0 B12R0.234 C=CCCCCCCCCC(=O)[O-] Amb10843808 [0,0,0,0,0,0|0,0,3]=3 1 B12R0.234 C=CCCCCCCCCC(O)=O Amb22353389 [0,0,0,0,0,0|0,0,2]=2 2 B12R0.234 C=CCCCCCCCCC(O)=O Amb22731323 [0,0,0,0,0,0|0,0,2]=2 3 B12R0.234 CC(=O)NCCCCNCCCN Amb22731369 [0,0,0,0,0,0|4,0,0]=4 4 B12R0.234 CC(=O)NCCCNCCCCN Amb22641893 [0,0,0,0,0,0|4,0,0]=4 5 B12R0.234 CC(=O)OCCCCCCCC=C Amb22733550 [0,0,0,0,0,0|2,0,2]=4 6 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [0,0,0,0,0,0|3,0,0]=3 7 B12R0.234 CC(C)CCCCCCCCCO Amb22055860 [0,0,0,0,0,0|3,0,1]=4 8 B12R0.234 CCCCCCCC/C=C/C(O)=O Amb17942922 [0,0,0,0,0,0|0,0,2]=2 9 B12R0.234 CCCCCCCCCCB(O)O Amb19958787 [0,0,0,0,0,0|1,0,1]=2 10 B12R0.234 CCCCCCCCCCC(C)Br Amb22338800 [0,0,0,0,0,0|2,0,1]=3 11 B12R0.234 CCCCCCCCCCC(C)C Amb22228876 [0,0,0,0,0,0|2,0,1]=3 12 B12R0.234 CCCCCCCCCC[SiH](C)C Amb19893766 [0,0,0,0,0,0|2,1,0]=3 13 B12R0.234 CCCCCCCCCOC(=O)Cl Amb22732385 [0,0,0,0,0,0|2,0,0]=2 14 B12R0.234 CCCCCCCCCOC([S-])=S Amb19748280 [0,0,0,0,0,0|1,2,0]=3 15 B12R0.234 CCCCCCC\C=C\CC(C)=O Amb21963229 [0,0,0,0,0,0|1,0,2]=3 16 B12R0.234 CCCCCC\C=C\COC(C)=O Amb22231667 [0,0,0,0,0,0|2,0,2]=4 17 B12R0.234 CC\C=C/CCCCCOC(C)=O Amb22734451 [0,0,0,0,0,0|2,0,2]=4 18 B12R0.234 CNCCOCCOCCC(O)=O Amb24057901 [0,0,0,0,0,0|3,0,0]=3 19 B12R0.234 COCCCOCCCOC(C)=O Amb22347959 [0,0,0,0,0,0|4,0,0]=4 20 B12R0.234 COCCOCCOCCC(=O)O Amb16184341 [0,0,0,0,0,0|3,0,0]=3 21 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [0,0,0,0,0,0|1,0,0]=1 22 B12R0.234 NCCOCCOCCCC(=O)O Amb16184328 [0,0,0,0,0,0|3,0,0]=3 23 B12R0.234 NCCOCCSCCCC(=O)O Amb17502011 [0,0,0,0,0,0|3,0,0]=3 24 B12R0.234 OCCOCCOCCC[Si](O)=O Amb22351667 [0,0,0,0,0,0|3,1,0]=4 25 B11R0.3 C=CCCCCCCCCC=C Amb19944679 [1,0,0,0,0,0|1,0,2]=4 26 B11R0.3 C=CCCCCCCCC[Mg]Br Amb22897280 [1,0,0,0,0,0|3,0,0]=4 27 B11R0.3 C=CCCCCCCCC[Zn]Br Amb22898142 [1,0,0,0,0,0|3,0,0]=4 28 B11R0.3 CCCCCCCCCCCF Amb17939015 [1,0,0,0,0,0|1,0,1]=3 29 B11R0.3 CCCCCCCCCCCS Amb22366963 [1,0,0,0,0,0|0,1,1]=3 30 B11R0.3 CCCCCCCCCCOC Amb21520322 [1,0,0,0,0,0|2,0,0]=3 31 B11R0.3 CCCCCCCCCC[13CH]=[13CH2] Amb22351201 [1,0,0,0,0,0|1,0,0]=2 32 B11R0.3 CCCCCCCCCC[Hg]Cl Amb22359876 [1,0,0,0,0,0|2,0,0]=3 33 B11R0.3 CCCCCCCCCC[Mg]Br Amb22363113 [1,0,0,0,0,0|2,0,0]=3 34 B11R0.3 CCCCCCCCCC[Mg]Cl Amb22737569 [1,0,0,0,0,0|2,0,0]=3 35 B11R0.3 CCCCCCCCCN=C=O Amb22336763 [1,0,0,0,0,0|1,0,1]=3 36 B11R0.3 CCCCCCCCCSCC Amb22359735 [1,0,0,0,0,0|2,0,1]=4 37 B11R0.3 CCCCCCCCNCCN Amb18794624 [1,0,0,0,0,0|2,0,1]=4 38 B11R0.3 CCCCCCCCNCCN Amb22358941 [1,0,0,0,0,0|2,0,1]=4 39 B11R0.3 CCCCCCCCOCC=O Amb18807440 [1,0,0,0,0,0|1,0,0]=2 40 B11R0.3 CCCCCCCCSCC#N Amb10669578 [1,0,0,0,0,0|2,0,1]=4 41 B11R0.3 CCCCCCCCSCCO Amb1032988 [1,0,0,0,0,0|1,0,1]=3 42 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [1,0,0,0,0,0|0,0,2]=3 43 B11R0.3 CCCCCCCC\C=C\CO Amb22052644 [1,0,0,0,0,0|0,0,3]=4 44 B11R0.3 CCCCCCCNCCCN Amb18794637 [1,0,0,0,0,0|2,0,1]=4 45 B11R0.3 CCCCCNCCCCOC Amb18808137 [1,0,0,0,0,0|3,0,0]=4 46 B11R0.3 CCCCCOCCOCCO Amb22366805 [1,0,0,0,0,0|2,0,1]=4 47 B11R0.3 CC\C=C/CCCCCCC=O Amb10807471 [1,0,0,0,0,0|0,0,2]=3 48 B11R0.3 CNCCCCCCCCNC Amb22336315 [1,0,0,0,0,0|3,0,0]=4 49 B11R0.3 CNCCNCCCCCCC Amb20140578 [1,0,0,0,0,0|3,0,0]=4 50 B11R0.3 COCCCCCCCCOC Amb21618846 [1,0,0,0,0,0|3,0,0]=4 51 B11R0.3 C\C=C\CCCCCCCCO Amb22641580 [1,0,0,0,0,0|0,0,3]=4 52 B11R0.3 ICCCCCCCCCCI Amb10071532 [1,0,0,0,0,0|2,0,1]=4 53 B11R0.3 NCCCCCCCCCCBr Amb17609917 [1,0,0,0,0,0|2,0,1]=4 54 B11R0.3 NCCCCCCCCCCN Amb22732919 [1,0,0,0,0,0|2,0,1]=4 55 B11R0.3 NCCCCCCCCCCO Amb17607975 [1,0,0,0,0,0|1,0,1]=3 56 B11R0.3 O=CCCCCCCCCCBr Amb21963218 [1,0,0,0,0,0|1,0,0]=2 57 B11R0.3 OCCCCCCCCC#CC Amb10605931 [1,0,0,0,0,0|0,0,3]=4 58 B11R0.3 OCCCCCCCCCCCl Amb10844747 [1,0,0,0,0,0|1,0,1]=3 59 B11R0.148 C#CCCCCCCCC(O)=O Amb22388895 [1,0,0,0,0,0|0,0,2]=3 60 B11R0.148 CCCC=CCCCCC(O)=O Amb24063196 [1,0,0,0,0,0|0,0,2]=3 61 B11R0.148 CCCCC=CCCCC(O)=O Amb24062906 [1,0,0,0,0,0|0,0,2]=3 62 B11R0.148 CCCCCC=CCCC(O)=O Amb24079160 [1,0,0,0,0,0|0,0,2]=3 63 B11R0.148 CCCCCCCCC=C(C)C Amb22899462 [1,0,0,0,0,0|2,0,1]=4 64 B11R0.148 CCCCCCCCCC(C)C Amb22043228 [1,0,0,0,0,0|2,0,1]=4 65 B11R0.148 CCCCCCCCCC([O-])=O Amb22733551 [1,0,0,0,0,0|0,0,1]=2 66 B11R0.148 CCCCCCCCCN(C)C Amb22360719 [1,0,0,0,0,0|3,0,0]=4 67 B11R0.148 CCCCCCCCC[13C](O)=O Amb22353426 [1,0,0,0,0,0|0,0,0]=1 68 B11R0.148 CCCCCCCCC[C@H](C)O Amb20240616 [1,0,0,0,0,0|1,0,1]=3 69 B11R0.148 CCCCCCCCNC(=O)C Amb10562300 [1,0,0,0,0,0|2,0,0]=3 70 B11R0.148 CCCCCCCCNC(=S)N Amb1152183 [1,0,0,0,0,0|2,1,0]=4 71 B11R0.148 CCCCCCCCNC(N)=N Amb22338463 [1,0,0,0,0,0|3,0,0]=4 72 B11R0.148 CCCCCCCCOC([S-])=S Amb22334140 [1,0,0,0,0,0|1,2,0]=4 73 B11R0.148 CCCCCCCC[13CH2][13C](O)=O Amb22054843 [1,0,0,0,0,0|0,0,0]=1 74 B11R0.148 CCCCCCCNCC(O)=O Amb19373457 [1,0,0,0,0,0|1,0,0]=2 75 B11R0.148 CCCCCC\C=C\CC(=O)O Amb10807476 [1,0,0,0,0,0|0,0,2]=3 76 B11R0.148 CCCCC\C=C\CCC(=O)O Amb17594266 [1,0,0,0,0,0|0,0,2]=3 77 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [1,0,0,0,0,0|1,0,0]=2 78 B11R0.148 CCC\C=C\CCCCC(O)=O Amb22411539 [1,0,0,0,0,0|0,0,2]=3 79 B11R0.148 CCNCCOCCCC(O)=O Amb18110845 [1,0,0,0,0,0|2,0,0]=3 80 B11R0.148 N#CCCCSCCCC(=O)O Amb17504253 [1,0,0,0,0,0|2,0,1]=4 81 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [1,0,0,0,0,0|2,0,0]=3 82 B11R0.148 NCCOCCOCCC(O)=O Amb18111401 [1,0,0,0,0,0|3,0,0]=4 83 B11R0.148 OC(=O)CCCCCCCC=O Amb17939414 [1,0,0,0,0,0|1,0,1]=3 84 B11R0.148 OC(=O)CCOCCOCCBr Amb24057758 [1,0,0,0,0,0|3,0,0]=4 85 B11R0.148 OC(=O)CCOCCOCCS Amb24058079 [1,0,0,0,0,0|3,0,0]=4 86 B11R0.148 OCCOCCOCCC(O)=O Amb24057823 [1,0,0,0,0,0|3,0,0]=4 87 B11R0.148 [13CH3]CCCCCCCCC(O)=O Amb22367552 [1,0,0,0,0,0|0,0,0]=1 88 B11R0.148 [N-]=[N+]=NCCCCCCC(O)=O Amb22407009 [1,0,0,0,0,0|3,0,0]=4 89 B13R0.1 CCCCCCC(O)C\C=C\C(O)=O Amb22545321 [0,1,0,0,0,0|0,0,2]=3 90 B13R0.1 CCCCCNC(=O)NCCC(=O)O Amb17042891 [0,1,0,0,0,0|2,0,1]=4 91 B13R0.1 COCCCCC(=O)NCCC(O)=O Amb25387598 [0,1,0,0,0,0|2,0,1]=4 92 B13R0.1 CSCCCCC(=O)NCCC(O)=O Amb25387540 [0,1,0,0,0,0|2,0,1]=4 93 B13R0.54 BrCCCCCCCCCCC(=O)N Amb16207966 [0,1,0,0,0,0|1,0,0]=2 94 B13R0.54 C=CCCCCCCCCOC(=O)C Amb10563791 [0,1,0,0,0,0|1,0,2]=4 95 B13R0.54 CC(C)CCCCCCCCCCO Amb22055767 [0,1,0,0,0,0|2,0,1]=4 96 B13R0.54 CC(C)CCCCCCCCCCO Amb22730980 [0,1,0,0,0,0|2,0,1]=4 97 B13R0.54 CCCCCCCCCC=CC(=O)O Amb13952752 [0,1,0,0,0,0|0,0,1]=2 98 B13R0.54 CCCCCCCCCCCC(=C)Br Amb19886460 [0,1,0,0,0,0|2,0,0]=3 99 B13R0.54 CCCCCCCCCCCC(=N)N Amb10568321 [0,1,0,0,0,0|2,0,0]=3 100 B13R0.54 CCCCCCCCCCCC(=S)N Amb13953232 [0,1,0,0,0,0|1,1,0]=3 101 B13R0.54 CCCCCCCCCCCC(C)=C Amb19886457 [0,1,0,0,0,0|2,0,0]=3 102 B13R0.54 CCCCCCCCCCCC(C)Br Amb22734063 [0,1,0,0,0,0|2,0,1]=4 103 B13R0.54 CCCCCCCCCCCC(C)N Amb21953727 [0,1,0,0,0,0|2,0,1]=4 104 B13R0.54 CCCCCCCCCCCC(O)=O Amb22348404 [0,1,0,0,0,0|0,0,0]=1 105 B13R0.54 CCCCCCCCCCCC(O)=O Amb22730643 [0,1,0,0,0,0|0,0,0]=1 106 B13R0.54 CCCCCCCCCCCC([O-])=O Amb17942849 [0,1,0,0,0,0|0,0,1]=2 107 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22729066 [0,1,0,0,0,0|0,0,1]=2 108 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730602 [0,1,0,0,0,0|0,0,1]=2 109 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730786 [0,1,0,0,0,0|0,0,1]=2 110 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731774 [0,1,0,0,0,0|0,0,1]=2 111 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731775 [0,1,0,0,0,0|0,0,1]=2 112 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22733752 [0,1,0,0,0,0|0,0,1]=2 113 B13R0.54 CCCCCCCCCCC[13C](O)=O Amb21928681 [0,1,0,0,0,0|0,0,0]=1 114 B13R0.54 CCCCCCCCCCC[14C](O)=O Amb22349630 [0,1,0,0,0,0|0,0,0]=1 115 B13R0.54 CCCCCCCCCCNC(=O)N Amb2228230 [0,1,0,0,0,0|1,0,0]=2 116 B13R0.54 CCCCCCCCCCOC(=O)Cl Amb22337976 [0,1,0,0,0,0|1,0,0]=2 117 B13R0.54 CCCCCCCCCCOC([S-])=S Amb22334119 [0,1,0,0,0,0|0,2,0]=3 118 B13R0.54 CCCCCCCCCCOP(O)O Amb22049477 [0,1,0,0,0,0|1,0,1]=3 119 B13R0.54 CCCCCCCCCC[13CH2]C(O)=O Amb22353612 [0,1,0,0,0,0|0,0,0]=1 120 B13R0.54 CCCCCCCCCC[13CH2][13C](O)=O Amb22353611 [0,1,0,0,0,0|0,0,0]=1 121 B13R0.54 CCCCCCCCSCCC(=O)N Amb10669601 [0,1,0,0,0,0|1,0,0]=2 122 B13R0.54 CCCCCCCCSCCC(=O)O Amb1038994 [0,1,0,0,0,0|0,0,0]=1 123 B13R0.54 CCCCCCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22353609 [0,1,0,0,0,0|0,0,0]=1 124 B13R0.54 CCCCCCC\C=C\COC(C)=O Amb22730835 [0,1,0,0,0,0|1,0,2]=4 125 B13R0.54 CCCCCC\C=C/CCCC(O)=O Amb20672025 [0,1,0,0,0,0|0,0,1]=2 126 B13R0.54 CCCCSCCCCCCC(=O)O Amb1036584 [0,1,0,0,0,0|0,0,0]=1 127 B13R0.54 CCCC\C=C\CCCCOC(C)=O Amb22731600 [0,1,0,0,0,0|1,0,2]=4 128 B13R0.54 CC\C=C/CCCCCCOC(=O)C Amb10563792 [0,1,0,0,0,0|1,0,2]=4 129 B13R0.54 CC\C=C\CCCCCCOC(C)=O Amb22729861 [0,1,0,0,0,0|1,0,2]=4 130 B13R0.54 CN(C)CCCCCCCCCCN Amb24117501 [0,1,0,0,0,0|3,0,0]=4 131 B13R0.54 N#CCCCCCCCCCC(O)=O Amb22547629 [0,1,0,0,0,0|0,0,1]=2 132 B13R0.54 NC(=[NH2+])SCCCCCCCCCO Amb22054616 [0,1,0,0,0,0|3,0,0]=4 133 B13R0.54 NCCCCCCCCCCC(=O)Cl Amb17143769 [0,1,0,0,0,0|1,0,0]=2 134 B13R0.54 NCCCCCCCCCCC([O-])=O Amb22353821 [0,1,0,0,0,0|0,0,1]=2 135 B13R0.54 OCCCCCCCCCCC(=O)O Amb1814707 [0,1,0,0,0,0|0,0,0]=1 136 B13R0.54 [13CH3]CCCCCCCCCCC(O)=O Amb22353502 [0,1,0,0,0,0|0,0,0]=1 137 B13R0.54 [13CH3]CCCCCCCCCC[13C](O)=O Amb22353610 [0,1,0,0,0,0|0,0,0]=1 138 B13R0.88 COCC(=O)NCCCCCC(=O)O Amb1131616 [0,1,0,0,0,0|2,0,1]=4 139 B13R0.147 C#CCCCCCCCCC(=O)NO Amb1625635 [0,1,0,0,0,0|0,0,2]=3 140 B13R0.147 CC#CCCCCCCCC(=O)OC Amb22641576 [0,1,0,0,0,0|0,0,2]=3 141 B13R0.147 CCCCCCCCC#CC(=O)OC Amb22228923 [0,1,0,0,0,0|0,0,2]=3 142 B13R0.147 CCCCCCCCCCC(=O)C=O Amb24084923 [0,1,0,0,0,0|0,0,1]=2 143 B13R0.147 CCCCCCCCCCC(C)[Mg]Br Amb22897298 [0,1,0,0,0,0|2,0,1]=4 144 B13R0.147 CCCCCCCCCCC(O)CC Amb22229414 [0,1,0,0,0,0|1,0,1]=3 145 B13R0.147 CCCCCCCCCCC(O)CO Amb22002456 [0,1,0,0,0,0|0,0,2]=3 146 B13R0.147 CCCCCCCCCNC(=O)CCl Amb17797886 [0,1,0,0,0,0|2,0,0]=3 147 B13R0.147 CCCCCCCCCOC(=O)C=C Amb20670989 [0,1,0,0,0,0|2,0,0]=3 148 B13R0.147 CCCCCCCCCOC(=O)CS Amb22369347 [0,1,0,0,0,0|1,1,0]=3 149 B13R0.147 CCCCCCCNCCC(=O)NN Amb20171959 [0,1,0,0,0,0|2,0,0]=3 150 B13R0.147 CCCCCCCNCC\C(\N)=N/O Amb19981286 [0,1,0,0,0,0|2,0,0]=3 151 B13R0.147 CCCCCCC\C=C\CC(=O)CC Amb21963232 [0,1,0,0,0,0|1,0,2]=4 152 B13R0.147 CCCCCCOCCOC(=O)C=C Amb17934068 [0,1,0,0,0,0|3,0,0]=4 153 B13R0.147 CNC(=O)CCNCCCCCCC Amb18333360 [0,1,0,0,0,0|2,0,0]=3 154 B13R0.147 C\C=C\CCCCCCCC(=O)OC Amb22641574 [0,1,0,0,0,0|0,0,2]=3 155 B13R0.147 NCCCCCCCCNC(=O)CBr Amb19981082 [0,1,0,0,0,0|3,0,0]=4 156 B13R0.147 NCCOCCSCCCC(=O)OC Amb17502012 [0,1,0,0,0,0|3,0,0]=4 157 B13R0.147 OCCCCCCCCCC(=O)OC Amb13887310 [0,1,0,0,0,0|1,0,0]=2 158 B13R0.150 CC(CCCCCCCCO)C(O)=O Amb20246737 [0,1,0,0,0,0|1,0,0]=2 159 B13R0.150 CCCCCCCCCC(C)C(O)=O Amb18320092 [0,1,0,0,0,0|0,0,0]=1 160 B13R0.150 CCCCCCCCCC(O)C(O)=O Amb22224801 [0,1,0,0,0,0|0,0,0]=1 161 B13R0.154 CCCCCCCC(=O)COC(=O)C Amb10562376 [0,1,0,0,0,0|2,0,1]=4 162 B13R0.154 CCCCCCCC(O)CCC(O)=O Amb22058992 [0,1,0,0,0,0|0,0,0]=1 163 B13R0.154 CCCCCCCC(O)CCC([O-])=O Amb19148937 [0,1,0,0,0,0|0,0,1]=2 164 B13R0.154 CCCCCCNC(=O)CCC(=O)N Amb17143236 [0,1,0,0,0,0|2,0,1]=4 165 B13R0.179 CC(C)CCCCCCCCC(O)=O Amb21928890 [0,1,0,0,0,0|0,0,0]=1 166 B13R0.179 CC(CCCCCCCCC(=O)O)N Amb2229643 [0,1,0,0,0,0|0,0,0]=1 167 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22264826 [0,1,0,0,0,0|1,0,1]=3 168 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22351881 [0,1,0,0,0,0|1,0,1]=3 169 B13R0.179 OC(=O)CCCCCCCCC(O)=O Amb22369048 [0,1,0,0,0,0|1,0,1]=3 170 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22168122 [0,1,0,0,0,0|1,0,2]=4 171 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22730286 [0,1,0,0,0,0|1,0,2]=4 172 B13R0.179 [O-]C(=O)CCCCCCCCC([O-])=O Amb22733850 [0,1,0,0,0,0|1,0,2]=4 173 B13R0.188 CCCCNC(=O)CSCCC(O)=O Amb22269137 [0,1,0,0,0,0|2,0,1]=4 174 B13R0.188 CSCCCC(=O)NCCCC(O)=O Amb18411872 [0,1,0,0,0,0|2,0,1]=4 175 B13R0.202 CCC(C)CCCCCCCC(O)=O Amb21928874 [0,1,0,0,0,0|0,0,0]=1 176 B13R0.202 CCC(CCCCCCCC(=O)O)N Amb2229644 [0,1,0,0,0,0|0,0,0]=1 177 B13R0.202 COC(=O)CCCCCCCC(=O)O Amb2099653 [0,1,0,0,0,0|1,0,1]=3 178 B13R0.202 OC(=O)CCCCCCCC(F)CBr Amb22547613 [0,1,0,0,0,0|1,0,0]=2 179 B13R0.280 CCCCCCCCCCP(=O)(C)C Amb1239581 [0,1,0,0,0,0|2,0,0]=3 180 B13R0.280 CCCCCCCCCCS(O)(=O)=O Amb22348234 [0,1,0,0,0,0|1,0,0]=2 181 B13R0.280 CCCCCCCCCC[N+](C)(C)[O-] Amb22265088 [0,1,0,0,0,0|2,0,1]=4 182 B13R0.280 CCCCCCCCCC[P+](C)(C)[O-] Amb22369691 [0,1,0,0,0,0|2,0,1]=4 183 B13R0.280 CCCCCCCCCC[Si](C)(Cl)Cl Amb19893767 [0,1,0,0,0,0|2,1,0]=4 184 B13R0.280 CCCCCCCCCC[Si](Cl)(Cl)Cl Amb19893769 [0,1,0,0,0,0|2,1,0]=4 185 B13R0.280 CCCCCCCCCOS(C)(=O)=O Amb24664290 [0,1,0,0,0,0|2,0,1]=4 186 B13R0.280 CCCCCCCCCOS([O-])(=O)=O Amb22045176 [0,1,0,0,0,0|2,0,1]=4 187 B13R0.335 CCCCCCCCC(O)CC(O)=O Amb21928763 [0,1,0,0,0,0|0,0,0]=1 188 B13R0.335 CCCCCCCNC(C)CC(N)=O Amb20090477 [0,1,0,0,0,0|2,0,0]=3 189 B13R0.335 CCCCCC\C=C\C(O)CC(O)=O Amb22831935 [0,1,0,0,0,0|0,0,2]=3 190 B13R0.335 CC\C=C/CCCCC(O)CC(O)=O Amb22831936 [0,1,0,0,0,0|0,0,2]=3 191 B13R1.6 CC1CCCC(C1)CCCCCC Amb22229365 [0,0,0,1,0,0|2,0,1]=4 192 B13R1.6 CCCCC#CC1CC(=O)CCC1 Amb25112538 [0,0,0,1,0,0|1,0,2]=4 193 B13R1.6 CC\C=C/CCC1CCCC(=O)O1 Amb22734229 [0,0,0,1,0,0|0,0,2]=3 194 B13R1.27 CCCCCCCC1CCC(=O)O1 Amb1154110 [0,0,0,1,0,0|0,0,0]=1 195 B13R1.27 OCCCC#CCC1CCC(=O)O1 Amb24404728 [0,0,0,1,0,0|1,0,2]=4 196 B13R1.27 OCCCCC#CC1CCC(=O)O1 Amb24613448 [0,0,0,1,0,0|1,0,2]=4 197 B13R1.90 CC(=O)NCC1CCCCC1CBr Amb25815718 [0,0,0,1,0,0|3,0,0]=4 198 B13R1.90 CC(=O)NCC1CCCCC1CCl Amb25092213 [0,0,0,1,0,0|3,0,0]=4 199 B13R1.90 CC(=O)NCC1CCCCC1CN Amb25315794 [0,0,0,1,0,0|3,0,0]=4 200 B13R1.90 CC(=O)NCC1CCCCC1CO Amb24400354 [0,0,0,1,0,0|3,0,0]=4 201 B13R1.90 CCC1CCCCC1NNC(N)=O Amb25060729 [0,0,0,1,0,0|3,0,0]=4 202 B13R1.90 CCC1CCCCC1\C=C\C(C)=O Amb25197461 [0,0,0,1,0,0|1,0,2]=4 203 B13R1.90 CCC1CCCCN1CCC(=O)Cl Amb17143287 [0,0,0,1,0,0|2,0,0]=3 204 B13R1.90 CCC1CCCCN1CCC(O)=O Amb21955365 [0,0,0,1,0,0|1,0,0]=2 205 B13R1.90 COC1CCCCC1CNC(C)=O Amb25092700 [0,0,0,1,0,0|3,0,0]=4 206 B13R1.90 NC(=O)NCC1CCCCC1CO Amb24400446 [0,0,0,1,0,0|3,0,0]=4 207 B13R1.90 OCC1CCCCN1CCC(O)=O Amb19076440 [0,0,0,1,0,0|2,0,0]=3 208 B13R1.103 CCC1CCCC1N\C=C\C(O)=O Amb24601524 [0,0,0,1,0,0|1,0,2]=4 209 B13R1.158 CC1CCCCC1=NOCC(O)=O Amb25707161 [0,0,0,1,0,0|2,0,1]=4 210 B13R1.158 CC1CCCCC1CCNC(N)=O Amb25246447 [0,0,0,1,0,0|2,0,0]=3 211 B13R1.158 CC1CCCCN1C\C=C\C(O)=O Amb18296429 [0,0,0,1,0,0|1,0,2]=4 212 B13R1.158 CC1CSCCN1CCCC(O)=O Amb24768864 [0,0,0,1,0,0|2,0,0]=3 213 B13R1.158 CN1CCCCC1CNCC(O)=O Amb18313080 [0,0,0,1,0,0|2,0,0]=3 214 B13R1.158 NC(=S)CCNC1CCCCC1C Amb17315343 [0,0,0,1,0,0|2,1,0]=4 215 B13R1.158 OC(=O)CCCC1CCCCC1=O Amb17594755 [0,0,0,1,0,0|1,0,1]=3 216 B13R1.167 CC1CCCC1CN\C=C\C(O)=O Amb25303472 [0,0,0,1,0,0|1,0,2]=4 217 B13R1.224 C#CCC1CCCCCC1C(O)=O Amb25369715 [0,0,0,1,0,0|0,0,2]=3 218 B13R1.224 CC(=O)N1CCCCCC1CCO Amb25077814 [0,0,0,1,0,0|3,0,0]=4 219 B13R1.224 CCCC1CCCCCC1C(O)=O Amb24377494 [0,0,0,1,0,0|0,0,0]=1 220 B13R1.224 CCSC1CCCCCC1C(O)=O Amb18303070 [0,0,0,1,0,0|1,0,0]=2 221 B13R1.224 OC(=O)C1CCCCCC1NC=O Amb24442240 [0,0,0,1,0,0|2,0,1]=4 222 B13R1.226 OCCC1CCCCCCC(=O)O1 Amb25284567 [0,0,0,1,0,0|1,0,0]=2 223 B13R1.279 NC1CCCCCCCCCCC1 Amb1116041 [0,0,0,1,0,0|2,0,1]=4 224 B13R1.279 O=C1CCCCCCCCCCC1 Amb1935123 [0,0,0,1,0,0|1,0,0]=2 225 B13R1.279 O=C1CCCCCCCCCCN1 Amb22011853 [0,0,0,1,0,0|1,0,0]=2 226 B13R1.279 O=C1NCCCCCCCCCN1 Amb24616274 [0,0,0,1,0,0|2,0,0]=3 227 B13R1.279 OC1CCCCCCCCCCO1 Amb24495296 [0,0,0,1,0,0|0,0,2]=3 228 B13R1.280 CC(=C)CCC1CCCCCC1Br Amb25274665 [0,0,0,1,0,0|3,0,0]=4 229 B13R1.280 CC(=C)CCC1CCCCCC1Cl Amb24389910 [0,0,0,1,0,0|3,0,0]=4 230 B13R1.280 CC(O)CCC1CCCCCC1O Amb24395895 [0,0,0,1,0,0|2,0,1]=4 231 B13R1.280 CC1CCCCCC1NCC(N)=O Amb24667329 [0,0,0,1,0,0|2,0,0]=3 232 B13R1.280 CC1CCCCCC1NCC(O)=O Amb24466628 [0,0,0,1,0,0|1,0,0]=2 233 B13R1.280 CC1CCCCCC1NC[C@@H](C)O Amb25675053 [0,0,0,1,0,0|2,0,1]=4 234 B13R1.280 CC1CCCCCN1CCC(C)=C Amb24719429 [0,0,0,1,0,0|3,0,0]=4 235 B13R1.280 CC1CCCCCN1CCC(C)=O Amb24385394 [0,0,0,1,0,0|2,0,0]=3 236 B13R1.280 CC1CCCCCN1CCC(C)O Amb25340369 [0,0,0,1,0,0|2,0,1]=4 237 B13R1.280 CC1CCCCCN1CCC(N)=N Amb24460270 [0,0,0,1,0,0|3,0,0]=4 238 B13R1.280 CC1CCCCCN1CCC(N)=O Amb25098032 [0,0,0,1,0,0|2,0,0]=3 239 B13R1.280 CC1CCOCCN1CCC(C)=O Amb25058163 [0,0,0,1,0,0|3,0,0]=4 240 B13R1.280 CC1CCOCCN1CCC(O)=O Amb25356852 [0,0,0,1,0,0|2,0,0]=3 241 B13R1.280 CC1CCSCCN1CCC(C)=O Amb25284021 [0,0,0,1,0,0|3,0,0]=4 242 B13R1.280 CC1CCSCCN1CCC(N)=O Amb25057333 [0,0,0,1,0,0|3,0,0]=4 243 B13R1.280 CC1CCSCCN1CCC(O)=O Amb25204492 [0,0,0,1,0,0|2,0,0]=3 244 B13R1.280 CC=1CCCCCC1CCC(O)=O Amb24391509 [0,0,0,1,0,0|0,0,2]=3 245 B13R1.280 CN1CCCCCC1CCC(O)=O Amb18191306 [0,0,0,1,0,0|1,0,0]=2 246 B13R1.280 CS(=O)CCC1CCCCCC1Br Amb24538787 [0,0,0,1,0,0|3,0,0]=4 247 B13R1.280 CS(=O)CCC1CCCCCC1N Amb24699696 [0,0,0,1,0,0|3,0,0]=4 248 B13R1.280 CS(=O)CCC1CCCCCC1O Amb25243805 [0,0,0,1,0,0|3,0,0]=4 249 B13R1.280 NC(=O)CCC1CCCCCC1=O Amb24680139 [0,0,0,1,0,0|2,0,1]=4 250 B13R1.280 NC(=O)CNC1CCCCCC1O Amb18970437 [0,0,0,1,0,0|3,0,0]=4 251 B13R1.280 OC(=O)CCC1CCCCCC1=O Amb18822898 [0,0,0,1,0,0|1,0,1]=3 252 B13R1.280 OC(=O)CCN1CCCCCC1=O Amb1125181 [0,0,0,1,0,0|2,0,1]=4 253 B13R1.283 CC(=O)N[C@@H]1CCCCCC[C@H]1O Amb24656143 [0,0,0,1,0,0|3,0,0]=4 254 B13R1.283 CC(=O)O[C@@H]1CCCCCC[C@@H]1O Amb25366144 [0,0,0,1,0,0|3,0,0]=4 255 B13R1.283 OC(=O)CC1CCCCCCC1=O Amb25187867 [0,0,0,1,0,0|1,0,1]=3 256 B13R1.337 CC(=O)CCC#CC1CCCCC1 Amb24370155 [0,0,0,1,0,0|1,0,2]=4 257 B13R1.337 NC(=O)CNCCC1CCCCC1 Amb13952496 [0,0,0,1,0,0|2,0,0]=3 258 B13R1.337 OC(=O)CCC=C=C1CCCCC1 Amb25362292 [0,0,0,1,0,0|0,0,3]=4 259 B13R1.337 OC(=O)CCCCC1CCCCC1 Amb22336378 [0,0,0,1,0,0|0,0,0]=1 260 B13R1.337 OC(=O)CCCCC1CCSSS1 Amb22056295 [0,0,0,1,0,0|3,0,0]=4 261 B13R1.337 OC(=O)CCCCN1CCCCC1 Amb19373622 [0,0,0,1,0,0|1,0,0]=2 262 B13R1.337 OC(=O)CCCCN1CCNCC1 Amb17479004 [0,0,0,1,0,0|2,0,0]=3 263 B13R1.337 OC(=O)CCCSC1CCNCC1 Amb17502196 [0,0,0,1,0,0|2,0,0]=3 264 B13R1.337 OC(=O)COCCC1CCCCN1 Amb18628209 [0,0,0,1,0,0|2,0,0]=3 265 B13R1.337 OC(=O)COCCN1CCNCC1 Amb18108890 [0,0,0,1,0,0|3,0,0]=4 266 B13R1.337 OC(=O)\C=C\NCC1CCCCC1 Amb25038835 [0,0,0,1,0,0|1,0,2]=4 267 B13R1.343 CC(=O)NCCCCN1CCCC1 Amb13848931 [0,0,0,1,0,0|3,0,0]=4 268 B13R1.343 NC(=O)CNCCCN1CCCC1 Amb19075351 [0,0,0,1,0,0|3,0,0]=4 269 B13R1.343 OC(=O)CCCCCC1CCSS1 Amb17614989 [0,0,0,1,0,0|2,0,0]=3 270 B13R1.343 OC(=O)CCCCCC1OCCO1 Amb25124123 [0,0,0,1,0,0|2,0,0]=3 271 B13R1.343 OC(=O)CNCCCN1CCCC1 Amb19058449 [0,0,0,1,0,0|2,0,0]=3 272 B13R1.380 C#CCN1CCCCC1CC(O)=O Amb18971239 [0,0,0,1,0,0|1,0,2]=4 273 B13R1.380 CC(=O)N[C@@H]1CCCC[C@H]1CCO Amb25287161 [0,0,0,1,0,0|3,0,0]=4 274 B13R1.380 CCCC1CCCCC1CC(O)=O Amb22339365 [0,0,0,1,0,0|0,0,0]=1 275 B13R1.380 CCCN1CCCCC1CC(O)=O Amb18304879 [0,0,0,1,0,0|1,0,0]=2 276 B13R1.380 CCNC1CCCCC1NC(C)=O Amb21862534 [0,0,0,1,0,0|3,0,0]=4 277 B13R1.380 CCOC1CCCCC1CC(O)=O Amb18191219 [0,0,0,1,0,0|1,0,0]=2 278 B13R1.380 CCOC1CCCCC1NC(C)=O Amb25366087 [0,0,0,1,0,0|3,0,0]=4 279 B13R1.380 COCC1CCCCN1CC(O)=O Amb21865524 [0,0,0,1,0,0|2,0,0]=3 280 B13R1.380 N#CCN1CCCCC1CC(O)=O Amb18971243 [0,0,0,1,0,0|2,0,1]=4 281 B13R1.380 OC(=O)CC1CCCCC1NC=O Amb24396622 [0,0,0,1,0,0|2,0,1]=4 282 B13R1.380 OC(=O)C[C@@H]1CCCC[C@@H]1NC=O Amb24601097 [0,0,0,1,0,0|2,0,1]=4 283 B13R1.380 [N-]=[N+]=NC1CCCCC1CC(O)=O Amb24441552 [0,0,0,1,0,0|3,0,0]=4 284 B13R1.392 CSCC1CCCN1CCC(O)=O Amb24769710 [0,0,0,1,0,0|2,0,0]=3 285 B13R1.486 CCCCC1CC(=O)NCCCN1 Amb24632778 [0,0,0,1,0,0|3,0,0]=4 286 B13R1.486 OCCCC1CCCCCC(=O)N1 Amb18191307 [0,0,0,1,0,0|2,0,0]=3 287 B13R1.486 OCCCC1CCCCCC(=O)O1 Amb24569922 [0,0,0,1,0,0|1,0,0]=2 288 B13R1.486 OCCOC1CC(=O)CCCCC1 Amb25226428 [0,0,0,1,0,0|3,0,0]=4 289 B13R1.572 C=CCNC1CCCCC1C(O)=O Amb22585760 [0,0,0,1,0,0|1,0,2]=4 290 B13R1.572 CC#CCC1CCCCC1C(O)=O Amb25838065 [0,0,0,1,0,0|0,0,2]=3 291 B13R1.572 CC#CCN1CCCCC1C(O)=O Amb18297007 [0,0,0,1,0,0|1,0,2]=4 292 B13R1.572 CCCCN1CCCCC1C(=O)O Amb13886354 [0,0,0,1,0,0|1,0,0]=2 293 B13R1.572 CCCCN1CCCCC1C(=O)O Amb2382770 [0,0,0,1,0,0|1,0,0]=2 294 B13R1.572 CCCCN1CCOCC1C(O)=O Amb24271291 [0,0,0,1,0,0|2,0,0]=3 295 B13R1.572 CCNCC1CCCCN1C(C)=O Amb21860340 [0,0,0,1,0,0|3,0,0]=4 296 B13R1.572 N#CCCN1CCCCC1C(O)=O Amb19000908 [0,0,0,1,0,0|2,0,1]=4 297 B13R1.572 N#CCCN1CCCC[C@@H]1C(O)=O Amb24557862 [0,0,0,1,0,0|2,0,1]=4 298 B13R1.572 OC(=O)C1CCCCC1CNC=O Amb24635051 [0,0,0,1,0,0|2,0,1]=4 299 B13R1.578 CC#CCN1CCCC1CC(O)=O Amb18185030 [0,0,0,1,0,0|1,0,2]=4 300 B13R1.578 COCCN1CCCC1CC([O-])=O Amb19514745 [0,0,0,1,0,0|2,0,1]=4 301 B13R1.610 CC(=C)CC1CCCCCC1CN Amb24715363 [0,0,0,1,0,0|3,0,0]=4 302 B13R1.610 CC(=O)CN1CCCCCC1CO Amb24417527 [0,0,0,1,0,0|3,0,0]=4 303 B13R1.610 CC(O)CC1CCCCCN1CC Amb24616222 [0,0,0,1,0,0|2,0,1]=4 304 B13R1.610 CCC1CCCCCC1NC(=O)C Amb2227899 [0,0,0,1,0,0|2,0,0]=3 305 B13R1.610 CCC1CCCCCN1CC(=C)Br Amb24548670 [0,0,0,1,0,0|3,0,0]=4 306 B13R1.610 CCC1CCCCCN1CC(=C)Cl Amb24450900 [0,0,0,1,0,0|3,0,0]=4 307 B13R1.610 CCC1CCCCCN1CC(N)=N Amb24349457 [0,0,0,1,0,0|3,0,0]=4 308 B13R1.610 CCC1CCCCCN1CC(N)=O Amb25090150 [0,0,0,1,0,0|2,0,0]=3 309 B13R1.610 CCC1CCCCCN1CC(O)=O Amb24349311 [0,0,0,1,0,0|1,0,0]=2 310 B13R1.610 CCN1CCCCCC1CC(C)=O Amb24472004 [0,0,0,1,0,0|2,0,0]=3 311 B13R1.610 CC[C@@H]1CCCCC[C@@H]1NC(C)=O Amb24560969 [0,0,0,1,0,0|2,0,0]=3 312 B13R1.610 CC[C@@H]1NCCCC[C@H]1CC(O)=O Amb18191310 [0,0,0,1,0,0|1,0,0]=2 313 B13R1.610 CNC1CCCCCC1CC(C)=C Amb24619093 [0,0,0,1,0,0|3,0,0]=4 314 B13R1.610 COC1CCCCCC1CC(O)=O Amb18822015 [0,0,0,1,0,0|1,0,0]=2 315 B13R1.610 COC1CCCCCC1NC(N)=O Amb24335007 [0,0,0,1,0,0|3,0,0]=4 316 B13R1.610 C[C@@H](O)CN1CCCCCC1CC Amb25153752 [0,0,0,1,0,0|2,0,1]=4 317 B13R1.610 C[C@H](O)CN1CCCCCC1CC Amb24617408 [0,0,0,1,0,0|2,0,1]=4 318 B13R1.610 OCC1CCCCCC1CC(O)=O Amb25101626 [0,0,0,1,0,0|1,0,0]=2 319 B13R1.610 OCC1CCCCCN1CC(O)=O Amb25696335 [0,0,0,1,0,0|2,0,0]=3 320 B13R1.614 CCC1CCCCCCC1C(O)=O Amb24710104 [0,0,0,1,0,0|0,0,0]=1 321 B13R1.614 CNC1CCCCCCC1S(C)=O Amb24394188 [0,0,0,1,0,0|3,0,0]=4 322 B13R1.659 CCCCCCCCCC[C@@H]1CO1 Amb22353251 [0,0,0,1,0,0|1,0,1]=3 323 B13R1.659 CCCCCCCCCC[C@H]1CS1 Amb22367103 [0,0,0,1,0,0|1,1,1]=4 324 B13R1.670 CC#CCCC1CCCC1C(O)=O Amb24471231 [0,0,0,1,0,0|0,0,2]=3 325 B13R1.670 CCSCCN1CCCC1C(O)=O Amb24769161 [0,0,0,1,0,0|2,0,0]=3 326 B13R1.670 CCSCCN1CCC[C@H]1C(O)=O Amb24769158 [0,0,0,1,0,0|2,0,0]=3 327 B13R1.1009 NC(=O)C1CCCCNCCCC1 Amb24461661 [0,0,0,1,0,0|2,0,0]=3 328 B13R1.1009 OC(=O)C1CCC=CCCCCC1 Amb25039409 [0,0,0,1,0,0|0,0,2]=3 329 B13R1.1009 OC(=O)C1CCCCCCCCC1 Amb25061287 [0,0,0,1,0,0|0,0,0]=1 330 B13R1.1009 OC(=O)C1CCCCNCCCC1 Amb24365928 [0,0,0,1,0,0|1,0,0]=2 331 B13R1.1009 OC(=O)C=1CCCCCCCCC1 Amb24711230 [0,0,0,1,0,0|0,0,2]=3 332 B13R1.1022 CC(=C)CNC1CCCCCCC1 Amb17308786 [0,0,0,1,0,0|3,0,0]=4 333 B13R1.1022 CC(=O)CCC1CCCCCCC1 Amb25120339 [0,0,0,1,0,0|1,0,0]=2 334 B13R1.1022 CC(=O)NCC1CCCCCCC1 Amb24072669 [0,0,0,1,0,0|2,0,0]=3 335 B13R1.1022 CC(=O)\C=C\C1CCCCCCC1 Amb24380069 [0,0,0,1,0,0|1,0,2]=4 336 B13R1.1022 CC(=O)\N=C/C1CCCCCCC1 Amb24073013 [0,0,0,1,0,0|2,0,1]=4 337 B13R1.1022 CC(Cl)CCC1CCCCCCC1 Amb24409444 [0,0,0,1,0,0|2,0,1]=4 338 B13R1.1022 CC(O)CCC1CCCCCCC1 Amb25260363 [0,0,0,1,0,0|1,0,1]=3 339 B13R1.1022 CC(O)CCN1CCCCCCC1 Amb18329034 [0,0,0,1,0,0|2,0,1]=4 340 B13R1.1022 CS(=O)CCN1CCCCCCC1 Amb25138484 [0,0,0,1,0,0|3,0,0]=4 341 B13R1.1022 C[C@@H](O)CNC1CCCCCCC1 Amb25038976 [0,0,0,1,0,0|2,0,1]=4 342 B13R1.1022 NC(=O)CCN1CCCCCCC1 Amb18328558 [0,0,0,1,0,0|2,0,0]=3 343 B13R1.1022 NC(=O)CNC1CCCCCCC1 Amb1113527 [0,0,0,1,0,0|2,0,0]=3 344 B13R1.1022 NC(=O)NCC1CCCCCCC1 Amb25163666 [0,0,0,1,0,0|2,0,0]=3 345 B13R1.1022 NC(=O)\C=C\C1CCCCCCC1 Amb25791108 [0,0,0,1,0,0|1,0,2]=4 346 B13R1.1022 OC(=O)C#CC1CCCCCCC1 Amb25332789 [0,0,0,1,0,0|0,0,2]=3 347 B13R1.1022 OC(=O)CCN1CCCCCCC1 Amb21955684 [0,0,0,1,0,0|1,0,0]=2 348 B13R1.1022 OC(=O)CCN1CCSCCCC1 Amb23596973 [0,0,0,1,0,0|2,0,0]=3 349 B13R1.1022 OC(=O)CNC1CCCCCC=C1 Amb25277891 [0,0,0,1,0,0|1,0,2]=4 350 B13R1.1022 OC(=O)CSC1CCCCCC=C1 Amb25075314 [0,0,0,1,0,0|1,0,2]=4 351 B13R1.1022 OC(=O)CSC1CCCCCCC1 Amb25725888 [0,0,0,1,0,0|1,0,0]=2 352 B13R1.1022 OC(=O)\C=C\C1CCCCCCC1 Amb24397482 [0,0,0,1,0,0|0,0,2]=3 353 B13R1.1022 [O-][N+](=O)CCN1CCCCCCC1 Amb25042470 [0,0,0,1,0,0|2,0,1]=4 354 B13R1.1107 CC(O)CN1CCCCCCCC1 Amb24749795 [0,0,0,1,0,0|2,0,1]=4 355 B13R1.1107 C[C@@H](O)CN1CCCCCCCC1 Amb24425026 [0,0,0,1,0,0|2,0,1]=4 356 B13R1.1107 NC(=S)CN1CCCCCCCC1 Amb25169162 [0,0,0,1,0,0|2,1,0]=4 357 B13R1.1107 OC(=O)CC1CCCCCCCC1 Amb25279551 [0,0,0,1,0,0|0,0,0]=1 358 B13R1.1107 OC(=O)CN1CCCCCCCC1 Amb25169064 [0,0,0,1,0,0|1,0,0]=2 359 B13R1.1107 OC(=O)CN1CCNCCNCC1 Amb21953270 [0,0,0,1,0,0|3,0,0]=4 360 B13R1.1107 OC(=O)CN1CCNCCNCC1 Amb24740859 [0,0,0,1,0,0|3,0,0]=4 361 B13R1.1148 C#CCCCC1CC(=O)CCCC1 Amb25137368 [0,0,0,1,0,0|1,0,2]=4 362 B13R1.1148 CC#CCCC1CC(=O)CCCC1 Amb24757506 [0,0,0,1,0,0|1,0,2]=4 363 B13R1.1988 NC(=O)NCCN1CCCCCC1 Amb25762687 [0,0,0,1,0,0|3,0,0]=4 364 B13R1.1988 OC(=O)CCCN1CCCCCC1 Amb10072744 [0,0,0,1,0,0|1,0,0]=2 365 B13R1.1988 OC(=O)CCNC1=NCCCCC1 Amb1052796 [0,0,0,1,0,0|2,0,1]=4 366 B13R1.1988 OC(=O)\C=C\CN1CCCCCC1 Amb18296443 [0,0,0,1,0,0|1,0,2]=4 367 B13R1.1988 OC(=O)\C=C\NC1CCCCCC1 Amb24731056 [0,0,0,1,0,0|1,0,2]=4 368 B13R1.2433 CCCCCCCC1CC1B(O)O Amb24329636 [0,0,0,1,0,0|1,0,1]=3 369 B13R1.3712 CC1(O)CCCCCCCCC1O Amb25036035 [0,0,0,1,0,0|2,0,1]=4 370 B13R1.3816 CN1CCCCCCCC1C(O)=O Amb25365310 [0,0,0,1,0,0|1,0,0]=2 371 B13R1.3816 NC1CCCCCCCC1C(O)=O Amb24436959 [0,0,0,1,0,0|1,0,0]=2 372 B10R0.71 C=CCCCCCCCC=O Amb22734770 [2,0,0,0,0,0|0,0,2]=4 373 B10R0.71 C=CCCCCCCCCCl Amb22898754 [2,0,0,0,0,0|1,0,1]=4 374 B10R0.71 CCCCCCCC#CCO Amb17774678 [2,0,0,0,0,0|0,0,2]=4 375 B10R0.71 CCCCCCCCCNC Amb10609826 [2,0,0,0,0,0|1,0,1]=4 376 B10R0.71 CCCCCCCCCOC Amb2582537 [2,0,0,0,0,0|1,0,1]=4 377 B10R0.71 CCCCCCCCCSC Amb22230926 [2,0,0,0,0,0|1,0,1]=4 378 B10R0.71 CCCCCCCCC[Mg]Br Amb22000598 [2,0,0,0,0,0|2,0,0]=4 379 B10R0.71 CCCCCCCCC[Zn]Br Amb22000508 [2,0,0,0,0,0|2,0,0]=4 380 B10R0.71 CCCCCCCCOC=O Amb22231360 [2,0,0,0,0,0|1,0,0]=3 381 B10R0.71 CCCCCCCCOCBr Amb22733274 [2,0,0,0,0,0|2,0,0]=4 382 B10R0.71 CCCCCCCCOCCl Amb22230404 [2,0,0,0,0,0|2,0,0]=4 383 B10R0.71 CCCCCCCCSCC Amb17672979 [2,0,0,0,0,0|1,0,1]=4 384 B10R0.71 CCCCCCC\C=C/CO Amb10563790 [2,0,0,0,0,0|0,0,2]=4 385 B10R0.71 CCCCCCNCCCN Amb17315272 [2,0,0,0,0,0|2,0,0]=4 386 B10R0.71 CCCCCC\C=C\CCO Amb22641690 [2,0,0,0,0,0|0,0,2]=4 387 B10R0.71 CCCCCNCCCCC Amb22359459 [2,0,0,0,0,0|1,0,1]=4 388 B10R0.71 CCCCCNCCCCC Amb22366791 [2,0,0,0,0,0|1,0,1]=4 389 B10R0.71 CCCCCSCCCCN Amb17500943 [2,0,0,0,0,0|2,0,0]=4 390 B10R0.71 CCCCC\C=C\CCC=O Amb10071527 [2,0,0,0,0,0|0,0,2]=4 391 B10R0.71 CCCCC\C=C\CCCO Amb10807437 [2,0,0,0,0,0|0,0,2]=4 392 B10R0.71 CCCCNCCCCCO Amb17334477 [2,0,0,0,0,0|1,0,0]=3 393 B10R0.71 CCNCCCNCCCO Amb20171980 [2,0,0,0,0,0|2,0,0]=4 394 B10R0.71 CC\C=C\CCCCCCO Amb22231682 [2,0,0,0,0,0|0,0,2]=4 395 B10R0.71 COCCCCCCCCO Amb17617052 [2,0,0,0,0,0|1,0,0]=3 396 B10R0.71 COCCCNCCCCO Amb17334530 [2,0,0,0,0,0|2,0,0]=4 397 B10R0.71 ICCCCCCCCCI Amb20242392 [2,0,0,0,0,0|2,0,0]=4 398 B10R0.71 N#CCCCCCCCCO Amb22641582 [2,0,0,0,0,0|1,0,1]=4 399 B10R0.71 O=CCCCCC\C=C/CC Amb10807429 [2,0,0,0,0,0|0,0,2]=4 400 B10R0.71 OCCCCCCCCC#C Amb16231465 [2,0,0,0,0,0|0,0,2]=4 401 B10R0.71 OCCCCCCCCCCl Amb16234125 [2,0,0,0,0,0|1,0,0]=3 402 B10R0.71 OCCCCNCCCCO Amb21858890 [2,0,0,0,0,0|2,0,0]=4 403 B10R0.71 OCCCCOCCCCO Amb21960124 [2,0,0,0,0,0|2,0,0]=4 404 B10R0.4 CCCCCC#CCC(O)=O Amb25384153 [2,0,0,0,0,0|0,0,2]=4 405 B10R0.4 CCCCCCCCB(O)O Amb2456044 [2,0,0,0,0,0|1,0,1]=4 406 B10R0.4 CCCCCCCCC([O-])=O Amb22729912 [2,0,0,0,0,0|0,0,1]=3 407 B10R0.4 CCCCCCCCS(=O)C Amb10553782 [2,0,0,0,0,0|2,0,0]=4 408 B10R0.4 CCCCCCCC[C@@H](C)O Amb19929333 [2,0,0,0,0,0|1,0,1]=4 409 B10R0.4 CCCCCCCC[C@@H](O)C Amb10068518 [2,0,0,0,0,0|1,0,1]=4 410 B10R0.4 CCCCCCCC[N+]([O-])=O Amb17672610 [2,0,0,0,0,0|1,0,1]=4 411 B10R0.4 CCCCCCCC[Sn](O)=O Amb22729697 [2,0,0,0,0,0|1,0,0]=3 412 B10R0.4 CCCCCCCNC(N)=O Amb17939018 [2,0,0,0,0,0|2,0,0]=4 413 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [2,0,0,0,0,0|2,0,0]=4 414 B10R0.4 CCCCC\C=C\CC(=O)O Amb17593915 [2,0,0,0,0,0|0,0,2]=4 415 B10R0.4 CCOCCCCCC(O)=O Amb22234334 [2,0,0,0,0,0|1,0,0]=3 416 B10R0.4 CNCCOCCCC(O)=O Amb18106300 [2,0,0,0,0,0|2,0,0]=4 417 B10R0.4 COCCCOCCC(O)=O Amb18180046 [2,0,0,0,0,0|2,0,0]=4 418 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [2,0,0,0,0,0|1,0,0]=3 419 B10R0.4 NCCCCCCCC(O)=O Amb19929586 [2,0,0,0,0,0|1,0,0]=3 420 B10R0.4 NCCCCCCNC(O)=O Amb22494605 [2,0,0,0,0,0|2,0,0]=4 421 B10R0.4 NCCCOCCCC(O)=O Amb18111568 [2,0,0,0,0,0|2,0,0]=4 422 B10R0.4 NCCCSCCCC(=O)O Amb17500719 [2,0,0,0,0,0|2,0,0]=4 423 B10R0.4 OC(=O)CCCCCCCS Amb22353760 [2,0,0,0,0,0|1,0,0]=3 424 B10R0.4 OCCCSCCCC(=O)O Amb17502860 [2,0,0,0,0,0|2,0,0]=4 425 B10R0.4 [O-]C(=O)CCCCCCCBr Amb22015198 [2,0,0,0,0,0|1,0,1]=4 426 B12R0.1 CCCCCCCCC(C)CCC Amb22734087 [1,1,0,0,0,0|1,0,1]=4 427 B12R0.1 CCCCCCCCS(=O)CCO Amb1085921 [1,1,0,0,0,0|1,0,1]=4 428 B12R0.5 C=CCCCCCCCCCCBr Amb22899287 [1,1,0,0,0,0|1,0,0]=3 429 B12R0.5 C=CCCCCCCCCCCN Amb24120407 [1,1,0,0,0,0|1,0,0]=3 430 B12R0.5 C=CCCCCCCCCC[Mg]Br Amb22897367 [1,1,0,0,0,0|2,0,0]=4 431 B12R0.5 C=CCCCCCCCCC[Zn]Br Amb22897886 [1,1,0,0,0,0|2,0,0]=4 432 B12R0.5 CCCCCCCCCCCCCl Amb22733144 [1,1,0,0,0,0|1,0,1]=4 433 B12R0.5 CCCCCCCCCCCCN Amb22366429 [1,1,0,0,0,0|1,0,1]=4 434 B12R0.5 CCCCCCCCCCCC[14CH3] Amb22352523 [1,1,0,0,0,0|1,0,1]=4 435 B12R0.5 CCCCCCCCCCCC[15NH2] Amb22362752 [1,1,0,0,0,0|1,0,1]=4 436 B12R0.5 CCCCCCCCCCCC[NH3+] Amb22049481 [1,1,0,0,0,0|1,0,1]=4 437 B12R0.5 CCCCCCCCCCC[13CH2]Br Amb22338410 [1,1,0,0,0,0|1,0,1]=4 438 B12R0.5 CCCCCCCCCCC[13CH2]O Amb22362751 [1,1,0,0,0,0|0,0,1]=3 439 B12R0.5 CCCCCCCCCCC[Mg]Br Amb22897368 [1,1,0,0,0,0|1,0,1]=4 440 B12R0.5 CCCCCCCCCCN=C=O Amb22348014 [1,1,0,0,0,0|0,0,1]=3 441 B12R0.5 CCCCCCCCCCOC=C Amb22735088 [1,1,0,0,0,0|1,0,0]=3 442 B12R0.5 CCCCCCCCCCOCC Amb24056425 [1,1,0,0,0,0|1,0,1]=4 443 B12R0.5 CCCCCCCCCC\C=C\Cl Amb22731233 [1,1,0,0,0,0|1,0,0]=3 444 B12R0.5 CCCCCCCCC\C=C\C=O Amb22351858 [1,1,0,0,0,0|0,0,1]=3 445 B12R0.5 CCCCCCCCC\C=C\CO Amb22350397 [1,1,0,0,0,0|0,0,1]=3 446 B12R0.5 CCCCCCCCNCCCN Amb19058864 [1,1,0,0,0,0|1,0,1]=4 447 B12R0.5 CCCCCCCCOCCCN Amb13951369 [1,1,0,0,0,0|1,0,1]=4 448 B12R0.5 CCCCCCCCSCCC#N Amb22358950 [1,1,0,0,0,0|1,0,1]=4 449 B12R0.5 CCCCCCCC\C=C\CC=O Amb22735030 [1,1,0,0,0,0|0,0,1]=3 450 B12R0.5 CCCCCCNCCCCCC Amb22350699 [1,1,0,0,0,0|1,0,1]=4 451 B12R0.5 CCCCCCNCCCCCC Amb22359816 [1,1,0,0,0,0|1,0,1]=4 452 B12R0.5 CCCCCC\C=C/CCCCO Amb22740006 [1,1,0,0,0,0|0,0,2]=4 453 B12R0.5 CCCCCC\C=C\CCCCO Amb22740007 [1,1,0,0,0,0|0,0,2]=4 454 B12R0.5 CCCC\C=C/CCCCCCO Amb10563789 [1,1,0,0,0,0|0,0,2]=4 455 B12R0.5 CCC\C=C/CCCCCCCO Amb20243410 [1,1,0,0,0,0|0,0,2]=4 456 B12R0.5 CCC\C=C\CCCCCCCO Amb22734806 [1,1,0,0,0,0|0,0,2]=4 457 B12R0.5 CCOCCCCCCCCCO Amb22233218 [1,1,0,0,0,0|0,0,1]=3 458 B12R0.5 CC\C=C\CCCCCCCCO Amb22731394 [1,1,0,0,0,0|0,0,2]=4 459 B12R0.5 CNCCCNCCCCCCC Amb20171957 [1,1,0,0,0,0|2,0,0]=4 460 B12R0.5 C\C=C\CCCCCCCCCO Amb22731398 [1,1,0,0,0,0|0,0,2]=4 461 B12R0.5 ICCCCCCCCCCCI Amb22346855 [1,1,0,0,0,0|1,0,1]=4 462 B12R0.5 NCCCCCCCCCCCN Amb16233911 [1,1,0,0,0,0|1,0,1]=4 463 B12R0.5 NCCCCCCCCCCCS Amb22336989 [1,1,0,0,0,0|0,1,1]=4 464 B12R0.5 OCCCCCCCCCCC#C Amb10602413 [1,1,0,0,0,0|0,0,2]=4 465 B12R0.5 OCCCCCCCCCCCO Amb15692712 [1,1,0,0,0,0|0,0,1]=3 466 B12R0.5 SCCCCCCCCCCCS Amb22352799 [1,1,0,0,0,0|0,1,1]=4 467 B12R0.248 CCCCCCCCC[C@@H](O)CCl Amb22736721 [1,1,0,0,0,0|1,0,1]=4 468 B12R0.248 CCCCCCCCC[C@H](O)CCl Amb22736722 [1,1,0,0,0,0|1,0,1]=4 469 B12R0.248 CCCCCCCCC\C(\N)=N\O Amb19046143 [1,1,0,0,0,0|1,0,1]=4 470 B12R0.248 OCCCCCCCCC(CO)O Amb10069452 [1,1,0,0,0,0|1,0,1]=4 471 B12R0.4 CCCCCCCC(=O)CC(O)=O Amb24273367 [1,1,0,0,0,0|0,0,1]=3 472 B12R0.4 CCCCCCCC(C)OC(C)=O Amb22734609 [1,1,0,0,0,0|2,0,0]=4 473 B12R0.4 CCCCCCCC(O)CC(O)=O Amb19071697 [1,1,0,0,0,0|0,0,0]=2 474 B12R0.4 CCCCC\C=C\C(O)CC(O)=O Amb22831933 [1,1,0,0,0,0|0,0,2]=4 475 B12R0.4 CC\C=C/CCCC(O)CC(O)=O Amb22831934 [1,1,0,0,0,0|0,0,2]=4 476 B12R0.119 CCCCCCCCCP(=O)(C)C Amb16204351 [1,1,0,0,0,0|2,0,0]=4 477 B12R0.119 CCCCCCCCCP(O)(O)=O Amb22388781 [1,1,0,0,0,0|1,0,0]=3 478 B12R0.119 CCCCCCCCCS(=O)(=O)Cl Amb22387375 [1,1,0,0,0,0|1,0,1]=4 479 B12R0.119 [2H]C([2H])(O)CCCCCCCCC Amb21928615 [1,1,0,0,0,0|1,0,1]=4 480 B12R0.184 CCC(=O)NCCCCCC(=O)O Amb1137874 [1,1,0,0,0,0|1,0,1]=4 481 B12R0.233 CCCCCC(C)CCCC(O)=O Amb24062978 [1,1,0,0,0,0|0,0,0]=2 482 B12R0.233 CCCCCC(O)CCCC([O-])=O Amb22352105 [1,1,0,0,0,0|0,0,1]=3 483 B12R0.233 CCCCNC(=O)CCCC(=O)O Amb1837519 [1,1,0,0,0,0|1,0,1]=4 484 B12R0.251 CCCCCCCCC(Br)C(O)=O Amb22347926 [1,1,0,0,0,0|0,0,0]=2 485 B12R0.251 CCCCCCCCC(C)C(O)=O Amb19058533 [1,1,0,0,0,0|0,0,0]=2 486 B12R0.251 CCCCCCCCN(C)C(C)=O Amb24096791 [1,1,0,0,0,0|2,0,0]=4 487 B12R0.251 CCCCCCCC[C@@H](N)C(O)=O Amb22745440 [1,1,0,0,0,0|0,0,0]=2 488 B12R0.251 CCCCCCCOC(C(=O)O)C Amb2445106 [1,1,0,0,0,0|1,0,0]=3 489 B12R0.251 CCCCCCSC[C@H](N)C(O)=O Amb22451174 [1,1,0,0,0,0|1,0,0]=3 490 B12R0.255 CCCCCCC(Br)CCC(N)=O Amb24065437 [1,1,0,0,0,0|1,0,0]=3 491 B12R0.255 CCCCCCC(O)CCC(O)=O Amb19071689 [1,1,0,0,0,0|0,0,0]=2 492 B12R0.255 CCCCCCC(O)CCC([O-])=O Amb19149307 [1,1,0,0,0,0|0,0,1]=3 493 B12R0.268 C=C(F)CCCCCCCC(O)=O Amb22641501 [1,1,0,0,0,0|0,0,2]=4 494 B12R0.268 CC(C)CCCCCCCC(O)=O Amb24117911 [1,1,0,0,0,0|0,0,0]=2 495 B12R0.268 OC(=O)CCCCCCCC(O)=O Amb22336282 [1,1,0,0,0,0|1,0,1]=4 496 B14R0.2 CCCCCOCC(=O)NCCC(O)=O Amb25391963 [0,2,0,0,0,0|1,0,1]=4 497 B14R0.2 CCCCSCCC(=O)NCCC(O)=O Amb25391980 [0,2,0,0,0,0|1,0,1]=4 498 B14R0.67 CC(C)CCCC(C)NCCCC(O)=O Amb25388560 [0,2,0,0,0,0|1,0,0]=3 499 B14R0.68 C=C(F)CCCCCCCCCC(O)=O Amb22641506 [0,2,0,0,0,0|0,0,1]=3 500 B14R0.68 CC(C)CCCCCCCCCC(O)=O Amb21928797 [0,2,0,0,0,0|0,0,0]=2 501 B14R0.68 OC(=O)CCCCCCCCCC(=O)O Amb10807546 [0,2,0,0,0,0|0,0,1]=3 502 B14R0.88 CCCCCCCCCCCP(O)(O)=O Amb22388785 [0,2,0,0,0,0|1,0,0]=3 503 B14R0.88 CCCCCCCCCCCS([O-])(=O)=O Amb22052665 [0,2,0,0,0,0|1,0,1]=4 504 B14R0.88 CCCCCCCCCCOS(=O)(=O)[O-] Amb10789214 [0,2,0,0,0,0|1,0,1]=4 505 B14R0.88 CCCCCCCCCCSS(=O)(=O)C Amb17611641 [0,2,0,0,0,0|1,0,1]=4 506 B14R0.88 NCCCCCCCCCCP(O)(O)=O Amb22388717 [0,2,0,0,0,0|1,0,0]=3 507 B14R0.88 NCCCCCCCCCCP(O)(O)=O Amb22388718 [0,2,0,0,0,0|1,0,0]=3 508 B14R0.88 OP(O)(=O)CCCCCCCCCCBr Amb24057492 [0,2,0,0,0,0|1,0,0]=3 509 B14R0.231 CCCOCC(=O)NCCCCC(O)=O Amb25391846 [0,2,0,0,0,0|1,0,1]=4 510 B14R0.231 CCCSCC(=O)NCCCCC(O)=O Amb25391845 [0,2,0,0,0,0|1,0,1]=4 511 B14R0.305 CC(C)CCCCCCCOC(=O)C=C Amb22733637 [0,2,0,0,0,0|2,0,0]=4 512 B14R0.305 CCC(=O)NCCCCCCCC(O)=O Amb25392233 [0,2,0,0,0,0|0,0,1]=3 513 B14R0.305 CCC(C)CCCCCCCCC(O)=O Amb21928795 [0,2,0,0,0,0|0,0,0]=2 514 B14R0.305 COC(=O)CCCCCCCCC(C)C Amb21928867 [0,2,0,0,0,0|0,0,0]=2 515 B14R0.305 NNC(=O)CCCCCCCCC(=O)O Amb1792999 [0,2,0,0,0,0|1,0,1]=4 516 B14R0.337 BrCCCCCCCCCCC(=O)NN Amb16207967 [0,2,0,0,0,0|1,0,0]=3 517 B14R0.337 CCCCCCCCCCCC(=O)NC Amb22043375 [0,2,0,0,0,0|1,0,0]=3 518 B14R0.337 CCCCCCCCCCCC(O)C#C Amb22345519 [0,2,0,0,0,0|1,0,1]=4 519 B14R0.337 CCCCCCCCCCNC(=O)C=C Amb22735131 [0,2,0,0,0,0|1,0,0]=3 520 B14R0.337 CCCCCCCCCCNC(=O)CBr Amb17333188 [0,2,0,0,0,0|1,0,0]=3 521 B14R0.337 CCCCCCCCCCOC(=O)CBr Amb1103529 [0,2,0,0,0,0|1,0,0]=3 522 B14R0.337 CCCCCCCCCOCC(CO)O Amb10071477 [0,2,0,0,0,0|0,0,2]=4 523 B14R0.337 COC(=O)CCCCCCCCCC=C Amb21928798 [0,2,0,0,0,0|0,0,1]=3 524 B14R0.337 COC(=O)CCCCCCCCCCCl Amb22522963 [0,2,0,0,0,0|0,0,0]=2 525 B14R0.337 COC(=O)CCCCCCCCCCN Amb23575681 [0,2,0,0,0,0|0,0,0]=2 526 B14R0.340 CC(=C)C(=O)OCCCCCCCCC Amb22731039 [0,2,0,0,0,0|2,0,0]=4 527 B14R0.340 CCCCCCCCCCC(N)C(O)=O Amb21858489 [0,2,0,0,0,0|0,0,0]=2 528 B14R0.340 CCCCCCCCCC[C@@H](N)C(O)=O Amb22745407 [0,2,0,0,0,0|0,0,0]=2 529 B14R0.344 CCCCCCCCC(C)CCC(O)=O Amb22347578 [0,2,0,0,0,0|0,0,0]=2 530 B14R0.344 CCCCCCCCC(O)C#CC(O)=O Amb17779806 [0,2,0,0,0,0|0,0,1]=3 531 B14R0.344 CCCCCCCCS(=O)CCC(=O)N Amb10669588 [0,2,0,0,0,0|1,0,0]=3 532 B14R0.344 CCCCCCCCS(=O)CCC(=O)O Amb1038995 [0,2,0,0,0,0|0,0,0]=2 533 B14R0.344 CCCCCCCNC(=O)CCC(=O)O Amb1771111 [0,2,0,0,0,0|0,0,1]=3 534 B14R0.391 CC(=O)CC(=O)NCCCCCCCC Amb22359801 [0,2,0,0,0,0|1,0,1]=4 535 B14R0.391 CCCCCCCCCC(O)CC(O)=O Amb21928747 [0,2,0,0,0,0|0,0,0]=2 536 B14R0.391 CCCCCCC\C=C\C(O)CC(O)=O Amb22831937 [0,2,0,0,0,0|0,0,1]=3 537 B14R0.391 CCCCC\C=C\CCC(O)CC(O)=O Amb22831938 [0,2,0,0,0,0|0,0,1]=3 538 B14R0.391 CC\C=C/CCCCCC(O)CC(O)=O Amb22831939 [0,2,0,0,0,0|0,0,1]=3 539 B14R0.394 C#CCCCCCCCCCCC(=O)O Amb1396957 [0,2,0,0,0,0|0,0,0]=2 540 B14R0.394 CC(=O)NCCCCCCCCCCN Amb22358951 [0,2,0,0,0,0|1,0,0]=3 541 B14R0.394 CC(=O)OCCCCCCCCCC=C Amb19930234 [0,2,0,0,0,0|1,0,1]=4 542 B14R0.394 CCCCCCCCCCCCB(O)O Amb13890365 [0,2,0,0,0,0|1,0,1]=4 543 B14R0.394 CCCCCCCCCCCCC(=C)Br Amb19886461 [0,2,0,0,0,0|2,0,0]=4 544 B14R0.394 CCCCCCCCCCCCC(=O)Cl Amb22353030 [0,2,0,0,0,0|1,0,0]=3 545 B14R0.394 CCCCCCCCCCCCC(C)=C Amb19886458 [0,2,0,0,0,0|2,0,0]=4 546 B14R0.394 CCCCCCCCCCCCC(C)=O Amb22730728 [0,2,0,0,0,0|1,0,0]=3 547 B14R0.394 CCCCCCCCCCCCC(N)=O Amb22359815 [0,2,0,0,0,0|1,0,0]=3 548 B14R0.394 CCCCCCCCCCCCS(C)=O Amb22337517 [0,2,0,0,0,0|2,0,0]=4 549 B14R0.394 CCCCCCCCCC\C=C\C(O)=O Amb22734282 [0,2,0,0,0,0|0,0,0]=2 550 B14R0.394 CCCCCCCCSCCSC(=N)N Amb1085938 [0,2,0,0,0,0|2,0,0]=4 551 B14R0.394 CCCCCCCCSCCSC(N)=N Amb22283870 [0,2,0,0,0,0|2,0,0]=4 552 B14R0.394 C\C=C\CCCCCCCCOC(C)=O Amb22641577 [0,2,0,0,0,0|1,0,1]=4 553 B14R0.394 NCCOCCOCCOCCC(O)=O Amb22371716 [0,2,0,0,0,0|2,0,0]=4 554 B14R0.394 OC(=O)CCCCCCCCCCCS Amb22350627 [0,2,0,0,0,0|0,0,0]=2 555 B14R0.394 OC(=O)CCCCCCCC\C=C\C=O Amb21928974 [0,2,0,0,0,0|0,0,2]=4 556 B14R0.394 OC(=O)CCCCCCC\C=C/CC=O Amb21928973 [0,2,0,0,0,0|0,0,2]=4 557 B14R0.394 OC(=O)CCOCCOCCOCCBr Amb24057426 [0,2,0,0,0,0|2,0,0]=4 558 B14R0.394 OC(=O)CCOCCOCCOCCS Amb24058080 [0,2,0,0,0,0|2,0,0]=4 559 B14R0.394 OCCOCCOCCOCCC(O)=O Amb24057824 [0,2,0,0,0,0|2,0,0]=4 560 B14R0.432 CCOC(=O)CCCCCCCC(=O)O Amb17608619 [0,2,0,0,0,0|0,0,1]=3 561 B14R0.2224 CCCCCNC(=O)NCCCC(=O)O Amb17043004 [0,2,0,0,0,0|1,0,1]=4 562 B14R0.2224 COCCCCC(=O)NCCCC(O)=O Amb25392005 [0,2,0,0,0,0|1,0,1]=4 563 B14R0.35 CCCC(=O)NCCCC[C@@H](N)C(O)=O Amb24184171 [0,2,0,0,0,0|1,0,1]=4 564 B14R0.131 CCC(C(=O)NCCCCCC(=O)O)C Amb1126691 [0,2,0,0,0,0|1,0,1]=4 565 B14R0.287 CCCS(=O)(=O)NCCCCCC(=O)O Amb1132097 [0,2,0,0,0,0|2,0,0]=4 566 B14R0.427 CC(CC(=O)NCCCCCC(=O)O)C Amb1132978 [0,2,0,0,0,0|1,0,1]=4 567 B14R0.46 CCCCC(C)C(=O)NCCCC(O)=O Amb24775430 [0,2,0,0,0,0|1,0,1]=4 568 B14R0.551 CC(C)CCOCCN(C)CCC(O)=O Amb24771014 [0,2,0,0,0,0|2,0,0]=4 569 B14R0.82 CCCCCCCCC(O)CC(=O)OC Amb21928846 [0,2,0,0,0,0|0,0,0]=2 570 B14R0.197 CCC(C)CCCCCCCC(=O)OC Amb21928866 [0,2,0,0,0,0|0,0,0]=2 571 B14R0.393 C=CCCCCCCCCC(=O)OC=C Amb17672568 [0,2,0,0,0,0|0,0,2]=4 572 B14R0.393 C=CCCCCCCCCC(=O)OCC Amb16193236 [0,2,0,0,0,0|0,0,2]=4 573 B14R0.393 CCCCCCCCCCC(O)CCC Amb24099722 [0,2,0,0,0,0|1,0,1]=4 574 B14R0.393 CCCCCCCCCCS(=O)CCCl Amb1085959 [0,2,0,0,0,0|2,0,0]=4 575 B14R0.393 CCCCCCCCCCS(=O)CCO Amb1039004 [0,2,0,0,0,0|1,0,0]=3 576 B14R0.393 CCCCCCCCCNC(=O)CCS Amb22353745 [0,2,0,0,0,0|1,1,0]=4 577 B14R0.393 CCCCCCCNCCC(=O)OCC Amb20171955 [0,2,0,0,0,0|1,0,0]=3 578 B14R0.393 CCNC(=O)CCNCCCCCCC Amb20171956 [0,2,0,0,0,0|2,0,0]=4 579 B14R0.393 CCOC(=O)C#CCCCCCCCC Amb22729218 [0,2,0,0,0,0|0,0,2]=4 580 B14R0.393 CCOC(=O)CCCCCCCCCBr Amb21945748 [0,2,0,0,0,0|1,0,0]=3 581 B14R0.2056 CCCCCCCCCC[Si](C)(C)OC Amb19893765 [0,2,0,0,0,0|1,1,0]=4 582 B14R0.2297 CCCCCCCCCCC(OC)OC Amb10559988 [0,2,0,0,0,0|0,0,2]=4 583 B14R0.92 CCCCCCCC(=O)NC(O)C(O)=O Amb24095717 [0,2,0,0,0,0|1,0,1]=4 584 B14R0.92 C\C(=C/C(C)CCCCCCC)\C(O)=O Amb20246327 [0,2,0,0,0,0|0,0,2]=4 585 B14R0.534 CCC(O)CCCCCCC(O)C(O)=O Amb22483586 [0,2,0,0,0,0|0,0,0]=2 586 B14R0.549 OC(=O)CCCCCCCC(O)C(O)=O Amb24325972 [0,2,0,0,0,0|1,0,1]=4 587 B14R0.2430 CCCCCC(NC(=O)CCC(=O)O)C Amb1790097 [0,2,0,0,0,0|1,0,1]=4 588 B14R0.2680 OC(=O)CCCCCCCSS(=O)(=O)C Amb17616798 [0,2,0,0,0,0|2,0,0]=4 589 B14R0.2680 [2H]C([2H])([2H])CCCCCCCCC(O)=O Amb21928612 [0,2,0,0,0,0|1,0,0]=3 590 B12R1.8 CCCCCCC1CCCCC1 Amb22230753 [1,0,0,1,0,0|1,0,1]=4 591 B12R1.8 CCCCCCC1CCCCN1 Amb2235857 [1,0,0,1,0,0|1,0,1]=4 592 B12R1.8 O=CC#CCCC1CCCCC1 Amb24370141 [1,0,0,1,0,0|0,0,2]=4 593 B12R1.8 O=CCCCOC1CCCCO1 Amb17620504 [1,0,0,1,0,0|2,0,0]=4 594 B12R1.8 OCCCCCN1CCCCC1 Amb13883419 [1,0,0,1,0,0|1,0,1]=4 595 B12R1.18 C=C1CCCCCC1CCCCl Amb24565800 [1,0,0,1,0,0|2,0,0]=4 596 B12R1.18 C=CCCC1CCCCCC1=O Amb24729033 [1,0,0,1,0,0|0,0,2]=4 597 B12R1.18 C=CCCC1CCCCCC1Br Amb24452398 [1,0,0,1,0,0|2,0,0]=4 598 B12R1.18 CC#CCC1CCCCCC1=O Amb18798357 [1,0,0,1,0,0|0,0,2]=4 599 B12R1.18 CC1CCCCCC1NCC=C Amb25305413 [1,0,0,1,0,0|2,0,0]=4 600 B12R1.18 CC1CCSCCN1CCC=O Amb24622116 [1,0,0,1,0,0|2,0,0]=4 601 B12R1.18 CC1COCCCN1CCC=O Amb24543358 [1,0,0,1,0,0|2,0,0]=4 602 B12R1.18 CCCCC1CCCCCC1=O Amb18799266 [1,0,0,1,0,0|0,0,0]=2 603 B12R1.18 CCCCC1CCCCCC1N Amb18801599 [1,0,0,1,0,0|1,0,1]=4 604 B12R1.18 CCCCC1CCCCCC1O Amb18806714 [1,0,0,1,0,0|0,0,1]=3 605 B12R1.18 CCCCC1CCCCOC1O Amb25221052 [1,0,0,1,0,0|1,0,1]=4 606 B12R1.18 CCCCC1OCCCCC1O Amb25739706 [1,0,0,1,0,0|1,0,1]=4 607 B12R1.18 CCCCN1CCNCCC1=O Amb21959310 [1,0,0,1,0,0|2,0,0]=4 608 B12R1.18 CCCC[C@@H]1CCCCC[C@@H]1O Amb24619174 [1,0,0,1,0,0|0,0,1]=3 609 B12R1.18 CCCC[C@@H]1OCCCC[C@H]1O Amb25219271 [1,0,0,1,0,0|1,0,1]=4 610 B12R1.18 CCCNC1CCCCCC1O Amb18289727 [1,0,0,1,0,0|1,0,1]=4 611 B12R1.18 CCCOC1CCCCCC1O Amb18807452 [1,0,0,1,0,0|1,0,1]=4 612 B12R1.18 CCC\C=C/1\CCCCCC1=O Amb24620106 [1,0,0,1,0,0|0,0,2]=4 613 B12R1.18 CNCCN1CCCCCC1=O Amb18977654 [1,0,0,1,0,0|2,0,0]=4 614 B12R1.18 COCCC1CCCCCC1=O Amb18801861 [1,0,0,1,0,0|1,0,0]=3 615 B12R1.18 COCCC1CCCCCC1O Amb18807461 [1,0,0,1,0,0|1,0,1]=4 616 B12R1.18 COCC[C@@H]1CCCCCC1=O Amb25667371 [1,0,0,1,0,0|1,0,0]=3 617 B12R1.18 COCC[C@H]1CCCCCC1=O Amb25128881 [1,0,0,1,0,0|1,0,0]=3 618 B12R1.18 CSCCC1CCCCCC1=O Amb24342167 [1,0,0,1,0,0|1,0,0]=3 619 B12R1.18 CSCCC1CCCCCC1O Amb25119109 [1,0,0,1,0,0|1,0,1]=4 620 B12R1.18 C\C=C\CC1CCCCCC1=O Amb24470381 [1,0,0,1,0,0|0,0,2]=4 621 B12R1.18 NCCCN1CCCCCC1=O Amb1153735 [1,0,0,1,0,0|2,0,0]=4 622 B12R1.18 O=C1CCCCCC1CCCF Amb25692540 [1,0,0,1,0,0|1,0,0]=3 623 B12R1.18 O=C1CCCCCN1CCCS Amb24402028 [1,0,0,1,0,0|2,0,0]=4 624 B12R1.18 OC1CCCCCC1CCCF Amb25204076 [1,0,0,1,0,0|1,0,1]=4 625 B12R1.18 OC1CCCCCC1CCCO Amb25692021 [1,0,0,1,0,0|1,0,1]=4 626 B12R1.37 CCCCCCCC1OCCO1 Amb25368281 [1,0,0,1,0,0|1,0,1]=4 627 B12R1.37 O=CCCCCCC1OCCO1 Amb25835714 [1,0,0,1,0,0|2,0,0]=4 628 B12R1.37 OCCCNCCC1CCCC1 Amb18802444 [1,0,0,1,0,0|1,0,1]=4 629 B12R1.52 C=C1CCCCCCC1CC=O Amb24444868 [1,0,0,1,0,0|0,0,2]=4 630 B12R1.52 C=CCC1CCCCCCC1=O Amb24584339 [1,0,0,1,0,0|0,0,2]=4 631 B12R1.52 CCCC1CCCCCCC1=O Amb25050208 [1,0,0,1,0,0|0,0,0]=2 632 B12R1.52 CCOC1CCCCCCC1O Amb18807444 [1,0,0,1,0,0|1,0,1]=4 633 B12R1.52 O=C1CCCCCCN1CCS Amb25734060 [1,0,0,1,0,0|2,0,0]=4 634 B12R1.73 COC1CCCCCCCC1=O Amb24706984 [1,0,0,1,0,0|1,0,0]=3 635 B12R1.73 N#CC1CCCCCCCC1=O Amb25340929 [1,0,0,1,0,0|1,0,1]=4 636 B12R1.73 N=NC1CCCCCCCC1=O Amb24452294 [1,0,0,1,0,0|2,0,0]=4 637 B12R1.73 NCN1CCCCCCCC1=O Amb25152335 [1,0,0,1,0,0|2,0,0]=4 638 B12R1.73 O=C1CCCCCCCN1CCl Amb24391520 [1,0,0,1,0,0|2,0,0]=4 639 B12R1.73 O=CC1CCCCCCCC1=O Amb24381375 [1,0,0,1,0,0|1,0,1]=4 640 B12R1.121 CCC1CCCCC1OCCO Amb18807445 [1,0,0,1,0,0|1,0,1]=4 641 B12R1.121 OCC1CCCCC1CNC=O Amb24407374 [1,0,0,1,0,0|2,0,0]=4 642 B12R1.150 CC1CCC=CCCCCC1=O Amb25807557 [1,0,0,1,0,0|0,0,2]=4 643 B12R1.150 CC1CCCCCCC=CC1=O Amb24582545 [1,0,0,1,0,0|0,0,2]=4 644 B12R1.150 CC1CCCCCCCCC1=O Amb24645477 [1,0,0,1,0,0|0,0,0]=2 645 B12R1.150 C[C@H]1CCCCCCCCC1=O Amb24456546 [1,0,0,1,0,0|0,0,0]=2 646 B12R1.150 NC1CCCCCCCCC1O Amb25152507 [1,0,0,1,0,0|1,0,1]=4 647 B12R1.150 N[C@H]1CCCCCCCC[C@H]1O Amb24634302 [1,0,0,1,0,0|1,0,1]=4 648 B12R1.150 O=C1CCCCCCCCC1=O Amb17594209 [1,0,0,1,0,0|1,0,1]=4 649 B12R1.150 O=C1NCCCCCCCC1Cl Amb25295490 [1,0,0,1,0,0|2,0,0]=4 650 B12R1.150 OC1CCCCCCCCC1O Amb17594327 [1,0,0,1,0,0|1,0,1]=4 651 B12R1.150 O[C@H]1CCCCCCCC[C@H]1O Amb17671073 [1,0,0,1,0,0|1,0,1]=4 652 B12R1.173 O=CCN1CCCCCCCC1 Amb25840505 [1,0,0,1,0,0|1,0,0]=3 653 B12R1.215 ClC1CCCCCCCCCC1 Amb24634227 [1,0,0,1,0,0|1,0,1]=4 654 B12R1.215 O=C1CC=CCCCCCCC1 Amb25112664 [1,0,0,1,0,0|0,0,2]=4 655 B12R1.215 O=C1CCC=CCCCCCC1 Amb25713005 [1,0,0,1,0,0|0,0,2]=4 656 B12R1.215 O=C1CCCCCCCCC#C1 Amb25706996 [1,0,0,1,0,0|0,0,2]=4 657 B12R1.215 O=C1CCCCCCCCCO1 Amb22732305 [1,0,0,1,0,0|1,0,0]=3 658 B12R1.215 O=C1CCCCCCNCCN1 Amb25784699 [1,0,0,1,0,0|2,0,0]=4 659 B12R1.215 O=C1CCNCCCCCCN1 Amb25704380 [1,0,0,1,0,0|2,0,0]=4 660 B12R1.215 OC1CCCCCCCCCC1 Amb24497641 [1,0,0,1,0,0|0,0,1]=3 661 B12R1.215 OC1CCCCCCCCCO1 Amb24352243 [1,0,0,1,0,0|1,0,1]=4 662 B12R1.215 OC1CCCCNCCCCC1 Amb24615660 [1,0,0,1,0,0|1,0,1]=4 663 B12R1.215 S=C1CCCCCCCCCN1 Amb24399743 [1,0,0,1,0,0|1,1,0]=4 664 B12R1.267 BrCCNCC1CCCCC1=O Amb1146038 [1,0,0,1,0,0|2,0,0]=4 665 B12R1.267 C=CCCCC1CCCCC1=O Amb17594142 [1,0,0,1,0,0|0,0,2]=4 666 B12R1.267 CCCC#CC1CCCCC1=O Amb24456552 [1,0,0,1,0,0|0,0,2]=4 667 B12R1.267 CCCCCC1CCCCC1=O Amb18788895 [1,0,0,1,0,0|0,0,0]=2 668 B12R1.267 CCCCN[C@@H]1CCCC[C@@H]1O Amb23263417 [1,0,0,1,0,0|1,0,1]=4 669 B12R1.267 N#CCCCC1CCCCC1=O Amb18646376 [1,0,0,1,0,0|1,0,1]=4 670 B12R1.272 OCCCNCCCC1CCC1 Amb23570828 [1,0,0,1,0,0|1,0,1]=4 671 B12R1.281 C=CCC1CCCCCC1CN Amb24763160 [1,0,0,1,0,0|2,0,0]=4 672 B12R1.281 CCC1CCCCCC1CNC Amb24745232 [1,0,0,1,0,0|2,0,0]=4 673 B12R1.281 CCC1CCCCCN1CC=C Amb24354161 [1,0,0,1,0,0|2,0,0]=4 674 B12R1.281 CCC1CCCCCN1CC=O Amb25693680 [1,0,0,1,0,0|1,0,0]=3 675 B12R1.281 CCCC1CCCCCC1CN Amb24540361 [1,0,0,1,0,0|1,0,1]=4 676 B12R1.281 CCCC1CCCCCC1NC Amb18801600 [1,0,0,1,0,0|2,0,0]=4 677 B12R1.281 CCCN1CCCCCC1CO Amb25153989 [1,0,0,1,0,0|1,0,1]=4 678 B12R1.281 CNC1CCCCCC1CC=C Amb18799003 [1,0,0,1,0,0|2,0,0]=4 679 B12R1.281 OCC1CCCCCN1CC=O Amb25153991 [1,0,0,1,0,0|2,0,0]=4 680 B12R1.320 CCCN1CCCC1CCCO Amb18807188 [1,0,0,1,0,0|1,0,1]=4 681 B12R1.329 C=CCCN1CCCCCCC1 Amb25822796 [1,0,0,1,0,0|2,0,0]=4 682 B12R1.329 CCNCC1CCCCCC=C1 Amb25157900 [1,0,0,1,0,0|2,0,0]=4 683 B12R1.329 CNCCC1CCCCCCC1 Amb18563069 [1,0,0,1,0,0|2,0,0]=4 684 B12R1.329 O=CCCN1CCCCCCC1 Amb18789074 [1,0,0,1,0,0|1,0,0]=3 685 B12R1.329 OCCCC1CCCCCCN1 Amb18198426 [1,0,0,1,0,0|1,0,1]=4 686 B12R1.329 OCCSC1CCCCCCC1 Amb25687850 [1,0,0,1,0,0|1,0,1]=4 687 B12R1.372 CC#CCCCC1CCCC1=O Amb25128888 [1,0,0,1,0,0|0,0,2]=4 688 B12R1.372 CCCCCCC1CCOC1=O Amb22230226 [1,0,0,1,0,0|1,0,0]=3 689 B12R1.372 CCCCC\C=C\1/CCCC1=O Amb22359638 [1,0,0,1,0,0|0,0,2]=4 690 B12R1.399 COC1CCCCCCC1CO Amb25048572 [1,0,0,1,0,0|1,0,1]=4 691 B12R1.399 OC[C@@H]1CCCCCC[C@@H]1CO Amb24632149 [1,0,0,1,0,0|1,0,1]=4 692 B12R1.410 CNC1CCCCCCCCC1 Amb13883575 [1,0,0,1,0,0|2,0,0]=4 693 B12R1.410 O=CC1CCC=CCCCCC1 Amb25289087 [1,0,0,1,0,0|0,0,2]=4 694 B12R1.410 ON=C1CCCCCCCCC1 Amb17671029 [1,0,0,1,0,0|1,0,1]=4 695 B12R1.1414 O=C=NCCC1CCCCCC1 Amb25222900 [1,0,0,1,0,0|1,0,1]=4 696 B12R1.1414 O=CNCCC1CCCCCC1 Amb24692921 [1,0,0,1,0,0|1,0,0]=3 697 B12R1.1414 O=CNCCN1CCCCCC1 Amb25150816 [1,0,0,1,0,0|2,0,0]=4 698 B12R1.1414 O=C\C=C\CC1CCCCCC1 Amb24405967 [1,0,0,1,0,0|0,0,2]=4 699 B12R1.7 CCCC#CCC1CCC(=O)O1 Amb22172847 [1,0,0,1,0,0|0,0,2]=4 700 B12R1.7 CCCCCCC1NC(=O)CS1 Amb22442619 [1,0,0,1,0,0|2,0,0]=4 701 B12R1.7 CCCCCC[C@@H]1CCC(=O)O1 Amb18511855 [1,0,0,1,0,0|0,0,0]=2 702 B12R1.7 CC\C=C/CCC1CCC(=O)O1 Amb22353125 [1,0,0,1,0,0|0,0,2]=4 703 B12R1.28 CC\C=C/CC1CCCC(=O)O1 Amb21520399 [1,0,0,1,0,0|0,0,2]=4 704 B12R1.28 CC\C=C\CC1CCCC(=O)O1 Amb25227687 [1,0,0,1,0,0|0,0,2]=4 705 B12R1.28 C\C=C\CCC1CCCC(=O)O1 Amb22731235 [1,0,0,1,0,0|0,0,2]=4 706 B12R1.75 C=CC1CCCCC1CC(O)=O Amb24423935 [1,0,0,1,0,0|0,0,2]=4 707 B12R1.75 C=C[C@H]1CCCC[C@@H]1CC(O)=O Amb24617762 [1,0,0,1,0,0|0,0,2]=4 708 B12R1.75 CCC1=CCCCC1CC(O)=O Amb25363222 [1,0,0,1,0,0|0,0,2]=4 709 B12R1.75 CCC1CCCCC1=CC(O)=O Amb25152411 [1,0,0,1,0,0|0,0,2]=4 710 B12R1.75 CCC1CCCCC1CC(O)=O Amb25152261 [1,0,0,1,0,0|0,0,0]=2 711 B12R1.75 CCC1CCCCC1NC(N)=O Amb18801890 [1,0,0,1,0,0|2,0,0]=4 712 B12R1.75 CCC1CCCCN1CC(=O)Cl Amb17143064 [1,0,0,1,0,0|2,0,0]=4 713 B12R1.75 CCC1CCCCN1CC(=O)N Amb17142913 [1,0,0,1,0,0|2,0,0]=4 714 B12R1.75 CCC1CNCCC1CC(=O)Cl Amb24398670 [1,0,0,1,0,0|2,0,0]=4 715 B12R1.75 CCC1NCCCC1CC(O)=O Amb24753781 [1,0,0,1,0,0|1,0,0]=3 716 B12R1.75 CCN1CCCCC1CC(O)=O Amb18979527 [1,0,0,1,0,0|1,0,0]=3 717 B12R1.75 CC[C@@H]1NCCC[C@H]1CC(O)=O Amb18198537 [1,0,0,1,0,0|1,0,0]=3 718 B12R1.75 COC1CCCCC1CC(C)=O Amb25112608 [1,0,0,1,0,0|2,0,0]=4 719 B12R1.75 COC1CCCCC1CC(O)=O Amb18647650 [1,0,0,1,0,0|1,0,0]=3 720 B12R1.75 COC1CCCOC1CC(O)=O Amb25101656 [1,0,0,1,0,0|2,0,0]=4 721 B12R1.75 COC1CCOCC1CC(O)=O Amb18197607 [1,0,0,1,0,0|2,0,0]=4 722 B12R1.75 COC1CCSCC1CC(O)=O Amb18190928 [1,0,0,1,0,0|2,0,0]=4 723 B12R1.75 COC1COCCC1CC(O)=O Amb18197629 [1,0,0,1,0,0|2,0,0]=4 724 B12R1.75 COC1CSCCC1CC(O)=O Amb18189240 [1,0,0,1,0,0|2,0,0]=4 725 B12R1.75 COC1OCCCC1CC(O)=O Amb18197635 [1,0,0,1,0,0|2,0,0]=4 726 B12R1.75 CO[C@H]1CCCC[C@@H]1CC(O)=O Amb24710034 [1,0,0,1,0,0|1,0,0]=3 727 B12R1.75 C\C=C/1\CCCCC1CC(O)=O Amb24741726 [1,0,0,1,0,0|0,0,2]=4 728 B12R1.75 N#CC1CCCCC1CC(O)=O Amb18827227 [1,0,0,1,0,0|1,0,1]=4 729 B12R1.75 NCC1CCCCC1CC(=O)O Amb10843836 [1,0,0,1,0,0|1,0,0]=3 730 B12R1.75 NCC1CCCCN1CC(O)=O Amb18982971 [1,0,0,1,0,0|2,0,0]=4 731 B12R1.75 OC(=O)CN1CCCCC1CBr Amb21860454 [1,0,0,1,0,0|2,0,0]=4 732 B12R1.75 OC(=O)CN1CCCCC1CCl Amb21860333 [1,0,0,1,0,0|2,0,0]=4 733 B12R1.75 OC(=O)CN1CCCCC1CI Amb21860478 [1,0,0,1,0,0|2,0,0]=4 734 B12R1.75 OC(=O)C[C@H]1CCCC[C@@H]1C=O Amb24595748 [1,0,0,1,0,0|1,0,1]=4 735 B12R1.75 OCC1CCCCN1CC(O)=O Amb18294605 [1,0,0,1,0,0|2,0,0]=4 736 B12R1.75 OC[C@H]1CCCCN1CC(O)=O Amb24397069 [1,0,0,1,0,0|2,0,0]=4 737 B12R1.81 COC1CCCC1NCC(O)=O Amb18807777 [1,0,0,1,0,0|2,0,0]=4 738 B12R1.125 C=C1CCCCC1CCC(O)=O Amb25700911 [1,0,0,1,0,0|0,0,2]=4 739 B12R1.125 CC(=O)CCC1CCCCC1O Amb25027519 [1,0,0,1,0,0|2,0,0]=4 740 B12R1.125 CC(=O)CCC1CCCCN1C Amb25034626 [1,0,0,1,0,0|2,0,0]=4 741 B12R1.125 CC1CCCCC1=NCC(O)=O Amb24580502 [1,0,0,1,0,0|1,0,1]=4 742 B12R1.125 CC1CCCCC1CCC(C)=O Amb25730309 [1,0,0,1,0,0|1,0,0]=3 743 B12R1.125 CC1CCCCC1CCC(O)=O Amb18647427 [1,0,0,1,0,0|0,0,0]=2 744 B12R1.125 CC1CCCCC1CNC(C)=O Amb25294550 [1,0,0,1,0,0|2,0,0]=4 745 B12R1.125 CC1CCCCC1CNC(N)=O Amb18793749 [1,0,0,1,0,0|2,0,0]=4 746 B12R1.125 CC1CCCCC1OCC(N)=O Amb18802286 [1,0,0,1,0,0|2,0,0]=4 747 B12R1.125 CC1CCCCC1\C=C\C(O)=O Amb24546661 [1,0,0,1,0,0|0,0,2]=4 748 B12R1.125 CC1CCCCN1CCC(O)=O Amb21953915 [1,0,0,1,0,0|1,0,0]=3 749 B12R1.125 CC1CNCCN1CCC(O)=O Amb18300045 [1,0,0,1,0,0|2,0,0]=4 750 B12R1.125 CC1COCCC1NCC(O)=O Amb25693455 [1,0,0,1,0,0|2,0,0]=4 751 B12R1.125 CC1NCCCC1NCC(O)=O Amb25302143 [1,0,0,1,0,0|2,0,0]=4 752 B12R1.125 CC1SCCCC1OCC(O)=O Amb25117392 [1,0,0,1,0,0|2,0,0]=4 753 B12R1.125 C[C@H]1CCCC[C@@H]1CCC(C)=O Amb24689550 [1,0,0,1,0,0|1,0,0]=3 754 B12R1.125 ClC(=O)CCN1CCCCC1C Amb17143073 [1,0,0,1,0,0|2,0,0]=4 755 B12R1.125 NC(=O)CCN1CCCCC1C Amb17142919 [1,0,0,1,0,0|2,0,0]=4 756 B12R1.125 NC(=O)CNC1CCCCC1C Amb1112866 [1,0,0,1,0,0|2,0,0]=4 757 B12R1.125 NC1CCCCC1NCC(O)=O Amb25714554 [1,0,0,1,0,0|2,0,0]=4 758 B12R1.125 NC1CCCCC1OCC(O)=O Amb24488516 [1,0,0,1,0,0|2,0,0]=4 759 B12R1.125 N[C@@H]1CCCC[C@H]1NCC(O)=O Amb24512945 [1,0,0,1,0,0|2,0,0]=4 760 B12R1.125 N[C@@H]1CCCC[C@H]1OCC(O)=O Amb24069129 [1,0,0,1,0,0|2,0,0]=4 761 B12R1.125 N[C@H]1CCCC[C@@H]1CCC(O)=O Amb25302248 [1,0,0,1,0,0|1,0,0]=3 762 B12R1.125 N[C@H]1CCCC[C@@H]1OCC(O)=O Amb24069130 [1,0,0,1,0,0|2,0,0]=4 763 B12R1.125 N[C@H]1CCCC[C@H]1CCC(O)=O Amb25295431 [1,0,0,1,0,0|1,0,0]=3 764 B12R1.125 OC(=O)CCC1CCCCN1C Amb10607785 [1,0,0,1,0,0|1,0,0]=3 765 B12R1.125 OC(=O)CCC1CCCCN1C Amb13949149 [1,0,0,1,0,0|1,0,0]=3 766 B12R1.125 OC(=O)COC1CCCCC1F Amb24496996 [1,0,0,1,0,0|2,0,0]=4 767 B12R1.125 OC(=O)CSC1CCCCC1C Amb17594900 [1,0,0,1,0,0|1,0,0]=3 768 B12R1.125 OC(=O)CSC1CCCCC1O Amb10808762 [1,0,0,1,0,0|2,0,0]=4 769 B12R1.125 OC1CCCCC1NCC(O)=O Amb18990895 [1,0,0,1,0,0|2,0,0]=4 770 B12R1.125 OC1CCCCC1OCC(O)=O Amb24465502 [1,0,0,1,0,0|2,0,0]=4 771 B12R1.125 OC1CCCCN1CCC(O)=O Amb25848698 [1,0,0,1,0,0|2,0,0]=4 772 B12R1.125 OC1CCCNC1CCC(O)=O Amb25258833 [1,0,0,1,0,0|2,0,0]=4 773 B12R1.125 O[C@H]1CCCC[C@@H]1CCC(O)=O Amb25179269 [1,0,0,1,0,0|1,0,0]=3 774 B12R1.125 O[C@H]1CCCC[C@@H]1SCC(O)=O Amb25286930 [1,0,0,1,0,0|2,0,0]=4 775 B12R1.130 CN1CCCC1CNCC(O)=O Amb22226811 [1,0,0,1,0,0|2,0,0]=4 776 B12R1.130 CN1CCCC1COCC(O)=O Amb21861056 [1,0,0,1,0,0|2,0,0]=4 777 B12R1.130 CN1CCC[C@H]1CNCC(O)=O Amb22226852 [1,0,0,1,0,0|2,0,0]=4 778 B12R1.130 CN1CCC[C@H]1COCC(O)=O Amb22224778 [1,0,0,1,0,0|2,0,0]=4 779 B12R1.141 CC1CC(=O)CCCCCCC1 Amb25373271 [1,0,0,1,0,0|1,0,0]=3 780 B12R1.170 CCCC1CCCCCC(=O)N1 Amb25035234 [1,0,0,1,0,0|1,0,0]=3 781 B12R1.170 CNCC1CC(=O)CCCCC1 Amb24638922 [1,0,0,1,0,0|2,0,0]=4 782 B12R1.170 NCCC1CCCCCC(=O)N1 Amb25701693 [1,0,0,1,0,0|2,0,0]=4 783 B12R1.210 CC(=O)CC1CCCCCC1O Amb25134615 [1,0,0,1,0,0|2,0,0]=4 784 B12R1.210 CC1CCCCCC1NC(N)=O Amb24483653 [1,0,0,1,0,0|2,0,0]=4 785 B12R1.210 CC1CCCCCN1CC(C)=O Amb25836787 [1,0,0,1,0,0|2,0,0]=4 786 B12R1.210 CC1CCCCCN1CC(O)=O Amb25247054 [1,0,0,1,0,0|1,0,0]=3 787 B12R1.210 C[C@@H]1NCCCC[C@H]1CC(O)=O Amb18198536 [1,0,0,1,0,0|1,0,0]=3 788 B12R1.210 OC(=O)CC1CCCCCC1=O Amb18825694 [1,0,0,1,0,0|1,0,1]=4 789 B12R1.210 OC1CCCCCC1CC(O)=O Amb18198284 [1,0,0,1,0,0|1,0,0]=3 790 B12R1.212 C=C1CCCCCCC1C(O)=O Amb24634098 [1,0,0,1,0,0|0,0,2]=4 791 B12R1.212 CC(=O)C1CCCCCCC1N Amb24737955 [1,0,0,1,0,0|2,0,0]=4 792 B12R1.212 CN1CCCCCCC1C(O)=O Amb25816705 [1,0,0,1,0,0|1,0,0]=3 793 B12R1.212 NC(=O)[C@@H]1CCCCCC[C@H]1O Amb24512072 [1,0,0,1,0,0|2,0,0]=4 794 B12R1.212 NC1CCCCCCC1C(O)=O Amb20667806 [1,0,0,1,0,0|1,0,0]=3 795 B12R1.212 NC1CCCCCCC1C(O)=O Amb22059713 [1,0,0,1,0,0|1,0,0]=3 796 B12R1.212 N[C@H]1CCCCCC[C@@H]1C(O)=O Amb25245343 [1,0,0,1,0,0|1,0,0]=3 797 B12R1.212 OC(=O)[C@@H]1CCCCCC[C@@H]1N Amb1993854 [1,0,0,1,0,0|1,0,0]=3 798 B12R1.212 OC(=O)[C@H]1CCCCCC[C@H]1N Amb1993853 [1,0,0,1,0,0|1,0,0]=3 799 B12R1.212 O[C@@H]1CCCCCC[C@@H]1C(O)=O Amb24692827 [1,0,0,1,0,0|1,0,0]=3 800 B12R1.212 O[C@H]1CCCCCC[C@H]1C(O)=O Amb24739651 [1,0,0,1,0,0|1,0,0]=3 801 B12R1.252 CC(=O)OCCC1CCCCC1 Amb22336360 [1,0,0,1,0,0|2,0,0]=4 802 B12R1.252 NC(=O)CCCN1CCCCC1 Amb17142921 [1,0,0,1,0,0|2,0,0]=4 803 B12R1.252 NC(=O)CNCC1CCCCC1 Amb1113547 [1,0,0,1,0,0|2,0,0]=4 804 B12R1.252 NC(=O)NCCC1CCCCC1 Amb18801889 [1,0,0,1,0,0|2,0,0]=4 805 B12R1.252 OB(O)CCCC1CCCCC1 Amb21927851 [1,0,0,1,0,0|1,0,1]=4 806 B12R1.252 OC(=O)CCC=C1CCCCC1 Amb18647035 [1,0,0,1,0,0|0,0,2]=4 807 B12R1.252 OC(=O)CCCC1CCCCC1 Amb22360661 [1,0,0,1,0,0|0,0,0]=2 808 B12R1.252 OC(=O)CCCC1CCCCN1 Amb1101084 [1,0,0,1,0,0|1,0,0]=3 809 B12R1.252 OC(=O)CCCC1CCCCN1 Amb22284114 [1,0,0,1,0,0|1,0,0]=3 810 B12R1.252 OC(=O)CCCC1CCNCC1 Amb1101085 [1,0,0,1,0,0|1,0,0]=3 811 B12R1.252 OC(=O)CCCN1CCNCC1 Amb17479003 [1,0,0,1,0,0|2,0,0]=4 812 B12R1.252 OC(=O)CCCN1CCOCC1 Amb21954071 [1,0,0,1,0,0|2,0,0]=4 813 B12R1.252 OC(=O)CCN=C1CCCCC1 Amb24405347 [1,0,0,1,0,0|1,0,1]=4 814 B12R1.252 OC(=O)CCNC1CCNCC1 Amb24271198 [1,0,0,1,0,0|2,0,0]=4 815 B12R1.252 OC(=O)CCOC1CCCCO1 Amb24120644 [1,0,0,1,0,0|2,0,0]=4 816 B12R1.252 OC(=O)CCOC1CCOCC1 Amb18790274 [1,0,0,1,0,0|2,0,0]=4 817 B12R1.252 [O-]C(=O)CCCC1CCCCC1 Amb10601869 [1,0,0,1,0,0|0,0,1]=3 818 B12R1.252 [O-]C(=O)CCCC1CCCCC1 Amb22053703 [1,0,0,1,0,0|0,0,1]=3 819 B12R1.255 OC(=O)C#CCCC1CCCC1 Amb25089799 [1,0,0,1,0,0|0,0,2]=4 820 B12R1.255 OC(=O)CCCCC1SSCC1 Amb1152511 [1,0,0,1,0,0|2,0,0]=4 821 B12R1.255 OC(=O)CCCCN1CCCC1 Amb10610408 [1,0,0,1,0,0|1,0,0]=3 822 B12R1.255 OC(=O)CCCC[C@@H]1SSCC1 Amb17616537 [1,0,0,1,0,0|2,0,0]=4 823 B12R1.255 OC(=O)CCCNC1CCCC1 Amb1110062 [1,0,0,1,0,0|1,0,0]=3 824 B12R1.255 OC(=O)CSCCN1CCCC1 Amb13949167 [1,0,0,1,0,0|2,0,0]=4 825 B12R1.255 O[13C](=O)[13CH2]CC[13CH2][13CH]1CCSS1 Amb22353982 [1,0,0,1,0,0|2,0,0]=4 826 B12R1.283 C#CCC1CCCCC1C(O)=O Amb24685505 [1,0,0,1,0,0|0,0,2]=4 827 B12R1.283 C=CCC1CCCCC1C(O)=O Amb18646999 [1,0,0,1,0,0|0,0,2]=4 828 B12R1.283 C=CC[C@@H]1CCCC[C@H]1C(O)=O Amb25227522 [1,0,0,1,0,0|0,0,2]=4 829 B12R1.283 CCCC1CC=CCC1C(O)=O Amb24415893 [1,0,0,1,0,0|0,0,2]=4 830 B12R1.283 CCCC1CCCCN1C(C)=O Amb25758684 [1,0,0,1,0,0|2,0,0]=4 831 B12R1.283 CCCC1NCCCC1C(N)=O Amb25790873 [1,0,0,1,0,0|2,0,0]=4 832 B12R1.283 CCCC1OCCCC1C(=O)O Amb10609660 [1,0,0,1,0,0|1,0,0]=3 833 B12R1.283 CCCC1OCCCC1C(N)=O Amb24350049 [1,0,0,1,0,0|2,0,0]=4 834 B12R1.283 CCCN1CCCCC1C(=O)O Amb10609773 [1,0,0,1,0,0|1,0,0]=3 835 B12R1.283 CCCN1CCCCC1C(=O)O Amb1110568 [1,0,0,1,0,0|1,0,0]=3 836 B12R1.283 CCCN1CCNCC1C(O)=O Amb18825347 [1,0,0,1,0,0|2,0,0]=4 837 B12R1.283 CCC[C@H]1CCCCN1C(C)=O Amb25707921 [1,0,0,1,0,0|2,0,0]=4 838 B12R1.283 CCNC1CCCCC1C(O)=O Amb24426291 [1,0,0,1,0,0|1,0,0]=3 839 B12R1.283 CCN[C@@H]1CCCC[C@@H]1C(O)=O Amb24512176 [1,0,0,1,0,0|1,0,0]=3 840 B12R1.283 CCSC1CCCCC1C(O)=O Amb18303075 [1,0,0,1,0,0|1,0,0]=3 841 B12R1.283 CNCC1CCCCC1C(O)=O Amb24436013 [1,0,0,1,0,0|1,0,0]=3 842 B12R1.283 NCCN1CCCCC1C(O)=O Amb24740282 [1,0,0,1,0,0|2,0,0]=4 843 B12R1.283 OC(=O)C1CCCCC1CCF Amb25202422 [1,0,0,1,0,0|1,0,0]=3 844 B12R1.283 OC(=O)C1CCCCN1CCF Amb24626977 [1,0,0,1,0,0|2,0,0]=4 845 B12R1.283 OC(=O)N1CCCCC1CCCl Amb24089605 [1,0,0,1,0,0|2,0,0]=4 846 B12R1.289 COCC1CCCN1CC(O)=O Amb21860507 [1,0,0,1,0,0|2,0,0]=4 847 B12R1.321 CCCCC1CC(=O)NCCC1 Amb25785211 [1,0,0,1,0,0|2,0,0]=4 848 B12R1.321 CCCCC1CCCCC(=N)N1 Amb24636858 [1,0,0,1,0,0|2,0,0]=4 849 B12R1.321 CCCCC1CCCCC(=O)O1 Amb22230135 [1,0,0,1,0,0|0,0,0]=2 850 B12R1.321 CCCCC1CCCCC(O)C1 Amb24435562 [1,0,0,1,0,0|1,0,1]=4 851 B12R1.321 CCCCC=1CCCCC(=O)C1 Amb24723928 [1,0,0,1,0,0|1,0,1]=4 852 B12R1.321 CCCC[C@@H]1CC(=O)CCCC1 Amb24584524 [1,0,0,1,0,0|1,0,0]=3 853 B12R1.321 CSCCC1CC(=O)CCCC1 Amb25760530 [1,0,0,1,0,0|2,0,0]=4 854 B12R1.321 NCCCC1CCCCC(=O)N1 Amb18825523 [1,0,0,1,0,0|2,0,0]=4 855 B12R1.321 OCCCC1CCCCC(=O)N1 Amb18825414 [1,0,0,1,0,0|2,0,0]=4 856 B12R1.405 C=CC1CCCCCC1C(O)=O Amb24358015 [1,0,0,1,0,0|0,0,2]=4 857 B12R1.405 C=C[C@H]1CCCCC[C@@H]1C(O)=O Amb25269439 [1,0,0,1,0,0|0,0,2]=4 858 B12R1.405 CCC1CCCCCC1C(O)=O Amb25336577 [1,0,0,1,0,0|0,0,0]=2 859 B12R1.405 CCC1CCCCCN1C(=O)Cl Amb24454511 [1,0,0,1,0,0|2,0,0]=4 860 B12R1.405 CCC1CCCCCN1C(C)=O Amb25035126 [1,0,0,1,0,0|2,0,0]=4 861 B12R1.405 CCN1CCCCCC1C(O)=O Amb23585538 [1,0,0,1,0,0|1,0,0]=3 862 B12R1.405 CC[C@@H]1CCCCC[C@@H]1C(C)=O Amb25373139 [1,0,0,1,0,0|1,0,0]=3 863 B12R1.405 CC[C@@H]1NCCCC[C@H]1C(O)=O Amb18198539 [1,0,0,1,0,0|1,0,0]=3 864 B12R1.405 CO[C@@H]1CCCCC[C@@H]1C(O)=O Amb25361094 [1,0,0,1,0,0|1,0,0]=3 865 B12R1.405 CO[C@@H]1CCCCC[C@H]1C(O)=O Amb24656000 [1,0,0,1,0,0|1,0,0]=3 866 B12R1.405 CSC1CCCCCC1C(O)=O Amb18967402 [1,0,0,1,0,0|1,0,0]=3 867 B12R1.405 N#CC1CCCCCC1C(O)=O Amb25761465 [1,0,0,1,0,0|1,0,1]=4 868 B12R1.405 OCC1CCCCCC1C(O)=O Amb25799614 [1,0,0,1,0,0|1,0,0]=3 869 B12R1.407 COC1CC(=O)CCCCCC1 Amb25718358 [1,0,0,1,0,0|2,0,0]=4 870 B12R1.522 CC#CCCC1CCC1C(O)=O Amb25795809 [1,0,0,1,0,0|0,0,2]=4 871 B12R1.1335 CC(=O)N1CCCCCCCC1 Amb25169087 [1,0,0,1,0,0|2,0,0]=4 872 B12R1.1335 CC(O)C1CCCCCCCC1 Amb25092009 [1,0,0,1,0,0|1,0,1]=4 873 B12R1.1335 NC(=O)C1CCCCCCCC1 Amb25685314 [1,0,0,1,0,0|1,0,0]=3 874 B12R1.1335 NC(=O)N1CCCCCCCC1 Amb25087978 [1,0,0,1,0,0|2,0,0]=4 875 B12R1.1335 OC(=O)C1CCCCCCCC1 Amb25034740 [1,0,0,1,0,0|0,0,0]=2 876 B12R1.1335 OC(=O)C1CCCCCCNN1 Amb24574710 [1,0,0,1,0,0|2,0,0]=4 877 B12R1.1343 CC(=O)CCN1CCCCCC1 Amb1136685 [1,0,0,1,0,0|2,0,0]=4 878 B12R1.1343 CC(=O)COC1CCCCCC1 Amb18793663 [1,0,0,1,0,0|2,0,0]=4 879 B12R1.1343 ClC(=O)CCN1CCCCCC1 Amb17143075 [1,0,0,1,0,0|2,0,0]=4 880 B12R1.1343 NC(=O)CCC1CCCCCC1 Amb25061418 [1,0,0,1,0,0|1,0,0]=3 881 B12R1.1343 NC(=O)CCN1CCCCCC1 Amb17142920 [1,0,0,1,0,0|2,0,0]=4 882 B12R1.1343 NC(=O)CCN1CCCCCC1 Amb22469065 [1,0,0,1,0,0|2,0,0]=4 883 B12R1.1343 NC(=O)CNC1CCCCCC1 Amb1114001 [1,0,0,1,0,0|2,0,0]=4 884 B12R1.1343 NC(=O)COC1CCCCCC1 Amb18802288 [1,0,0,1,0,0|2,0,0]=4 885 B12R1.1343 OC(=O)C#CC1CCCCCC1 Amb24556561 [1,0,0,1,0,0|0,0,2]=4 886 B12R1.1343 OC(=O)CCC1CCCCCC1 Amb18825578 [1,0,0,1,0,0|0,0,0]=2 887 B12R1.1343 OC(=O)CCC1CCCCCN1 Amb18198528 [1,0,0,1,0,0|1,0,0]=3 888 B12R1.1343 OC(=O)CCC1CCCCSS1 Amb25326088 [1,0,0,1,0,0|2,0,0]=4 889 B12R1.1343 OC(=O)CCC1CCCNCC1 Amb18198557 [1,0,0,1,0,0|1,0,0]=3 890 B12R1.1343 OC(=O)CCC1CCCOCC1 Amb18825358 [1,0,0,1,0,0|1,0,0]=3 891 B12R1.1343 OC(=O)CCC1CCCSCC1 Amb18820668 [1,0,0,1,0,0|1,0,0]=3 892 B12R1.1343 OC(=O)CCC=1CCCCCC1 Amb25209946 [1,0,0,1,0,0|0,0,2]=4 893 B12R1.1343 OC(=O)CCN1CCCOCC1 Amb19000940 [1,0,0,1,0,0|2,0,0]=4 894 B12R1.1343 OC(=O)CCN1CCCSCC1 Amb18977928 [1,0,0,1,0,0|2,0,0]=4 895 B12R1.1343 OC(=O)CNN1CCCCCC1 Amb25111269 [1,0,0,1,0,0|2,0,0]=4 896 B12R1.1343 OC(=O)COC1CCCCCC1 Amb18972071 [1,0,0,1,0,0|1,0,0]=3 897 B12R1.1343 OC(=O)CSC1CCCCCC1 Amb24493198 [1,0,0,1,0,0|1,0,0]=3 898 B12R1.1343 OC(=O)\C=C\C1CCCCCC1 Amb24715822 [1,0,0,1,0,0|0,0,2]=4 899 B12R1.1392 CC(=C)CC1CCCCCCC1 Amb24488603 [1,0,0,1,0,0|2,0,0]=4 900 B12R1.1392 NC(=O)CC1CCCCCCC1 Amb25798922 [1,0,0,1,0,0|1,0,0]=3 901 B12R1.1392 NC(=O)CN1CCCCCCC1 Amb18806561 [1,0,0,1,0,0|2,0,0]=4 902 B12R1.1392 OC(=O)CC1CCCCCC=C1 Amb25059238 [1,0,0,1,0,0|0,0,2]=4 903 B12R1.1392 OC(=O)CC=1CCCCCCC1 Amb25751340 [1,0,0,1,0,0|0,0,2]=4 904 B12R1.1755 CCCCCC[C@@H]1C[C@H]1B(O)O Amb24329634 [1,0,0,1,0,0|1,0,1]=4 905 B14R1.220 CCCCCCC1NC(CS1)C(=O)O Amb2435528 [0,1,0,1,0,0|1,0,0]=3 906 B14R1.333 NC1CCCCCCC1SCC(N)=O Amb24507705 [0,1,0,1,0,0|2,0,0]=4 907 B14R1.333 OC1CCCCCCC1CCC(O)=O Amb24378159 [0,1,0,1,0,0|0,0,0]=2 908 B14R1.420 O=C(C1CCCCC1)NCCC(=O)O Amb1121032 [0,1,0,1,0,0|1,0,1]=4 909 B14R1.1454 OC(=O)\C=C\CN1CCCCCCC1 Amb18296450 [0,1,0,1,0,0|0,0,2]=4 910 B14R1.1454 OC(=O)\C=C\NC1CCCCCCC1 Amb24658938 [0,1,0,1,0,0|0,0,2]=4 911 B14R1.4456 CC1CCCCC1(O)C\C=C\C(O)=O Amb18130516 [0,1,0,1,0,0|0,0,2]=4 912 B14R1.4456 C[C@H]1CCCC[C@@]1(O)C\C=C\C(O)=O Amb25233395 [0,1,0,1,0,0|0,0,2]=4 913 B14R1.4795 CC1CCCCC(C)C1=CCC(O)=O Amb25685342 [0,1,0,1,0,0|0,0,2]=4 914 B14R1.20828 OC(=O)\C=C\CC1(O)CCCCCC1 Amb25858119 [0,1,0,1,0,0|0,0,2]=4 915 B14R1.96 CCC1CCCCC1N\C=C\C(O)=O Amb24730088 [0,1,0,1,0,0|0,0,2]=4 916 B14R1.96 CCC1CCCCN1CCCC(=O)Cl Amb17143700 [0,1,0,1,0,0|1,0,0]=3 917 B14R1.96 CCC1CCCCN1CCCC(=O)N Amb17143194 [0,1,0,1,0,0|1,0,0]=3 918 B14R1.122 CCCCCCCCC1CCC(=O)O1 Amb10071536 [0,1,0,1,0,0|0,0,0]=2 919 B14R1.159 CC1CSCCN1CCCCC(O)=O Amb25386602 [0,1,0,1,0,0|1,0,0]=3 920 B14R1.221 CCCCCCCCCCCC1CO1 Amb24057487 [0,1,0,1,0,0|1,0,1]=4 921 B14R1.221 CCCCCCCCCCC[C@@H]1CO1 Amb22337892 [0,1,0,1,0,0|1,0,1]=4 922 B14R1.269 CCCC1CCCCCC1NC(=O)C Amb2227902 [0,1,0,1,0,0|1,0,0]=3 923 B14R1.269 CCC[C@@H]1CCCCC[C@@H]1NC(C)=O Amb24629779 [0,1,0,1,0,0|1,0,0]=3 924 B14R1.422 NC(=O)CCCCCC1CCCCC1 Amb22340011 [0,1,0,1,0,0|1,0,0]=3 925 B14R1.422 OC(=O)CCCC#CC1CCCCC1 Amb25774995 [0,1,0,1,0,0|0,0,1]=3 926 B14R1.422 OC(=O)CCCCCC1CCCCC1 Amb22230076 [0,1,0,1,0,0|0,0,0]=2 927 B14R1.422 OC(=O)CCCSCC1CCCNC1 Amb17503127 [0,1,0,1,0,0|1,0,0]=3 928 B14R1.422 OC(=O)CCCSCC1CCNCC1 Amb17503028 [0,1,0,1,0,0|1,0,0]=3 929 B14R1.422 OC(=O)CCNCCC1=CCCCC1 Amb17309052 [0,1,0,1,0,0|0,0,2]=4 930 B14R1.422 OC(=O)CNCCCN1CCCCC1 Amb20152206 [0,1,0,1,0,0|1,0,0]=3 931 B14R1.427 OC(=O)CCNCCCN1CCCC1 Amb19090342 [0,1,0,1,0,0|1,0,0]=3 932 B14R1.498 CSCC1CCCN1CCCC(O)=O Amb25387490 [0,1,0,1,0,0|1,0,0]=3 933 B14R1.651 C#CCCC1CCCCCC1C(O)=O Amb25165528 [0,1,0,1,0,0|0,0,1]=3 934 B14R1.651 C#CCCN1CCCCCC1C(O)=O Amb25774429 [0,1,0,1,0,0|0,0,2]=4 935 B14R1.651 CC#CCC1CCCCCC1C(O)=O Amb25165527 [0,1,0,1,0,0|0,0,1]=3 936 B14R1.651 CC#CCN1CCCCCC1C(O)=O Amb25257396 [0,1,0,1,0,0|0,0,2]=4 937 B14R1.653 CCCCC1CCC=CCCC(=O)N1 Amb24443708 [0,1,0,1,0,0|1,0,1]=4 938 B14R1.653 OCCCC1CC=CCCCC(=O)O1 Amb25136300 [0,1,0,1,0,0|0,0,2]=4 939 B14R1.786 CC#CCN1CCCCC1CC(O)=O Amb19063514 [0,1,0,1,0,0|0,0,2]=4 940 B14R1.786 CCCCN1CCCCC1CC(O)=O Amb19056735 [0,1,0,1,0,0|0,0,0]=2 941 B14R1.854 CSC1CCCCCCC1NC(C)=O Amb25165897 [0,1,0,1,0,0|2,0,0]=4 942 B14R1.903 CCOCCN1CCCCC1C(O)=O Amb24770122 [0,1,0,1,0,0|1,0,0]=3 943 B14R1.903 CSCCNC1CCCCC1C(N)=O Amb24271669 [0,1,0,1,0,0|2,0,0]=4 944 B14R1.1820 C=CC1CCCCCCCC1C(O)=O Amb25672397 [0,1,0,1,0,0|0,0,1]=3 945 B14R1.4408 O=C1C=CCCCCCCCCCN1 Amb24404897 [0,1,0,1,0,0|1,0,1]=4 946 B14R1.4408 O=C1CCCCCCCCCCC=C1 Amb25793577 [0,1,0,1,0,0|1,0,0]=3 947 B14R1.4408 O=C1CCCCCCCNCCCN1 Amb25037669 [0,1,0,1,0,0|1,0,0]=3 948 B14R1.4408 O=C1CCNCCCCNCCCN1 Amb25664304 [0,1,0,1,0,0|2,0,0]=4 949 B14R1.4408 O=C1OCCCCCCCCCCO1 Amb24459843 [0,1,0,1,0,0|0,0,0]=2 950 B14R1.4408 OC1CCCCCCCCCCC=C1 Amb25855851 [0,1,0,1,0,0|1,0,1]=4 951 B14R1.4408 OC1CCCCCCCCCCCN1 Amb25139380 [0,1,0,1,0,0|1,0,1]=4 952 B14R1.4408 O[C@H]1CCCCCCCCCCC=C1 Amb25098681 [0,1,0,1,0,0|1,0,1]=4 953 B14R1.4408 S=C1CCCCCCCCCCCN1 Amb25835726 [0,1,0,1,0,0|1,1,0]=4 954 B14R1.4728 CCCCCCCCC1CC1C(=O)O Amb1033024 [0,1,0,1,0,0|0,0,0]=2 955 B14R1.5254 C#CCN1CCCCCCC1C(O)=O Amb24731020 [0,1,0,1,0,0|0,0,2]=4 956 B14R1.5254 CCCN1CCCCCCC1C(O)=O Amb25354108 [0,1,0,1,0,0|0,0,0]=2 957 B14R1.5254 OC(=O)C1CCCCCCN1CCF Amb25715628 [0,1,0,1,0,0|1,0,0]=3 958 B14R1.5254 OCCN1CCCCCCC1C(O)=O Amb24418260 [0,1,0,1,0,0|1,0,0]=3 959 B14R1.6335 CC(=O)CCN1CCCCCCCC1 Amb24351727 [0,1,0,1,0,0|1,0,0]=3 960 B14R1.6335 CC(O)CCN1CCCCCCCC1 Amb25793669 [0,1,0,1,0,0|1,0,1]=4 961 B14R1.6335 NC(=N)CCN1CCCCCCCC1 Amb25060830 [0,1,0,1,0,0|2,0,0]=4 962 B14R1.6335 NC(=O)CCN1CCCCCCCC1 Amb25169053 [0,1,0,1,0,0|1,0,0]=3 963 B14R1.6335 OC(=O)CCN1CCCCCCCC1 Amb25298722 [0,1,0,1,0,0|0,0,0]=2 964 B14R1.6343 NC(=O)CSCCN1CCCCCC1 Amb21983543 [0,1,0,1,0,0|2,0,0]=4 965 B14R1.6343 OC(=O)CCCCN1CCNCCC1 Amb17479032 [0,1,0,1,0,0|1,0,0]=3 966 B14R1.6343 OC(=O)CNCCN1CCCCCC1 Amb20573254 [0,1,0,1,0,0|1,0,0]=3 967 B14R1.6343 OC(=O)CSCCN1CCCCCC1 Amb21988835 [0,1,0,1,0,0|1,0,0]=3 968 B14R1.6414 CC(O)C1CCCCCCCCCC1 Amb25107604 [0,1,0,1,0,0|1,0,1]=4 969 B14R1.6414 OC(=O)C1CC=CCCCCCCC1 Amb24498139 [0,1,0,1,0,0|0,0,1]=3 970 B14R1.6444 OC(=O)CC1CCCCCCCCC1 Amb25125214 [0,1,0,1,0,0|0,0,0]=2 971 B14R1.6444 OC(=O)CC=1CCCCCCCCC1 Amb24498388 [0,1,0,1,0,0|0,0,1]=3 972 B14R1.115 CC[C@@H]1[C@@H](CC(O)=O)CCCCN1C Amb18811008 [0,1,0,1,0,0|1,0,0]=3 973 B14R1.468 CCCC1CN(CCO1)CCC(O)=O Amb25387421 [0,1,0,1,0,0|2,0,0]=4 974 B14R1.623 CCCC(=O)[C@@H]1CCCC[C@H]1C(O)=O Amb23558955 [0,1,0,1,0,0|0,0,1]=3 975 B14R1.623 CCNC(=O)[C@@H]1CCCC[C@H]1C(O)=O Amb25200941 [0,1,0,1,0,0|1,0,1]=4 976 B14R1.4928 CN1CCCN(CCC(O)=O)C(C)C1 Amb25689322 [0,1,0,1,0,0|2,0,0]=4 977 B14R1.4960 OC1CC=CCCCC(=O)OCCC1 Amb24534779 [0,1,0,1,0,0|0,0,2]=4 978 B14R1.4960 OC1CCCCCCC(=O)OCC=C1 Amb25357554 [0,1,0,1,0,0|0,0,2]=4 979 B14R1.6452 OC(=O)CCCCCNC(=O)C1CC1 Amb1125210 [0,1,0,1,0,0|1,0,1]=4 980 B14R1.6673 CCSC1CN(CC(O)=O)CCCC1 Amb25387444 [0,1,0,1,0,0|2,0,0]=4 981 B14R1.778 CCCCN1CC(CC(O)=O)CCC1 Amb19085186 [0,1,0,1,0,0|1,0,0]=3 982 B14R1.942 CCCCC(=O)N1CCC[C@@H]1C(O)=O Amb19038303 [0,1,0,1,0,0|1,0,1]=4 983 B14R1.1595 CC[C@@H]1NC(=O)CCC[C@H]1CC(O)=O Amb18811240 [0,1,0,1,0,0|1,0,1]=4 984 B14R1.5093 CCCN1C(CCC1=O)CCC(O)=O Amb23541268 [0,1,0,1,0,0|1,0,1]=4 985 B14R1.5842 CN1CCCCC(CCCC1)C(N)=O Amb25701740 [0,1,0,1,0,0|2,0,0]=4 986 B14R1.14542 CC1CCCCCC(O)C=CC(=O)O1 Amb25343672 [0,1,0,1,0,0|0,0,2]=4 987 B14R1.15720 CN1CCN(CCC(O)=O)C(C)CC1 Amb25334304 [0,1,0,1,0,0|2,0,0]=4 988 B14R1.228 CCCCCCC1CCN=C(O1)C=C Amb10559728 [0,1,0,1,0,0|2,0,0]=4 989 B14R1.230 CCCCCCCCC[C@@H]1O[C@H]1CO Amb24308872 [0,1,0,1,0,0|0,0,2]=4 990 B14R1.247 C=C1CCCCCCCCCCC1O Amb25796402 [0,1,0,1,0,0|1,0,0]=3 991 B14R1.247 CN1CCCCCCCCCCC1=S Amb24444297 [0,1,0,1,0,0|1,1,0]=4 992 B14R1.247 C[C@@H]1CCCCCCCCCC[C@H]1O Amb25234824 [0,1,0,1,0,0|1,0,1]=4 993 B14R1.247 NC1CCCCCCCCCCC1=O Amb25760755 [0,1,0,1,0,0|1,0,0]=3 994 B14R1.247 N[C@H]1CCCCCCCCCC[C@H]1O Amb24595408 [0,1,0,1,0,0|1,0,1]=4 995 B14R1.247 O=C1CCCCCCCCCCC1Cl Amb24093621 [0,1,0,1,0,0|1,0,0]=3 996 B14R1.247 O=C1NCCCCCCCCCC1Cl Amb25277219 [0,1,0,1,0,0|1,0,0]=3 997 B14R1.247 OC1CCCCC#CCCCCC1=O Amb24420766 [0,1,0,1,0,0|0,0,2]=4 998 B14R1.247 OC1CCCCCCCCCC=C1F Amb25732410 [0,1,0,1,0,0|1,0,1]=4 999 B14R1.247 OC1CCCCCCCCCCC1O Amb22729167 [0,1,0,1,0,0|0,0,2]=4 1000 B14R1.247 OC1CCCCCCCCCNC1=O Amb24375308 [0,1,0,1,0,0|1,0,0]=3 1001 B14R1.247 O[C@@H]1CCCCCCCCCC[C@H]1Cl Amb24561061 [0,1,0,1,0,0|1,0,1]=4 1002 B14R1.247 O[C@H]1CCCCCCCCCC[C@H]1Cl Amb25366221 [0,1,0,1,0,0|1,0,1]=4 1003 B14R1.709 CC1CCCCCC1NCC(=O)NC Amb25798713 [0,1,0,1,0,0|2,0,0]=4 1004 B14R1.709 CC1CCCCCN1CCC(=O)NN Amb25076683 [0,1,0,1,0,0|2,0,0]=4 1005 B14R1.709 COC(=O)CCC1CCCCCC1=O Amb17595252 [0,1,0,1,0,0|1,0,1]=4 1006 B14R1.716 COC(=O)C#CCCC1CCCCC1 Amb25207505 [0,1,0,1,0,0|0,0,2]=4 1007 B14R1.716 COC(=O)CCCCC1COCCO1 Amb24060694 [0,1,0,1,0,0|2,0,0]=4 1008 B14R1.716 COC(=O)CCCSC1CCNCC1 Amb17502197 [0,1,0,1,0,0|2,0,0]=4 1009 B14R1.716 COC(=O)CCOCC1CCCNC1 Amb21957656 [0,1,0,1,0,0|2,0,0]=4 1010 B14R1.716 COC(=O)CCOCC1CCNCC1 Amb21957780 [0,1,0,1,0,0|2,0,0]=4 1011 B14R1.716 COC(=O)CCSCC1CCCCN1 Amb22395632 [0,1,0,1,0,0|2,0,0]=4 1012 B14R1.716 COC(=O)CCSCC1CCNCC1 Amb22395596 [0,1,0,1,0,0|2,0,0]=4 1013 B14R1.716 COC(=O)CCSCC1CNCCC1 Amb22395611 [0,1,0,1,0,0|2,0,0]=4 1014 B14R1.716 COC(=O)CSCCC1CCCCN1 Amb22395652 [0,1,0,1,0,0|2,0,0]=4 1015 B14R1.716 COC(=O)CSCCC1CCNCC1 Amb22395700 [0,1,0,1,0,0|2,0,0]=4 1016 B14R1.716 O=C(CCl)NCCCC1CCCCC1 Amb19514479 [0,1,0,1,0,0|2,0,0]=4 1017 B14R1.837 COC(=O)CCCN1CCSCC1C Amb24271479 [0,1,0,1,0,0|2,0,0]=4 1018 B14R1.845 C#CC=1CCCCCCCCCCC1 Amb22363969 [0,1,0,1,0,0|2,0,0]=4 1019 B14R1.845 NN=C1CCCCCCCCCCC1 Amb25318680 [0,1,0,1,0,0|2,0,0]=4 1020 B14R1.845 ON=C1CCCCCCCCCCC1 Amb1635111 [0,1,0,1,0,0|1,0,0]=3 1021 B14R1.848 CCC1CCCCCN1CC(N)=NO Amb25349264 [0,1,0,1,0,0|2,0,0]=4 1022 B14R1.863 COC(=O)CNC1CCCCC1CO Amb24271627 [0,1,0,1,0,0|2,0,0]=4 1023 B14R1.1224 CCC(=O)CN1CCCCCCCC1 Amb25169081 [0,1,0,1,0,0|2,0,0]=4 1024 B14R1.1224 NNC(=O)CN1CCCCCCCC1 Amb25169080 [0,1,0,1,0,0|2,0,0]=4 1025 B14R1.1586 COC(=O)C#CCC1CCCCCC1 Amb25067530 [0,1,0,1,0,0|0,0,2]=4 1026 B14R1.1586 COC(=O)CCCN1CCCCCC1 Amb10072747 [0,1,0,1,0,0|1,0,0]=3 1027 B14R1.4811 OC1CCCCCCCCC(=O)C1=O Amb25846220 [0,1,0,1,0,0|1,0,1]=4 1028 B14R1.4889 O=C1CCCCCCCCC(=O)CC1 Amb22434392 [0,1,0,1,0,0|1,0,1]=4 1029 B14R1.7633 COC(=O)C1CCCCNCCCC1 Amb25301494 [0,1,0,1,0,0|1,0,0]=3 1030 B14R1.7684 CNC(=O)COC1CCCCCCC1 Amb25325052 [0,1,0,1,0,0|2,0,0]=4 1031 B14R1.7684 COC(=O)\C=C\C1CCCCCCC1 Amb25709518 [0,1,0,1,0,0|0,0,2]=4 1032 B14R1.7684 NCC(=O)NCC1CCCCCCC1 Amb24429721 [0,1,0,1,0,0|2,0,0]=4 1033 B14R1.7684 NNC(=O)CCN1CCCCCCC1 Amb24344933 [0,1,0,1,0,0|2,0,0]=4 1034 B14R1.9689 NCC1(O)CCCCCCCCCC1 Amb25193504 [0,1,0,1,0,0|1,0,1]=4 1035 B14R1.161 CC1CCCCC1CNC(=O)C(O)=O Amb18980003 [0,1,0,1,0,0|1,0,1]=4 1036 B14R1.328 CC(CN1CCSCCC1C)C(O)=O Amb24546105 [0,1,0,1,0,0|2,0,0]=4 1037 B14R1.328 CC(NC1CCCCCC1O)C(O)=O Amb25057992 [0,1,0,1,0,0|2,0,0]=4 1038 B14R1.328 CC(OC1CCCCCC1O)C(O)=O Amb25721300 [0,1,0,1,0,0|2,0,0]=4 1039 B14R1.328 CC1CCCCCN1CC(C)C(O)=O Amb25703525 [0,1,0,1,0,0|1,0,0]=3 1040 B14R1.328 CC1CCCCCN1CC(Cl)C(O)=O Amb24353737 [0,1,0,1,0,0|1,0,0]=3 1041 B14R1.328 CC1CCCCCN1CC(N)C(O)=O Amb24763669 [0,1,0,1,0,0|1,0,0]=3 1042 B14R1.328 CC1CCCCCN1CC(O)C(O)=O Amb24543473 [0,1,0,1,0,0|1,0,0]=3 1043 B14R1.328 CC1COCCCN1CC(C)C(O)=O Amb25230942 [0,1,0,1,0,0|2,0,0]=4 1044 B14R1.328 CC1COCCCN1CC(Cl)C(O)=O Amb24562012 [0,1,0,1,0,0|2,0,0]=4 1045 B14R1.328 CC1COCCCN1CC(N)C(O)=O Amb24568496 [0,1,0,1,0,0|2,0,0]=4 1046 B14R1.328 C[C@@H](OC1CCCCCC1O)C(O)=O Amb25186243 [0,1,0,1,0,0|2,0,0]=4 1047 B14R1.328 C[C@H](OC1CCCCCC1O)C(O)=O Amb24395558 [0,1,0,1,0,0|2,0,0]=4 1048 B14R1.328 N[C@@H](CC1CCCCCC1=O)C(O)=O Amb24468452 [0,1,0,1,0,0|1,0,1]=4 1049 B14R1.899 CC#CCCC1CCCC(N1)C(O)=O Amb25856124 [0,1,0,1,0,0|0,0,2]=4 1050 B14R1.1695 OCC1CCCCCCC(S1)C(O)=O Amb24638031 [0,1,0,1,0,0|1,0,0]=3 1051 B14R1.1722 CC(C(O)=O)N1CCCCCC1CO Amb25677843 [0,1,0,1,0,0|2,0,0]=4 1052 B14R1.1722 CCC1CCCCCN1C(=O)C(O)=O Amb24635262 [0,1,0,1,0,0|1,0,1]=4 1053 B14R1.2354 CCCCCCOC1CC(C1)C(O)=O Amb23449125 [0,1,0,1,0,0|1,0,0]=3 1054 B14R1.3135 CCC1CCCCC1NC(=O)C(O)=O Amb18978400 [0,1,0,1,0,0|1,0,1]=4 1055 B14R1.3135 C\C(=C\C1CCCCC1CC)\C(O)=O Amb24630684 [0,1,0,1,0,0|0,0,2]=4 1056 B14R1.3218 CC(CNCCN1CCCC1)C(O)=O Amb19086671 [0,1,0,1,0,0|2,0,0]=4 1057 B14R1.4967 OC(=O)C=1CCCCCCCC(O)C1 Amb24366620 [0,1,0,1,0,0|0,0,2]=4 1058 B14R1.6426 CC1(CCCCCCCCC1)C(O)=O Amb24552864 [0,1,0,1,0,0|0,0,0]=2 1059 B14R1.6449 CC(OCCC1CCCCN1)C(O)=O Amb18630747 [0,1,0,1,0,0|2,0,0]=4 1060 B14R1.10025 CC(C(C)=O)N1CCCCCCCC1 Amb25367518 [0,1,0,1,0,0|2,0,0]=4 1061 B14R1.10025 OC(=O)C(=O)N1CCCCCCCC1 Amb25044402 [0,1,0,1,0,0|1,0,1]=4 1062 B14R1.10030 OC(=O)C(F)=CCC1CCCCCC1 Amb24569305 [0,1,0,1,0,0|0,0,2]=4 1063 B14R1.10072 CC(=CC1CCCCCCC1)C(O)=O Amb25229442 [0,1,0,1,0,0|0,0,2]=4 1064 B14R1.10072 CC(NC1CCCCCCC1)C(O)=O Amb18978550 [0,1,0,1,0,0|1,0,0]=3 1065 B14R1.10072 C[C@@H](NC1CCCCCCC1)C(O)=O Amb24360141 [0,1,0,1,0,0|1,0,0]=3 1066 B14R1.10072 C[C@H](NC1CCCCCCC1)C(O)=O Amb24390628 [0,1,0,1,0,0|1,0,0]=3 1067 B14R1.10072 NC(CN1CCCCCCC1)C(N)=O Amb18294518 [0,1,0,1,0,0|2,0,0]=4 1068 B14R1.10072 NC(CN1CCCCCCC1)C(O)=O Amb18981877 [0,1,0,1,0,0|1,0,0]=3 1069 B14R1.10072 N[C@@H](CC1CCCCCCC1)C(O)=O Amb25846297 [0,1,0,1,0,0|0,0,0]=2 1070 B14R1.10072 N[C@H](CC1CCCCCCC1)C(O)=O Amb24412235 [0,1,0,1,0,0|0,0,0]=2 1071 B14R1.10072 OC(=O)C(=O)CC1CCCCCCC1 Amb25246019 [0,1,0,1,0,0|0,0,1]=3 1072 B14R1.10072 OC(=O)C(F)CC1CCCCCCC1 Amb25078456 [0,1,0,1,0,0|0,0,0]=2 1073 B14R1.10072 OC(CN1CCCCCCC1)C(O)=O Amb25775570 [0,1,0,1,0,0|1,0,0]=3 1074 B14R1.160 OC(=O)CCC(=O)N1CCCCC1C Amb1120040 [0,1,0,1,0,0|1,0,1]=4 1075 B14R1.4526 CN(CCC(=O)O)CCN1CCCC1 Amb17561223 [0,1,0,1,0,0|2,0,0]=4 1076 B14R1.4526 O=C(NCC(=O)O)CCC1CCCC1 Amb1135361 [0,1,0,1,0,0|1,0,1]=4 1077 B14R1.4902 OC(=O)CCC1CCCCCC(=O)N1 Amb18811231 [0,1,0,1,0,0|1,0,1]=4 1078 B14R1.10371 OC(=O)CNC(=O)C1CCCCCC1 Amb18299593 [0,1,0,1,0,0|1,0,1]=4 1079 B14R1.814 CC(C)CC1COCCN1CC(O)=O Amb25387569 [0,1,0,1,0,0|2,0,0]=4 1080 B14R1.814 CN(C)CC1CCCCN1CC(O)=O Amb21860196 [0,1,0,1,0,0|2,0,0]=4 1081 B14R1.4522 CC(C)=C1CCCCC1CCC(O)=O Amb24694086 [0,1,0,1,0,0|0,0,2]=4 1082 B14R1.4522 CC(C)=C1CCCC[C@@H]1CCC(O)=O Amb24438759 [0,1,0,1,0,0|0,0,2]=4 1083 B14R1.4522 CC(C)CCC1CCNCC1C(O)=O Amb18811004 [0,1,0,1,0,0|1,0,0]=3 1084 B14R1.4522 CC(C)CNC1CCCCC1C(O)=O Amb22585851 [0,1,0,1,0,0|1,0,0]=3 1085 B14R1.4522 CC(CCN1CCCCC1C(=O)O)C Amb1110298 [0,1,0,1,0,0|1,0,0]=3 1086 B14R1.4522 CN(C)C1CCCCC1CCC(O)=O Amb18811056 [0,1,0,1,0,0|1,0,0]=3 1087 B14R1.4522 CN(C)C1CCCCC1NCC(O)=O Amb22224908 [0,1,0,1,0,0|2,0,0]=4 1088 B14R1.4522 CN(C)C1CCCOC1CCC(O)=O Amb18810004 [0,1,0,1,0,0|2,0,0]=4 1089 B14R1.4522 CN(C)C1CCCSC1CCC(O)=O Amb18170233 [0,1,0,1,0,0|2,0,0]=4 1090 B14R1.4522 CN(C)C1CCOCC1CCC(O)=O Amb18187189 [0,1,0,1,0,0|2,0,0]=4 1091 B14R1.4522 CN(C)C1CCSCC1CCC(O)=O Amb18170236 [0,1,0,1,0,0|2,0,0]=4 1092 B14R1.4522 CN(C)C1COCCC1CCC(O)=O Amb18187187 [0,1,0,1,0,0|2,0,0]=4 1093 B14R1.4522 CN(C)C1CSCCC1CCC(O)=O Amb18170229 [0,1,0,1,0,0|2,0,0]=4 1094 B14R1.4522 CN(C)CC[C@@H]1NCCC[C@H]1C(O)=O Amb18187380 [0,1,0,1,0,0|2,0,0]=4 1095 B14R1.4522 OC(=O)CCC1CCCCC1C(O)=O Amb18653245 [0,1,0,1,0,0|1,0,1]=4 1096 B14R1.6325 CC(=O)OC1CCCCCC1C(O)=O Amb25756136 [0,1,0,1,0,0|1,0,1]=4 1097 B14R1.6325 CC(C)C1NCCCCC1CC(O)=O Amb25804069 [0,1,0,1,0,0|1,0,0]=3 1098 B14R1.6325 CC(C)CN1CCCCCC1C(O)=O Amb25075791 [0,1,0,1,0,0|1,0,0]=3 1099 B14R1.6325 CC(C)C[C@@H]1NCCCC[C@H]1C(O)=O Amb18811022 [0,1,0,1,0,0|1,0,0]=3 1100 B14R1.6325 CC(C)N1CCCCCC1CC(C)=O Amb24498423 [0,1,0,1,0,0|2,0,0]=4 1101 B14R1.6325 CC(C)NC1CCCCCC1C(N)=O Amb25814165 [0,1,0,1,0,0|2,0,0]=4 1102 B14R1.6325 CC(C)NC1CCCCCC1C(O)=O Amb25683713 [0,1,0,1,0,0|1,0,0]=3 1103 B14R1.6325 CC(C)SC1CCCCCC1C(O)=O Amb25340654 [0,1,0,1,0,0|1,0,0]=3 1104 B14R1.6325 CC(C)[C@@H]1NCCCC[C@H]1CC(O)=O Amb18811009 [0,1,0,1,0,0|1,0,0]=3 1105 B14R1.6325 CC(N)CC1CCCCCN1C(N)=O Amb24418141 [0,1,0,1,0,0|2,0,0]=4 1106 B14R1.6325 CN(C)C1CCCCCC1CC(O)=O Amb18811051 [0,1,0,1,0,0|1,0,0]=3 1107 B14R1.6325 CS(=O)NC1CCCCCC1C(O)=O Amb24557585 [0,1,0,1,0,0|2,0,0]=4 1108 B14R1.6325 NC(=O)C[C@H]1CCCCC[C@@H]1C(O)=O Amb25210522 [0,1,0,1,0,0|1,0,1]=4 1109 B14R1.6325 OC(=O)C1CCCCCN1CC(F)F Amb24360817 [0,1,0,1,0,0|2,0,0]=4 1110 B14R1.6325 OC(=O)CC1CCCCCC1C(O)=O Amb24585789 [0,1,0,1,0,0|1,0,1]=4 1111 B14R1.6325 OC(=O)C[C@@H]1CCCCC[C@@H]1C(O)=O Amb24597082 [0,1,0,1,0,0|1,0,1]=4 1112 B14R1.6412 OC(=O)[C@H]1CCCCCC[C@H]1C(O)=O Amb24639168 [0,1,0,1,0,0|1,0,1]=4 1113 B14R1.418 O=C(C1CCCC1)NCCCC(=O)O Amb1111117 [0,1,0,1,0,0|1,0,1]=4 1114 B14R1.1865 CC1CN(CCC(O)=O)C(CO1)CC Amb19018511 [0,1,0,1,0,0|2,0,0]=4 1115 B14R1.4920 CC1CCCC(N1CCCC(=O)Cl)C Amb17143702 [0,1,0,1,0,0|2,0,0]=4 1116 B14R1.4920 CC1CCCC(N1CCCC(=O)N)C Amb17143196 [0,1,0,1,0,0|2,0,0]=4 1117 B14R1.13293 CC1CN(CCC(O)=O)C(C)CCC1 Amb24349122 [0,1,0,1,0,0|1,0,0]=3 1118 B14R1.13293 CC1CN(CCC(O)=O)C(C)CCC1 Amb25833184 [0,1,0,1,0,0|1,0,0]=3 1119 B14R1.154 CC1C(C)SCCN1CCCC(O)=O Amb24271581 [0,1,0,1,0,0|2,0,0]=4 1120 B14R1.677 NC1CCN(CC1)CCCCC(O)=O Amb24271458 [0,1,0,1,0,0|1,0,0]=3 1121 B14R1.1134 CC(CC)C1CCCCCC1C(O)=O Amb25330257 [0,1,0,1,0,0|0,0,0]=2 1122 B14R1.1134 CC(CO)N1CCCCCC1C(O)=O Amb25805414 [0,1,0,1,0,0|2,0,0]=4 1123 B14R1.1134 CCN(C)C1CCCCCC1C(O)=O Amb19002550 [0,1,0,1,0,0|1,0,0]=3 1124 B14R1.3302 CCC(=O)NC1CCCCC1C(O)=O Amb24510578 [0,1,0,1,0,0|1,0,1]=4 1125 B14R1.4944 CN1C(CCCCC1=O)CCC(O)=O Amb18811230 [0,1,0,1,0,0|1,0,1]=4 1126 B14R1.13252 OC(=O)CCCCC1SCC(C1N)N Amb1090866 [0,1,0,1,0,0|2,0,0]=4 1127 B14R1.327 CC1CCCCCN1C(C)CC(C)=O Amb24510849 [0,1,0,1,0,0|2,0,0]=4 1128 B14R1.327 CC1COCCCN1C(C)CC(O)=O Amb24562021 [0,1,0,1,0,0|2,0,0]=4 1129 B14R1.337 CC1CCCCC1NC(=O)CC(O)=O Amb18987398 [0,1,0,1,0,0|1,0,1]=4 1130 B14R1.337 CN(CC1CCCCN1C)CC(O)=O Amb22227441 [0,1,0,1,0,0|2,0,0]=4 1131 B14R1.6454 CC(CC(O)=O)NCCN1CCCC1 Amb19086670 [0,1,0,1,0,0|2,0,0]=4 1132 B14R1.6454 CN(CC(O)=O)CCCC1CCCO1 Amb19616871 [0,1,0,1,0,0|2,0,0]=4 1133 B14R1.13044 CC(=C)CC(O)C1CCCCCCC1 Amb24418128 [0,1,0,1,0,0|2,0,0]=4 1134 B14R1.13044 CC(CC(C)=O)N1CCCCCCC1 Amb24456287 [0,1,0,1,0,0|2,0,0]=4 1135 B14R1.13044 NC(CC(N)=O)C1CCCCCCC1 Amb25332799 [0,1,0,1,0,0|1,0,0]=3 1136 B14R1.13044 N[C@@H](CC(O)=O)C1CCCCCCC1 Amb24337081 [0,1,0,1,0,0|0,0,0]=2 1137 B14R1.13044 N[C@H](CC(N)=O)C1CCCCCCC1 Amb25306847 [0,1,0,1,0,0|1,0,0]=3 1138 B14R1.13044 OC(=O)CC(=O)N1CCCCCCC1 Amb18959579 [0,1,0,1,0,0|1,0,1]=4 1139 B14R1.13081 CC(CC(=O)N)NC1CCCCCC1 Amb17236795 [0,1,0,1,0,0|2,0,0]=4 1140 B14R1.13081 O=C(CC(=O)O)NC1CCCCCC1 Amb17402289 [0,1,0,1,0,0|1,0,1]=4 1141 B14R2.13 CCC1CCCC12COCC(=O)N2 Amb24588995 [0,0,0,2,0,0|2,0,0]=4 1142 B14R2.21 O=C1CC(CCC1)C2CCCCC2 Amb25736052 [0,0,0,2,0,0|1,0,0]=3 1143 B14R2.21 O=C1CC(CCC1)C2COCCC2 Amb24420311 [0,0,0,2,0,0|2,0,0]=4 1144 B14R2.21 O=C1CCCC(N1)C2CCCCC2 Amb24600075 [0,0,0,2,0,0|1,0,0]=3 1145 B14R2.21 O=C1CCCC(N1)C2CCCCN2 Amb23580689 [0,0,0,2,0,0|2,0,0]=4 1146 B14R2.21 O=C1CNCC(N1)C2CCCCC2 Amb25194587 [0,0,0,2,0,0|2,0,0]=4 1147 B14R2.21 O=C1CNC[C@H](N1)C2CCCCC2 Amb25054433 [0,0,0,2,0,0|2,0,0]=4 1148 B14R2.21 O=C1COCC(N1)C2CCCCC2 Amb25841029 [0,0,0,2,0,0|2,0,0]=4 1149 B14R2.21 O=C1COC[C@@H](N1)C2CCCCC2 Amb25342169 [0,0,0,2,0,0|2,0,0]=4 1150 B14R2.21 O=C1COC[C@H](N1)C2CCCCC2 Amb24743379 [0,0,0,2,0,0|2,0,0]=4 1151 B14R2.21 OC1CC(CCC1)C2CCCCC2 Amb25743358 [0,0,0,2,0,0|1,0,1]=4 1152 B14R2.716 O=C1CC(CC2CCCC2)OCC1 Amb24552655 [0,0,0,2,0,0|2,0,0]=4 1153 B14R2.4475 O=C1CCCC(CNC2CCC2)N1 Amb25042551 [0,0,0,2,0,0|2,0,0]=4 1154 B14R2.7841 O=C1CC2CC(CCCCCC2)=C1 Amb24380783 [0,0,0,2,0,0|1,0,1]=4 1155 B14R2.7841 OC1CC2CC(C1)CCCCCC2 Amb25823124 [0,0,0,2,0,0|1,0,1]=4 1156 B14R2.7963 O=C1CCCC=2CCCCCCC21 Amb25767703 [0,0,0,2,0,0|1,0,1]=4 1157 B14R2.11635 OCC1CCCC2CCCC(=O)C21 Amb25097817 [0,0,0,2,0,0|2,0,0]=4 1158 B14R2.20965 CC1CCCCC12CC(=O)CCO2 Amb25105366 [0,0,0,2,0,0|2,0,0]=4 1159 B14R2.20965 O=C1CC2(CCCCC2Cl)CCC1 Amb24386499 [0,0,0,2,0,0|2,0,0]=4 1160 B14R2.20965 OC1CCCCC12CC(=O)CCC2 Amb25357445 [0,0,0,2,0,0|2,0,0]=4 1161 B14R2.20965 O[C@@H]1CCCC[C@]12CCCC(=O)N2 Amb24682784 [0,0,0,2,0,0|2,0,0]=4 1162 B14R2.23229 O=C1CC2(CCCCCC2)NCC1 Amb18192857 [0,0,0,2,0,0|2,0,0]=4 1163 B14R2.23229 O=C1CC2(CCCCCC2)OCC1 Amb18192438 [0,0,0,2,0,0|2,0,0]=4 1164 B14R2.23229 O=C1CC2(CCCCCC2)SCC1 Amb18187892 [0,0,0,2,0,0|2,0,0]=4 1165 B14R2.23229 O=C1COCC2(CCCCCC2)N1 Amb25298613 [0,0,0,2,0,0|2,0,0]=4 1166 B14R2.23229 O=C1NCCC2(CCCNCC2)O1 Amb25212372 [0,0,0,2,0,0|2,0,0]=4 1167 B14R2.23229 O=C1NCCC2(CCCOCC2)O1 Amb24637019 [0,0,0,2,0,0|2,0,0]=4 1168 B14R2.12 CCC1CCCCC12CNC(=O)O2 Amb24719971 [0,0,0,2,0,0|1,0,0]=3 1169 B14R2.19 O=C1CC(CC1)NC2CCCCC2 Amb25799301 [0,0,0,2,0,0|2,0,0]=4 1170 B14R2.19 O=C1CCC(CC2CCCCC2)N1 Amb25095146 [0,0,0,2,0,0|1,0,0]=3 1171 B14R2.19 O=C1CCC(CC2COCCC2)N1 Amb24465560 [0,0,0,2,0,0|2,0,0]=4 1172 B14R2.19 O=C1CCC(N1)OC2CCCCC2 Amb25766443 [0,0,0,2,0,0|2,0,0]=4 1173 B14R2.19 O=C1CC[C@@H](CN2CCCCC2)N1 Amb25095220 [0,0,0,2,0,0|2,0,0]=4 1174 B14R2.19 O=C1NC(CC2CCCCC2)CN1 Amb24434854 [0,0,0,2,0,0|2,0,0]=4 1175 B14R2.19 O=C1NCC(CC2CCCCC2)O1 Amb24438974 [0,0,0,2,0,0|1,0,0]=3 1176 B14R2.99 CCC1CCN1CC2CNC(=O)O2 Amb25807400 [0,0,0,2,0,0|2,0,0]=4 1177 B14R2.251 CC1CCC1NCC2CNC(=O)O2 Amb25135926 [0,0,0,2,0,0|2,0,0]=4 1178 B14R2.252 O=C1CC(CCC2CCCC2)CC1 Amb24450998 [0,0,0,2,0,0|1,0,0]=3 1179 B14R2.252 O=C1CC(CCC2COCC2)CC1 Amb24623187 [0,0,0,2,0,0|2,0,0]=4 1180 B14R2.252 O=C1CCC(CNC2CCCC2)N1 Amb24360116 [0,0,0,2,0,0|2,0,0]=4 1181 B14R2.252 O=C1CCC(CSC2CCCC2)N1 Amb25163502 [0,0,0,2,0,0|2,0,0]=4 1182 B14R2.252 O=C1CN(CCC2CCCC2)CC1 Amb18181425 [0,0,0,2,0,0|2,0,0]=4 1183 B14R2.252 O=C1NCC(CNC2CCCC2)O1 Amb24464468 [0,0,0,2,0,0|2,0,0]=4 1184 B14R2.252 OC1CC(CC1)CCC2CCCC2 Amb25213503 [0,0,0,2,0,0|1,0,1]=4 1185 B14R2.256 CC1CCCCC1C2CC(=O)NC2 Amb25210089 [0,0,0,2,0,0|2,0,0]=4 1186 B14R2.256 CC1CCCCC1C2COC(=O)N2 Amb25321105 [0,0,0,2,0,0|2,0,0]=4 1187 B14R2.256 O[C@@H]1CCCC[C@H]1C2COC(=O)O2 Amb25296254 [0,0,0,2,0,0|2,0,0]=4 1188 B14R2.259 CC1CCCC1CN2CC(=O)CC2 Amb24759972 [0,0,0,2,0,0|2,0,0]=4 1189 B14R2.259 CC1CCCN1C[C@@H]2CCC(=O)N2 Amb24682113 [0,0,0,2,0,0|2,0,0]=4 1190 B14R2.259 C[C@H]1CCCN1C[C@@H]2CCC(=O)N2 Amb25315191 [0,0,0,2,0,0|2,0,0]=4 1191 B14R2.1171 CC[C@H]1CCCCC2=CC(=O)C[C@@H]21 Amb24583556 [0,0,0,2,0,0|1,0,1]=4 1192 B14R2.4359 O=C1CC(CC1)C2CCCCCC2 Amb25679234 [0,0,0,2,0,0|1,0,0]=3 1193 B14R2.4359 O=C1CCC(=C1)C2CCCCCC2 Amb25047847 [0,0,0,2,0,0|1,0,1]=4 1194 B14R2.4359 O=C1NC(CO1)C2CCCCCC2 Amb25140534 [0,0,0,2,0,0|2,0,0]=4 1195 B14R2.4526 O[C@H]1CC[C@H]2CCCCCC(=O)[C@@H]21 Amb24733392 [0,0,0,2,0,0|2,0,0]=4 1196 B14R2.4933 O=C1CC2CCCCCCCC2=C1 Amb25320043 [0,0,0,2,0,0|1,0,1]=4 1197 B14R2.5594 O=C1CCC=2CCCCCCCC21 Amb25053034 [0,0,0,2,0,0|1,0,1]=4 1198 B14R2.28862 O=C1CCC2(CCCNCCC2)O1 Amb25743493 [0,0,0,2,0,0|1,0,0]=3 1199 B14R2.28862 O=C1NC2(CO1)CCCCCCC2 Amb24661451 [0,0,0,2,0,0|2,0,0]=4 1200 B14R2.2 CC(=O)NC1CCC2CCCCC21 Amb24072695 [0,0,0,2,0,0|2,0,0]=4 1201 B14R2.2 CC(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]21 Amb25233501 [0,0,0,2,0,0|2,0,0]=4 1202 B14R2.2 NC(=O)CN1CCC2CCCCC12 Amb24753502 [0,0,0,2,0,0|2,0,0]=4 1203 B14R2.2 OC(=O)CC1CCC2CCCC=C12 Amb18128731 [0,0,0,2,0,0|0,0,2]=4 1204 B14R2.2 OC(=O)CC1CCC2CCCCC12 Amb24639217 [0,0,0,2,0,0|0,0,0]=2 1205 B14R2.2 OC(=O)CC1CCN2CCCCC21 Amb18823239 [0,0,0,2,0,0|1,0,0]=3 1206 B14R2.2 OC(=O)CC1CCN2CCNCC21 Amb18191608 [0,0,0,2,0,0|2,0,0]=4 1207 B14R2.2 OC(=O)CC1CCN2CCOCC21 Amb18822514 [0,0,0,2,0,0|2,0,0]=4 1208 B14R2.2 OC(=O)CC1CCN2CCSCC21 Amb18177108 [0,0,0,2,0,0|2,0,0]=4 1209 B14R2.2 OC(=O)CN1CCC2CCCCC12 Amb25828246 [0,0,0,2,0,0|1,0,0]=3 1210 B14R2.2 OC(=O)C[C@H]1CC[C@@H]2CCCC=C12 Amb25241175 [0,0,0,2,0,0|0,0,2]=4 1211 B14R2.52 CC1=CC(=O)CCC2CCCCC12 Amb25112383 [0,0,0,2,0,0|1,0,1]=4 1212 B14R2.450 CC1C(OC2CCCCC21)C(O)=O Amb23589671 [0,0,0,2,0,0|1,0,0]=3 1213 B14R2.450 CN1C2CCCCC2CC1C(N)=O Amb24509995 [0,0,0,2,0,0|2,0,0]=4 1214 B14R2.450 CN1C2CCCCC2CC1C(O)=O Amb24735494 [0,0,0,2,0,0|1,0,0]=3 1215 B14R2.450 CN1C2CCNCC2CC1C(O)=O Amb24349197 [0,0,0,2,0,0|2,0,0]=4 1216 B14R2.450 CN1[C@H]2CCCC[C@H]2C[C@H]1C(O)=O Amb24710259 [0,0,0,2,0,0|1,0,0]=3 1217 B14R2.781 CC(=O)C1CCC2CCCCC2N1 Amb24411204 [0,0,0,2,0,0|2,0,0]=4 1218 B14R2.781 CC(=O)N1CC2CCCCC2CC1 Amb25833747 [0,0,0,2,0,0|2,0,0]=4 1219 B14R2.781 NC(=O)C1CCC2C(C1)CCCN2 Amb1133742 [0,0,0,2,0,0|2,0,0]=4 1220 B14R2.781 NC(=O)C1CCC2C(N1)CCCC2 Amb1137682 [0,0,0,2,0,0|2,0,0]=4 1221 B14R2.781 NC(=O)C1CN2CCCCC2CC1 Amb24389348 [0,0,0,2,0,0|2,0,0]=4 1222 B14R2.781 NC(=O)C1C[C@H]2CCCC[C@@H]2CC1 Amb24587274 [0,0,0,2,0,0|1,0,0]=3 1223 B14R2.781 NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2CC1 Amb25179191 [0,0,0,2,0,0|1,0,0]=3 1224 B14R2.781 NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2CC1 Amb24557793 [0,0,0,2,0,0|1,0,0]=3 1225 B14R2.781 NC(=O)[C@H]1C[C@H]2CCCC[C@H]2CC1 Amb24626614 [0,0,0,2,0,0|1,0,0]=3 1226 B14R2.781 O=C(Cl)C1CC2CCCCC2CC1 Amb24588044 [0,0,0,2,0,0|1,0,0]=3 1227 B14R2.781 OC(=O)C1CC2CCCCN2CC1 Amb18191948 [0,0,0,2,0,0|1,0,0]=3 1228 B14R2.781 OC(=O)C1CC2CCCNC2CC1 Amb25315891 [0,0,0,2,0,0|1,0,0]=3 1229 B14R2.781 OC(=O)C1CC2COCCN2CC1 Amb18191372 [0,0,0,2,0,0|2,0,0]=4 1230 B14R2.781 OC(=O)C1CC2CSCCN2CC1 Amb18177106 [0,0,0,2,0,0|2,0,0]=4 1231 B14R2.781 OC(=O)C1CCC2C(C1)CCCC2 Amb10553405 [0,0,0,2,0,0|0,0,0]=2 1232 B14R2.781 OC(=O)C1CCC2C(N1)CCCC2 Amb1135800 [0,0,0,2,0,0|1,0,0]=3 1233 B14R2.781 OC(=O)C1CCC2CCCCC2N1 Amb19149342 [0,0,0,2,0,0|1,0,0]=3 1234 B14R2.781 OC(=O)C1CN2CCCCC2CO1 Amb25153644 [0,0,0,2,0,0|2,0,0]=4 1235 B14R2.781 OC(=O)C1CN2CCNCC2CC1 Amb25674672 [0,0,0,2,0,0|2,0,0]=4 1236 B14R2.781 OC(=O)C1CNC2CCCCC2N1 Amb24365335 [0,0,0,2,0,0|2,0,0]=4 1237 B14R2.781 OC(=O)C1C[C@@H]2CCCC[C@H]2CC1 Amb24670520 [0,0,0,2,0,0|0,0,0]=2 1238 B14R2.781 OC(=O)C1C[C@H]2CCCC[C@H]2CN1 Amb24744720 [0,0,0,2,0,0|1,0,0]=3 1239 B14R2.781 OC(=O)C1NCC2C(C1)CCCC2 Amb10067011 [0,0,0,2,0,0|1,0,0]=3 1240 B14R2.781 OC(=O)C=1CC2CCCCC2CC1 Amb25120922 [0,0,0,2,0,0|0,0,2]=4 1241 B14R2.781 OC(=O)[C@@H]1CC2CCCCC2CN1 Amb24330221 [0,0,0,2,0,0|1,0,0]=3 1242 B14R2.781 OC(=O)[C@@H]1CC=C2CCCC[C@@H]2C1 Amb25321943 [0,0,0,2,0,0|0,0,2]=4 1243 B14R2.781 OC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2CC1 Amb25362227 [0,0,0,2,0,0|0,0,0]=2 1244 B14R2.781 OC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2CN1 Amb24709362 [0,0,0,2,0,0|1,0,0]=3 1245 B14R2.781 OC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2CC1 Amb24739633 [0,0,0,2,0,0|0,0,0]=2 1246 B14R2.781 OC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2CN1 Amb24632236 [0,0,0,2,0,0|1,0,0]=3 1247 B14R2.781 OC(=O)[C@H]1C[C@H]2CCCCN2CC1 Amb24606214 [0,0,0,2,0,0|1,0,0]=3 1248 B14R2.781 OC(=O)[C@H]1NC[C@@H]2[C@H](C1)CCCC2 Amb13886423 [0,0,0,2,0,0|1,0,0]=3 1249 B14R2.781 OC(=O)[C@H]1NC[C@@H]2[C@H](C1)CCCC2 Amb2382893 [0,0,0,2,0,0|1,0,0]=3 1250 B14R2.9455 CC(=O)CCN1C2CCCC1CC2 Amb25688457 [0,0,0,2,0,0|2,0,0]=4 1251 B14R2.9455 OC(=O)CCN1C2CCCC1CC2 Amb24349975 [0,0,0,2,0,0|1,0,0]=3 1252 B14R2.9466 CC(=O)CCC1CN2CCC1CC2 Amb25039028 [0,0,0,2,0,0|2,0,0]=4 1253 B14R2.9466 CC(=O)NCC1CC2CCC1CC2 Amb24618459 [0,0,0,2,0,0|2,0,0]=4 1254 B14R2.9466 NC(=O)CNC1CC2CCC1CC2 Amb25712780 [0,0,0,2,0,0|2,0,0]=4 1255 B14R2.9466 OC(=O)C#CC1CC2CCC1CC2 Amb24722466 [0,0,0,2,0,0|0,0,2]=4 1256 B14R2.9466 OC(=O)CC[C@H]1CN2CCC1CC2 Amb25241541 [0,0,0,2,0,0|1,0,0]=3 1257 B14R2.9466 OC(=O)CNC1CC2CCC1CC2 Amb25370266 [0,0,0,2,0,0|1,0,0]=3 1258 B14R2.11451 CC[C@@H]1CN2CC[C@@H]1CC2C(O)=O Amb24540849 [0,0,0,2,0,0|1,0,0]=3 1259 B14R2.11451 CC[C@H]1CN2CC[C@H]1CC2C(O)=O Amb25233427 [0,0,0,2,0,0|1,0,0]=3 1260 B14R2.11451 CC[C@H]1CN2CC[C@H]1C[C@@H]2C(O)=O Amb24565779 [0,0,0,2,0,0|1,0,0]=3 1261 B14R2.11451 NCC1CC2CCC1CC2C(O)=O Amb25830594 [0,0,0,2,0,0|1,0,0]=3 1262 B14R2.11451 OC[C@@H]1C[C@@H]2CCN1C[C@@H]2C(O)=O Amb25176151 [0,0,0,2,0,0|2,0,0]=4 1263 B14R2.11451 OC[C@H]1C[C@@H]2CCN1C[C@@H]2C(O)=O Amb25176152 [0,0,0,2,0,0|2,0,0]=4 1264 B14R2.13811 NC[C@@]12CC(=O)CC[C@H]1CCCC2 Amb24512083 [0,0,0,2,0,0|2,0,0]=4 1265 B14R2.13811 O=CC12CCCCC1CCC(=O)O2 Amb24440214 [0,0,0,2,0,0|1,0,1]=4 1266 B14R2.13811 O=CC12CCCC[C@@H]1CCC(=O)O2 Amb24400604 [0,0,0,2,0,0|1,0,1]=4 1267 B14R2.13811 O=CC12CCCC[C@H]1CCC(=O)O2 Amb24496847 [0,0,0,2,0,0|1,0,1]=4 1268 B14R2.13811 O=C[C@@]12CCCC[C@H]1CCC(=O)O2 Amb25289164 [0,0,0,2,0,0|1,0,1]=4 1269 B14R2.13811 OCC12CC(=O)CCC1CCCC2 Amb25051322 [0,0,0,2,0,0|2,0,0]=4 1270 B14R2.1008 CC(=O)NC1CC2CCCC2CC1 Amb24417155 [0,0,0,2,0,0|2,0,0]=4 1271 B14R2.1008 CC(=O)N[C@@H]1C[C@@H]2CCC[C@@H]2CC1 Amb25290261 [0,0,0,2,0,0|2,0,0]=4 1272 B14R2.1008 CC(=O)N[C@@H]1C[C@H]2CCC[C@@H]2CC1 Amb25229538 [0,0,0,2,0,0|2,0,0]=4 1273 B14R2.1008 CC(=O)N[C@H]1C[C@H]2CCC[C@@H]2CC1 Amb25317583 [0,0,0,2,0,0|2,0,0]=4 1274 B14R2.1008 CC(=O)OC1CC2CCCC2CC1 Amb25730777 [0,0,0,2,0,0|2,0,0]=4 1275 B14R2.1008 OC(=O)CC1CC2CCCN2CC1 Amb18191949 [0,0,0,2,0,0|1,0,0]=3 1276 B14R2.1008 OC(=O)CC1CN2CCCC2CN1 Amb18191616 [0,0,0,2,0,0|2,0,0]=4 1277 B14R2.1008 OC(=O)CN1CC2CNCC2CC1 Amb25191319 [0,0,0,2,0,0|2,0,0]=4 1278 B14R2.2918 CC1C2CNCC2CN1CC(O)=O Amb25781963 [0,0,0,2,0,0|2,0,0]=4 1279 B14R2.9451 CC(=O)CCN1CCC2CCCC12 Amb24505402 [0,0,0,2,0,0|2,0,0]=4 1280 B14R2.9451 NC(=O)CCN1CCC2CCCC12 Amb24344007 [0,0,0,2,0,0|2,0,0]=4 1281 B14R2.9451 OC(=O)CCC1CCC2CCCC12 Amb24518920 [0,0,0,2,0,0|0,0,0]=2 1282 B14R2.9451 OC(=O)CCC1CC[C@@H]2OCC[C@H]12 Amb24519268 [0,0,0,2,0,0|1,0,0]=3 1283 B14R2.9451 OC(=O)CCN1CCC2CCCC12 Amb25355618 [0,0,0,2,0,0|1,0,0]=3 1284 B14R2.9451 OC(=O)CNC1CCN2CCCC21 Amb18294576 [0,0,0,2,0,0|2,0,0]=4 1285 B14R2.9499 OC(=O)C#CCC1CC2CC1CC2 Amb25042140 [0,0,0,2,0,0|0,0,2]=4 1286 B14R2.768 CC(=O)CN1CC2CCCCC2C1 Amb24648053 [0,0,0,2,0,0|2,0,0]=4 1287 B14R2.768 CC(=O)CN1C[C@@H]2CCCC[C@@H]2C1 Amb25831589 [0,0,0,2,0,0|2,0,0]=4 1288 B14R2.768 CC(=O)NC1CC2CCCCC2C1 Amb25203901 [0,0,0,2,0,0|2,0,0]=4 1289 B14R2.768 NC(=O)CC1C[C@H]2CCCC[C@@H]2C1 Amb24634028 [0,0,0,2,0,0|1,0,0]=3 1290 B14R2.768 NC(=O)CN1CC2CCCCC2C1 Amb25375339 [0,0,0,2,0,0|2,0,0]=4 1291 B14R2.768 NC(=O)CN1C[C@@H]2CCCC[C@@H]2C1 Amb25251952 [0,0,0,2,0,0|2,0,0]=4 1292 B14R2.768 OC(=O)CC1CC2CCCCC2O1 Amb25773783 [0,0,0,2,0,0|1,0,0]=3 1293 B14R2.768 OC(=O)CC=1CC2CCCCC2C1 Amb24366129 [0,0,0,2,0,0|0,0,2]=4 1294 B14R2.768 OC(=O)CC=1C[C@H]2CCCC[C@@H]2C1 Amb24626636 [0,0,0,2,0,0|0,0,2]=4 1295 B14R2.768 OC(=O)CN1CC2CCCCC2C1 Amb25749226 [0,0,0,2,0,0|1,0,0]=3 1296 B14R2.768 OC(=O)CN1CC2CCCNC2C1 Amb24533470 [0,0,0,2,0,0|2,0,0]=4 1297 B14R2.768 OC(=O)CN1C[C@@H]2CCCN[C@@H]2C1 Amb24588530 [0,0,0,2,0,0|2,0,0]=4 1298 B14R2.5443 CC1CCCCC1C2CC2C(O)=O Amb25368729 [0,0,0,2,0,0|0,0,0]=2 1299 B14R2.5443 CN1CCCCC1C2CC2C(O)=O Amb25284481 [0,0,0,2,0,0|1,0,0]=3 1300 B14R2.11002 CC12CC1CCC2\C=C\CC(O)=O Amb24608186 [0,0,0,2,0,0|0,0,2]=4 1301 B14R2.28454 O[C@H]1CCC[C@H]2OC(=O)CCC[C@@H]21 Amb25266756 [0,0,0,2,0,0|1,0,0]=3 1302 B14R2.31137 CC(=O)CCN1C[C@H]2CCCC[C@@H]12 Amb25031666 [0,0,0,2,0,0|2,0,0]=4 1303 B14R2.31137 OC(=O)CCN1CC2CCCCC12 Amb24525197 [0,0,0,2,0,0|1,0,0]=3 1304 B14R2.31137 OC(=O)CCN1C[C@H]2CCCC[C@@H]12 Amb24716259 [0,0,0,2,0,0|1,0,0]=3 1305 B14R2.31233 CC12CCCCC1CCC2C(O)=O Amb25082844 [0,0,0,2,0,0|0,0,0]=2 1306 B14R2.31233 CC12CCCCC1CNC2C(O)=O Amb24558166 [0,0,0,2,0,0|1,0,0]=3 1307 B14R2.312 CC1CCCC12CNCC2C(N)=O Amb25354212 [0,0,0,2,0,0|2,0,0]=4 1308 B14R2.312 CC1OCCC12CNCC2C(O)=O Amb25190486 [0,0,0,2,0,0|2,0,0]=4 1309 B14R2.312 OC(=O)C1CCCC12CCCC2=O Amb24356038 [0,0,0,2,0,0|1,0,1]=4 1310 B14R2.770 OC(=O)CCC1CC2CCCC2N1 Amb17673615 [0,0,0,2,0,0|1,0,0]=3 1311 B14R2.770 OC(=O)CCN1CC2CNCC2C1 Amb24364513 [0,0,0,2,0,0|2,0,0]=4 1312 B14R2.5452 OC1CCCC12CC(=O)CCCC2 Amb25676698 [0,0,0,2,0,0|2,0,0]=4 1313 B14R2.9422 OC(=O)C1CN2CCCC2CCC1 Amb24488836 [0,0,0,2,0,0|1,0,0]=3 1314 B14R2.9422 OC(=O)[C@@H]1CCC[C@@H]2CCC[C@H]2N1 Amb24550161 [0,0,0,2,0,0|1,0,0]=3 1315 B14R2.373 CC1CC1CN2CCCC2C(N)=O Amb24529727 [0,0,0,2,0,0|2,0,0]=4 1316 B14R2.496 COCC1C(C2CNCC21)C(O)=O Amb24404679 [0,0,0,2,0,0|2,0,0]=4 1317 B14R2.6126 CC1CC(=O)C2CCCCCC2O1 Amb18192436 [0,0,0,2,0,0|2,0,0]=4 1318 B14R2.6126 CC1CC(=O)NC2CCCCCC21 Amb24447071 [0,0,0,2,0,0|2,0,0]=4 1319 B14R2.9509 OC(=O)C1CCCCNC1C2CC2 Amb25780120 [0,0,0,2,0,0|1,0,0]=3 1320 B14R2.9509 OC(=O)[C@@H]1CCCCN[C@H]1C2CC2 Amb18191956 [0,0,0,2,0,0|1,0,0]=3 1321 B14R2.9516 OC(=O)C1CCCCC2CCCC21 Amb24374700 [0,0,0,2,0,0|0,0,0]=2 1322 B14R2.9516 OC(=O)C1CCCCN2CCCC21 Amb24398715 [0,0,0,2,0,0|1,0,0]=3 1323 B14R2.9516 OC(=O)C1CCCCN2CCC[C@@H]21 Amb18191966 [0,0,0,2,0,0|1,0,0]=3 1324 B14R2.9516 OC(=O)[C@@H]1CCC=C[C@@H]2CCC[C@H]21 Amb24512188 [0,0,0,2,0,0|0,0,2]=4 1325 B14R2.9516 OC(=O)[C@H]1CCCC[C@@H]2CCC[C@@H]21 Amb24610068 [0,0,0,2,0,0|0,0,0]=2 1326 B14R2.30659 NC(=O)[C@]12CCCCC[C@@H]1CCC2 Amb24682601 [0,0,0,2,0,0|1,0,0]=3 1327 B14R2.30659 OC(=O)C12CCCCCC1CCC2 Amb24443706 [0,0,0,2,0,0|0,0,0]=2 1328 B14R2.30659 OC(=O)[C@]12CCCCC[C@H]1CCC2 Amb24745791 [0,0,0,2,0,0|0,0,0]=2 1329 B14R2.510 CCOC1NC(=O)C2CCCCC21 Amb24721644 [0,0,0,2,0,0|2,0,0]=4 1330 B14R2.5313 O=C1CCCCCCC2CCC=C12 Amb25320047 [0,0,0,2,0,0|1,0,1]=4 1331 B14R2.7840 O=C1NC2CNCC1CCCCC2 Amb18278104 [0,0,0,2,0,0|2,0,0]=4 1332 B14R2.7840 O=C1N[C@@H]2CNC[C@H]1CCCCC2 Amb25245216 [0,0,0,2,0,0|2,0,0]=4 1333 B14R2.19834 OCCC12CC(=O)CCC1CCC2 Amb25845350 [0,0,0,2,0,0|2,0,0]=4 1334 B14R2.4911 OC12CCCCCCCCC1CC2 Amb25793457 [0,0,0,2,0,0|1,0,1]=4 1335 B14R2.5709 OC1CCC2C(CC1)CCCCC2 Amb17594704 [0,0,0,2,0,0|1,0,1]=4 1336 B14R2.8028 O=C1CCCC2CCCNCC2N1 Amb25695404 [0,0,0,2,0,0|2,0,0]=4 1337 B14R2.8028 O=C1CCCC2CNCCCC2N1 Amb25690275 [0,0,0,2,0,0|2,0,0]=4 1338 B14R2.8028 O=C1CCC[C@@H]2CCCNC[C@H]2N1 Amb18192427 [0,0,0,2,0,0|2,0,0]=4 1339 B14R2.8028 O=C1CCC[C@@H]2CCNCC[C@H]2N1 Amb18192425 [0,0,0,2,0,0|2,0,0]=4 1340 B14R2.8028 O=C1CCC[C@@H]2CNCCC[C@H]2N1 Amb18192430 [0,0,0,2,0,0|2,0,0]=4 1341 B14R2.8028 OC1CC2CCCCCC2CCC1 Amb25152890 [0,0,0,2,0,0|1,0,1]=4 1342 B14R2.24101 O=C1CCCCCC=2CCCCC21 Amb24388641 [0,0,0,2,0,0|1,0,1]=4 1343 B14R2.9465 OC(=O)CCC1CC2CN1CCC2 Amb25363383 [0,0,0,2,0,0|1,0,0]=3 1344 B14R2.31338 OC(=O)C1CC2CCCCCC2N1 Amb18191979 [0,0,0,2,0,0|1,0,0]=3 1345 B14R2.31338 OC(=O)C1CN2CCNCCC2C1 Amb18191607 [0,0,0,2,0,0|2,0,0]=4 1346 B14R2.31338 OC(=O)[C@H]1C[C@H]2CCCCC[C@@H]2N1 Amb25302217 [0,0,0,2,0,0|1,0,0]=3 1347 B14R2.9576 OC(=O)CC12CC1CCCCCC2 Amb25708355 [0,0,0,2,0,0|0,0,0]=2 1348 B14R2.11012 OC(=O)CC1CCC2CC1CCC2 Amb25685341 [0,0,0,2,0,0|0,0,0]=2 1349 B14R2.6159 CC1=CC(=O)C2CCCCCCC12 Amb24691758 [0,0,0,2,0,0|1,0,1]=4 1350 B14R2.6159 CC1=CC(=O)[C@H]2CCCCCC[C@@H]12 Amb24582500 [0,0,0,2,0,0|1,0,1]=4 1351 B14R2.5501 CC1CCC1NC2CCC2C(O)=O Amb25153396 [0,0,0,2,0,0|1,0,0]=3 1352 B14R2.55 CC(=O)N1CCCC12CCCCC2 Amb24078320 [0,0,0,2,0,0|2,0,0]=4 1353 B14R2.55 OC(=O)C1CCCC12CCCCC2 Amb25374968 [0,0,0,2,0,0|0,0,0]=2 1354 B14R2.55 OC(=O)C1CCCC12CCOCC2 Amb25853711 [0,0,0,2,0,0|1,0,0]=3 1355 B14R2.55 OC(=O)C1CCCC12CNCCO2 Amb25740519 [0,0,0,2,0,0|2,0,0]=4 1356 B14R2.55 OC(=O)C1CNCC12CCCCC2 Amb23597880 [0,0,0,2,0,0|1,0,0]=3 1357 B14R2.55 OC(=O)C1CNCC12CCOCC2 Amb23597885 [0,0,0,2,0,0|2,0,0]=4 1358 B14R2.55 OC(=O)C1CNCC12COCCC2 Amb25769848 [0,0,0,2,0,0|2,0,0]=4 1359 B14R2.55 OC(=O)N1CCOC12CCCCC2 Amb24089194 [0,0,0,2,0,0|2,0,0]=4 1360 B14R2.55 OC(=O)[C@@H]1CCC[C@@]12CNCCO2 Amb24561137 [0,0,0,2,0,0|2,0,0]=4 1361 B14R2.55 OC(=O)[C@H]1CNCC12CCCCC2 Amb25798869 [0,0,0,2,0,0|1,0,0]=3 1362 B14R2.436 O=C1CC(C1)OCC2CCCCC2 Amb24410669 [0,0,0,2,0,0|2,0,0]=4 1363 B14R2.764 NC(=O)C1CC1CC2CCCCO2 Amb24375798 [0,0,0,2,0,0|2,0,0]=4 1364 B14R2.764 NC(=O)C1CC1OC2CCCCC2 Amb25803407 [0,0,0,2,0,0|2,0,0]=4 1365 B14R2.764 OC(=O)C1CC1=CC2CCCCC2 Amb24391525 [0,0,0,2,0,0|0,0,2]=4 1366 B14R2.764 OC(=O)C1CC1OC2CCCCC2 Amb24341204 [0,0,0,2,0,0|1,0,0]=3 1367 B14R2.766 CC(=O)NC1CCC12CCCCC2 Amb25688302 [0,0,0,2,0,0|2,0,0]=4 1368 B14R2.769 NC(=O)CNC1CC12CCCCC2 Amb24606895 [0,0,0,2,0,0|2,0,0]=4 1369 B14R2.780 OC(=O)C1CCC1C2COCCC2 Amb25284799 [0,0,0,2,0,0|1,0,0]=3 1370 B14R2.780 OC(=O)C1CCC1N2CCCCC2 Amb24353585 [0,0,0,2,0,0|1,0,0]=3 1371 B14R2.780 OC(=O)C1CCC1N2CCSCC2 Amb25304624 [0,0,0,2,0,0|2,0,0]=4 1372 B14R2.780 OC(=O)C1CCN1C2CCCCC2 Amb2237291 [0,0,0,2,0,0|1,0,0]=3 1373 B14R2.790 NC(=O)N[C@@H]1C[C@H]1C2CCCCC2 Amb25031609 [0,0,0,2,0,0|2,0,0]=4 1374 B14R2.11013 OC(=O)CC1CCC2CCN1CC2 Amb25139364 [0,0,0,2,0,0|1,0,0]=3 1375 B14R2.11013 OC(=O)CN1CCN2CCC1CC2 Amb24652896 [0,0,0,2,0,0|2,0,0]=4 1376 B14R2.23919 OC1CC2(CCCCC2)CCCC1 Amb25823096 [0,0,0,2,0,0|1,0,1]=4 1377 B14R2.31359 NC(=O)C1CCCC2C1CCCN2 Amb1141212 [0,0,0,2,0,0|2,0,0]=4 1378 B14R2.31359 NC(=O)C1CCCC2C1NCCC2 Amb1125309 [0,0,0,2,0,0|2,0,0]=4 1379 B14R2.31359 NC(=O)C1CCCC2CCCCC21 Amb24711303 [0,0,0,2,0,0|1,0,0]=3 1380 B14R2.31359 NC(=O)C1CCNC2CCCCC12 Amb25829216 [0,0,0,2,0,0|2,0,0]=4 1381 B14R2.31359 NC(=O)N1CCC[C@@H]2CCCC[C@H]12 Amb25236329 [0,0,0,2,0,0|2,0,0]=4 1382 B14R2.31359 NC(=O)[C@@H]1CCC[C@H]2CCCCC21 Amb24714894 [0,0,0,2,0,0|1,0,0]=3 1383 B14R2.31359 O=C(Cl)C1CCOC2CCCCC12 Amb25364201 [0,0,0,2,0,0|2,0,0]=4 1384 B14R2.31359 O=C(Cl)N1CCC[C@@H]2CCCC[C@H]12 Amb25378518 [0,0,0,2,0,0|2,0,0]=4 1385 B14R2.31359 O=C(Cl)N1CCC[C@H]2CCCC[C@@H]12 Amb24068517 [0,0,0,2,0,0|2,0,0]=4 1386 B14R2.31359 OC(=O)C1CCC=C2CCCCC21 Amb18648405 [0,0,0,2,0,0|0,0,2]=4 1387 B14R2.31359 OC(=O)C1CCCC2CCCCC21 Amb22886529 [0,0,0,2,0,0|0,0,0]=2 1388 B14R2.31359 OC(=O)C1CCCC2CNCCN21 Amb18822893 [0,0,0,2,0,0|2,0,0]=4 1389 B14R2.31359 OC(=O)C1CCCC2COCCN21 Amb18191373 [0,0,0,2,0,0|2,0,0]=4 1390 B14R2.31359 OC(=O)C1CCCC2CSCCN21 Amb18177107 [0,0,0,2,0,0|2,0,0]=4 1391 B14R2.31359 OC(=O)C1CCCC2NCCCC12 Amb24490448 [0,0,0,2,0,0|1,0,0]=3 1392 B14R2.31359 OC(=O)C1CCCC2NCCNC21 Amb24724386 [0,0,0,2,0,0|2,0,0]=4 1393 B14R2.31359 OC(=O)C1CCCC2OCOCC21 Amb24656678 [0,0,0,2,0,0|2,0,0]=4 1394 B14R2.31359 OC(=O)C1CCCN2CCCC[C@@H]21 Amb18191967 [0,0,0,2,0,0|1,0,0]=3 1395 B14R2.31359 OC(=O)C1CCCN2CCNCC21 Amb18191609 [0,0,0,2,0,0|2,0,0]=4 1396 B14R2.31359 OC(=O)C1CCC[C@@H]2CCCC[C@H]21 Amb24710442 [0,0,0,2,0,0|0,0,0]=2 1397 B14R2.31359 OC(=O)C1CCNC2CCCCC12 Amb23590776 [0,0,0,2,0,0|1,0,0]=3 1398 B14R2.31359 OC(=O)C1CCNC2CCOCC12 Amb25675456 [0,0,0,2,0,0|2,0,0]=4 1399 B14R2.31359 OC(=O)C1NCC[C@H]2CCCC[C@H]21 Amb25326710 [0,0,0,2,0,0|1,0,0]=3 1400 B14R2.31359 OC(=O)C=1CCCC2CCCCC12 Amb24711333 [0,0,0,2,0,0|0,0,2]=4 1401 B14R2.31359 OC(=O)[C@@H]1CCC=C2CCCC[C@H]21 Amb25210848 [0,0,0,2,0,0|0,0,2]=4 1402 B14R2.31359 OC(=O)[C@@H]1CCCN2CCCCC21 Amb24288672 [0,0,0,2,0,0|1,0,0]=3 1403 B14R2.31359 OC(=O)[C@@H]1CCCN2CCCC[C@@H]21 Amb22586871 [0,0,0,2,0,0|1,0,0]=3 1404 B14R2.31359 OC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 Amb25176113 [0,0,0,2,0,0|0,0,0]=2 1405 B14R2.31359 OC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 Amb25286602 [0,0,0,2,0,0|0,0,0]=2 1406 B14R2.31359 OC(=O)[C@@H]1CCC[C@H]2NCCC[C@@H]12 Amb25179105 [0,0,0,2,0,0|1,0,0]=3 1407 B14R2.31359 OC(=O)[C@@H]1NCC[C@@H]2CCCC[C@@H]21 Amb25295364 [0,0,0,2,0,0|1,0,0]=3 1408 B14R2.31359 OC(=O)[C@H]1CCCC2CCNC[C@H]21 Amb24714929 [0,0,0,2,0,0|1,0,0]=3 1409 B14R2.31359 OC(=O)[C@H]1CCC[C@@H]2CCCC[C@@H]21 Amb24739634 [0,0,0,2,0,0|0,0,0]=2 1410 B14R2.31359 OC(=O)[C@H]1CCC[C@H]2CCCC[C@H]21 Amb25173175 [0,0,0,2,0,0|0,0,0]=2 1411 B14R2.31359 OC(=O)[C@H]1CCC[C@H]2NCCC[C@@H]12 Amb25179104 [0,0,0,2,0,0|1,0,0]=3 1412 B14R2.54 CC(=O)C1CCCCC12CCCC2 Amb24573787 [0,0,0,2,0,0|1,0,0]=3 1413 B14R2.54 CC(O)C1CCCCC12CCCC2 Amb25129255 [0,0,0,2,0,0|1,0,1]=4 1414 B14R2.54 OC(=O)C1CCCCC12OCCO2 Amb22477720 [0,0,0,2,0,0|2,0,0]=4 1415 B14R2.54 OC(=O)C1CCOCC12CSCC2 Amb18176947 [0,0,0,2,0,0|2,0,0]=4 1416 B14R2.54 OC(=O)C1OCCOC12CCCC2 Amb23538728 [0,0,0,2,0,0|2,0,0]=4 1417 B14R2.76 OC(=O)CC1CCCC12CCCC2 Amb24438814 [0,0,0,2,0,0|0,0,0]=2 1418 B14R2.76 OC(=O)CC1CCCC12OCCO2 Amb24443017 [0,0,0,2,0,0|2,0,0]=4 1419 B14R2.76 OC(=O)CN1CCCC12COCC2 Amb24556167 [0,0,0,2,0,0|2,0,0]=4 1420 B14R2.76 OC(=O)CN1CCOC12CCCC2 Amb24574135 [0,0,0,2,0,0|2,0,0]=4 1421 B14R2.763 CC(=O)N1CCCC1C2CCCC2 Amb25833705 [0,0,0,2,0,0|2,0,0]=4 1422 B14R2.763 NC(=O)C1CCCN1C2CCCC2 Amb24366676 [0,0,0,2,0,0|2,0,0]=4 1423 B14R2.763 NC(=O)N1CCCC1C2CCCC2 Amb18322282 [0,0,0,2,0,0|2,0,0]=4 1424 B14R2.763 O=C(Cl)N1CCCC1C2CCCC2 Amb24758637 [0,0,0,2,0,0|2,0,0]=4 1425 B14R2.763 OC(=O)C1CCCC1N2CCCC2 Amb18288577 [0,0,0,2,0,0|1,0,0]=3 1426 B14R2.763 OC(=O)C1CCCN1C2CCCC2 Amb22097477 [0,0,0,2,0,0|1,0,0]=3 1427 B14R2.763 OC(=O)C1CCCN1C2CNCC2 Amb13952365 [0,0,0,2,0,0|2,0,0]=4 1428 B14R2.763 OC(=O)C1CCNC1C2CCCC2 Amb25803488 [0,0,0,2,0,0|1,0,0]=3 1429 B14R2.763 OC(=O)C1CCOC1C2CCCO2 Amb24492227 [0,0,0,2,0,0|2,0,0]=4 1430 B14R2.763 OC(=O)C1CNCC1C2CCCC2 Amb18191972 [0,0,0,2,0,0|1,0,0]=3 1431 B14R2.763 OC(=O)C1CNCC1C2CCCO2 Amb24687234 [0,0,0,2,0,0|2,0,0]=4 1432 B14R2.763 OC(=O)C1CNCC1C2COCC2 Amb24384487 [0,0,0,2,0,0|2,0,0]=4 1433 B14R2.763 OC(=O)C1NCCC1C2CCCC2 Amb24533942 [0,0,0,2,0,0|1,0,0]=3 1434 B14R2.763 OC(=O)C1NCCC1C2CCCN2 Amb25724931 [0,0,0,2,0,0|2,0,0]=4 1435 B14R2.763 OC(=O)C1NCCC1N2CCCC2 Amb25281107 [0,0,0,2,0,0|2,0,0]=4 1436 B14R2.763 OC(=O)[C@@H]1CCCN1C2CSCC2 Amb24650759 [0,0,0,2,0,0|2,0,0]=4 1437 B14R2.763 OC(=O)[C@@H]1CCN[C@H]1C2CCCC2 Amb18191958 [0,0,0,2,0,0|1,0,0]=3 1438 B14R2.763 OC(=O)[C@H]1CCCN1C2CCCC2 Amb24641513 [0,0,0,2,0,0|1,0,0]=3 1439 B14R2.763 OC(=O)[C@H]1CCCN1C2CSCC2 Amb24388488 [0,0,0,2,0,0|2,0,0]=4 1440 B14R2.765 OC(=O)C1CCC1CC2CCCC2 Amb24642324 [0,0,0,2,0,0|0,0,0]=2 1441 B14R2.765 OC(=O)C1CCC1CC2COCC2 Amb24593037 [0,0,0,2,0,0|1,0,0]=3 1442 B14R2.765 OC(=O)C1CCC1NC2CCCC2 Amb24700576 [0,0,0,2,0,0|1,0,0]=3 1443 B14R2.765 OC(=O)C1CCC1NC2COCC2 Amb24471749 [0,0,0,2,0,0|2,0,0]=4 1444 B14R2.765 OC(=O)C1CCC1NC2CSCC2 Amb25340609 [0,0,0,2,0,0|2,0,0]=4 1445 B14R2.765 OC(=O)C1CCC1SC2CCCC2 Amb24343956 [0,0,0,2,0,0|1,0,0]=3 1446 B14R2.765 OC(=O)C1CCN1CC2CCCO2 Amb25118007 [0,0,0,2,0,0|2,0,0]=4 1447 B14R2.9440 CC(=O)NC1CCCC2CCCC21 Amb24690544 [0,0,0,2,0,0|2,0,0]=4 1448 B14R2.9440 CC(=O)NC1CCC[C@@H]2CCC[C@H]21 Amb25233074 [0,0,0,2,0,0|2,0,0]=4 1449 B14R2.9440 OC(=O)CC1CCCC2OCCC12 Amb23560391 [0,0,0,2,0,0|1,0,0]=3 1450 B14R2.9440 OC(=O)CC1CCCN2CCCC21 Amb18191952 [0,0,0,2,0,0|1,0,0]=3 1451 B14R2.9440 OC(=O)CC1CCOC2CCCC12 Amb18822895 [0,0,0,2,0,0|1,0,0]=3 1452 B14R2.9440 OC(=O)CC1COCC2CCCN21 Amb18822512 [0,0,0,2,0,0|2,0,0]=4 1453 B14R2.9440 OC(=O)CN1CCOC2CCCC12 Amb18956041 [0,0,0,2,0,0|2,0,0]=4 1454 B14R2.8995 O=C1CC(CC2CCCCCC2)N1 Amb24738812 [0,0,0,2,0,0|1,0,0]=3 1455 B14R2.507 CCCN1C2CCCC1CC(=O)C2 Amb10610690 [0,0,0,2,0,0|2,0,0]=4 1456 B14R2.507 CCCN1[C@@H]2CC(=O)C[C@H]1CCC2 Amb25760726 [0,0,0,2,0,0|2,0,0]=4 1457 B14R2.642 CC1CC2CCCCC2N1C(=O)Cl Amb25301381 [0,0,0,2,0,0|2,0,0]=4 1458 B14R2.642 CC1CC2CCCCC2N1C(N)=O Amb24618615 [0,0,0,2,0,0|2,0,0]=4 1459 B14R2.642 CC1OC2CCCCC2N1C(O)=O Amb24061898 [0,0,0,2,0,0|2,0,0]=4 1460 B14R2.642 CN1CC2CCCCC2C1C(O)=O Amb24687955 [0,0,0,2,0,0|1,0,0]=3 1461 B14R2.642 CN1CC2CNCCC2C1C(O)=O Amb24557156 [0,0,0,2,0,0|2,0,0]=4 1462 B14R2.642 CN1C[C@@H]2CNCC[C@@H]2C1C(O)=O Amb18822890 [0,0,0,2,0,0|2,0,0]=4 1463 B14R2.1146 CC[C@H]1NC(=O)O[C@H]2CCCCC21 Amb24513151 [0,0,0,2,0,0|2,0,0]=4 1464 B14R2.1146 OCC1OC(=O)CC2CCNCC21 Amb25047269 [0,0,0,2,0,0|2,0,0]=4 1465 B14R2.9572 CC(=O)N[C@H]1C[C@H]2CCC[C@@H]1CC2 Amb24642506 [0,0,0,2,0,0|2,0,0]=4 1466 B14R2.9577 OC(=O)CC1CCCCN1C2CC2 Amb18191973 [0,0,0,2,0,0|1,0,0]=3 1467 B14R2.9577 OC(=O)CC1CSCCN1C2CC2 Amb25288880 [0,0,0,2,0,0|2,0,0]=4 1468 B14R2.9577 OC(=O)C[C@@H]1CCCN[C@H]1C2CC2 Amb18191953 [0,0,0,2,0,0|1,0,0]=3 1469 B14R2.9577 OC(=O)C[C@H]1CCCN[C@@H]1C2CC2 Amb24628495 [0,0,0,2,0,0|1,0,0]=3 1470 B14R2.11030 OC(=O)CC1CCOCC12CCC2 Amb18191665 [0,0,0,2,0,0|1,0,0]=3 1471 B14R2.11030 OC(=O)CC1CCSCC12CCC2 Amb18810424 [0,0,0,2,0,0|1,0,0]=3 1472 B14R2.11030 OC(=O)CN1CCOCC12CCC2 Amb25214353 [0,0,0,2,0,0|2,0,0]=4 1473 B14R2.30919 NC(=O)CN1C2CCCC1CCC2 Amb24400481 [0,0,0,2,0,0|2,0,0]=4 1474 B14R2.30919 OC(=O)CC1C2CCCC1CCC2 Amb24463134 [0,0,0,2,0,0|0,0,0]=2 1475 B14R2.30919 OC(=O)CN1C2CCCC1CCC2 Amb25672003 [0,0,0,2,0,0|1,0,0]=3 1476 B14R2.30919 OC(=O)C[C@@H]1[C@H]2CNC[C@@H]1CCC2 Amb24650945 [0,0,0,2,0,0|1,0,0]=3 1477 B14R2.31681 OC(=O)CC12CC=CCC1CCC2 Amb25287263 [0,0,0,2,0,0|0,0,2]=4 1478 B14R2.6207 NCCN1C2CCC1CC2C(O)=O Amb25085377 [0,0,0,2,0,0|2,0,0]=4 1479 B14R2.6207 OCCN1C2CCC1CC2C(O)=O Amb24424218 [0,0,0,2,0,0|2,0,0]=4 1480 B14R2.21878 CC(=O)CCN1CCCC12CCC2 Amb25829686 [0,0,0,2,0,0|2,0,0]=4 1481 B14R2.21878 NC(=O)CNC1CCCC12CCC2 Amb24602612 [0,0,0,2,0,0|2,0,0]=4 1482 B14R2.21878 OC(=O)CCN1CCCC12CCC2 Amb24644978 [0,0,0,2,0,0|1,0,0]=3 1483 B14R2.30999 OC(=O)CCC12CCCC1CCC2 Amb24443729 [0,0,0,2,0,0|0,0,0]=2 1484 B14R2.9513 CC(=O)C1CCCCN1CC2CC2 Amb25321862 [0,0,0,2,0,0|2,0,0]=4 1485 B14R2.9513 OC(=O)C1CCCCC1NC2CC2 Amb22585732 [0,0,0,2,0,0|1,0,0]=3 1486 B14R2.9513 OC(=O)C1CCCCN1CC2CC2 Amb13886158 [0,0,0,2,0,0|1,0,0]=3 1487 B14R2.9513 OC(=O)C1CCCCN1CC2CC2 Amb2382769 [0,0,0,2,0,0|1,0,0]=3 1488 B14R2.9513 OC(=O)C1CCCNC1CC2CC2 Amb24356392 [0,0,0,2,0,0|1,0,0]=3 1489 B14R2.9513 OC(=O)C1CNCCN1CC2CC2 Amb18822866 [0,0,0,2,0,0|2,0,0]=4 1490 B14R2.9513 OC(=O)C1COCCN1CC2CC2 Amb25111002 [0,0,0,2,0,0|2,0,0]=4 1491 B14R2.9513 OC(=O)C1CSCCN1CC2CC2 Amb24730142 [0,0,0,2,0,0|2,0,0]=4 1492 B14R2.9532 OC(=O)C1CCCCC1N2CCC2 Amb25219988 [0,0,0,2,0,0|1,0,0]=3 1493 B14R2.9532 OC(=O)C1CCCCN1C2COC2 Amb18822519 [0,0,0,2,0,0|2,0,0]=4 1494 B14R2.9532 OC(=O)C1CNCCC1C2CCC2 Amb25716872 [0,0,0,2,0,0|1,0,0]=3 1495 B14R2.30654 CC(O)C12CCCCC1CCCC2 Amb24672758 [0,0,0,2,0,0|1,0,1]=4 1496 B14R2.30654 CC(O)[C@@]12CCCC[C@@H]1CCCC2 Amb25792314 [0,0,0,2,0,0|1,0,1]=4 1497 B14R2.30654 CC(O)[C@]12CCCC[C@@H]1CCCC2 Amb24412151 [0,0,0,2,0,0|1,0,1]=4 1498 B14R2.30654 NC(=O)C12CCCCC1CCCC2 Amb25088377 [0,0,0,2,0,0|1,0,0]=3 1499 B14R2.30654 NC(=O)C12CCCCN1CCCC2 Amb25321034 [0,0,0,2,0,0|2,0,0]=4 1500 B14R2.30654 OC(=O)C12CC=CCC1CCCC2 Amb18128727 [0,0,0,2,0,0|0,0,2]=4 1501 B14R2.30654 OC(=O)C12CCCCC1CCCC2 Amb18648658 [0,0,0,2,0,0|0,0,0]=2 1502 B14R2.30654 OC(=O)C12CCNCC1CCCC2 Amb25195620 [0,0,0,2,0,0|1,0,0]=3 1503 B14R2.30654 OC(=O)C12CNCCC1CCCC2 Amb25224065 [0,0,0,2,0,0|1,0,0]=3 1504 B14R2.30654 OC(=O)[C@@]12CCCC[C@@H]1CCCC2 Amb25295441 [0,0,0,2,0,0|0,0,0]=2 1505 B14R2.30654 OC(=O)[C@@]12COCC[C@H]1NCCC2 Amb24546922 [0,0,0,2,0,0|2,0,0]=4 1506 B14R2.30654 OC(=O)[C@]12CC=CC[C@H]1CCCC2 Amb24692686 [0,0,0,2,0,0|0,0,2]=4 1507 B14R2.849 CCCCN1C2CC(=O)CC1CC2 Amb18805387 [0,0,0,2,0,0|2,0,0]=4 1508 B14R2.849 CCCCN1[C@@H]2CC(=O)C[C@H]1CC2 Amb25278335 [0,0,0,2,0,0|2,0,0]=4 1509 B14R2.1103 CCN1CC2CCCC2C1C(N)=O Amb24403546 [0,0,0,2,0,0|2,0,0]=4 1510 B14R2.4497 CC1NCC2CCCN2C1C(O)=O Amb18191615 [0,0,0,2,0,0|2,0,0]=4 1511 B14R2.4497 NC1CCN2CCCC2C1C(O)=O Amb18191612 [0,0,0,2,0,0|2,0,0]=4 1512 B14R2.4497 OC1CCC2CCCC2C1C(O)=O Amb24392129 [0,0,0,2,0,0|1,0,0]=3 1513 B14R2.4497 O[C@@H]1CC[C@H]2CCC[C@@H]2[C@@H]1C(O)=O Amb24580358 [0,0,0,2,0,0|1,0,0]=3 1514 B14R2.9434 OC(=O)CN1C2CCNCC1CC2 Amb24490045 [0,0,0,2,0,0|2,0,0]=4 1515 B14R2.11049 OC(=O)CC1CCCN1C2CCC2 Amb25085332 [0,0,0,2,0,0|1,0,0]=3 1516 B14R2.11049 OC(=O)CN1CCCC1C2CCC2 Amb25285528 [0,0,0,2,0,0|1,0,0]=3 1517 B14R2.11049 OC(=O)CN1CCCC1C2CCC2 Amb25749228 [0,0,0,2,0,0|1,0,0]=3 1518 B14R2.9564 NC(=O)C1CCCN1CC2CCC2 Amb25056454 [0,0,0,2,0,0|2,0,0]=4 1519 B14R2.9564 OC(=O)[C@@H]1CCCN1CC2CCC2 Amb24700192 [0,0,0,2,0,0|1,0,0]=3 1520 B14R2.9564 OC(=O)[C@@H]1CCCN1CC2CCC2 Amb25091968 [0,0,0,2,0,0|1,0,0]=3 1521 B14R2.9564 OC(=O)[C@H]1CCCN1CC2CCC2 Amb24394521 [0,0,0,2,0,0|1,0,0]=3 1522 B14R2.31232 OC(=O)C1CCN2CCCCCC21 Amb25110152 [0,0,0,2,0,0|1,0,0]=3 1523 B14R2.31232 OC(=O)C1CCN2CCCCC[C@@H]21 Amb18191968 [0,0,0,2,0,0|1,0,0]=3 1524 B14R2.2303 OCC1CCC2CCCCC(=O)N21 Amb25048521 [0,0,0,2,0,0|2,0,0]=4 1525 B14R2.2303 OC[C@@H]1CCC2CCCCC(=O)N21 Amb25236221 [0,0,0,2,0,0|2,0,0]=4 1526 B14R2.30687 OC(=O)C1CCCCCCC2CC21 Amb25702315 [0,0,0,2,0,0|0,0,0]=2 1527 B14R2.30687 OC(=O)[C@H]1CCCCCC[C@@H]2C[C@@H]21 Amb24558220 [0,0,0,2,0,0|0,0,0]=2 1528 B14R2.30847 OC(=O)C1C2CCCCCCCC21 Amb24724812 [0,0,0,2,0,0|0,0,0]=2 1529 B14R2.30927 NC(=O)N[C@@H]1[C@H]2CCCCCC[C@H]21 Amb25060661 [0,0,0,2,0,0|2,0,0]=4 1530 B14R2.30927 OC(=O)CC1C2CCC=CCCC21 Amb25139492 [0,0,0,2,0,0|0,0,2]=4 1531 B14R2.30927 OC(=O)C[C@@H]1[C@@H]2CCC=CCC[C@@H]21 Amb25363381 [0,0,0,2,0,0|0,0,2]=4 1532 B14R2.30710 OC(=O)C1CC1C2CCCCCC2 Amb25780545 [0,0,0,2,0,0|0,0,0]=2