(=O)[C@H]1C[C@H]2CCC[C@@H]2CC1 Amb24512287 [0,0,0,2,0,0|1,0,0]=3 2986 B13R2.430 NC(=O)[C@H]1C[C@H]2CCC[C@H]2CC1 Amb25274029 [0,0,0,2,0,0|1,0,0]=3 2987 B13R2.430 OC(=O)C1CC2CCCC2CC1 Amb24513627 [0,0,0,2,0,0|0,0,0]=2 2988 B13R2.430 OC(=O)C1CC2CCCN2CC1 Amb18826004 [0,0,0,2,0,0|1,0,0]=3 2989 B13R2.430 OC(=O)C1CC2CNCC2CC1 Amb18825999 [0,0,0,2,0,0|1,0,0]=3 2990 B13R2.430 OC(=O)C1CCC2CCCC2=C1 Amb24341552 [0,0,0,2,0,0|0,0,2]=4 2991 B13R2.430 OC(=O)C1CCC2CCCC2N1 Amb25828484 [0,0,0,2,0,0|1,0,0]=3 2992 B13R2.430 OC(=O)C1CN2CCCC2CC1 Amb25072618 [0,0,0,2,0,0|1,0,0]=3 2993 B13R2.430 OC(=O)C1CN2CCCC2CN1 Amb18647395 [0,0,0,2,0,0|2,0,0]=4 2994 B13R2.430 OC(=O)C1CN2CCCC2CO1 Amb24417843 [0,0,0,2,0,0|2,0,0]=4 2995 B13R2.430 OC(=O)C1CNC2CNCC2C1 Amb25282998 [0,0,0,2,0,0|2,0,0]=4 2996 B13R2.430 OC(=O)C1CNC2COCC2C1 Amb25762041 [0,0,0,2,0,0|2,0,0]=4 2997 B13R2.430 OC(=O)C1CSC2CCCC2N1 Amb25053699 [0,0,0,2,0,0|2,0,0]=4 2998 B13R2.430 OC(=O)C=1CC2CCCC2CC1 Amb24341792 [0,0,0,2,0,0|0,0,2]=4 2999 B13R2.430 OC(=O)C=1CC[C@H]2CCC[C@@H]2C1 Amb25211670 [0,0,0,2,0,0|0,0,2]=4 3000 B13R2.430 OC(=O)C=1C[C@H]2CCC[C@@H]2CC1 Amb24595776 [0,0,0,2,0,0|0,0,2]=4 3001 B13R2.430 OC(=O)C=1C[C@H]2CCC[C@H]2CC1 Amb25241549 [0,0,0,2,0,0|0,0,2]=4 3002 B13R2.430 OC(=O)[C@@H]1CC=2CCCC2CC1 Amb24366651 [0,0,0,2,0,0|0,0,2]=4 3003 B13R2.430 OC(=O)[C@@H]1CC[C@@H]2CCC[C@@H]2N1 Amb24068296 [0,0,0,2,0,0|1,0,0]=3 3004 B13R2.430 OC(=O)[C@@H]1CN2CCC[C@H]2CO1 Amb24563861 [0,0,0,2,0,0|2,0,0]=4 3005 B13R2.430 OC(=O)[C@@H]1C[C@@H]2CCC[C@H]2CC1 Amb24557812 [0,0,0,2,0,0|0,0,0]=2 3006 B13R2.430 OC(=O)[C@H]1CN2CCC[C@H]2CO1 Amb24740914 [0,0,0,2,0,0|2,0,0]=4 3007 B13R2.687 CC(=O)CN1CCC2CCCC12 Amb25031997 [0,0,0,2,0,0|2,0,0]=4 3008 B13R2.687 CC(=O)NC1CCC2CCCC21 Amb25828317 [0,0,0,2,0,0|2,0,0]=4 3009 B13R2.687 NC(=O)CN1CCC2CCCC12 Amb24497339 [0,0,0,2,0,0|2,0,0]=4 3010 B13R2.687 OC(=O)CC1CCC2OCCC12 Amb25159558 [0,0,0,2,0,0|1,0,0]=3 3011 B13R2.687 OC(=O)CC1CCN2CCCC21 Amb18826008 [0,0,0,2,0,0|1,0,0]=3 3012 B13R2.687 OC(=O)CC1CC[C@H]2CCC[C@@H]12 Amb24739560 [0,0,0,2,0,0|0,0,0]=2 3013 B13R2.687 OC(=O)CC1CC[C@H]2OCC[C@@H]12 Amb24745724 [0,0,0,2,0,0|1,0,0]=3 3014 B13R2.687 OC(=O)CC1CSC2CNCC12 Amb18821373 [0,0,0,2,0,0|2,0,0]=4 3015 B13R2.687 OC(=O)C[C@H]1CO[C@H]2OCC[C@@H]12 Amb25363185 [0,0,0,2,0,0|2,0,0]=4 3016 B13R2.1264 NC(=O)CCN1C2CCC1CC2 Amb25283747 [0,0,0,2,0,0|2,0,0]=4 3017 B13R2.1264 OC(=O)CCN1C2CCC1CC2 Amb23441961 [0,0,0,2,0,0|1,0,0]=3 3018 B13R2.2334 CN1C2CCCC2CC1C(O)=O Amb24628264 [0,0,0,2,0,0|1,0,0]=3 3019 B13R2.3462 NC1C2CC1CN2CCC(O)=O Amb25215046 [0,0,0,2,0,0|2,0,0]=4 3020 B13R2.5551 CC(=O)CCN1CC2CC1CC2 Amb18792964 [0,0,0,2,0,0|2,0,0]=4 3021 B13R2.5551 CC(=O)OCC1C[C@H]2C[C@@H]1CC2 Amb24546965 [0,0,0,2,0,0|2,0,0]=4 3022 B13R2.5551 NC(=O)CCN1CC2CC1CC2 Amb18793106 [0,0,0,2,0,0|2,0,0]=4 3023 B13R2.5551 NC(=O)CC[C@H]1C[C@@H]2C[C@H]1CC2 Amb25257942 [0,0,0,2,0,0|1,0,0]=3 3024 B13R2.5551 NC(=O)CNC1CC2CC1CC2 Amb18788834 [0,0,0,2,0,0|2,0,0]=4 3025 B13R2.5551 NC(=O)COC1CC2CC1CC2 Amb25062078 [0,0,0,2,0,0|2,0,0]=4 3026 B13R2.5551 OC(=O)CCC1CC2CC1C=C2 Amb24373820 [0,0,0,2,0,0|0,0,2]=4 3027 B13R2.5551 OC(=O)CCC1CC2CC1CC2 Amb24692916 [0,0,0,2,0,0|0,0,0]=2 3028 B13R2.5551 OC(=O)CCN1CC2CC1CC2 Amb10608579 [0,0,0,2,0,0|1,0,0]=3 3029 B13R2.5551 OC(=O)CCN1CC2CC1CC2 Amb17622303 [0,0,0,2,0,0|1,0,0]=3 3030 B13R2.5551 OC(=O)CC[C@@H]1C[C@H]2C[C@@H]1CC2 Amb25249118 [0,0,0,2,0,0|0,0,0]=2 3031 B13R2.5551 OC(=O)CNC1CC2CC1CC2 Amb18788990 [0,0,0,2,0,0|1,0,0]=3 3032 B13R2.5551 OC(=O)CNC1CC2CCC1O2 Amb24665449 [0,0,0,2,0,0|2,0,0]=4 3033 B13R2.5551 [O-]C(=O)CN[C@@H]1C[C@@H]2C[C@H]1CC2 Amb24756607 [0,0,0,2,0,0|1,0,1]=4 3034 B13R2.33 O=C1CCC2CCCCC2CC1 Amb24723947 [0,0,0,2,0,0|1,0,0]=3 3035 B13R2.33 O=C1COC2CCCCC2CC1 Amb25112633 [0,0,0,2,0,0|2,0,0]=4 3036 B13R2.33 O=C1COC2CCCCC2CN1 Amb24497052 [0,0,0,2,0,0|2,0,0]=4 3037 B13R2.34 CC12CCCCC1CCC(O)C2 Amb25795565 [0,0,0,2,0,0|1,0,1]=4 3038 B13R2.34 CC12CCCCC1CNC(=O)N2 Amb25125872 [0,0,0,2,0,0|2,0,0]=4 3039 B13R2.34 CC12CCCCN1CCC(=O)N2 Amb25821757 [0,0,0,2,0,0|2,0,0]=4 3040 B13R2.34 C[C@@]12CC(=O)CCN1CCCC2 Amb24370115 [0,0,0,2,0,0|2,0,0]=4 3041 B13R2.34 C[C@@]12CC(=O)CC[C@H]1CCCC2 Amb25179667 [0,0,0,2,0,0|1,0,0]=3 3042 B13R2.34 C[C@]12CC(=O)CC[C@@H]1CCCC2 Amb24604888 [0,0,0,2,0,0|1,0,0]=3 3043 B13R2.34 C[C@]12CC(=O)CC[C@H]1CCCC2 Amb24570380 [0,0,0,2,0,0|1,0,0]=3 3044 B13R2.34 C[C@]12CCCC[C@@H]1CCC(O)C2 Amb25215396 [0,0,0,2,0,0|1,0,1]=4 3045 B13R2.34 C[C@]12CCCC[C@@H]1CC[C@@H](O)C2 Amb24718402 [0,0,0,2,0,0|1,0,1]=4 3046 B13R2.34 O=C1CCC2C(C1)(C)CCCC2 Amb17594140 [0,0,0,2,0,0|1,0,0]=3 3047 B13R2.34 O[C@]12CCCC[C@H]1CCC(=O)N2 Amb24513146 [0,0,0,2,0,0|2,0,0]=4 3048 B13R2.435 CC(=O)C1CC2CCCCC2C1 Amb25282805 [0,0,0,2,0,0|1,0,0]=3 3049 B13R2.435 CC(=O)C1CC2CCCCC2N1 Amb25302667 [0,0,0,2,0,0|2,0,0]=4 3050 B13R2.435 CC(=O)N1C[C@@H]2CCCC[C@@H]2C1 Amb24453029 [0,0,0,2,0,0|2,0,0]=4 3051 B13R2.435 NC(=O)C1CC2CCCCN2C1 Amb19515513 [0,0,0,2,0,0|2,0,0]=4 3052 B13R2.435 NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1 Amb25236898 [0,0,0,2,0,0|2,0,0]=4 3053 B13R2.435 O=C(Cl)N1CC2CCCCC2C1 Amb25173295 [0,0,0,2,0,0|2,0,0]=4 3054 B13R2.435 OC(=O)C1CC2C(N1)CCCC2 Amb2371208 [0,0,0,2,0,0|1,0,0]=3 3055 B13R2.435 OC(=O)C1CC2CCCCC2C1 Amb18647052 [0,0,0,2,0,0|0,0,0]=2 3056 B13R2.435 OC(=O)C1CC2CCCCN2C1 Amb19149350 [0,0,0,2,0,0|1,0,0]=3 3057 B13R2.435 OC(=O)C1CC2CCNCC2C1 Amb24681595 [0,0,0,2,0,0|1,0,0]=3 3058 B13R2.435 OC(=O)C1CC2CCOCC2N1 Amb18198665 [0,0,0,2,0,0|2,0,0]=4 3059 B13R2.435 OC(=O)C1CC2CCSCC2N1 Amb18821371 [0,0,0,2,0,0|2,0,0]=4 3060 B13R2.435 OC(=O)C1CC2CNCCC2N1 Amb25283000 [0,0,0,2,0,0|2,0,0]=4 3061 B13R2.435 OC(=O)C1CC2COCCC2N1 Amb18198664 [0,0,0,2,0,0|2,0,0]=4 3062 B13R2.435 OC(=O)C1CC2CSCCC2N1 Amb18821372 [0,0,0,2,0,0|2,0,0]=4 3063 B13R2.435 OC(=O)C1CC2N(C1)CCCC2 Amb10606352 [0,0,0,2,0,0|1,0,0]=3 3064 B13R2.435 OC(=O)C1CC2OCCCC2N1 Amb18198663 [0,0,0,2,0,0|2,0,0]=4 3065 B13R2.435 OC(=O)C1CC2SCCCC2N1 Amb18821370 [0,0,0,2,0,0|2,0,0]=4 3066 B13R2.435 OC(=O)C1CN2CCNCC2C1 Amb18825632 [0,0,0,2,0,0|2,0,0]=4 3067 B13R2.435 OC(=O)C1C[C@@H]2CC=CC[C@@H]2C1 Amb24415400 [0,0,0,2,0,0|0,0,2]=4 3068 B13R2.435 OC(=O)C1C[C@@H]2CCCC[C@@H]2C1 Amb24426257 [0,0,0,2,0,0|0,0,0]=2 3069 B13R2.435 OC(=O)C1C[C@@H]2CCCC[C@@H]2N1 Amb24184035 [0,0,0,2,0,0|1,0,0]=3 3070 B13R2.435 OC(=O)C1N[C@@H]2CCCCC2N1 Amb24068381 [0,0,0,2,0,0|2,0,0]=4 3071 B13R2.435 OC(=O)C=1CC2CCCCC2C1 Amb25137239 [0,0,0,2,0,0|0,0,2]=4 3072 B13R2.435 OC(=O)C=1C[C@@H]2CCCC[C@@H]2N1 Amb24078945 [0,0,0,2,0,0|1,0,1]=4 3073 B13R2.435 OC(=O)C=1C[C@H]2CCCC[C@@H]2C1 Amb25245273 [0,0,0,2,0,0|0,0,2]=4 3074 B13R2.435 OC(=O)[C@@H]1CC2CCCCC2N1 Amb22746110 [0,0,0,2,0,0|1,0,0]=3 3075 B13R2.435 OC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1 Amb24606879 [0,0,0,2,0,0|1,0,0]=3 3076 B13R2.435 OC(=O)[C@@H]1C[C@@H]2[C@@H](N1)CCCC2 Amb16233005 [0,0,0,2,0,0|1,0,0]=3 3077 B13R2.435 OC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1 Amb22752915 [0,0,0,2,0,0|1,0,0]=3 3078 B13R2.435 OC(=O)[C@@H]1C[C@H]2[C@@H](N1)CCCC2 Amb1157219 [0,0,0,2,0,0|1,0,0]=3 3079 B13R2.435 OC(=O)[C@H]1C[C@H]2CCCC[C@H]2N1 Amb24624093 [0,0,0,2,0,0|1,0,0]=3 3080 B13R2.3101 CC1CCCCC12CC2C(O)=O Amb18799104 [0,0,0,2,0,0|0,0,0]=2 3081 B13R2.3101 CC1CCCCC12OC2C(O)=O Amb25278083 [0,0,0,2,0,0|1,0,0]=3 3082 B13R2.3101 OC(=O)C1CC12CCCCC2=O Amb24366021 [0,0,0,2,0,0|1,0,1]=4 3083 B13R2.3863 CN1[C@@H]2CCC[C@H]1C[C@@H]2C(O)=O Amb24602434 [0,0,0,2,0,0|1,0,0]=3 3084 B13R2.3863 CN1[C@H]2CCC[C@@H]1C[C@H]2C(O)=O Amb25241140 [0,0,0,2,0,0|1,0,0]=3 3085 B13R2.4742 CC1CN2CCN1CC2C(O)=O Amb24587219 [0,0,0,2,0,0|2,0,0]=4 3086 B13R2.4742 OC1CC2CCC1CC2C(O)=O Amb24470133 [0,0,0,2,0,0|1,0,0]=3 3087 B13R2.4742 OC1CC2CCC1NC2C(O)=O Amb24557633 [0,0,0,2,0,0|2,0,0]=4 3088 B13R2.4742 OC1CC2CCC1N[C@@H]2C(O)=O Amb24636551 [0,0,0,2,0,0|2,0,0]=4 3089 B13R2.4742 O[C@@H]1C[C@H]2CC[C@@H]1C[C@H]2C(O)=O Amb24600098 [0,0,0,2,0,0|1,0,0]=3 3090 B13R2.4823 CN1CCC[C@H]2[C@@H]1C2CC(O)=O Amb24707962 [0,0,0,2,0,0|1,0,0]=3 3091 B13R2.4958 O[C@@H]1C[C@@H]2CC[C@H]1[C@@H]2CC(O)=O Amb25362087 [0,0,0,2,0,0|1,0,0]=3 3092 B13R2.5881 OC(=O)CC1CC2CCCCC21 Amb25243282 [0,0,0,2,0,0|0,0,0]=2 3093 B13R2.5881 OC(=O)CN1CC2CCCCC12 Amb24717869 [0,0,0,2,0,0|1,0,0]=3 3094 B13R2.13856 NC(=O)CCN1CCCC2CC12 Amb24497950 [0,0,0,2,0,0|2,0,0]=4 3095 B13R2.13856 NC(=O)CCN1CCC[C@@H]2C[C@H]12 Amb25031939 [0,0,0,2,0,0|2,0,0]=4 3096 B13R2.13856 NC(=O)CNC1CCCC2CC21 Amb25369818 [0,0,0,2,0,0|2,0,0]=4 3097 B13R2.13856 NC(=O)CNC1CCC[C@@H]2C[C@@H]21 Amb25837515 [0,0,0,2,0,0|2,0,0]=4 3098 B13R2.13856 NC(=O)CNC1CCC[C@H]2C[C@H]21 Amb25031608 [0,0,0,2,0,0|2,0,0]=4 3099 B13R2.13856 OC(=O)CCN1CCC[C@@H]2C[C@H]12 Amb24704196 [0,0,0,2,0,0|1,0,0]=3 3100 B13R2.543 CC(O)CC1C[C@H]2CCC[C@@H]2C1 Amb24632492 [0,0,0,2,0,0|1,0,1]=4 3101 B13R2.543 OC(=O)C=C1CC2CCCC2C1 Amb24390916 [0,0,0,2,0,0|0,0,2]=4 3102 B13R2.543 OC(=O)CN1CC2CNCC2C1 Amb24744080 [0,0,0,2,0,0|2,0,0]=4 3103 B13R2.543 OC(=O)CN1C[C@@H]2CNC[C@@H]2C1 Amb24525018 [0,0,0,2,0,0|2,0,0]=4 3104 B13R2.3676 CN1CCC2C1C2CCC(O)=O Amb24617808 [0,0,0,2,0,0|1,0,0]=3 3105 B13R2.3732 CC(=O)C1CCC2C(Cl)CCC12 Amb25276482 [0,0,0,2,0,0|2,0,0]=4 3106 B13R2.3732 CC(=O)[C@H]1CCC2C(Cl)CCC12 Amb24341548 [0,0,0,2,0,0|2,0,0]=4 3107 B13R2.3732 CN1CCC2C(NCC12)C(O)=O Amb18825685 [0,0,0,2,0,0|2,0,0]=4 3108 B13R2.3732 CN1CCC2C(OCC12)C(O)=O Amb18198643 [0,0,0,2,0,0|2,0,0]=4 3109 B13R2.3732 CN1CCC2C(SCC12)C(O)=O Amb18821365 [0,0,0,2,0,0|2,0,0]=4 3110 B13R2.3732 N[C@@H]1CC[C@H]2[C@@H]1CC[C@@H]2C(O)=O Amb25313351 [0,0,0,2,0,0|1,0,0]=3 3111 B13R2.3732 OC(=O)C1NCC2C(F)CCC21 Amb24070279 [0,0,0,2,0,0|2,0,0]=4 3112 B13R2.3732 OC1CCC2C1CNC2C(O)=O Amb24518622 [0,0,0,2,0,0|2,0,0]=4 3113 B13R2.4849 CC1CCC2CC(=O)CCCC21 Amb24632248 [0,0,0,2,0,0|1,0,0]=3 3114 B13R2.4983 OC(=O)[C@@H]1CC[C@@H]2C[C@H]1CC2=O Amb25261352 [0,0,0,2,0,0|1,0,1]=4 3115 B13R2.5532 OC(=O)CCN1CC2CCCC12 Amb24705102 [0,0,0,2,0,0|1,0,0]=3 3116 B13R2.5532 OC(=O)CCN1CC2CCCC12 Amb25728888 [0,0,0,2,0,0|1,0,0]=3 3117 B13R2.11877 CN1C2CCC1CCC2C(N)=O Amb24433956 [0,0,0,2,0,0|2,0,0]=4 3118 B13R2.11877 CN1C2CCC1CC[C@@H]2C(O)=O Amb24739760 [0,0,0,2,0,0|1,0,0]=3 3119 B13R2.11877 CN1C2CCC1CC[C@H]2C(O)=O Amb25724950 [0,0,0,2,0,0|1,0,0]=3 3120 B13R2.11877 CN1[C@@H]2CC[C@H]1CC[C@@H]2C(O)=O Amb24642663 [0,0,0,2,0,0|1,0,0]=3 3121 B13R2.11877 CN1[C@@H]2CC[C@H]1CC[C@H]2C(O)=O Amb25272784 [0,0,0,2,0,0|1,0,0]=3 3122 B13R2.207 CC1C[C@H]2CCC[C@@H]2CC(=O)C1 Amb24621303 [0,0,0,2,0,0|1,0,0]=3 3123 B13R2.3342 O=C1CC2CC2CCCCCC1 Amb24706951 [0,0,0,2,0,0|1,0,0]=3 3124 B13R2.4023 O=C1OC(=O)C2CCCCCC12 Amb25159661 [0,0,0,2,0,0|1,0,1]=4 3125 B13R2.4023 O=C1OC(=O)[C@@H]2CCCCC[C@H]12 Amb22356765 [0,0,0,2,0,0|1,0,1]=4 3126 B13R2.4746 CC12CC(=O)CC1CCCCC2 Amb25759610 [0,0,0,2,0,0|1,0,0]=3 3127 B13R2.4746 CC12CCCCCC1NC(=O)O2 Amb24411559 [0,0,0,2,0,0|1,0,0]=3 3128 B13R2.4746 C[C@]12CC(=O)C[C@@H]1CCCCC2 Amb24631687 [0,0,0,2,0,0|1,0,0]=3 3129 B13R2.5226 OC1CCCCCCCC2CC21 Amb25048534 [0,0,0,2,0,0|1,0,1]=4 3130 B13R2.5226 O[C@@H]1CCCCCCC[C@@H]2C[C@H]21 Amb25175284 [0,0,0,2,0,0|1,0,1]=4 3131 B13R2.5852 CC(=O)CCN1CCC12CCC2 Amb24625193 [0,0,0,2,0,0|2,0,0]=4 3132 B13R2.218 O=C1CCCCC2CCCC2=C1 Amb24364204 [0,0,0,2,0,0|1,0,1]=4 3133 B13R2.218 O=C1CCCCC2CCCC2N1 Amb24682761 [0,0,0,2,0,0|1,0,0]=3 3134 B13R2.218 O=C1CCCC[C@@H]2CCC[C@@H]2N1 Amb25256754 [0,0,0,2,0,0|1,0,0]=3 3135 B13R2.278 CCO[C@@H]1NC(=O)[C@@H]2CCC[C@@H]21 Amb24620923 [0,0,0,2,0,0|2,0,0]=4 3136 B13R2.278 CCO[C@H]1NC(=O)[C@@H]2CCC[C@@H]21 Amb24613534 [0,0,0,2,0,0|2,0,0]=4 3137 B13R2.278 OCCC1CC(=O)C2CCCC21 Amb24690577 [0,0,0,2,0,0|2,0,0]=4 3138 B13R2.3047 O=C1CCCCCC2CCCN12 Amb22494063 [0,0,0,2,0,0|1,0,0]=3 3139 B13R2.4718 O=C1NC2CNCC1CCCC2 Amb18278103 [0,0,0,2,0,0|2,0,0]=4 3140 B13R2.4718 O=C1N[C@H]2CNC[C@H]1CCCC2 Amb25230103 [0,0,0,2,0,0|2,0,0]=4 3141 B13R2.5011 O=C1CC2CCCC(C1)CCC2 Amb25714248 [0,0,0,2,0,0|1,0,0]=3 3142 B13R2.2744 CC(=O)C1CCC2CC2C1OC Amb25723260 [0,0,0,2,0,0|2,0,0]=4 3143 B13R2.2744 CC(=O)[C@H]1CC[C@H]2C[C@H]2[C@@H]1OC Amb24745780 [0,0,0,2,0,0|2,0,0]=4 3144 B13R2.1286 CC(=O)NC1CC2CC1CCC2 Amb25685891 [0,0,0,2,0,0|2,0,0]=4 3145 B13R2.12752 CN1C2CC(=O)CC1CCCC2 Amb24646451 [0,0,0,2,0,0|2,0,0]=4 3146 B13R2.12752 CN1[C@@H]2CC(=O)C[C@H]1CCCC2 Amb25358981 [0,0,0,2,0,0|2,0,0]=4 3147 B13R2.13972 CC(=O)[C@@H]1C[C@H]2CCCCC[C@H]21 Amb24656067 [0,0,0,2,0,0|1,0,0]=3 3148 B13R2.13972 CC(=O)[C@H]1C[C@@H]2CCCCC[C@@H]21 Amb24604838 [0,0,0,2,0,0|1,0,0]=3 3149 B13R2.14165 CC(=O)NC1CCCCC2CC21 Amb24427407 [0,0,0,2,0,0|2,0,0]=4 3150 B13R2.355 CN1CC2CCCC2C1C(N)=O Amb24343598 [0,0,0,2,0,0|2,0,0]=4 3151 B13R2.355 CN1CC2CCCC2C1C(O)=O Amb25276162 [0,0,0,2,0,0|1,0,0]=3 3152 B13R2.355 CN1CC2NCCC2C1C(O)=O Amb18825636 [0,0,0,2,0,0|2,0,0]=4 3153 B13R2.355 CN1C[C@@H]2CCC[C@@H]2[C@H]1C(O)=O Amb25362070 [0,0,0,2,0,0|1,0,0]=3 3154 B13R2.3024 O=C1CC[C@H]2CCC[C@@H]1C(=O)O2 Amb25273004 [0,0,0,2,0,0|1,0,1]=4 3155 B13R2.5513 CC(O)C12CC1CCCCCC2 Amb25157877 [0,0,0,2,0,0|1,0,1]=4 3156 B13R2.5558 OC(=O)C1CCN2CC1CCC2 Amb25705270 [0,0,0,2,0,0|1,0,0]=3 3157 B13R2.5567 OC(=O)C1CC2CCCCC1N2 Amb25331367 [0,0,0,2,0,0|1,0,0]=3 3158 B13R2.10832 C[C@@H]1CC2CCCC[C@@]12C(C)=O Amb25179587 [0,0,0,2,0,0|1,0,0]=3 3159 B13R2.11644 CC1CCC2CCCC12C(C)=O Amb25273081 [0,0,0,2,0,0|1,0,0]=3 3160 B13R2.11644 C[C@@H]1CC[C@H]2CCCC12C(C)=O Amb24512622 [0,0,0,2,0,0|1,0,0]=3 3161 B13R2.13710 CC(=O)C1CCCC2CCC1N2 Amb25784670 [0,0,0,2,0,0|2,0,0]=4 3162 B13R2.5252 O=C1C=CCC[C@@H]2CCCC[C@H]12 Amb25179688 [0,0,0,2,0,0|1,0,1]=4 3163 B13R2.5252 O=C1CCCCC2CCCC=C12 Amb24416717 [0,0,0,2,0,0|1,0,1]=4 3164 B13R2.5252 O=C1CCCCC2CCCCC12 Amb25712919 [0,0,0,2,0,0|1,0,0]=3 3165 B13R2.5252 O=C1CCCCC2OCCCC12 Amb25319992 [0,0,0,2,0,0|2,0,0]=4 3166 B13R2.5252 O=C1CCCCC=2CCCCC21 Amb25713669 [0,0,0,2,0,0|1,0,1]=4 3167 B13R2.5252 O=C1CCCC[C@@H]2CCCC=C12 Amb25059719 [0,0,0,2,0,0|1,0,1]=4 3168 B13R2.5252 O=C1CCCC[C@H]2CCCC[C@H]12 Amb25263095 [0,0,0,2,0,0|1,0,0]=3 3169 B13R2.5252 O=C1CCCNC2CCCCC12 Amb24743876 [0,0,0,2,0,0|2,0,0]=4 3170 B13R2.5252 O=C1CCNCC2CCCCN12 Amb22494024 [0,0,0,2,0,0|2,0,0]=4 3171 B13R2.5252 O=C1NCCCN2CCCCC21 Amb25050003 [0,0,0,2,0,0|2,0,0]=4 3172 B13R2.5252 O=C1OCCCN2CCCCC21 Amb25066893 [0,0,0,2,0,0|1,0,0]=3 3173 B13R2.5252 OC1CCCCC2CCCCC21 Amb25107683 [0,0,0,2,0,0|1,0,1]=4 3174 B13R2.5252 O[C@H]1CCCC[C@H]2CCCC[C@@H]21 Amb25345052 [0,0,0,2,0,0|1,0,1]=4 3175 B13R2.408 CC1CCC12CNCC2C(O)=O Amb24685814 [0,0,0,2,0,0|1,0,0]=3 3176 B13R2.423 CC(=O)C1CC1C2CCCCC2 Amb18798691 [0,0,0,2,0,0|1,0,0]=3 3177 B13R2.423 CC(=O)C1CC1C2CCOCC2 Amb18799106 [0,0,0,2,0,0|2,0,0]=4 3178 B13R2.423 NC(=O)C1CC1C2CCCCC2 Amb24497949 [0,0,0,2,0,0|1,0,0]=3 3179 B13R2.423 NC(=O)C1OC1C2CCCCC2 Amb25151125 [0,0,0,2,0,0|2,0,0]=4 3180 B13R2.423 O=C(Cl)C1CC1C2CCCCC2 Amb25045510 [0,0,0,2,0,0|1,0,0]=3 3181 B13R2.423 OB(O)[C@@H]1CC1C2CCCCC2 Amb24331948 [0,0,0,2,0,0|1,0,1]=4 3182 B13R2.423 OB(O)[C@@H]1C[C@H]1C2CCCCC2 Amb24329630 [0,0,0,2,0,0|1,0,1]=4 3183 B13R2.423 OC(=O)C1CC1C2CCCCC2 Amb18960083 [0,0,0,2,0,0|0,0,0]=2 3184 B13R2.423 OC(=O)C1CC1C2CCOCC2 Amb17605505 [0,0,0,2,0,0|1,0,0]=3 3185 B13R2.423 OC(=O)C1OC1C2CCCCC2 Amb24513773 [0,0,0,2,0,0|1,0,0]=3 3186 B13R2.423 OC(=O)C1OC1C2CCOCC2 Amb24375282 [0,0,0,2,0,0|2,0,0]=4 3187 B13R2.437 OC(=O)C1NCC12CCCCC2 Amb24061108 [0,0,0,2,0,0|1,0,0]=3 3188 B13R2.442 CC(=O)CC1CC12CCCCC2 Amb24536026 [0,0,0,2,0,0|1,0,0]=3 3189 B13R2.442 CC(=O)CC1CC12CNCCC2 Amb24564813 [0,0,0,2,0,0|2,0,0]=4 3190 B13R2.442 OC(=O)CC1CC12CCCCC2 Amb25174683 [0,0,0,2,0,0|0,0,0]=2 3191 B13R2.5849 NC(=O)CNC1C2CCCCC21 Amb24395888 [0,0,0,2,0,0|2,0,0]=4 3192 B13R2.5849 OC(=O)C#CC1C2CCCCC21 Amb25302579 [0,0,0,2,0,0|0,0,2]=4 3193 B13R2.5849 OC(=O)CCC1C2CCCCC21 Amb25339591 [0,0,0,2,0,0|0,0,0]=2 3194 B13R2.5849 OC(=O)CCC1C2CCSCC12 Amb25243107 [0,0,0,2,0,0|1,0,0]=3 3195 B13R2.5849 OC(=O)CCC1[C@@H]2NCCC[C@H]12 Amb25350618 [0,0,0,2,0,0|1,0,0]=3 3196 B13R2.35 CC(=O)N1CCCC12CCCC2 Amb24525226 [0,0,0,2,0,0|2,0,0]=4 3197 B13R2.35 CC(O)C1CCCC12CCCC2 Amb24588540 [0,0,0,2,0,0|1,0,1]=4 3198 B13R2.35 NC(=O)C1CCCC12CCCN2 Amb24579213 [0,0,0,2,0,0|2,0,0]=4 3199 B13R2.35 NC(=O)C1CNCC12CCCC2 Amb25691062 [0,0,0,2,0,0|2,0,0]=4 3200 B13R2.35 O=C(Cl)N1CCCC12CCCC2 Amb25084682 [0,0,0,2,0,0|2,0,0]=4 3201 B13R2.35 OC(=O)C1CCNC12CCCC2 Amb24514360 [0,0,0,2,0,0|1,0,0]=3 3202 B13R2.35 OC(=O)C1CNCC12CCCC2 Amb23597878 [0,0,0,2,0,0|1,0,0]=3 3203 B13R2.35 OC(=O)C1CNCC12COCC2 Amb25353876 [0,0,0,2,0,0|2,0,0]=4 3204 B13R2.35 OC(=O)C1NCCC12CCCC2 Amb24061109 [0,0,0,2,0,0|1,0,0]=3 3205 B13R2.35 OC(=O)C1NCOC12CCCC2 Amb25159507 [0,0,0,2,0,0|2,0,0]=4 3206 B13R2.425 OC(=O)CC1CC1C2CCCC2 Amb25196111 [0,0,0,2,0,0|0,0,0]=2 3207 B13R2.426 CC(=O)NC1CCC12CCCC2 Amb24473918 [0,0,0,2,0,0|2,0,0]=4 3208 B13R2.427 CC(=O)CCC1CC12COCC2 Amb24708161 [0,0,0,2,0,0|2,0,0]=4 3209 B13R2.432 OC(=O)C1CCC1N2CCCC2 Amb25102154 [0,0,0,2,0,0|1,0,0]=3 3210 B13R2.432 OC(=O)C1CCN1C2CCCC2 Amb10071666 [0,0,0,2,0,0|1,0,0]=3 3211 B13R2.3633 CC1(O)CCCCC12CCCC2 Amb24410796 [0,0,0,2,0,0|1,0,1]=4 3212 B13R2.5569 OC(=O)C1=CCCC2CCCC12 Amb18646554 [0,0,0,2,0,0|0,0,2]=4 3213 B13R2.5569 OC(=O)C1CCC=C2CCCC21 Amb18646588 [0,0,0,2,0,0|0,0,2]=4 3214 B13R2.5569 OC(=O)C1CCCC2CCCN21 Amb25232742 [0,0,0,2,0,0|1,0,0]=3 3215 B13R2.5569 OC(=O)C1CCCC2CNCC21 Amb19374763 [0,0,0,2,0,0|1,0,0]=3 3216 B13R2.5569 OC(=O)C1CCCC2OCCC12 Amb23560311 [0,0,0,2,0,0|1,0,0]=3 3217 B13R2.5569 OC(=O)C1CCCN2CCCC21 Amb24740902 [0,0,0,2,0,0|1,0,0]=3 3218 B13R2.5569 OC(=O)C1CCCN2CCC[C@@H]21 Amb18826019 [0,0,0,2,0,0|1,0,0]=3 3219 B13R2.5569 OC(=O)C1CCNC2CCCC12 Amb23590775 [0,0,0,2,0,0|1,0,0]=3 3220 B13R2.5569 OC(=O)C1CCNC2COCC12 Amb23590777 [0,0,0,2,0,0|2,0,0]=4 3221 B13R2.5569 OC(=O)C1NCCN2CCCC21 Amb25212241 [0,0,0,2,0,0|2,0,0]=4 3222 B13R2.5569 OC(=O)C=1CCCC2CCCC12 Amb25774511 [0,0,0,2,0,0|0,0,2]=4 3223 B13R2.5569 OC(=O)[C@@H]1CC=C[C@@H]2CCC[C@@H]12 Amb24602432 [0,0,0,2,0,0|0,0,2]=4 3224 B13R2.5569 OC(=O)[C@@H]1CCCN2CCC[C@H]21 Amb25179314 [0,0,0,2,0,0|1,0,0]=3 3225 B13R2.11149 O=C1CC2(CCCC1)CCCC2 Amb25044272 [0,0,0,2,0,0|1,0,0]=3 3226 B13R2.11149 O=C1CC2(CCCO2)CCCC1 Amb25723230 [0,0,0,2,0,0|2,0,0]=4 3227 B13R2.11149 O=C1CCCCC2(CCCC2)N1 Amb24625849 [0,0,0,2,0,0|1,0,0]=3 3228 B13R2.11149 O=C1C[C@]2(CCCO2)CCCC1 Amb24633621 [0,0,0,2,0,0|2,0,0]=4 3229 B13R2.5584 OC(=O)C1CNCCC12COC2 Amb25761210 [0,0,0,2,0,0|2,0,0]=4 3230 B13R2.5602 NC(=O)N1CCCC1C2CCC2 Amb25762617 [0,0,0,2,0,0|2,0,0]=4 3231 B13R2.5602 OC(=O)C1CCCC1C2CCC2 Amb25088475 [0,0,0,2,0,0|0,0,0]=2 3232 B13R2.5602 OC(=O)C1CCOC1C2CCC2 Amb24532621 [0,0,0,2,0,0|1,0,0]=3 3233 B13R2.13743 OC(=O)C1CCC1NC2CCC2 Amb24700648 [0,0,0,2,0,0|1,0,0]=3 3234 B13R2.13743 OC(=O)C1CCC1NC2COC2 Amb25704522 [0,0,0,2,0,0|2,0,0]=4 3235 B13R2.2931 NCC1OC(=O)N2CCCCC21 Amb24553304 [0,0,0,2,0,0|2,0,0]=4 3236 B13R2.5509 CC(=O)C1C[C@H]2CCC[C@@H]1CC2 Amb24737541 [0,0,0,2,0,0|1,0,0]=3 3237 B13R2.5509 CC(=O)[C@@H]1C[C@@H]2CCC[C@@H]1CC2 Amb25318870 [0,0,0,2,0,0|1,0,0]=3 3238 B13R2.5509 OC(=O)C1CC2CCCC1C=C2 Amb24356090 [0,0,0,2,0,0|0,0,2]=4 3239 B13R2.5509 OC(=O)C1CC2CCCC1CC2 Amb24739745 [0,0,0,2,0,0|0,0,0]=2 3240 B13R2.5509 OC(=O)C1C[C@H]2CCC[C@@H]1CC2 Amb24692755 [0,0,0,2,0,0|0,0,0]=2 3241 B13R2.5509 OC(=O)[C@@H]1C[C@@H]2CCC[C@@H]1CC2 Amb24612095 [0,0,0,2,0,0|0,0,0]=2 3242 B13R2.5509 OC(=O)[C@H]1C[C@H]2CCC[C@H]1C=C2 Amb24565695 [0,0,0,2,0,0|0,0,2]=4 3243 B13R2.5514 NC(=O)C1CCCNC1C2CC2 Amb25214065 [0,0,0,2,0,0|2,0,0]=4 3244 B13R2.5514 NC(=O)C1CNCCC1C2CC2 Amb25218014 [0,0,0,2,0,0|2,0,0]=4 3245 B13R2.5514 OC(=O)C1CCNCC1C2CC2 Amb25247445 [0,0,0,2,0,0|1,0,0]=3 3246 B13R2.5514 OC(=O)C1COCCN1C2CC2 Amb24430143 [0,0,0,2,0,0|2,0,0]=4 3247 B13R2.5514 OC(=O)C1NCCCC1C2CC2 Amb25683479 [0,0,0,2,0,0|1,0,0]=3 3248 B13R2.5514 OC(=O)[C@@H]1CCCN[C@H]1C2CC2 Amb18826010 [0,0,0,2,0,0|1,0,0]=3 3249 B13R2.13663 CC(=O)[C@@]12CCCC[C@@H]1CCC2 Amb24553633 [0,0,0,2,0,0|1,0,0]=3 3250 B13R2.13663 CC(O)C12CCCC1CCCC2 Amb25099406 [0,0,0,2,0,0|1,0,1]=4 3251 B13R2.13663 NC(=O)C12CCCC1NCCC2 Amb25325128 [0,0,0,2,0,0|2,0,0]=4 3252 B13R2.13663 NC(=O)C12CCNC1CCCC2 Amb24519038 [0,0,0,2,0,0|2,0,0]=4 3253 B13R2.13663 NC(=O)[C@]12CNC[C@@H]1CCCC2 Amb24619450 [0,0,0,2,0,0|2,0,0]=4 3254 B13R2.13663 OC(=O)C12CC=CCC1CCC2 Amb25363713 [0,0,0,2,0,0|0,0,2]=4 3255 B13R2.13663 OC(=O)C12CCCCC1CCC2 Amb18646993 [0,0,0,2,0,0|0,0,0]=2 3256 B13R2.13663 OC(=O)C12CCNC1CCCC2 Amb24519037 [0,0,0,2,0,0|1,0,0]=3 3257 B13R2.13663 OC(=O)C12CCNCC1NCC2 Amb25127271 [0,0,0,2,0,0|2,0,0]=4 3258 B13R2.13663 OC(=O)C12CNCCC1CCC2 Amb24569484 [0,0,0,2,0,0|1,0,0]=3 3259 B13R2.13663 OC(=O)C12CNCCC1NCC2 Amb25850533 [0,0,0,2,0,0|2,0,0]=4 3260 B13R2.13663 OC(=O)[C@]12CCCC[C@H]1CCC2 Amb24588675 [0,0,0,2,0,0|0,0,0]=2 3261 B13R2.13663 OC(=O)[C@]12CNC[C@H]1CCOC2 Amb24700240 [0,0,0,2,0,0|2,0,0]=4 3262 B13R2.13779 CC(=O)N1C2CCCC1CCC2 Amb25822770 [0,0,0,2,0,0|2,0,0]=4 3263 B13R2.13779 NC(=O)C1C2CCCC1CCC2 Amb24602423 [0,0,0,2,0,0|1,0,0]=3 3264 B13R2.13779 NC(=O)N1C2CCCC1CCC2 Amb25073264 [0,0,0,2,0,0|2,0,0]=4 3265 B13R2.13779 O=C(Cl)C1C2CCCC1CCC2 Amb25342732 [0,0,0,2,0,0|1,0,0]=3 3266 B13R2.13779 OC(=O)C1C2CCCC1CCN2 Amb25845321 [0,0,0,2,0,0|1,0,0]=3 3267 B13R2.13779 OC(=O)C1C2CCCC1CNC2 Amb13953128 [0,0,0,2,0,0|1,0,0]=3 3268 B13R2.13779 OC(=O)C1C2CNCC1CCC2 Amb25114066 [0,0,0,2,0,0|1,0,0]=3 3269 B13R2.13779 OC(=O)C1C2CNCC1COC2 Amb20623290 [0,0,0,2,0,0|2,0,0]=4 3270 B13R2.13779 OC(=O)C1[C@@H]2CNC[C@H]1CCC2 Amb24540748 [0,0,0,2,0,0|1,0,0]=3 3271 B13R2.13779 OC(=O)[C@@H]1[C@@H]2CNC[C@H]1CCC2 Amb19374738 [0,0,0,2,0,0|1,0,0]=3 3272 B13R2.13779 OC(=O)[C@@H]1[C@H]2CNC[C@@H]1CCC2 Amb19374736 [0,0,0,2,0,0|1,0,0]=3 3273 B13R2.249 CCCN1C2CCC1CC(=O)C2 Amb10610694 [0,0,0,2,0,0|2,0,0]=4 3274 B13R2.249 O=C1CC2CCC(O1)C2CC=O Amb24584417 [0,0,0,2,0,0|1,0,1]=4 3275 B13R2.249 O=C1C[C@H]2CCC(O1)C2CC=O Amb25835749 [0,0,0,2,0,0|1,0,1]=4 3276 B13R2.623 CCC1NC(=O)OC2CCCC21 Amb24548883 [0,0,0,2,0,0|2,0,0]=4 3277 B13R2.2925 OCC1C(C2CNCC21)C(O)=O Amb24525617 [0,0,0,2,0,0|2,0,0]=4 3278 B13R2.4501 CCCN1CC2CC1C2C(O)=O Amb25213707 [0,0,0,2,0,0|1,0,0]=3 3279 B13R2.5604 NC(=O)CN1CCCC1C2CC2 Amb24496147 [0,0,0,2,0,0|2,0,0]=4 3280 B13R2.5604 OC(=O)CC1CCCN1C2CC2 Amb18826032 [0,0,0,2,0,0|1,0,0]=3 3281 B13R2.14125 NC(=O)C[C@]12CCC[C@H]1CCC2 Amb25700368 [0,0,0,2,0,0|1,0,0]=3 3282 B13R2.14125 OC(=O)CC12CCCC1CCC2 Amb25102487 [0,0,0,2,0,0|0,0,0]=2 3283 B13R2.14125 OC(=O)CC12CCCN1CCC2 Amb18647190 [0,0,0,2,0,0|1,0,0]=3 3284 B13R2.14125 OC(=O)C[C@]12CCC[C@H]1CCC2 Amb24688806 [0,0,0,2,0,0|0,0,0]=2 3285 B13R2.10288 O=C1CCCCC(CC2CO2)N1 Amb24638014 [0,0,0,2,0,0|2,0,0]=4 3286 B13R2.654 CC[C@H]1CN2CCC[C@@H]2C(=O)N1 Amb24068481 [0,0,0,2,0,0|2,0,0]=4 3287 B13R2.654 OCC1CC2CCCN2C(=O)O1 Amb24748311 [0,0,0,2,0,0|2,0,0]=4 3288 B13R2.654 OC[C@@H]1C[C@@H]2CCC[C@@H]2C(=O)N1 Amb24597717 [0,0,0,2,0,0|2,0,0]=4 3289 B13R2.5574 CC(=O)C1CCCC1CC2CO2 Amb25723259 [0,0,0,2,0,0|2,0,0]=4 3290 B13R2.5574 CC(=O)C1CCC[C@H]1CC2CO2 Amb25373192 [0,0,0,2,0,0|2,0,0]=4 3291 B13R2.5574 NC(=O)C1CCCN1CC2CC2 Amb25258908 [0,0,0,2,0,0|2,0,0]=4 3292 B13R2.5574 OC(=O)C1CCCC1CC2CC2 Amb25212499 [0,0,0,2,0,0|0,0,0]=2 3293 B13R2.5574 OC(=O)C1CCCN1CC2CC2 Amb10603099 [0,0,0,2,0,0|1,0,0]=3 3294 B13R2.5574 OC(=O)C1CCCN1CC2CC2 Amb2382745 [0,0,0,2,0,0|1,0,0]=3 3295 B13R2.5574 OC(=O)[C@H]1CCCN1CC2CC2 Amb24350247 [0,0,0,2,0,0|1,0,0]=3 3296 B13R2.13649 CC(=O)C1C2CCC1CCCC2 Amb24422549 [0,0,0,2,0,0|1,0,0]=3 3297 B13R2.13649 NC(=O)N1C2CCC1CCCC2 Amb24665828 [0,0,0,2,0,0|2,0,0]=4 3298 B13R2.13776 CC(=O)C1[C@H]2CCCCCC[C@H]21 Amb25735156 [0,0,0,2,0,0|1,0,0]=3 3299 B13R2.13776 OC(=O)C1C2C1CCCCCC2 Amb10071664 [0,0,0,2,0,0|0,0,0]=2 3300 B13R2.13776 OC(=O)C1[C@@H]2C=CCCCC[C@H]12 Amb24519264 [0,0,0,2,0,0|0,0,2]=4 3301 B13R2.13776 OC(=O)C1[C@H]2CCCCCC[C@H]21 Amb25783941 [0,0,0,2,0,0|0,0,0]=2 3302 B13R2.13776 OC(=O)[C@@H]1[C@@H]2CCC=CCC[C@@H]21 Amb25056073 [0,0,0,2,0,0|0,0,2]=4 3303 B13R2.13776 OC(=O)[C@@H]1[C@H]2CCCCCC[C@H]21 Amb25088396 [0,0,0,2,0,0|0,0,0]=2 3304 B13R2.13687 CC(=O)C1CC12CCCNCC2 Amb25212969 [0,0,0,2,0,0|2,0,0]=4 3305 B13R2.13687 CC(=O)C1CC12CCCOCC2 Amb24653004 [0,0,0,2,0,0|2,0,0]=4 3306 B13R2.13687 OC(=O)C1CC12CCCCCC2 Amb18947399 [0,0,0,2,0,0|0,0,0]=2 3307 B13R2.13815 CC(=O)NC1C2CCCCCC21 Amb24419830 [0,0,0,2,0,0|2,0,0]=4