0 B11R0.3 C=CCCCCCCCCC=C Amb19944679 [0,0,0,0,0,0|1,0,3]=4 1 B11R0.3 C=CCCCCCCCC[Mg]Br Amb22897280 [0,0,0,0,0,0|2,0,2]=4 2 B11R0.3 C=CCCCCCCCC[Zn]Br Amb22898142 [0,0,0,0,0,0|2,0,2]=4 3 B11R0.3 CCC#CCC#CCCCCO Amb24379917 [0,0,0,0,0,0|0,0,4]=4 4 B11R0.3 CCCCC#CCC#CCCO Amb25725506 [0,0,0,0,0,0|0,0,4]=4 5 B11R0.3 CCCCCC#CCC#CCO Amb24463863 [0,0,0,0,0,0|0,0,4]=4 6 B11R0.3 CCCCCCCCCCCF Amb17939015 [0,0,0,0,0,0|1,0,0]=1 7 B11R0.3 CCCCCCCCCCCS Amb22366963 [0,0,0,0,0,0|0,1,0]=1 8 B11R0.3 CCCCCCCCCCOC Amb21520322 [0,0,0,0,0,0|2,0,0]=2 9 B11R0.3 CCCCCCCCCC[13CH]=[13CH2] Amb22351201 [0,0,0,0,0,0|1,0,1]=2 10 B11R0.3 CCCCCCCCCC[Hg]Cl Amb22359876 [0,0,0,0,0,0|2,0,0]=2 11 B11R0.3 CCCCCCCCCC[Mg]Br Amb22363113 [0,0,0,0,0,0|2,0,0]=2 12 B11R0.3 CCCCCCCCCC[Mg]Cl Amb22737569 [0,0,0,0,0,0|2,0,0]=2 13 B11R0.3 CCCCCCCCCN=C=O Amb22336763 [0,0,0,0,0,0|1,0,2]=3 14 B11R0.3 CCCCCCCCCSCC Amb22359735 [0,0,0,0,0,0|2,0,0]=2 15 B11R0.3 CCCCCCCCNCCN Amb18794624 [0,0,0,0,0,0|2,0,0]=2 16 B11R0.3 CCCCCCCCNCCN Amb22358941 [0,0,0,0,0,0|2,0,0]=2 17 B11R0.3 CCCCCCCCOCC=O Amb18807440 [0,0,0,0,0,0|1,0,2]=3 18 B11R0.3 CCCCCCCCSCC#N Amb10669578 [0,0,0,0,0,0|2,0,1]=3 19 B11R0.3 CCCCCCCCSCCO Amb1032988 [0,0,0,0,0,0|1,0,0]=1 20 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [0,0,0,0,0,0|0,0,4]=4 21 B11R0.3 CCCCCCCC\C=C\CO Amb22052644 [0,0,0,0,0,0|0,0,2]=2 22 B11R0.3 CCCCCCCNCCCN Amb18794637 [0,0,0,0,0,0|2,0,0]=2 23 B11R0.3 CCCCCC\C=C\C=C\CO Amb22732394 [0,0,0,0,0,0|0,0,4]=4 24 B11R0.3 CCCCCNCCCCOC Amb18808137 [0,0,0,0,0,0|3,0,0]=3 25 B11R0.3 CCCCCOCCOCCO Amb22366805 [0,0,0,0,0,0|2,0,0]=2 26 B11R0.3 CCCCCSCCOCCN Amb17501985 [0,0,0,0,0,0|3,0,0]=3 27 B11R0.3 CCCCCSSCCCCC Amb22733468 [0,0,0,0,0,0|3,0,0]=3 28 B11R0.3 CCCCNCCNCCCC Amb20214589 [0,0,0,0,0,0|3,0,0]=3 29 B11R0.3 CCCCNCCNCCOC Amb18804253 [0,0,0,0,0,0|4,0,0]=4 30 B11R0.3 CCCCOCCOCCCC Amb22168138 [0,0,0,0,0,0|3,0,0]=3 31 B11R0.3 CCCC\C=C\CCCCCC Amb22546624 [0,0,0,0,0,0|1,0,2]=3 32 B11R0.3 CCCNCCCCNCCC Amb18803293 [0,0,0,0,0,0|3,0,0]=3 33 B11R0.3 CCCNCCNCCCOC Amb18804248 [0,0,0,0,0,0|4,0,0]=4 34 B11R0.3 CCCSCCCCSCCC Amb22366042 [0,0,0,0,0,0|3,0,0]=3 35 B11R0.3 CCNCCCCCCNCC Amb22733571 [0,0,0,0,0,0|3,0,0]=3 36 B11R0.3 CCNCCCNCCCOC Amb20203747 [0,0,0,0,0,0|4,0,0]=4 37 B11R0.3 CC\C=C/CCCCCCC=O Amb10807471 [0,0,0,0,0,0|0,0,4]=4 38 B11R0.3 CNCCCCCCCCNC Amb22336315 [0,0,0,0,0,0|3,0,0]=3 39 B11R0.3 CNCCNCCCCCCC Amb20140578 [0,0,0,0,0,0|3,0,0]=3 40 B11R0.3 COCCCCCCCCOC Amb21618846 [0,0,0,0,0,0|3,0,0]=3 41 B11R0.3 COCCCCNCCCOC Amb18808762 [0,0,0,0,0,0|4,0,0]=4 42 B11R0.3 COCCOCCOCCCC Amb24059881 [0,0,0,0,0,0|4,0,0]=4 43 B11R0.3 C\C=C\CCCCCCCCO Amb22641580 [0,0,0,0,0,0|0,0,2]=2 44 B11R0.3 ICCCCCCCCCCI Amb10071532 [0,0,0,0,0,0|2,0,0]=2 45 B11R0.3 NCCCCCCCCCCBr Amb17609917 [0,0,0,0,0,0|2,0,0]=2 46 B11R0.3 NCCCCCCCCCCN Amb22732919 [0,0,0,0,0,0|2,0,0]=2 47 B11R0.3 NCCCCCCCCCCO Amb17607975 [0,0,0,0,0,0|1,0,0]=1 48 B11R0.3 NCCCSCCSCCCN Amb21953301 [0,0,0,0,0,0|4,0,0]=4 49 B11R0.3 NCCNCCCCNCCN Amb22365939 [0,0,0,0,0,0|4,0,0]=4 50 B11R0.3 NCCOCCOCOCCO Amb22731197 [0,0,0,0,0,0|4,0,0]=4 51 B11R0.3 O=CCCCCCCCCCBr Amb21963218 [0,0,0,0,0,0|1,0,2]=3 52 B11R0.3 OCCCCCCCCC#CC Amb10605931 [0,0,0,0,0,0|0,0,2]=2 53 B11R0.3 OCCCCCCCCCCCl Amb10844747 [0,0,0,0,0,0|1,0,0]=1 54 B11R0.3 OCCCCSSCCCCO Amb10562289 [0,0,0,0,0,0|3,0,0]=3 55 B10R0.71 BrCCCCOCCCCBr Amb24064682 [1,0,0,0,0,0|3,0,0]=4 56 B10R0.71 C=CCCCCCCCCCl Amb22898754 [1,0,0,0,0,0|1,0,2]=4 57 B10R0.71 CCC#CCCCCCCCl Amb22052713 [1,0,0,0,0,0|1,0,2]=4 58 B10R0.71 CCCCCC#CCCCCl Amb22227924 [1,0,0,0,0,0|1,0,2]=4 59 B10R0.71 CCCCCCCC#CCO Amb17774678 [1,0,0,0,0,0|0,0,2]=3 60 B10R0.71 CCCCCCCCCNC Amb10609826 [1,0,0,0,0,0|1,0,0]=2 61 B10R0.71 CCCCCCCCCOC Amb2582537 [1,0,0,0,0,0|1,0,0]=2 62 B10R0.71 CCCCCCCCCSC Amb22230926 [1,0,0,0,0,0|1,0,0]=2 63 B10R0.71 CCCCCCCCC[Mg]Br Amb22000598 [1,0,0,0,0,0|2,0,0]=3 64 B10R0.71 CCCCCCCCC[Zn]Br Amb22000508 [1,0,0,0,0,0|2,0,0]=3 65 B10R0.71 CCCCCCCCOC=O Amb22231360 [1,0,0,0,0,0|1,0,2]=4 66 B10R0.71 CCCCCCCCOCBr Amb22733274 [1,0,0,0,0,0|2,0,0]=3 67 B10R0.71 CCCCCCCCOCCl Amb22230404 [1,0,0,0,0,0|2,0,0]=3 68 B10R0.71 CCCCCCCCSC#N Amb17939432 [1,0,0,0,0,0|2,0,1]=4 69 B10R0.71 CCCCCCCCSCC Amb17672979 [1,0,0,0,0,0|1,0,0]=2 70 B10R0.71 CCCCCCC\C=C/CO Amb10563790 [1,0,0,0,0,0|0,0,2]=3 71 B10R0.71 CCCCCCNCCCN Amb17315272 [1,0,0,0,0,0|2,0,0]=3 72 B10R0.71 CCCCCC\C=C\CCO Amb22641690 [1,0,0,0,0,0|0,0,2]=3 73 B10R0.71 CCCCCNCCCCC Amb22359459 [1,0,0,0,0,0|1,0,0]=2 74 B10R0.71 CCCCCNCCCCC Amb22366791 [1,0,0,0,0,0|1,0,0]=2 75 B10R0.71 CCCCCSCCCCN Amb17500943 [1,0,0,0,0,0|2,0,0]=3 76 B10R0.71 CCCCC\C=C\CCCO Amb10807437 [1,0,0,0,0,0|0,0,2]=3 77 B10R0.71 CCCCNCCCCCO Amb17334477 [1,0,0,0,0,0|1,0,0]=2 78 B10R0.71 CCCCOCCCNCC Amb18183369 [1,0,0,0,0,0|2,0,0]=3 79 B10R0.71 CCCCOCOCCCC Amb10566860 [1,0,0,0,0,0|2,0,0]=3 80 B10R0.71 CCCCSCCOCCN Amb17501984 [1,0,0,0,0,0|3,0,0]=4 81 B10R0.71 CCCNCCNCCCC Amb18800035 [1,0,0,0,0,0|2,0,0]=3 82 B10R0.71 CCCNCCNCCOC Amb18797900 [1,0,0,0,0,0|3,0,0]=4 83 B10R0.71 CCNCCCNCCCO Amb20171980 [1,0,0,0,0,0|2,0,0]=3 84 B10R0.71 CCNCCCNCCOC Amb18797912 [1,0,0,0,0,0|3,0,0]=4 85 B10R0.71 CCNCCNCCCOC Amb18797907 [1,0,0,0,0,0|3,0,0]=4 86 B10R0.71 CC\C=C\CCCCCCO Amb22231682 [1,0,0,0,0,0|0,0,2]=3 87 B10R0.71 CNCCCNCCCOC Amb20171986 [1,0,0,0,0,0|3,0,0]=4 88 B10R0.71 COCCCCCCCCO Amb17617052 [1,0,0,0,0,0|1,0,0]=2 89 B10R0.71 COCCCNCCCCO Amb17334530 [1,0,0,0,0,0|2,0,0]=3 90 B10R0.71 COCOCCCCCCCl Amb22641573 [1,0,0,0,0,0|3,0,0]=4 91 B10R0.71 ICCCCCCCCCI Amb20242392 [1,0,0,0,0,0|2,0,0]=3 92 B10R0.71 N#CCCCCCCCCO Amb22641582 [1,0,0,0,0,0|1,0,1]=3 93 B10R0.71 NCCCCNCCCCN Amb22055385 [1,0,0,0,0,0|3,0,0]=4 94 B10R0.71 NCCCNCCCOCC Amb17315298 [1,0,0,0,0,0|3,0,0]=4 95 B10R0.71 NCCCOCCOCCO Amb22292476 [1,0,0,0,0,0|3,0,0]=4 96 B10R0.71 OCCCCCCCCC#C Amb16231465 [1,0,0,0,0,0|0,0,2]=3 97 B10R0.71 OCCCCCCCCCCl Amb16234125 [1,0,0,0,0,0|1,0,0]=2 98 B10R0.71 OCCCCNCCCCO Amb21858890 [1,0,0,0,0,0|2,0,0]=3 99 B10R0.71 OCCCCOCCCCO Amb21960124 [1,0,0,0,0,0|2,0,0]=3 100 B10R0.71 OCCNCCCNCCO Amb21858029 [1,0,0,0,0,0|3,0,0]=4 101 B12R0.1 BrCCCCCCCC(=O)OCC Amb10604167 [0,1,0,0,0,0|2,0,1]=4 102 B12R0.1 CCCC(=O)NCCCCCCO Amb24072634 [0,1,0,0,0,0|1,0,1]=3 103 B12R0.1 CCCCCCCCC(=O)NCO Amb22043215 [0,1,0,0,0,0|1,0,1]=3 104 B12R0.1 CCCCCCCCC(C)CCC Amb22734087 [0,1,0,0,0,0|1,0,0]=2 105 B12R0.1 CCCCCCCCS(=O)CCCl Amb1034855 [0,1,0,0,0,0|2,0,0]=3 106 B12R0.1 CCCCCCCCS(=O)CCO Amb1085921 [0,1,0,0,0,0|1,0,0]=2 107 B12R0.1 CCCCCCCNC(C)CCN Amb20090499 [0,1,0,0,0,0|2,0,0]=3 108 B12R0.1 CCOC(=O)CCCCCCCCl Amb22002672 [0,1,0,0,0,0|2,0,1]=4 109 B12R0.1 CCOC(=O)CCCCCCCF Amb24063238 [0,1,0,0,0,0|2,0,1]=4 110 B12R0.1 CCOC(=O)CCCCCCCN Amb19375589 [0,1,0,0,0,0|2,0,1]=4 111 B12R0.5 C=CCCCCCCCCCCBr Amb22899287 [0,1,0,0,0,0|1,0,1]=3 112 B12R0.5 C=CCCCCCCCCCCN Amb24120407 [0,1,0,0,0,0|1,0,1]=3 113 B12R0.5 C=CCCCCCCCCC[Mg]Br Amb22897367 [0,1,0,0,0,0|1,0,2]=4 114 B12R0.5 C=CCCCCCCCCC[Zn]Br Amb22897886 [0,1,0,0,0,0|1,0,2]=4 115 B12R0.5 CCCCC#CCCCCCCCl Amb16232464 [0,1,0,0,0,0|1,0,1]=3 116 B12R0.5 CCCCCCCCCCCCCl Amb22733144 [0,1,0,0,0,0|1,0,0]=2 117 B12R0.5 CCCCCCCCCCCCN Amb22366429 [0,1,0,0,0,0|1,0,0]=2 118 B12R0.5 CCCCCCCCCCCC[14CH3] Amb22352523 [0,1,0,0,0,0|1,0,0]=2 119 B12R0.5 CCCCCCCCCCCC[15NH2] Amb22362752 [0,1,0,0,0,0|1,0,0]=2 120 B12R0.5 CCCCCCCCCCCC[NH3+] Amb22049481 [0,1,0,0,0,0|1,0,0]=2 121 B12R0.5 CCCCCCCCCCC[13CH2]Br Amb22338410 [0,1,0,0,0,0|1,0,0]=2 122 B12R0.5 CCCCCCCCCCC[13CH2]O Amb22362751 [0,1,0,0,0,0|0,0,0]=1 123 B12R0.5 CCCCCCCCCCC[Mg]Br Amb22897368 [0,1,0,0,0,0|1,0,0]=2 124 B12R0.5 CCCCCCCCCCN=C=O Amb22348014 [0,1,0,0,0,0|0,0,2]=3 125 B12R0.5 CCCCCCCCCCOC=C Amb22735088 [0,1,0,0,0,0|1,0,1]=3 126 B12R0.5 CCCCCCCCCCOCC Amb24056425 [0,1,0,0,0,0|1,0,0]=2 127 B12R0.5 CCCCCCCCCC\C=C\Cl Amb22731233 [0,1,0,0,0,0|1,0,1]=3 128 B12R0.5 CCCCCCCCC\C=C\C=O Amb22351858 [0,1,0,0,0,0|0,0,3]=4 129 B12R0.5 CCCCCCCCC\C=C\CO Amb22350397 [0,1,0,0,0,0|0,0,1]=2 130 B12R0.5 CCCCCCCCNCCCN Amb19058864 [0,1,0,0,0,0|1,0,0]=2 131 B12R0.5 CCCCCCCCOCCCN Amb13951369 [0,1,0,0,0,0|1,0,0]=2 132 B12R0.5 CCCCCCCCSCCC#N Amb22358950 [0,1,0,0,0,0|1,0,1]=3 133 B12R0.5 CCCCCCCC\C=C\CC=O Amb22735030 [0,1,0,0,0,0|0,0,3]=4 134 B12R0.5 CCCCCCNCCCCCC Amb22350699 [0,1,0,0,0,0|1,0,0]=2 135 B12R0.5 CCCCCCNCCCCCC Amb22359816 [0,1,0,0,0,0|1,0,0]=2 136 B12R0.5 CCCCCC\C=C/CCCCO Amb22740006 [0,1,0,0,0,0|0,0,1]=2 137 B12R0.5 CCCCCC\C=C\CCCCO Amb22740007 [0,1,0,0,0,0|0,0,1]=2 138 B12R0.5 CCCCNCCNCCCOC Amb20140559 [0,1,0,0,0,0|2,0,0]=3 139 B12R0.5 CCCCOCCOCOCCO Amb24080645 [0,1,0,0,0,0|2,0,0]=3 140 B12R0.5 CCCC\C=C/CCCCCCO Amb10563789 [0,1,0,0,0,0|0,0,1]=2 141 B12R0.5 CCC\C=C/CCCCCCCO Amb20243410 [0,1,0,0,0,0|0,0,1]=2 142 B12R0.5 CCC\C=C\CCCCCCCO Amb22734806 [0,1,0,0,0,0|0,0,1]=2 143 B12R0.5 CCNCCNCCCCCCC Amb20140577 [0,1,0,0,0,0|2,0,0]=3 144 B12R0.5 CCOCCCCCCCCCO Amb22233218 [0,1,0,0,0,0|0,0,0]=1 145 B12R0.5 CC\C=C\CCCCCCCCO Amb22731394 [0,1,0,0,0,0|0,0,1]=2 146 B12R0.5 CNCCCNCCCCCCC Amb20171957 [0,1,0,0,0,0|2,0,0]=3 147 B12R0.5 COCCNCCNCCCOC Amb19073125 [0,1,0,0,0,0|3,0,0]=4 148 B12R0.5 C\C=C\CCCCCCCCCO Amb22731398 [0,1,0,0,0,0|0,0,1]=2 149 B12R0.5 ICCCCCCCCCCCI Amb22346855 [0,1,0,0,0,0|1,0,0]=2 150 B12R0.5 N#CCCCCCCCCCC#N Amb22734365 [0,1,0,0,0,0|1,0,2]=4 151 B12R0.5 NCCCCCCCCCCCN Amb16233911 [0,1,0,0,0,0|1,0,0]=2 152 B12R0.5 NCCCCCCCCCCCS Amb22336989 [0,1,0,0,0,0|0,1,0]=2 153 B12R0.5 NCCCSCCCSCCCN Amb21953257 [0,1,0,0,0,0|3,0,0]=4 154 B12R0.5 NCCCSCCCSCCCN Amb21953298 [0,1,0,0,0,0|3,0,0]=4 155 B12R0.5 NCCNCCCCCNCCN Amb24184153 [0,1,0,0,0,0|3,0,0]=4 156 B12R0.5 NCCOCCOCCOCCO Amb10604926 [0,1,0,0,0,0|3,0,0]=4 157 B12R0.5 OCCCCCCCCCCC#C Amb10602413 [0,1,0,0,0,0|0,0,1]=2 158 B12R0.5 OCCCCCCCCCCCO Amb15692712 [0,1,0,0,0,0|0,0,0]=1 159 B12R0.5 OCCCOCCCOCCCO Amb10789558 [0,1,0,0,0,0|2,0,0]=3 160 B12R0.5 OCCNCCCCCNCCO Amb24080936 [0,1,0,0,0,0|2,0,0]=3 161 B12R0.5 OCCOCCOCCOCCBr Amb24057547 [0,1,0,0,0,0|3,0,0]=4 162 B12R0.5 OCCOCCOCCOCCS Amb24058083 [0,1,0,0,0,0|3,0,0]=4 163 B12R0.5 SCCCCCCCCCCCS Amb22352799 [0,1,0,0,0,0|0,1,0]=2 164 B12R0.47 CCCCC\C=C(\I)/CCCCC Amb22546769 [0,1,0,0,0,0|1,0,2]=4 165 B12R0.47 CCCCOC(=O)CCCCCO Amb22054598 [0,1,0,0,0,0|1,0,1]=3 166 B12R0.206 CCCCC(=O)NCCCCCN Amb18100642 [0,1,0,0,0,0|2,0,1]=4 167 B12R0.206 CCCCC(=O)OCCCCCC Amb22348394 [0,1,0,0,0,0|2,0,1]=4 168 B12R0.206 CCCCCCNC(=O)CCCCl Amb17332518 [0,1,0,0,0,0|2,0,1]=4 169 B12R0.206 CCCCCCOC(=O)CCCCl Amb19960303 [0,1,0,0,0,0|2,0,1]=4 170 B12R0.234 C=CCCCCCCCCC(O)=O Amb22353389 [0,1,0,0,0,0|0,0,3]=4 171 B12R0.234 C=CCCCCCCCCC(O)=O Amb22731323 [0,1,0,0,0,0|0,0,3]=4 172 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [0,1,0,0,0,0|2,0,1]=4 173 B12R0.234 CC(C)CCCCCCCCC=O Amb22055859 [0,1,0,0,0,0|0,0,2]=3 174 B12R0.234 CC(C)CCCCCCCCCO Amb22055860 [0,1,0,0,0,0|0,0,0]=1 175 B12R0.234 CC(C)OCCOCCOCCO Amb24325423 [0,1,0,0,0,0|3,0,0]=4 176 B12R0.234 CCCCCCCC/C=C/C(O)=O Amb17942922 [0,1,0,0,0,0|0,0,3]=4 177 B12R0.234 CCCCCCCCCCB(O)O Amb19958787 [0,1,0,0,0,0|1,0,0]=2 178 B12R0.234 CCCCCCCCCCC(C)Br Amb22338800 [0,1,0,0,0,0|1,0,0]=2 179 B12R0.234 CCCCCCCCCCC(C)C Amb22228876 [0,1,0,0,0,0|1,0,0]=2 180 B12R0.234 CCCCCCCCCC[SiH](C)C Amb19893766 [0,1,0,0,0,0|1,1,0]=3 181 B12R0.234 CCCCCCCCCOC(=O)Cl Amb22732385 [0,1,0,0,0,0|1,0,2]=4 182 B12R0.234 CCCCCCCCCOC([S-])=S Amb19748280 [0,1,0,0,0,0|1,1,1]=4 183 B12R0.234 CCCCCCCC\N=C\C(C)C Amb10561683 [0,1,0,0,0,0|2,0,1]=4 184 B12R0.234 COCCCCNCCCC(C)C Amb23510254 [0,1,0,0,0,0|3,0,0]=4 185 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [0,1,0,0,0,0|1,0,1]=3 186 B12R0.248 CCCCCCCCC[14C](=O)O[Na] Amb22352051 [0,1,0,0,0,0|2,0,1]=4 187 B12R0.248 CCCCCCCCC[C@@H](O)CCl Amb22736721 [0,1,0,0,0,0|1,0,0]=2 188 B12R0.248 CCCCCCCCC[C@H](O)CCl Amb22736722 [0,1,0,0,0,0|1,0,0]=2 189 B12R0.248 CCCCCCCCC\C(\N)=N\O Amb19046143 [0,1,0,0,0,0|1,0,1]=3 190 B12R0.248 CCCCCCCCNC(=O)CBr Amb17329848 [0,1,0,0,0,0|2,0,1]=4 191 B12R0.248 CCCCCCCCNC(=O)CN Amb24115163 [0,1,0,0,0,0|2,0,1]=4 192 B12R0.248 CCCCCCCCOC(=O)CS Amb22735097 [0,1,0,0,0,0|1,1,1]=4 193 B12R0.248 CCCCCCCCOC(=O)C[NH3+] Amb22049491 [0,1,0,0,0,0|2,0,1]=4 194 B12R0.248 OCCCCCCCCC(=O)OC Amb17616943 [0,1,0,0,0,0|1,0,1]=3 195 B12R0.248 OCCCCCCCCC(CO)O Amb10069452 [0,1,0,0,0,0|1,0,0]=2 196 B12R1.8 BrCCCCOC1CCCCO1 Amb10605338 [0,0,0,1,0,0|2,0,0]=3 197 B12R1.8 Br[Mg]CCCOC1CCCCO1 Amb22897359 [0,0,0,1,0,0|3,0,0]=4 198 B12R1.8 Br[Zn]CCCOC1CCCCO1 Amb22897871 [0,0,0,1,0,0|3,0,0]=4 199 B12R1.8 C=CCCCOC1CCCCO1 Amb21961860 [0,0,0,1,0,0|1,0,2]=4 200 B12R1.8 CC#CCNCC1CCCCO1 Amb18798886 [0,0,0,1,0,0|1,0,2]=4 201 B12R1.8 CC#CCSCC1CCCCO1 Amb25820969 [0,0,0,1,0,0|1,0,2]=4 202 B12R1.8 CCCCC#CC1CCCCO1 Amb10558594 [0,0,0,1,0,0|0,0,2]=3 203 B12R1.8 CCCCCCC1CCCCC1 Amb22230753 [0,0,0,1,0,0|1,0,0]=2 204 B12R1.8 CCCCCCC1CCCCN1 Amb2235857 [0,0,0,1,0,0|1,0,0]=2 205 B12R1.8 CCCCCCC1CSCCS1 Amb2228604 [0,0,0,1,0,0|1,1,0]=3 206 B12R1.8 CCCCCOC1CCNCC1 Amb19149283 [0,0,0,1,0,0|3,0,0]=4 207 B12R1.8 CCCCCOC1CNCCC1 Amb21957467 [0,0,0,1,0,0|3,0,0]=4 208 B12R1.8 CCCCOCC1CCNCC1 Amb17083673 [0,0,0,1,0,0|3,0,0]=4 209 B12R1.8 CCCCOCC1CCNCC1 Amb21954733 [0,0,0,1,0,0|3,0,0]=4 210 B12R1.8 CCCCOCC1CNCCC1 Amb21954811 [0,0,0,1,0,0|3,0,0]=4 211 B12R1.8 CCCCOCN1CCCCC1 Amb24105713 [0,0,0,1,0,0|3,0,0]=4 212 B12R1.8 CCCNCCC1=CCCCC1 Amb1834835 [0,0,0,1,0,0|2,0,1]=4 213 B12R1.8 CCCNCCN1CCCCC1 Amb17232778 [0,0,0,1,0,0|3,0,0]=4 214 B12R1.8 CCCOCCC1CCCCN1 Amb21955080 [0,0,0,1,0,0|2,0,0]=3 215 B12R1.8 CCCOCCC1CCNCC1 Amb21955092 [0,0,0,1,0,0|3,0,0]=4 216 B12R1.8 CCCOCCC1CNCCC1 Amb21955097 [0,0,0,1,0,0|3,0,0]=4 217 B12R1.8 CCCSCCC1CCCCN1 Amb17503510 [0,0,0,1,0,0|2,0,0]=3 218 B12R1.8 CCNCCCC1CCCCN1 Amb18806805 [0,0,0,1,0,0|2,0,0]=3 219 B12R1.8 CCNCCCC1CCNCC1 Amb18806804 [0,0,0,1,0,0|3,0,0]=4 220 B12R1.8 CCNCCCC1CNCCC1 Amb18802058 [0,0,0,1,0,0|3,0,0]=4 221 B12R1.8 CCSCCNC1CCCCC1 Amb22588085 [0,0,0,1,0,0|3,0,0]=4 222 B12R1.8 CNCCCCC1CNCCC1 Amb23557906 [0,0,0,1,0,0|3,0,0]=4 223 B12R1.8 CNCCCCN1CCCCC1 Amb18793821 [0,0,0,1,0,0|3,0,0]=4 224 B12R1.8 CNCCCNC1CCCCC1 Amb18802059 [0,0,0,1,0,0|3,0,0]=4 225 B12R1.8 COCCNCC1CCCCC1 Amb2119880 [0,0,0,1,0,0|3,0,0]=4 226 B12R1.8 ClCCCCCN1CCCCC1 Amb19040192 [0,0,0,1,0,0|2,0,0]=3 227 B12R1.8 ClCCCCCN1CCCCC1 Amb19515039 [0,0,0,1,0,0|2,0,0]=3 228 B12R1.8 ClCCCCCN1CCOCC1 Amb17933321 [0,0,0,1,0,0|3,0,0]=4 229 B12R1.8 ClCCNCCN1CCCCC1 Amb20573237 [0,0,0,1,0,0|3,0,0]=4 230 B12R1.8 FCCOCCC1CCCCN1 Amb21956590 [0,0,0,1,0,0|3,0,0]=4 231 B12R1.8 FCCOCCC1CCNCC1 Amb21956695 [0,0,0,1,0,0|3,0,0]=4 232 B12R1.8 FCCOCCC1CNCCC1 Amb21956696 [0,0,0,1,0,0|3,0,0]=4 233 B12R1.8 ICCCCOC1CCCCO1 Amb22055542 [0,0,0,1,0,0|2,0,0]=3 234 B12R1.8 NCCCCCN1CCNCC1 Amb22756848 [0,0,0,1,0,0|3,0,0]=4 235 B12R1.8 NCCCCCN1CCOCC1 Amb13949080 [0,0,0,1,0,0|3,0,0]=4 236 B12R1.8 NCCCCCN1CCSCC1 Amb19060232 [0,0,0,1,0,0|3,0,0]=4 237 B12R1.8 NCCCOCC1CCOCC1 Amb18803463 [0,0,0,1,0,0|3,0,0]=4 238 B12R1.8 NCCNCCN1CCCCC1 Amb20573497 [0,0,0,1,0,0|3,0,0]=4 239 B12R1.8 NCCOCCN1CCCCC1 Amb17138694 [0,0,0,1,0,0|3,0,0]=4 240 B12R1.8 O=CCCCOC1CCCCO1 Amb17620504 [0,0,0,1,0,0|2,0,1]=4 241 B12R1.8 OCC#CCCC1CCCCC1 Amb24577375 [0,0,0,1,0,0|0,0,2]=3 242 B12R1.8 OCCC#CCC1CCCCC1 Amb25681384 [0,0,0,1,0,0|0,0,2]=3 243 B12R1.8 OCCC#CCN1CCCCC1 Amb1094127 [0,0,0,1,0,0|1,0,2]=4 244 B12R1.8 OCCC#CCN1CCCCC1 Amb22283991 [0,0,0,1,0,0|1,0,2]=4 245 B12R1.8 OCCCC#CC1CCCCC1 Amb24642474 [0,0,0,1,0,0|0,0,2]=3 246 B12R1.8 OCCCC=C=C1CCCCC1 Amb24618743 [0,0,0,1,0,0|0,0,3]=4 247 B12R1.8 OCCCCCN1CCCCC1 Amb13883419 [0,0,0,1,0,0|1,0,0]=2 248 B12R1.8 OCCCCOC1CCCCO1 Amb17620505 [0,0,0,1,0,0|2,0,0]=3 249 B12R1.8 OCCNCCC1=CCCCC1 Amb17309067 [0,0,0,1,0,0|1,0,2]=4 250 B12R1.8 OCCNCCN1CCCCC1 Amb18807488 [0,0,0,1,0,0|2,0,0]=3 251 B12R1.8 OCCOCCC1CNCCN1 Amb24089704 [0,0,0,1,0,0|3,0,0]=4 252 B12R1.8 OCCOCCN1CCNCC1 Amb20621403 [0,0,0,1,0,0|3,0,0]=4 253 B12R1.8 SCCNCCC1CCCCC1 Amb24099178 [0,0,0,1,0,0|1,1,0]=3 254 B12R1.18 C#CCCC1CCCCCC1Cl Amb24650539 [0,0,0,1,0,0|1,0,2]=4 255 B12R1.18 C#CCCC1CCCCCC1O Amb25764667 [0,0,0,1,0,0|0,0,2]=3 256 B12R1.18 C#CCNC1CCCCCC1O Amb18281488 [0,0,0,1,0,0|1,0,2]=4 257 B12R1.18 C=C1CCCCCC1CCCCl Amb24565800 [0,0,0,1,0,0|1,0,2]=4 258 B12R1.18 C=CCCC1CCCCCC1Br Amb24452398 [0,0,0,1,0,0|1,0,2]=4 259 B12R1.18 C=CCNC1CCCCCC1O Amb18970408 [0,0,0,1,0,0|1,0,2]=4 260 B12R1.18 C=CCN[C@@H]1CCCCC[C@H]1O Amb25337651 [0,0,0,1,0,0|1,0,2]=4 261 B12R1.18 C=CCSC1CCCCCC1O Amb24641065 [0,0,0,1,0,0|1,0,2]=4 262 B12R1.18 CC#CCC1CCCCCC1Br Amb25224317 [0,0,0,1,0,0|1,0,2]=4 263 B12R1.18 CC#CCC1CCCCCC1Cl Amb18326625 [0,0,0,1,0,0|1,0,2]=4 264 B12R1.18 CC#CCC1CCCCCC1N Amb18798497 [0,0,0,1,0,0|1,0,2]=4 265 B12R1.18 CC#CCC1CCCCCC1O Amb18798689 [0,0,0,1,0,0|0,0,2]=3 266 B12R1.18 CC1CCCCCC1NCC#C Amb24610356 [0,0,0,1,0,0|2,0,1]=4 267 B12R1.18 CC1CCCCCC1NCC=C Amb25305413 [0,0,0,1,0,0|2,0,1]=4 268 B12R1.18 CC1CCCCCC1NCCC Amb18801601 [0,0,0,1,0,0|2,0,0]=3 269 B12R1.18 CC1CCCCCC1NCCN Amb24725700 [0,0,0,1,0,0|2,0,0]=3 270 B12R1.18 CC1CCCCCN1CCCBr Amb24364287 [0,0,0,1,0,0|2,0,0]=3 271 B12R1.18 CC1CCCCCN1CCCF Amb25795294 [0,0,0,1,0,0|2,0,0]=3 272 B12R1.18 CC1CCCCCN1CCON Amb25359685 [0,0,0,1,0,0|3,0,0]=4 273 B12R1.18 CC1CCSCCN1CCCO Amb25154401 [0,0,0,1,0,0|2,0,0]=3 274 B12R1.18 CC1CCSCCN1NCCO Amb24557062 [0,0,0,1,0,0|3,0,0]=4 275 B12R1.18 CC1COCCCN1CCCI Amb25796104 [0,0,0,1,0,0|3,0,0]=4 276 B12R1.18 CC1COCCCN1CCCO Amb25777464 [0,0,0,1,0,0|2,0,0]=3 277 B12R1.18 CCCCC1C=CCCCC1O Amb25831773 [0,0,0,1,0,0|0,0,2]=3 278 B12R1.18 CCCCC1CCCCCC1=O Amb18799266 [0,0,0,1,0,0|0,0,2]=3 279 B12R1.18 CCCCC1CCCCCC1N Amb18801599 [0,0,0,1,0,0|1,0,0]=2 280 B12R1.18 CCCCC1CCCCCC1O Amb18806714 [0,0,0,1,0,0|0,0,0]=1 281 B12R1.18 CCCCC1CCCCOC1O Amb25221052 [0,0,0,1,0,0|1,0,0]=2 282 B12R1.18 CCCCC1NCCCCC1N Amb25766465 [0,0,0,1,0,0|2,0,0]=3 283 B12R1.18 CCCCC1OCCCCC1O Amb25739706 [0,0,0,1,0,0|1,0,0]=2 284 B12R1.18 CCCCN1CCCCCC1C Amb25355926 [0,0,0,1,0,0|2,0,0]=3 285 B12R1.18 CCCCN1CCCNCC1C Amb17578228 [0,0,0,1,0,0|3,0,0]=4 286 B12R1.18 CCCCN1CCCOCC1C Amb25305908 [0,0,0,1,0,0|3,0,0]=4 287 B12R1.18 CCCCN1CCNCCC1C Amb17578241 [0,0,0,1,0,0|3,0,0]=4 288 B12R1.18 CCCCN1CCSCCC1C Amb24747895 [0,0,0,1,0,0|3,0,0]=4 289 B12R1.18 CCCC[C@@H]1CCCCC[C@@H]1O Amb24619174 [0,0,0,1,0,0|0,0,0]=1 290 B12R1.18 CCCC[C@@H]1OCCCC[C@H]1O Amb25219271 [0,0,0,1,0,0|1,0,0]=2 291 B12R1.18 CCCC[C@H]1C=CCCC[C@@H]1O Amb24515588 [0,0,0,1,0,0|0,0,2]=3 292 B12R1.18 CCCNC1CCCCCC1Cl Amb25084320 [0,0,0,1,0,0|2,0,0]=3 293 B12R1.18 CCCNC1CCCCCC1O Amb18289727 [0,0,0,1,0,0|1,0,0]=2 294 B12R1.18 CCCOC1CCCCCC1I Amb25188247 [0,0,0,1,0,0|2,0,0]=3 295 B12R1.18 CCCOC1CCCCCC1O Amb18807452 [0,0,0,1,0,0|1,0,0]=2 296 B12R1.18 CCCSC1CCCCCC1N Amb25315692 [0,0,0,1,0,0|2,0,0]=3 297 B12R1.18 CCNCC1CCCCCC1N Amb25830871 [0,0,0,1,0,0|2,0,0]=3 298 B12R1.18 CCOCC1CCCCCC1Cl Amb25340998 [0,0,0,1,0,0|2,0,0]=3 299 B12R1.18 CN1CCCCCC1CCCN Amb18198764 [0,0,0,1,0,0|2,0,0]=3 300 B12R1.18 CNCCN1CCCCCC1C Amb25034583 [0,0,0,1,0,0|3,0,0]=4 301 B12R1.18 COCCC1CCCCCC1=O Amb18801861 [0,0,0,1,0,0|1,0,2]=4 302 B12R1.18 COCCC1CCCCCC1Cl Amb19078434 [0,0,0,1,0,0|2,0,0]=3 303 B12R1.18 COCCC1CCCCCC1N Amb18984575 [0,0,0,1,0,0|2,0,0]=3 304 B12R1.18 COCCC1CCCCCC1O Amb18807461 [0,0,0,1,0,0|1,0,0]=2 305 B12R1.18 COCC[C@@H]1CCCCCC1=O Amb25667371 [0,0,0,1,0,0|1,0,2]=4 306 B12R1.18 COCC[C@H]1CCCCCC1=O Amb25128881 [0,0,0,1,0,0|1,0,2]=4 307 B12R1.18 CSCCC1CCCCCC1=O Amb24342167 [0,0,0,1,0,0|1,0,2]=4 308 B12R1.18 CSCCC1CCCCCC1N Amb25374732 [0,0,0,1,0,0|2,0,0]=3 309 B12R1.18 CSCCC1CCCCCC1O Amb25119109 [0,0,0,1,0,0|1,0,0]=2 310 B12R1.18 CSCOC1CCCCCC1O Amb24440511 [0,0,0,1,0,0|2,0,0]=3 311 B12R1.18 C\C=C\CC1CCCCCC1O Amb24588049 [0,0,0,1,0,0|0,0,2]=3 312 B12R1.18 NC1CCCCCC1OCCO Amb24670858 [0,0,0,1,0,0|2,0,0]=3 313 B12R1.18 NC1CCCCCC1SCCO Amb25805718 [0,0,0,1,0,0|2,0,0]=3 314 B12R1.18 NCCNC1CCCCCC1O Amb18986525 [0,0,0,1,0,0|2,0,0]=3 315 B12R1.18 NCCOC1CCCCCC1O Amb25742526 [0,0,0,1,0,0|2,0,0]=3 316 B12R1.18 O=C1CCCCCC1CCCF Amb25692540 [0,0,0,1,0,0|1,0,2]=4 317 B12R1.18 OC1CCCCCC1CCCF Amb25204076 [0,0,0,1,0,0|1,0,0]=2 318 B12R1.18 OC1CCCCCC1CCCO Amb25692021 [0,0,0,1,0,0|1,0,0]=2 319 B12R1.18 OC1CCCCCC1NCCO Amb18970453 [0,0,0,1,0,0|2,0,0]=3 320 B12R1.37 C=CCCCCCC1OCCO1 Amb24351682 [0,0,0,1,0,0|1,0,2]=4 321 B12R1.37 CCCCCCCC1=NCCS1 Amb22442795 [0,0,0,1,0,0|1,1,1]=4 322 B12R1.37 CCCCCCCC1OCCO1 Amb25368281 [0,0,0,1,0,0|1,0,0]=2 323 B12R1.37 CCCCCOCC1CNCC1 Amb21956729 [0,0,0,1,0,0|3,0,0]=4 324 B12R1.37 CCCCC\C=C\C1OCCO1 Amb25375130 [0,0,0,1,0,0|1,0,2]=4 325 B12R1.37 CCCCNCCC1CCCC1 Amb18789130 [0,0,0,1,0,0|2,0,0]=3 326 B12R1.37 CCNCCNCC1CCCO1 Amb18807526 [0,0,0,1,0,0|2,0,0]=3 327 B12R1.37 CCSCCSCC1OCCO1 Amb24343834 [0,0,0,1,0,0|3,0,0]=4 328 B12R1.37 CNCCCNCC1CCCO1 Amb18803062 [0,0,0,1,0,0|2,0,0]=3 329 B12R1.37 COCCNCCC1CCCC1 Amb18794147 [0,0,0,1,0,0|3,0,0]=4 330 B12R1.37 ClCCCNCCN1CCCC1 Amb20573481 [0,0,0,1,0,0|3,0,0]=4 331 B12R1.37 ClCCNCCCN1CCCC1 Amb20573416 [0,0,0,1,0,0|3,0,0]=4 332 B12R1.37 NCCCSCCN1CCCC1 Amb17500710 [0,0,0,1,0,0|3,0,0]=4 333 B12R1.37 NCCNCCCN1CCCC1 Amb18794236 [0,0,0,1,0,0|3,0,0]=4 334 B12R1.37 O=CCCCCCC1OCCO1 Amb25835714 [0,0,0,1,0,0|2,0,1]=4 335 B12R1.37 OCCCC#CCN1CCCC1 Amb25158123 [0,0,0,1,0,0|1,0,2]=4 336 B12R1.37 OCCCCCCC1OCCO1 Amb25069706 [0,0,0,1,0,0|2,0,0]=3 337 B12R1.37 OCCCNCCC1CCCC1 Amb18802444 [0,0,0,1,0,0|1,0,0]=2 338 B12R1.37 OCCCNCCN1CCCC1 Amb17318027 [0,0,0,1,0,0|2,0,0]=3 339 B12R1.37 OCCNCCCN1CCCC1 Amb18794541 [0,0,0,1,0,0|2,0,0]=3 340 B12R1.45 CC#CCCC1CCCC1CN Amb25803194 [0,0,0,1,0,0|1,0,2]=4 341 B12R1.45 CC#CCN[C@@H]1CCC[C@@H]1CO Amb24739932 [0,0,0,1,0,0|1,0,2]=4 342 B12R1.45 CCC#CCN1CCCC1CO Amb25235588 [0,0,0,1,0,0|1,0,2]=4 343 B12R1.45 CCC#CCN1CCC[C@@H]1CO Amb25036235 [0,0,0,1,0,0|1,0,2]=4 344 B12R1.45 CCC#CCN1CCC[C@H]1CO Amb24364265 [0,0,0,1,0,0|1,0,2]=4 345 B12R1.45 CCN1CCCC1CCCNC Amb23541780 [0,0,0,1,0,0|3,0,0]=4 346 B12R1.45 CCN1CCCC1CNCCN Amb23570922 [0,0,0,1,0,0|3,0,0]=4 347 B12R1.45 NCCCCN1CCCC1CO Amb18789797 [0,0,0,1,0,0|2,0,0]=3 348 B12R1.52 CCCC1CCCCCCC1=O Amb25050208 [0,0,0,1,0,0|0,0,2]=3 349 B12R1.52 CCNC1CCC=CCCC1O Amb25158778 [0,0,0,1,0,0|1,0,2]=4 350 B12R1.52 CCN[C@@H]1CCC=CCC[C@H]1O Amb24580470 [0,0,0,1,0,0|1,0,2]=4 351 B12R1.52 CCOC1CCCCCCC1I Amb25130056 [0,0,0,1,0,0|2,0,0]=3 352 B12R1.52 CCOC1CCCCCCC1N Amb1140735 [0,0,0,1,0,0|2,0,0]=3 353 B12R1.52 CCOC1CCCCCCC1O Amb18807444 [0,0,0,1,0,0|1,0,0]=2 354 B12R1.52 N#CC[C@@H]1CCCCCC[C@@H]1O Amb25345023 [0,0,0,1,0,0|1,0,1]=3 355 B12R1.52 N#CSC1CCCCCCC1O Amb25796281 [0,0,0,1,0,0|2,0,1]=4 356 B12R1.52 N#CS[C@@H]1CCCCCC[C@H]1O Amb24544329 [0,0,0,1,0,0|2,0,1]=4 357 B12R1.52 OC1CCCCCCC1\C=C/Cl Amb25109255 [0,0,0,1,0,0|1,0,2]=4 358 B12R1.73 COC1CCCCCCCC1=O Amb24706984 [0,0,0,1,0,0|1,0,2]=4 359 B12R1.121 C#CCCN1CCCCC1CO Amb18798881 [0,0,0,1,0,0|1,0,2]=4 360 B12R1.121 C#CCNC1CCCCC1CO Amb24383542 [0,0,0,1,0,0|1,0,2]=4 361 B12R1.121 C#CCN[C@@H]1CCCC[C@H]1CO Amb24339780 [0,0,0,1,0,0|1,0,2]=4 362 B12R1.121 CC#CCN1CCCCC1CO Amb18798889 [0,0,0,1,0,0|1,0,2]=4 363 B12R1.121 CCC1CCCCC1=CCCN Amb25723699 [0,0,0,1,0,0|1,0,2]=4 364 B12R1.121 CCC1CCCCC1NCC#C Amb18792716 [0,0,0,1,0,0|2,0,1]=4 365 B12R1.121 CCC1CCCCC1NCC#N Amb18978375 [0,0,0,1,0,0|2,0,1]=4 366 B12R1.121 CCC1CCCCC1OCCO Amb18807445 [0,0,0,1,0,0|1,0,0]=2 367 B12R1.121 CCC1CCCCC1\C=C\CCl Amb24569363 [0,0,0,1,0,0|1,0,2]=4 368 B12R1.121 CCC1CCCCC1\C=C\CN Amb24593031 [0,0,0,1,0,0|1,0,2]=4 369 B12R1.121 CCC1CCCCN1CCC#C Amb24748858 [0,0,0,1,0,0|2,0,1]=4 370 B12R1.121 CCCNC/1CCCC\C1=N\O Amb25674379 [0,0,0,1,0,0|2,0,1]=4 371 B12R1.121 CCCNC1CCCCC1C#N Amb18996781 [0,0,0,1,0,0|2,0,1]=4 372 B12R1.121 CNCCC1CCCCC1OC Amb23538324 [0,0,0,1,0,0|3,0,0]=4 373 B12R1.121 COC1CCCCC1CCC#N Amb18646797 [0,0,0,1,0,0|2,0,1]=4 374 B12R1.121 CO\C=C\C1CCCCC1CO Amb24705718 [0,0,0,1,0,0|1,0,2]=4 375 B12R1.121 CO\C=C\[C@@H]1CCCC[C@H]1CO Amb24588353 [0,0,0,1,0,0|1,0,2]=4 376 B12R1.121 C\C=C\CN1CCCC[C@H]1CO Amb24404308 [0,0,0,1,0,0|1,0,2]=4 377 B12R1.121 ClCCCN1CCCCC1CC Amb17336179 [0,0,0,1,0,0|2,0,0]=3 378 B12R1.121 N#CC1CCCCC1CCCCl Amb25189411 [0,0,0,1,0,0|2,0,1]=4 379 B12R1.121 N#CC1CCCCC1NCCO Amb18996806 [0,0,0,1,0,0|2,0,1]=4 380 B12R1.121 N#CCCN1CCCCC1CO Amb18805858 [0,0,0,1,0,0|2,0,1]=4 381 B12R1.121 N#CCNC1CCCCC1CO Amb24411086 [0,0,0,1,0,0|2,0,1]=4 382 B12R1.121 N#CNCC1CCCCC1CO Amb25751517 [0,0,0,1,0,0|2,0,1]=4 383 B12R1.121 NCCCN1CCCCC1CC Amb1108292 [0,0,0,1,0,0|2,0,0]=3 384 B12R1.121 OCC1CCCCC1CNC=O Amb24407374 [0,0,0,1,0,0|2,0,1]=4 385 B12R1.121 [C-]#[N+]CCC1CCCCC1OC Amb25276762 [0,0,0,1,0,0|3,0,0]=4 386 B12R1.150 CC1CCCCCCCCC1=O Amb24645477 [0,0,0,1,0,0|0,0,2]=3 387 B12R1.150 C[C@H]1CCCCCCCCC1=O Amb24456546 [0,0,0,1,0,0|0,0,2]=3 388 B12R1.150 ClC1CCCCCCCCC1Cl Amb25113953 [0,0,0,1,0,0|2,0,0]=3 389 B12R1.150 NC1CCCCCCCCC1O Amb25152507 [0,0,0,1,0,0|1,0,0]=2 390 B12R1.150 N[C@H]1CCCCCCCC[C@H]1O Amb24634302 [0,0,0,1,0,0|1,0,0]=2 391 B12R1.150 OC1CCC=CCCCCC1O Amb25042947 [0,0,0,1,0,0|1,0,2]=4 392 B12R1.150 OC1CCCCCCCCC1O Amb17594327 [0,0,0,1,0,0|1,0,0]=2 393 B12R1.150 O[C@@H]1CCCC=CCCC[C@@H]1O Amb24386795 [0,0,0,1,0,0|1,0,2]=4 394 B12R1.150 O[C@H]1CCCCCCCC[C@H]1O Amb17671073 [0,0,0,1,0,0|1,0,0]=2 395 B12R1.169 C#CCN1CCCCC1CCO Amb18805650 [0,0,0,1,0,0|1,0,2]=4 396 B12R1.169 CCCC1OCCOC1CCBr Amb24064679 [0,0,0,1,0,0|3,0,0]=4 397 B12R1.169 CCNC1CCCCC1CC#C Amb18798499 [0,0,0,1,0,0|2,0,1]=4 398 B12R1.169 CCNC1CCCCC1OCC Amb17606037 [0,0,0,1,0,0|3,0,0]=4 399 B12R1.169 COCC1CCCCN1CCN Amb21860254 [0,0,0,1,0,0|3,0,0]=4 400 B12R1.169 COCC1CCCCN1CCO Amb21860248 [0,0,0,1,0,0|2,0,0]=3 401 B12R1.169 OCCC1CCCCN1CCCl Amb19041509 [0,0,0,1,0,0|2,0,0]=3 402 B12R1.169 OCCC1NCCNC1CCO Amb24060963 [0,0,0,1,0,0|3,0,0]=4 403 B12R1.173 BrCCN1CCCCCCCC1 Amb24725516 [0,0,0,1,0,0|2,0,0]=3 404 B12R1.173 C#CCN1CCCCCCCC1 Amb24460898 [0,0,0,1,0,0|2,0,1]=4 405 B12R1.173 ClCCN1CCCCCCCC1 Amb25808148 [0,0,0,1,0,0|2,0,0]=3 406 B12R1.173 N#CCN1CCCCCCCC1 Amb25168957 [0,0,0,1,0,0|2,0,1]=4 407 B12R1.173 NCCN1CCCCCCCC1 Amb24365183 [0,0,0,1,0,0|2,0,0]=3 408 B12R1.173 O=CCN1CCCCCCCC1 Amb25840505 [0,0,0,1,0,0|1,0,2]=4 409 B12R1.173 OCCC=1CCCCCCCC1 Amb25332403 [0,0,0,1,0,0|0,0,2]=3 410 B12R1.173 OCCN1CCSCCNCC1 Amb21953507 [0,0,0,1,0,0|3,0,0]=4 411 B12R1.173 SCCN1CCCCCCCC1 Amb25719049 [0,0,0,1,0,0|1,1,0]=3 412 B12R1.215 ClC1CCCCCCCCCC1 Amb24634227 [0,0,0,1,0,0|1,0,0]=2 413 B12R1.215 O=C1CCCCCCCCCO1 Amb22732305 [0,0,0,1,0,0|1,0,1]=3 414 B12R1.215 OC1CCC=CCCCCCC1 Amb25345017 [0,0,0,1,0,0|0,0,2]=3 415 B12R1.215 OC1CCCCC#CCCCC1 Amb25144475 [0,0,0,1,0,0|0,0,2]=3 416 B12R1.215 OC1CCCCCCCC=C=C1 Amb25788216 [0,0,0,1,0,0|0,0,3]=4 417 B12R1.215 OC1CCCCCCCCCC1 Amb24497641 [0,0,0,1,0,0|0,0,0]=1 418 B12R1.215 OC1CCCCCCCCCO1 Amb24352243 [0,0,0,1,0,0|1,0,0]=2 419 B12R1.215 OC1CCCCNCCCCC1 Amb24615660 [0,0,0,1,0,0|1,0,0]=2 420 B12R1.215 S=C1CCCCCCCCCN1 Amb24399743 [0,0,0,1,0,0|1,1,1]=4 421 B12R1.267 C#CCCCC1CCCCC1Br Amb25744302 [0,0,0,1,0,0|1,0,2]=4 422 B12R1.267 C#CCCCC1CCCCC1Cl Amb24376285 [0,0,0,1,0,0|1,0,2]=4 423 B12R1.267 C#CCCCC1CCCCC1O Amb24416932 [0,0,0,1,0,0|0,0,2]=3 424 B12R1.267 C#CCCCC1CNCCC1O Amb24617078 [0,0,0,1,0,0|1,0,2]=4 425 B12R1.267 C#CCCN[C@H]1CCCC[C@@H]1O Amb24618187 [0,0,0,1,0,0|1,0,2]=4 426 B12R1.267 C=C=CCCC1CCCCC1O Amb25686206 [0,0,0,1,0,0|0,0,3]=4 427 B12R1.267 CC#CCCC1CCCCC1Br Amb24405425 [0,0,0,1,0,0|1,0,2]=4 428 B12R1.267 CC#CCCC1CCCCC1Cl Amb25341979 [0,0,0,1,0,0|1,0,2]=4 429 B12R1.267 CC#CCNC1CCCCC1O Amb18989684 [0,0,0,1,0,0|1,0,2]=4 430 B12R1.267 CC#CCN[C@H]1CCCC[C@@H]1O Amb25368300 [0,0,0,1,0,0|1,0,2]=4 431 B12R1.267 CC1CCCCC1=C=CCCO Amb25156856 [0,0,0,1,0,0|0,0,3]=4 432 B12R1.267 CC1CCCCC1CNCC#C Amb18792717 [0,0,0,1,0,0|2,0,1]=4 433 B12R1.267 CC1CCCCC1CNCC#N Amb18979886 [0,0,0,1,0,0|2,0,1]=4 434 B12R1.267 CC1CNCCN1CCCCF Amb19890731 [0,0,0,1,0,0|3,0,0]=4 435 B12R1.267 CCC#CCC1CCCCC1O Amb25051003 [0,0,0,1,0,0|0,0,2]=3 436 B12R1.267 CCCCCC1=[N+](C)CCCC1 Amb10553378 [0,0,0,1,0,0|2,0,1]=4 437 B12R1.267 CCCCCC1CCCCC1=O Amb18788895 [0,0,0,1,0,0|0,0,2]=3 438 B12R1.267 CCCCCN1CCNCC1C Amb17232790 [0,0,0,1,0,0|3,0,0]=4 439 B12R1.267 CCCCNC1CCCCC1N Amb23559104 [0,0,0,1,0,0|2,0,0]=3 440 B12R1.267 CCCCN[C@@H]1CCCC[C@@H]1O Amb23263417 [0,0,0,1,0,0|1,0,0]=2 441 B12R1.267 CCNCCN1CCCCC1C Amb19024685 [0,0,0,1,0,0|3,0,0]=4 442 B12R1.267 CN1CCCCC1CNCCO Amb18313081 [0,0,0,1,0,0|2,0,0]=3 443 B12R1.267 CN1CCCCC1COCCN Amb21865788 [0,0,0,1,0,0|3,0,0]=4 444 B12R1.267 CN1CCCCC1COCCO Amb21865692 [0,0,0,1,0,0|2,0,0]=3 445 B12R1.267 COCCNC1CCCCC1N Amb23559111 [0,0,0,1,0,0|3,0,0]=4 446 B12R1.267 COCCNC1CCCCC1O Amb18303814 [0,0,0,1,0,0|2,0,0]=3 447 B12R1.267 COCCN[C@@H]1CCCC[C@@H]1O Amb23263429 [0,0,0,1,0,0|2,0,0]=3 448 B12R1.267 C\C=C\CNC1CCCCC1O Amb24358604 [0,0,0,1,0,0|1,0,2]=4 449 B12R1.267 C\C=C\CN[C@H]1CCCC[C@@H]1O Amb24594550 [0,0,0,1,0,0|1,0,2]=4 450 B12R1.267 ClCCCCN1CCCCC1C Amb17336177 [0,0,0,1,0,0|2,0,0]=3 451 B12R1.267 N#CCCNC1CCCCC1O Amb18989662 [0,0,0,1,0,0|2,0,1]=4 452 B12R1.267 N#CCCS[C@@H]1CCCC[C@H]1O Amb24618758 [0,0,0,1,0,0|2,0,1]=4 453 B12R1.267 NCCCNC1CCCCC1C Amb17315297 [0,0,0,1,0,0|2,0,0]=3 454 B12R1.267 NOCCCN1CCCCC1C Amb17104890 [0,0,0,1,0,0|3,0,0]=4 455 B12R1.267 OC1CCCCC1CC#CCO Amb25802070 [0,0,0,1,0,0|1,0,2]=4 456 B12R1.267 O[C@@H]1CCCC[C@H]1CC#CCCl Amb25258328 [0,0,0,1,0,0|1,0,2]=4 457 B12R1.272 CCCCNCCCC1CCC1 Amb23570816 [0,0,0,1,0,0|2,0,0]=3 458 B12R1.272 CCOCCCNCC1CCC1 Amb23579949 [0,0,0,1,0,0|3,0,0]=4 459 B12R1.272 COCCNCCCC1CCC1 Amb23570817 [0,0,0,1,0,0|3,0,0]=4 460 B12R1.272 NCCCNCCCC1CCC1 Amb23570829 [0,0,0,1,0,0|2,0,0]=3 461 B12R1.272 OCCCNCCCC1CCC1 Amb23570828 [0,0,0,1,0,0|1,0,0]=2 462 B12R1.281 C=CCC1CCCCCC1CN Amb24763160 [0,0,0,1,0,0|1,0,2]=4 463 B12R1.281 CCC1CCCCCC1CNC Amb24745232 [0,0,0,1,0,0|2,0,0]=3 464 B12R1.281 CCC1CCCCCN1CC#C Amb24492835 [0,0,0,1,0,0|2,0,1]=4 465 B12R1.281 CCC1CCCCCN1CC=C Amb24354161 [0,0,0,1,0,0|2,0,1]=4 466 B12R1.281 CCC1CCCCCN1CC=O Amb25693680 [0,0,0,1,0,0|1,0,2]=4 467 B12R1.281 CCC1CCCCCN1CCBr Amb25704747 [0,0,0,1,0,0|2,0,0]=3 468 B12R1.281 CCC1CCCCCN1CCN Amb25035125 [0,0,0,1,0,0|2,0,0]=3 469 B12R1.281 CCC1SCCCNC1CCC Amb25150065 [0,0,0,1,0,0|3,0,0]=4 470 B12R1.281 CCCC1CCCCCC1CN Amb24540361 [0,0,0,1,0,0|1,0,0]=2 471 B12R1.281 CCCC1CCCCCC1NC Amb18801600 [0,0,0,1,0,0|2,0,0]=3 472 B12R1.281 CCCN1CCCCCC1CBr Amb25153990 [0,0,0,1,0,0|2,0,0]=3 473 B12R1.281 CCCN1CCCCCC1CCl Amb25809639 [0,0,0,1,0,0|2,0,0]=3 474 B12R1.281 CCCN1CCCCCC1CO Amb25153989 [0,0,0,1,0,0|1,0,0]=2 475 B12R1.281 CCCN1CCCNCC1CO Amb17578265 [0,0,0,1,0,0|2,0,0]=3 476 B12R1.281 CCNC1CCCCCC1C#N Amb18964025 [0,0,0,1,0,0|2,0,1]=4 477 B12R1.281 CCNC1CCCCCC1CC Amb18801607 [0,0,0,1,0,0|2,0,0]=3 478 B12R1.281 CCNC1CCCCCC1OC Amb17606043 [0,0,0,1,0,0|3,0,0]=4 479 B12R1.281 CCNC1CCCCCC1SC Amb24365060 [0,0,0,1,0,0|3,0,0]=4 480 B12R1.281 CCOC1CCCCCC1NC Amb17606041 [0,0,0,1,0,0|3,0,0]=4 481 B12R1.281 CCSC1CCCCCC1NC Amb25126268 [0,0,0,1,0,0|3,0,0]=4 482 B12R1.281 CNC1CCCCCC1CC#C Amb18798501 [0,0,0,1,0,0|2,0,1]=4 483 B12R1.281 CNC1CCCCCC1CC=C Amb18799003 [0,0,0,1,0,0|2,0,1]=4 484 B12R1.281 COCC1CCCCCC1CN Amb25314728 [0,0,0,1,0,0|2,0,0]=3 485 B12R1.281 FCCN1CCCCCC1CBr Amb25727364 [0,0,0,1,0,0|3,0,0]=4 486 B12R1.281 FCCN1CCCCCC1CCl Amb24597535 [0,0,0,1,0,0|3,0,0]=4 487 B12R1.281 N#CCN1CCCCCC1CO Amb25113075 [0,0,0,1,0,0|2,0,1]=4 488 B12R1.281 NCC1CCCCCN1CCF Amb25076950 [0,0,0,1,0,0|3,0,0]=4 489 B12R1.281 OCC1CCCCCN1CC=O Amb25153991 [0,0,0,1,0,0|2,0,1]=4 490 B12R1.281 OCC1CCCCCN1CCCl Amb25378470 [0,0,0,1,0,0|2,0,0]=3 491 B12R1.281 OCC1CCCCCN1CCS Amb25041598 [0,0,0,1,0,0|2,0,0]=3 492 B12R1.320 CC#CCN1CCCC1CCO Amb25767450 [0,0,0,1,0,0|1,0,2]=4 493 B12R1.320 CCCN1CCCC1CCCN Amb23541767 [0,0,0,1,0,0|2,0,0]=3 494 B12R1.320 CCCN1CCCC1CCCO Amb18807188 [0,0,0,1,0,0|1,0,0]=2 495 B12R1.329 BrC\C=C\C1CCCCCCC1 Amb25357932 [0,0,0,1,0,0|1,0,2]=4 496 B12R1.329 C#CCCN1CCCCCCC1 Amb24483501 [0,0,0,1,0,0|2,0,1]=4 497 B12R1.329 C=CCCN1CCCCCCC1 Amb25822796 [0,0,0,1,0,0|2,0,1]=4 498 B12R1.329 CCCCN1CCCCCCC1 Amb25135965 [0,0,0,1,0,0|2,0,0]=3 499 B12R1.329 CCCCN1CCCNCCC1 Amb18292629 [0,0,0,1,0,0|3,0,0]=4 500 B12R1.329 CCNCC1CCCCCC=C1 Amb25157900 [0,0,0,1,0,0|2,0,1]=4 501 B12R1.329 CCONC1CCCCCCC1 Amb25831411 [0,0,0,1,0,0|3,0,0]=4 502 B12R1.329 CNCCC1CCCCCCC1 Amb18563069 [0,0,0,1,0,0|2,0,0]=3 503 B12R1.329 COCCN1CCCCCCC1 Amb13979396 [0,0,0,1,0,0|3,0,0]=4 504 B12R1.329 CONCC1CCCCCCC1 Amb25204845 [0,0,0,1,0,0|3,0,0]=4 505 B12R1.329 ClCCCN1CCCCCCC1 Amb18317332 [0,0,0,1,0,0|2,0,0]=3 506 B12R1.329 ClCCOC1CCCCCCO1 Amb25258338 [0,0,0,1,0,0|2,0,0]=3 507 B12R1.329 FCCCN1CCCNCCC1 Amb25036506 [0,0,0,1,0,0|3,0,0]=4 508 B12R1.329 NCCC=C1CCCCCCC1 Amb25064430 [0,0,0,1,0,0|1,0,2]=4 509 B12R1.329 NCCNC1CCCCCCC1 Amb18969720 [0,0,0,1,0,0|2,0,0]=3 510 B12R1.329 NCCOC1CCCCCCC1 Amb25111074 [0,0,0,1,0,0|2,0,0]=3 511 B12R1.329 NC\C=C\C1CCCCCCC1 Amb25306737 [0,0,0,1,0,0|1,0,2]=4 512 B12R1.329 O=CCCN1CCCCCCC1 Amb18789074 [0,0,0,1,0,0|1,0,2]=4 513 B12R1.329 OCCCC1CCCCCCN1 Amb18198426 [0,0,0,1,0,0|1,0,0]=2 514 B12R1.329 OCCCC=1CCCCCCC1 Amb24520643 [0,0,0,1,0,0|0,0,2]=3 515 B12R1.329 OCCNC1CCCCCC=C1 Amb25157875 [0,0,0,1,0,0|1,0,2]=4 516 B12R1.329 OCCOC1CCCC=CCC1 Amb24533631 [0,0,0,1,0,0|1,0,2]=4 517 B12R1.329 OCCSC1CCCCCCC1 Amb25687850 [0,0,0,1,0,0|1,0,0]=2 518 B12R1.329 SCCCN1CCCCCCC1 Amb25306077 [0,0,0,1,0,0|1,1,0]=3 519 B12R1.372 CC#CCCN[C@@H]1CCC[C@H]1O Amb25240501 [0,0,0,1,0,0|1,0,2]=4 520 B12R1.372 CC#CCCN[C@H]1CCC[C@@H]1O Amb25232449 [0,0,0,1,0,0|1,0,2]=4 521 B12R1.372 CCCCC#CC1CCCC1N Amb25835842 [0,0,0,1,0,0|1,0,2]=4 522 B12R1.372 CCCCC#CC1CCCC1O Amb24493289 [0,0,0,1,0,0|0,0,2]=3 523 B12R1.372 CCCCC#CC1OCCC1O Amb24688108 [0,0,0,1,0,0|1,0,2]=4 524 B12R1.372 CCCCC#C[C@@H]1CCC[C@@H]1O Amb24520443 [0,0,0,1,0,0|0,0,2]=3 525 B12R1.372 CCCCC#C[C@@H]1OCC[C@@H]1O Amb24576495 [0,0,0,1,0,0|1,0,2]=4 526 B12R1.372 CCCCCCC1CCOC1=O Amb22230226 [0,0,0,1,0,0|1,0,2]=4 527 B12R1.372 CCCCCNC1CCCC1N Amb23559149 [0,0,0,1,0,0|2,0,0]=3 528 B12R1.372 CCCCCNC1COCC1O Amb18794910 [0,0,0,1,0,0|2,0,0]=3 529 B12R1.372 CCNCCCC1CCCN1C Amb23541771 [0,0,0,1,0,0|3,0,0]=4 530 B12R1.372 COCCCNC1CCCC1N Amb23559156 [0,0,0,1,0,0|3,0,0]=4 531 B12R1.375 CCCCCCNCCC1CC1 Amb23570777 [0,0,0,1,0,0|2,0,0]=3 532 B12R1.375 COCCOCCOCC1CO1 Amb24057511 [0,0,0,1,0,0|3,0,0]=4 533 B12R1.399 CNC1CCCCCCC1NC Amb25300381 [0,0,0,1,0,0|3,0,0]=4 534 B12R1.399 CNC1CCCCCCC1OC Amb17606047 [0,0,0,1,0,0|3,0,0]=4 535 B12R1.399 CN[C@@H]1CCCCCC[C@@H]1NC Amb24565804 [0,0,0,1,0,0|3,0,0]=4 536 B12R1.399 COC1CCCCCCC1CO Amb25048572 [0,0,0,1,0,0|1,0,0]=2 537 B12R1.399 OC[C@@H]1CCCCCC[C@@H]1CO Amb24632149 [0,0,0,1,0,0|1,0,0]=2 538 B12R1.410 CNC1CCCCCCCCC1 Amb13883575 [0,0,0,1,0,0|2,0,0]=3 539 B12R1.410 ON=C1CCCCCCCCC1 Amb17671029 [0,0,0,1,0,0|1,0,1]=3 540 B12R1.410 ON=C1CCCCCCCCN1 Amb25217575 [0,0,0,1,0,0|2,0,1]=4 541 B12R1.550 C1CCCCNCCCCCN1 Amb24743503 [0,0,0,1,0,0|2,0,0]=3 542 B12R1.550 C1CCCNCCCCCCN1 Amb24532505 [0,0,0,1,0,0|2,0,0]=3 543 B12R1.550 C1CCNCCCCCCCN1 Amb24682593 [0,0,0,1,0,0|2,0,0]=3 544 B12R1.550 C1CCNCCCNCCCN1 Amb21953152 [0,0,0,1,0,0|3,0,0]=4 545 B12R1.550 C1CCNCCCNCCCN1 Amb21953153 [0,0,0,1,0,0|3,0,0]=4 546 B12R1.550 C1CCNCCCNCCCN1 Amb22363165 [0,0,0,1,0,0|3,0,0]=4 547 B12R1.550 C1CCNCCCNCCCS1 Amb21953172 [0,0,0,1,0,0|2,1,0]=4 548 B12R1.550 C1CCNCCCNCCCS1 Amb21953173 [0,0,0,1,0,0|2,1,0]=4 549 B12R1.550 C1CCSCCCSCCCS1 Amb21953196 [0,0,0,1,0,0|2,1,0]=4 550 B12R1.550 C1CNCCCCCNCCN1 Amb21953165 [0,0,0,1,0,0|3,0,0]=4 551 B12R1.550 C1CNCCSCCNCCO1 Amb24424491 [0,0,0,1,0,0|3,0,0]=4 552 B12R1.550 C1CSCCOCCSCCN1 Amb24121215 [0,0,0,1,0,0|3,0,0]=4 553 B12R1.1414 C#CCCCC1CCNCCC1 Amb24525124 [0,0,0,1,0,0|2,0,1]=4 554 B12R1.1414 C#CCCCN1CCCCCC1 Amb25035242 [0,0,0,1,0,0|2,0,1]=4 555 B12R1.1414 C#CCCNC1CCCCCC1 Amb24552784 [0,0,0,1,0,0|2,0,1]=4 556 B12R1.1414 CC#CCCC1CCCCCN1 Amb24492908 [0,0,0,1,0,0|1,0,2]=4 557 B12R1.1414 CCCCNC1CCCCCC1 Amb22587068 [0,0,0,1,0,0|2,0,0]=3 558 B12R1.1414 CCNCCN1CCCCCC1 Amb13949094 [0,0,0,1,0,0|3,0,0]=4 559 B12R1.1414 CNCCCN1CCCCCC1 Amb10607516 [0,0,0,1,0,0|3,0,0]=4 560 B12R1.1414 COCCCN1CCCCCC1 Amb17232846 [0,0,0,1,0,0|3,0,0]=4 561 B12R1.1414 ClCCCCN1CCCCCC1 Amb17336176 [0,0,0,1,0,0|2,0,0]=3 562 B12R1.1414 ClCC\C=C\C1CCCCCC1 Amb25821731 [0,0,0,1,0,0|1,0,2]=4 563 B12R1.1414 FCCCCN1CCCNCC1 Amb19890863 [0,0,0,1,0,0|3,0,0]=4 564 B12R1.1414 N#CCCCC1CCNCCC1 Amb25053346 [0,0,0,1,0,0|2,0,1]=4 565 B12R1.1414 N#CCCOC1CCCCCC1 Amb18792959 [0,0,0,1,0,0|2,0,1]=4 566 B12R1.1414 NCCCCN1CCCCCC1 Amb22586873 [0,0,0,1,0,0|2,0,0]=3 567 B12R1.1414 NCCCNC1CCCCCC1 Amb17315279 [0,0,0,1,0,0|2,0,0]=3 568 B12R1.1414 NCC\C=C\C1CCCCCC1 Amb24741442 [0,0,0,1,0,0|1,0,2]=4 569 B12R1.1414 NOCCCN1CCCCCC1 Amb17104889 [0,0,0,1,0,0|3,0,0]=4 570 B12R1.1414 O=C=NCCC1CCCCCC1 Amb25222900 [0,0,0,1,0,0|1,0,2]=4 571 B12R1.1414 O=CNCCC1CCCCCC1 Amb24692921 [0,0,0,1,0,0|1,0,2]=4 572 B12R1.1414 OCC#CCN1CCCCCC1 Amb24704316 [0,0,0,1,0,0|1,0,2]=4 573 B12R1.1414 OCCCNC=1CCCCCN1 Amb25797873 [0,0,0,1,0,0|2,0,1]=4 574 B9R0.45 C=CCCCCCCCO Amb22733549 [2,0,0,0,0,0|0,0,2]=4 575 B9R0.45 CCCCC#CCCCO Amb21962548 [2,0,0,0,0,0|0,0,2]=4 576 B9R0.45 CCCCC=NCCCO Amb24735221 [2,0,0,0,0,0|1,0,1]=4 577 B9R0.45 CCCCCC=NCCO Amb25769358 [2,0,0,0,0,0|1,0,1]=4 578 B9R0.45 CCCCCCCC=NO Amb25207893 [2,0,0,0,0,0|1,0,1]=4 579 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [2,0,0,0,0,0|1,0,0]=3 580 B9R0.45 CCCCCCCCNN Amb22552570 [2,0,0,0,0,0|2,0,0]=4 581 B9R0.45 CCCCCCCCSC Amb10553780 [2,0,0,0,0,0|1,0,0]=3 582 B9R0.45 CCCCCCCCSCl Amb25226772 [2,0,0,0,0,0|2,0,0]=4 583 B9R0.45 CCCCCCCCS[Au] Amb22354036 [2,0,0,0,0,0|2,0,0]=4 584 B9R0.45 CCCCCCCC[13C]#[13CH] Amb22338942 [2,0,0,0,0,0|0,0,2]=4 585 B9R0.45 CCCCCCCC[Hg]Cl Amb22359875 [2,0,0,0,0,0|2,0,0]=4 586 B9R0.45 CCCCCCCC[Mg]Br Amb22363181 [2,0,0,0,0,0|2,0,0]=4 587 B9R0.45 CCCCCCCC[Mg]Cl Amb22349193 [2,0,0,0,0,0|2,0,0]=4 588 B9R0.45 CCCCCCCNOC Amb25335283 [2,0,0,0,0,0|2,0,0]=4 589 B9R0.45 CCCCCCCOCCl Amb25709280 [2,0,0,0,0,0|2,0,0]=4 590 B9R0.45 CCCCCCNCCF Amb25676977 [2,0,0,0,0,0|2,0,0]=4 591 B9R0.45 CCCCCCNCCS Amb24692640 [2,0,0,0,0,0|1,1,0]=4 592 B9R0.45 CCCCCCNOCC Amb24415602 [2,0,0,0,0,0|2,0,0]=4 593 B9R0.45 CCCCCCSCCCl Amb22228746 [2,0,0,0,0,0|2,0,0]=4 594 B9R0.45 CCCCCC\C=C/CO Amb10807383 [2,0,0,0,0,0|0,0,2]=4 595 B9R0.45 CCCCCC\C=C\CO Amb22168300 [2,0,0,0,0,0|0,0,2]=4 596 B9R0.45 CCCCCNCCCCl Amb24733861 [2,0,0,0,0,0|2,0,0]=4 597 B9R0.45 CCCCCNCCCI Amb24747725 [2,0,0,0,0,0|2,0,0]=4 598 B9R0.45 CCCCCNCCCN Amb17315271 [2,0,0,0,0,0|2,0,0]=4 599 B9R0.45 CCCCCNCCSC Amb18800589 [2,0,0,0,0,0|2,0,0]=4 600 B9R0.45 CCCCCOCCCS Amb25730351 [2,0,0,0,0,0|1,1,0]=4 601 B9R0.45 CCCCCOCCNC Amb24390412 [2,0,0,0,0,0|2,0,0]=4 602 B9R0.45 CCCCCSCCCBr Amb24675807 [2,0,0,0,0,0|2,0,0]=4 603 B9R0.45 CCCCCSCCCC Amb25119856 [2,0,0,0,0,0|1,0,0]=3 604 B9R0.45 CCCCCSCCCN Amb17500694 [2,0,0,0,0,0|2,0,0]=4 605 B9R0.45 CCCCCSCCCO Amb17502837 [2,0,0,0,0,0|1,0,0]=3 606 B9R0.45 CCCCCSCCOC Amb24747268 [2,0,0,0,0,0|2,0,0]=4 607 B9R0.45 CCCCCSCOCC Amb25143190 [2,0,0,0,0,0|2,0,0]=4 608 B9R0.45 CCCCNCCCCCl Amb25349351 [2,0,0,0,0,0|2,0,0]=4 609 B9R0.45 CCCCNCCCCN Amb17334221 [2,0,0,0,0,0|2,0,0]=4 610 B9R0.45 CCCCNCCSCC Amb18798052 [2,0,0,0,0,0|2,0,0]=4 611 B9R0.45 CCCCOCCCCCl Amb18798377 [2,0,0,0,0,0|2,0,0]=4 612 B9R0.45 CCCCOCCCCO Amb19375051 [2,0,0,0,0,0|1,0,0]=3 613 B9R0.45 CCCCOCCCNC Amb20076072 [2,0,0,0,0,0|2,0,0]=4 614 B9R0.45 CCCCOCCNCC Amb24640236 [2,0,0,0,0,0|2,0,0]=4 615 B9R0.45 CCCCOCOCCO Amb24414113 [2,0,0,0,0,0|2,0,0]=4 616 B9R0.45 CCCCSCCCCCl Amb18184911 [2,0,0,0,0,0|2,0,0]=4 617 B9R0.45 CCCCSCCCNC Amb18177749 [2,0,0,0,0,0|2,0,0]=4 618 B9R0.45 CCCCSCCNCC Amb18177758 [2,0,0,0,0,0|2,0,0]=4 619 B9R0.45 CCCCSCCOCC Amb10669603 [2,0,0,0,0,0|2,0,0]=4 620 B9R0.45 CCCC[SnH2]CCCCN Amb22504059 [2,0,0,0,0,0|2,0,0]=4 621 B9R0.45 CCCNCCCCCCl Amb24472566 [2,0,0,0,0,0|2,0,0]=4 622 B9R0.45 CCCNCCCCCO Amb17334254 [2,0,0,0,0,0|1,0,0]=3 623 B9R0.45 CCCNCCCCOC Amb24478093 [2,0,0,0,0,0|2,0,0]=4 624 B9R0.45 CCCNCCCCSC Amb18798068 [2,0,0,0,0,0|2,0,0]=4 625 B9R0.45 CCCNCCCSCC Amb18177748 [2,0,0,0,0,0|2,0,0]=4 626 B9R0.45 CCCNCCNCCO Amb24644910 [2,0,0,0,0,0|2,0,0]=4 627 B9R0.45 CCCNCCOCCC Amb24653369 [2,0,0,0,0,0|2,0,0]=4 628 B9R0.45 CCCNCCSCCC Amb18177754 [2,0,0,0,0,0|2,0,0]=4 629 B9R0.45 CCCOCCCCCS Amb24475512 [2,0,0,0,0,0|1,1,0]=4 630 B9R0.45 CCCOCCCCNC Amb24332221 [2,0,0,0,0,0|2,0,0]=4 631 B9R0.45 CCCOCCCNCC Amb20171773 [2,0,0,0,0,0|2,0,0]=4 632 B9R0.45 CCCOCCOCCO Amb22351569 [2,0,0,0,0,0|2,0,0]=4 633 B9R0.45 CCCONCCCCC Amb25074780 [2,0,0,0,0,0|2,0,0]=4 634 B9R0.45 CCCONCCCCO Amb24398863 [2,0,0,0,0,0|2,0,0]=4 635 B9R0.45 CCCSCCCCCN Amb18792401 [2,0,0,0,0,0|2,0,0]=4 636 B9R0.45 CCCSCCCCCO Amb18800675 [2,0,0,0,0,0|1,0,0]=3 637 B9R0.45 CCCSCCCCNC Amb18798059 [2,0,0,0,0,0|2,0,0]=4 638 B9R0.45 CCCSCCCCOC Amb25106252 [2,0,0,0,0,0|2,0,0]=4 639 B9R0.45 CCCSCCCNCC Amb18177744 [2,0,0,0,0,0|2,0,0]=4 640 B9R0.45 CCCSCCCOCC Amb24482731 [2,0,0,0,0,0|2,0,0]=4 641 B9R0.45 CCCSCCOCCO Amb18792609 [2,0,0,0,0,0|2,0,0]=4 642 B9R0.45 CCC\C=C/CCCCC Amb22230436 [2,0,0,0,0,0|0,0,2]=4 643 B9R0.45 CCC\C=C\CCCCC Amb22231673 [2,0,0,0,0,0|0,0,2]=4 644 B9R0.45 CCC\C=N\CCCCC Amb18090835 [2,0,0,0,0,0|1,0,1]=4 645 B9R0.45 CCNCCCCCCCl Amb24613632 [2,0,0,0,0,0|2,0,0]=4 646 B9R0.45 CCNCCCCCCF Amb25686439 [2,0,0,0,0,0|2,0,0]=4 647 B9R0.45 CCNCCCCCCI Amb24481103 [2,0,0,0,0,0|2,0,0]=4 648 B9R0.45 CCNCCCCCCN Amb25855319 [2,0,0,0,0,0|2,0,0]=4 649 B9R0.45 CCNCCCCCCO Amb24683613 [2,0,0,0,0,0|1,0,0]=3 650 B9R0.45 CCNCCCCNCC Amb20621746 [2,0,0,0,0,0|2,0,0]=4 651 B9R0.45 CCNCCCNCCC Amb20171972 [2,0,0,0,0,0|2,0,0]=4 652 B9R0.45 CCNCCCOCCO Amb25687058 [2,0,0,0,0,0|2,0,0]=4 653 B9R0.45 CCNCCNCCCC Amb20214616 [2,0,0,0,0,0|2,0,0]=4 654 B9R0.45 CCNCCOCCCO Amb25320517 [2,0,0,0,0,0|2,0,0]=4 655 B9R0.45 CCNCCSCCCO Amb25046236 [2,0,0,0,0,0|2,0,0]=4 656 B9R0.45 CCOCCCCCCBr Amb25299496 [2,0,0,0,0,0|2,0,0]=4 657 B9R0.45 CCOCCCCCCCl Amb18800872 [2,0,0,0,0,0|2,0,0]=4 658 B9R0.45 CCOCCCCCCI Amb25085906 [2,0,0,0,0,0|2,0,0]=4 659 B9R0.45 CCOCCCCCCN Amb24388111 [2,0,0,0,0,0|2,0,0]=4 660 B9R0.45 CCOCCCCCCO Amb25074993 [2,0,0,0,0,0|1,0,0]=3 661 B9R0.45 CCOCCCCNCC Amb24476926 [2,0,0,0,0,0|2,0,0]=4 662 B9R0.45 CCOCCCCOCC Amb10807403 [2,0,0,0,0,0|2,0,0]=4 663 B9R0.45 CCOCCOCCCC Amb25248413 [2,0,0,0,0,0|2,0,0]=4 664 B9R0.45 CCSCCCCCCBr Amb25822578 [2,0,0,0,0,0|2,0,0]=4 665 B9R0.45 CCSCCCCCCCl Amb18186755 [2,0,0,0,0,0|2,0,0]=4 666 B9R0.45 CCSCCCCCCN Amb24482109 [2,0,0,0,0,0|2,0,0]=4 667 B9R0.45 CCSCCCCCNC Amb25110066 [2,0,0,0,0,0|2,0,0]=4 668 B9R0.45 CCSCCCCCOC Amb24482935 [2,0,0,0,0,0|2,0,0]=4 669 B9R0.45 CCSCCCCNCC Amb18798057 [2,0,0,0,0,0|2,0,0]=4 670 B9R0.45 CCSCCCNCCO Amb24380672 [2,0,0,0,0,0|2,0,0]=4 671 B9R0.45 CCSCCCSCCO Amb24376336 [2,0,0,0,0,0|2,0,0]=4 672 B9R0.45 CCSCCSCCCC Amb25279629 [2,0,0,0,0,0|2,0,0]=4 673 B9R0.45 CC\C=C/CCCCCC Amb22230427 [2,0,0,0,0,0|0,0,2]=4 674 B9R0.45 CC\C=C\CCCCCC Amb22231672 [2,0,0,0,0,0|0,0,2]=4 675 B9R0.45 CNCCCCCCCCl Amb25809475 [2,0,0,0,0,0|2,0,0]=4 676 B9R0.45 CNCCCCCCOC Amb25699667 [2,0,0,0,0,0|2,0,0]=4 677 B9R0.45 CNCCCNCCCC Amb24502382 [2,0,0,0,0,0|2,0,0]=4 678 B9R0.45 CNCCCNCCCO Amb20171918 [2,0,0,0,0,0|2,0,0]=4 679 B9R0.45 CNCCCSCCCO Amb25110847 [2,0,0,0,0,0|2,0,0]=4 680 B9R0.45 CNCCNCCCCO Amb25785280 [2,0,0,0,0,0|2,0,0]=4 681 B9R0.45 COCCCCCCCBr Amb25122735 [2,0,0,0,0,0|2,0,0]=4 682 B9R0.45 COCCCCCCCO Amb25315004 [2,0,0,0,0,0|1,0,0]=3 683 B9R0.45 COCCCCCCOC Amb10807404 [2,0,0,0,0,0|2,0,0]=4 684 B9R0.45 COCCCCSCCO Amb25841523 [2,0,0,0,0,0|2,0,0]=4 685 B9R0.45 COCCCNCCCO Amb17308606 [2,0,0,0,0,0|2,0,0]=4 686 B9R0.45 COCCCOCCCO Amb20242414 [2,0,0,0,0,0|2,0,0]=4 687 B9R0.45 COCCCSCCCO Amb25041322 [2,0,0,0,0,0|2,0,0]=4 688 B9R0.45 COCCNCCCCO Amb17334271 [2,0,0,0,0,0|2,0,0]=4 689 B9R0.45 CSCCCCCCCCl Amb25032475 [2,0,0,0,0,0|2,0,0]=4 690 B9R0.45 CSCCCCCCCO Amb24378634 [2,0,0,0,0,0|1,0,0]=3 691 B9R0.45 CSCCCCNCCO Amb24423555 [2,0,0,0,0,0|2,0,0]=4 692 B9R0.45 CSCCCSCCCC Amb24482722 [2,0,0,0,0,0|2,0,0]=4 693 B9R0.45 CSCCNCCCCO Amb25703017 [2,0,0,0,0,0|2,0,0]=4 694 B9R0.45 CSCCSCCCCO Amb24356155 [2,0,0,0,0,0|2,0,0]=4 695 B9R0.45 C\C=C\CCCCCCC Amb22730483 [2,0,0,0,0,0|0,0,2]=4 696 B9R0.45 FCCCCCCCCF Amb22641491 [2,0,0,0,0,0|2,0,0]=4 697 B9R0.45 ICCCCCCCCI Amb20242379 [2,0,0,0,0,0|2,0,0]=4 698 B9R0.45 NCCCCCCCCBr Amb24744173 [2,0,0,0,0,0|2,0,0]=4 699 B9R0.45 NCCCCCCCCCl Amb25147234 [2,0,0,0,0,0|2,0,0]=4 700 B9R0.45 NCCCCCCCCF Amb25063266 [2,0,0,0,0,0|2,0,0]=4 701 B9R0.45 NCCCCCCCCO Amb24116967 [2,0,0,0,0,0|1,0,0]=3 702 B9R0.45 NCCCCCCCCS Amb25757074 [2,0,0,0,0,0|1,1,0]=4 703 B9R0.45 NCCCCCOCCO Amb24456752 [2,0,0,0,0,0|2,0,0]=4 704 B9R0.45 NCCCCSCCCO Amb17500966 [2,0,0,0,0,0|2,0,0]=4 705 B9R0.45 NCCCNCCCCO Amb24561165 [2,0,0,0,0,0|2,0,0]=4 706 B9R0.45 NCCCSCCCCO Amb24546562 [2,0,0,0,0,0|2,0,0]=4 707 B9R0.45 NCCOCCCCCO Amb24433692 [2,0,0,0,0,0|2,0,0]=4 708 B9R0.45 NCCSCCCCCO Amb18183510 [2,0,0,0,0,0|2,0,0]=4 709 B9R0.45 OCCCCCCCC#C Amb10563785 [2,0,0,0,0,0|0,0,2]=4 710 B9R0.45 OCCCCCCCC=O Amb25765567 [2,0,0,0,0,0|1,0,1]=4 711 B9R0.45 OCCCCCCCCF Amb25330666 [2,0,0,0,0,0|1,0,0]=3 712 B9R0.45 OCCCCCNCCF Amb25697650 [2,0,0,0,0,0|2,0,0]=4 713 B9R0.45 OCCCCCSCCS Amb25682475 [2,0,0,0,0,0|2,0,0]=4 714 B9R0.45 OCCCCC\C=C/CC Amb10807384 [2,0,0,0,0,0|0,0,2]=4 715 B9R0.45 OCCCCNCCCF Amb25065751 [2,0,0,0,0,0|2,0,0]=4 716 B9R0.45 OCCNCCCCCO Amb25771811 [2,0,0,0,0,0|2,0,0]=4 717 B9R0.45 OCCOCCCCCCl Amb25368354 [2,0,0,0,0,0|2,0,0]=4 718 B9R0.45 OCCSCCCCCF Amb25800644 [2,0,0,0,0,0|2,0,0]=4 719 B9R0.45 OCCSCCCCCO Amb18800854 [2,0,0,0,0,0|2,0,0]=4 720 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [2,0,0,0,0,0|2,0,0]=4 721 B11R0.4 CCCCCCCC(O)CCC Amb18803156 [1,1,0,0,0,0|0,0,0]=2 722 B11R0.4 CCCCCCNC(=O)CCC Amb17855601 [1,1,0,0,0,0|1,0,1]=4 723 B11R0.4 CCOC(=O)CCCCCCO Amb22230670 [1,1,0,0,0,0|1,0,1]=4 724 B11R0.40 CCC(O)CNCCCOCC Amb18795692 [1,1,0,0,0,0|2,0,0]=4 725 B11R0.40 CCCCCCCCC(C#N)C Amb17614640 [1,1,0,0,0,0|1,0,1]=4 726 B11R0.40 CCCCCCCCC(C)C=O Amb22730336 [1,1,0,0,0,0|0,0,2]=4 727 B11R0.40 CCCCCCCCC(C)CC Amb22729013 [1,1,0,0,0,0|0,0,0]=2 728 B11R0.40 CCCCCCCCC(C)[Mg]Br Amb22897281 [1,1,0,0,0,0|2,0,0]=4 729 B11R0.40 CCCCCCCCC(C)[Zn]Br Amb22897739 [1,1,0,0,0,0|2,0,0]=4 730 B11R0.40 CCCCCCCCC(O)CC Amb18803155 [1,1,0,0,0,0|0,0,0]=2 731 B11R0.40 CCCCCCCC[C@@H](O)CCl Amb22736715 [1,1,0,0,0,0|1,0,0]=3 732 B11R0.40 CCCCCCCC[C@H](O)CCl Amb22736716 [1,1,0,0,0,0|1,0,0]=3 733 B11R0.40 OCCCCCCCC(O)CO Amb24325369 [1,1,0,0,0,0|1,0,0]=3 734 B11R0.81 CCCCC(O)CCCCCC Amb22045161 [1,1,0,0,0,0|0,0,0]=2 735 B11R0.81 CCCCCCC(=O)CCCC Amb17940262 [1,1,0,0,0,0|0,0,1]=3 736 B11R0.81 CCCCCOC(=O)CCCC Amb22350606 [1,1,0,0,0,0|1,0,1]=4 737 B11R0.81 CCCCNCC(CNCC)O Amb16750662 [1,1,0,0,0,0|2,0,0]=4 738 B11R0.81 CCCOC(=O)CCCCCC Amb22167368 [1,1,0,0,0,0|1,0,1]=4 739 B11R0.140 CCCCCC(CCCCC)Br Amb10553280 [1,1,0,0,0,0|0,0,0]=2 740 B11R0.140 CCCCCN(CCCCC)O Amb10554077 [1,1,0,0,0,0|1,0,0]=3 741 B11R0.140 CCCCOC(C)OCCCC Amb17939403 [1,1,0,0,0,0|2,0,0]=4 742 B11R0.148 CC(C)CCCCCCCC=O Amb22055758 [1,1,0,0,0,0|0,0,2]=4 743 B11R0.148 CC(C)CCCCCCCCO Amb22055759 [1,1,0,0,0,0|0,0,0]=2 744 B11R0.148 CCCCCCCCC=C(C)C Amb22899462 [1,1,0,0,0,0|0,0,2]=4 745 B11R0.148 CCCCCCCCCC(C)C Amb22043228 [1,1,0,0,0,0|0,0,0]=2 746 B11R0.148 CCCCCCCCCC([O-])=O Amb22733551 [1,1,0,0,0,0|0,0,2]=4 747 B11R0.148 CCCCCCCCCN(C)C Amb22360719 [1,1,0,0,0,0|1,0,0]=3 748 B11R0.148 CCCCCCCCC[13C](O)=O Amb22353426 [1,1,0,0,0,0|0,0,1]=3 749 B11R0.148 CCCCCCCCC[C@H](C)O Amb20240616 [1,1,0,0,0,0|0,0,0]=2 750 B11R0.148 CCCCCCCCNC(=O)C Amb10562300 [1,1,0,0,0,0|1,0,1]=4 751 B11R0.148 CCCCCCCC[13CH2][13C](O)=O Amb22054843 [1,1,0,0,0,0|0,0,1]=3 752 B11R0.148 CCCCCCCNCC(O)=O Amb19373457 [1,1,0,0,0,0|1,0,1]=4 753 B11R0.148 CCCCOCCOCC(C)O Amb18808894 [1,1,0,0,0,0|2,0,0]=4 754 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [1,1,0,0,0,0|1,0,1]=4 755 B11R0.148 CN(C)CCCCCCCCN Amb24117500 [1,1,0,0,0,0|2,0,0]=4 756 B11R0.148 CN(C)CCCCCCCCO Amb22733872 [1,1,0,0,0,0|1,0,0]=3 757 B11R0.148 [13CH3]CCCCCCCCC(O)=O Amb22367552 [1,1,0,0,0,0|0,0,1]=3 758 B13R0.2 CC(CNCCOCCCC)CCC Amb18321001 [0,2,0,0,0,0|2,0,0]=4 759 B13R0.2 CCCCCCCCCC(O)CCC Amb22229885 [0,2,0,0,0,0|1,0,0]=3 760 B13R0.2 CCCCCCCCCC(O)CCO Amb24081769 [0,2,0,0,0,0|0,0,0]=2 761 B13R0.2 CCCCCCCCNC(=O)CCCl Amb17327381 [0,2,0,0,0,0|1,0,1]=4 762 B13R0.2 CCCCCCCCOC(=O)CCC Amb22043399 [0,2,0,0,0,0|1,0,1]=4 763 B13R0.2 CCOC(=O)CCCCCCCCBr Amb21520303 [0,2,0,0,0,0|1,0,1]=4 764 B13R0.2 OCCCCCCCCC(=O)OCC Amb17613857 [0,2,0,0,0,0|0,0,1]=3 765 B13R0.66 CC(CCCC)NCCOCCCC Amb18321003 [0,2,0,0,0,0|2,0,0]=4 766 B13R0.66 CCCCC(=C)CCCCCCCC Amb22228693 [0,2,0,0,0,0|1,0,0]=3 767 B13R0.66 CCCCC(O)CCCCCCCC Amb22230023 [0,2,0,0,0,0|1,0,0]=3 768 B13R0.66 CCCCCCCCC(=O)OCCC Amb22734143 [0,2,0,0,0,0|1,0,1]=4 769 B13R0.66 CCCCCCCCS(=O)CCCCl Amb22731437 [0,2,0,0,0,0|1,0,0]=3 770 B13R0.66 CCCCCCCCS(=O)CCCO Amb1085915 [0,2,0,0,0,0|0,0,0]=2 771 B13R0.66 CCCCCCCNC(=O)CCCCl Amb17323882 [0,2,0,0,0,0|1,0,1]=4 772 B13R0.66 CCCCCCCOC(=O)CCCCl Amb19960304 [0,2,0,0,0,0|1,0,1]=4 773 B13R0.66 CCCCC\C=C\CC(CCCC)O Amb10564673 [0,2,0,0,0,0|1,0,1]=4 774 B13R0.282 COC(CCC)CCCNCCCC Amb23538252 [0,2,0,0,0,0|2,0,0]=4 775 B13R0.335 CCCCCCCCC(O)CC(O)=O Amb21928763 [0,2,0,0,0,0|0,0,1]=3 776 B13R0.340 CCCCCCCCC(F)[C@@H](O)CO Amb24122594 [0,2,0,0,0,0|0,0,0]=2 777 B13R0.1338 CCCCCCCCS(=O)(=O)CCBr Amb1034856 [0,2,0,0,0,0|2,0,0]=4 778 B13R0.1338 CCCCCCCCS(=O)(=O)CCCl Amb1039001 [0,2,0,0,0,0|2,0,0]=4 779 B13R0.1338 CCCCCCCCS(=O)(=O)CCO Amb1085975 [0,2,0,0,0,0|1,0,0]=3 780 B13R0.54 BrCCCCCCCCCCC(=O)N Amb16207966 [0,2,0,0,0,0|0,0,2]=4 781 B13R0.54 CC(C)CCCCCCCCCC=O Amb22055766 [0,2,0,0,0,0|0,0,1]=3 782 B13R0.54 CC(C)CCCCCCCCCCO Amb22055767 [0,2,0,0,0,0|0,0,0]=2 783 B13R0.54 CC(C)CCCCCCCCCCO Amb22730980 [0,2,0,0,0,0|0,0,0]=2 784 B13R0.54 CCCCCCCCCC=CC(=O)O Amb13952752 [0,2,0,0,0,0|0,0,2]=4 785 B13R0.54 CCCCCCCCCCCC(=C)Br Amb19886460 [0,2,0,0,0,0|1,0,0]=3 786 B13R0.54 CCCCCCCCCCCC(=N)N Amb10568321 [0,2,0,0,0,0|1,0,0]=3 787 B13R0.54 CCCCCCCCCCCC(=S)N Amb13953232 [0,2,0,0,0,0|0,1,0]=3 788 B13R0.54 CCCCCCCCCCCC(C)=C Amb19886457 [0,2,0,0,0,0|1,0,0]=3 789 B13R0.54 CCCCCCCCCCCC(C)Br Amb22734063 [0,2,0,0,0,0|1,0,0]=3 790 B13R0.54 CCCCCCCCCCCC(C)N Amb21953727 [0,2,0,0,0,0|1,0,0]=3 791 B13R0.54 CCCCCCCCCCCC(O)=O Amb22348404 [0,2,0,0,0,0|0,0,0]=2 792 B13R0.54 CCCCCCCCCCCC(O)=O Amb22730643 [0,2,0,0,0,0|0,0,0]=2 793 B13R0.54 CCCCCCCCCCCC([O-])=O Amb17942849 [0,2,0,0,0,0|0,0,1]=3 794 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22729066 [0,2,0,0,0,0|0,0,1]=3 795 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730602 [0,2,0,0,0,0|0,0,1]=3 796 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22730786 [0,2,0,0,0,0|0,0,1]=3 797 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731774 [0,2,0,0,0,0|0,0,1]=3 798 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22731775 [0,2,0,0,0,0|0,0,1]=3 799 B13R0.54 CCCCCCCCCCCC([O-])=O Amb22733752 [0,2,0,0,0,0|0,0,1]=3 800 B13R0.54 CCCCCCCCCCC[13C](O)=O Amb21928681 [0,2,0,0,0,0|0,0,0]=2 801 B13R0.54 CCCCCCCCCCC[14C](O)=O Amb22349630 [0,2,0,0,0,0|0,0,0]=2 802 B13R0.54 CCCCCCCCCCNC(=O)N Amb2228230 [0,2,0,0,0,0|0,0,2]=4 803 B13R0.54 CCCCCCCCCCOC(=O)Cl Amb22337976 [0,2,0,0,0,0|0,0,2]=4 804 B13R0.54 CCCCCCCCCCOC([S-])=S Amb22334119 [0,2,0,0,0,0|0,1,1]=4 805 B13R0.54 CCCCCCCCCCOP(O)O Amb22049477 [0,2,0,0,0,0|1,0,0]=3 806 B13R0.54 CCCCCCCCCC[13CH2]C(O)=O Amb22353612 [0,2,0,0,0,0|0,0,0]=2 807 B13R0.54 CCCCCCCCCC[13CH2][13C](O)=O Amb22353611 [0,2,0,0,0,0|0,0,0]=2 808 B13R0.54 CCCCCCCCSCCC(=O)N Amb10669601 [0,2,0,0,0,0|0,0,2]=4 809 B13R0.54 CCCCCCCCSCCC(=O)O Amb1038994 [0,2,0,0,0,0|0,0,1]=3 810 B13R0.54 CCCCCCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22353609 [0,2,0,0,0,0|0,0,0]=2 811 B13R0.54 CCCCCCCNCCNC(C)C Amb20140556 [0,2,0,0,0,0|2,0,0]=4 812 B13R0.54 CCCCCC\C=C/CCCC(O)=O Amb20672025 [0,2,0,0,0,0|0,0,2]=4 813 B13R0.54 CCCCOCCCNCCC(C)C Amb18118834 [0,2,0,0,0,0|2,0,0]=4 814 B13R0.54 CCCCSCCCCCCC(=O)O Amb1036584 [0,2,0,0,0,0|0,0,1]=3 815 B13R0.54 CN(C)CCCCCCCCCCN Amb24117501 [0,2,0,0,0,0|1,0,0]=3 816 B13R0.54 N#CCCCCCCCCCC(O)=O Amb22547629 [0,2,0,0,0,0|0,0,2]=4 817 B13R0.54 NC(=[NH2+])SCCCCCCCCCO Amb22054616 [0,2,0,0,0,0|1,0,1]=4 818 B13R0.54 NCCCCCCCCCCC(=O)Cl Amb17143769 [0,2,0,0,0,0|0,0,2]=4 819 B13R0.54 NCCCCCCCCCCC([O-])=O Amb22353821 [0,2,0,0,0,0|0,0,2]=4 820 B13R0.54 OCCCCCCCCCCC(=O)O Amb1814707 [0,2,0,0,0,0|0,0,1]=3 821 B13R0.54 [13CH3]CCCCCCCCCCC(O)=O Amb22353502 [0,2,0,0,0,0|0,0,0]=2 822 B13R0.54 [13CH3]CCCCCCCCCC[13C](O)=O Amb22353610 [0,2,0,0,0,0|0,0,0]=2 823 B13R0.147 CCCCCCCCCCC(=O)C=O Amb24084923 [0,2,0,0,0,0|0,0,2]=4 824 B13R0.147 CCCCCCCCCCC(C)[Mg]Br Amb22897298 [0,2,0,0,0,0|1,0,0]=3 825 B13R0.147 CCCCCCCCCCC(O)CC Amb22229414 [0,2,0,0,0,0|0,0,0]=2 826 B13R0.147 CCCCCCCCCCC(O)CO Amb22002456 [0,2,0,0,0,0|0,0,0]=2 827 B13R0.147 CCCCCCCCCNC(=O)CCl Amb17797886 [0,2,0,0,0,0|1,0,1]=4 828 B13R0.147 CCCCCCCCCOC(=O)CS Amb22369347 [0,2,0,0,0,0|0,1,1]=4 829 B13R0.147 CCCCCCCNCC\C(\N)=N/O Amb19981286 [0,2,0,0,0,0|1,0,1]=4 830 B13R0.147 OCCCCCCCCCC(=O)OC Amb13887310 [0,2,0,0,0,0|0,0,1]=3 831 B13R0.165 CC(OCCCCC)OCCCCC Amb22230583 [0,2,0,0,0,0|2,0,0]=4 832 B13R0.165 CCCCCCC(=C)CCCCCC Amb22228841 [0,2,0,0,0,0|1,0,0]=3 833 B13R0.165 CCCCCCC(=O)CCCCCC Amb1158882 [0,2,0,0,0,0|1,0,0]=3 834 B13R0.165 CCCCCCC(=O)OCCCCC Amb24087762 [0,2,0,0,0,0|1,0,1]=4 835 B13R0.165 CCCCCCC(CCCCCC)O Amb10553307 [0,2,0,0,0,0|1,0,0]=3 836 B13R0.165 CCCCCC[Sn](=O)CCCCCC Amb22346032 [0,2,0,0,0,0|1,0,0]=3 837 B13R0.165 CN(CCCCCC)CCCCCC Amb22338347 [0,2,0,0,0,0|1,0,0]=3 838 B13R0.336 C=CCCCCCCCCCCC=C Amb22227679 [0,2,0,0,0,0|1,0,1]=4 839 B13R0.336 CCCCC#CCCCCCC[Mg]Cl Amb22897299 [0,2,0,0,0,0|1,0,1]=4 840 B13R0.336 CCCCCCC#CCNCCCC Amb1019966 [0,2,0,0,0,0|1,0,1]=4 841 B13R0.336 CCCCCCCCCCCCCBr Amb16234183 [0,2,0,0,0,0|1,0,0]=3 842 B13R0.336 CCCCCCCCCCCCC[NH3+] Amb10555901 [0,2,0,0,0,0|1,0,0]=3 843 B13R0.336 CCCCCCCCCCCCON Amb24117984 [0,2,0,0,0,0|0,0,0]=2 844 B13R0.336 CCCCCCCCCCCCS[Au] Amb22354035 [0,2,0,0,0,0|0,1,0]=3 845 B13R0.336 CCCCCCCCCCCC[Hg]Cl Amb22359879 [0,2,0,0,0,0|1,0,0]=3 846 B13R0.336 CCCCCCCCCCCC[Mg]Br Amb22353523 [0,2,0,0,0,0|1,0,0]=3 847 B13R0.336 CCCCCCCCCCCN=C=O Amb16233603 [0,2,0,0,0,0|0,0,1]=3 848 B13R0.336 CCCCCCCCCCCN=C=S Amb19883893 [0,2,0,0,0,0|0,1,0]=3 849 B13R0.336 CCCCCCCCCCNCCN Amb18333779 [0,2,0,0,0,0|1,0,0]=3 850 B13R0.336 CCCCCCCCCCOCC#N Amb22358974 [0,2,0,0,0,0|1,0,0]=3 851 B13R0.336 CCCCCCCCCCSCCN Amb24060873 [0,2,0,0,0,0|1,0,0]=3 852 B13R0.336 CCCCCCCCCCSCCO Amb1032989 [0,2,0,0,0,0|0,0,0]=2 853 B13R0.336 CCCCCCCCCC\C=C\C=O Amb22351314 [0,2,0,0,0,0|0,0,2]=4 854 B13R0.336 CCCCCCCCCC\C=C\CO Amb22336246 [0,2,0,0,0,0|0,0,0]=2 855 B13R0.336 CCCNCCCCCCNCCC Amb22346014 [0,2,0,0,0,0|1,0,0]=3 856 B13R0.336 CCCNCCNCCCCCCC Amb20140560 [0,2,0,0,0,0|1,0,0]=3 857 B13R0.336 CCNCCCNCCCCCCC Amb20171958 [0,2,0,0,0,0|1,0,0]=3 858 B13R0.336 COCCCCCCCCNCCS Amb24087352 [0,2,0,0,0,0|0,1,0]=3 859 B13R0.336 COCCCNCCNCCCOC Amb19966692 [0,2,0,0,0,0|2,0,0]=4 860 B13R0.336 COCCCOCCCOCCCO Amb22348070 [0,2,0,0,0,0|1,0,0]=3 861 B13R0.336 NCCCCCCCCCCCCBr Amb17609918 [0,2,0,0,0,0|1,0,0]=3 862 B13R0.336 NCCCCCCCCCCCCO Amb17608041 [0,2,0,0,0,0|0,0,0]=2 863 B13R0.336 NCCCNCCCCNCCCN Amb20671224 [0,2,0,0,0,0|2,0,0]=4 864 B13R0.336 NCCCNCCCNCCCCN Amb23399719 [0,2,0,0,0,0|2,0,0]=4 865 B13R0.336 OCCCCCCCCCCN=[N+]=[N-] Amb17608636 [0,2,0,0,0,0|1,0,0]=3 866 B13R0.336 OC\C=C\CCCCCCCCCBr Amb22347650 [0,2,0,0,0,0|0,0,1]=3 867 B13R0.338 CCCCCCCC(=O)CCCCC Amb22730631 [0,2,0,0,0,0|1,0,0]=3 868 B13R0.338 CCCCCCCC(O)CCCCC Amb22230107 [0,2,0,0,0,0|1,0,0]=3 869 B13R0.338 CCCCNC(=O)CCCCCCN Amb24769979 [0,2,0,0,0,0|1,0,1]=4 870 B13R0.338 CCCCOC(=O)CCCCCCC Amb22734044 [0,2,0,0,0,0|1,0,1]=4 871 B13R0.1 CC(C)CCCC(C)NCCCCO Amb18331843 [0,2,0,0,0,0|1,0,0]=3 872 B13R0.1129 CCCCCCS(=O)(=O)CCCCN Amb17501046 [0,2,0,0,0,0|2,0,0]=4 873 B13R0.1129 C[Si](Cl)(CCCCC)CCCCCC Amb19893993 [0,2,0,0,0,0|1,1,0]=4 874 B13R0.1171 CCCC[C@@H](O)[C@@H](O)CCCCCC Amb22801396 [0,2,0,0,0,0|1,0,0]=3 875 B13R0.1171 CCCC[C@@H](O)[C@H](O)CCCCCC Amb22801397 [0,2,0,0,0,0|1,0,0]=3 876 B13R0.154 CCCCCCCC(=O)OCC(C)O Amb22731171 [0,2,0,0,0,0|1,0,1]=4 877 B13R0.154 CCCCCCCC(O)CCC(O)=O Amb22058992 [0,2,0,0,0,0|0,0,1]=3 878 B13R0.154 CCCCCCCC(O)CCC([O-])=O Amb19148937 [0,2,0,0,0,0|0,0,2]=4 879 B13R0.150 CC(CCCCCCCCO)C(O)=O Amb20246737 [0,2,0,0,0,0|1,0,1]=4 880 B13R0.150 CCCCCCCCCC(C)C(O)=O Amb18320092 [0,2,0,0,0,0|0,0,1]=3 881 B13R0.150 CCCCCCCCCC(O)C(O)=O Amb22224801 [0,2,0,0,0,0|0,0,1]=3 882 B13R0.150 CCCCCCCCNC(=O)C(C)O Amb22346363 [0,2,0,0,0,0|1,0,1]=4 883 B13R0.179 CC(C)CCCCCCCCC(O)=O Amb21928890 [0,2,0,0,0,0|0,0,1]=3 884 B13R0.179 CC(CCCCCCCCC(=O)O)N Amb2229643 [0,2,0,0,0,0|0,0,1]=3 885 B13R0.202 CCC(C)CCCCCCCC(O)=O Amb21928874 [0,2,0,0,0,0|0,0,1]=3 886 B13R0.202 CCC(CCCCCCCC(=O)O)N Amb2229644 [0,2,0,0,0,0|0,0,1]=3 887 B13R0.202 OC(=O)CCCCCCCC(F)CBr Amb22547613 [0,2,0,0,0,0|1,0,1]=4 888 B13R0.280 CCCCCCCCCCP(=O)(C)C Amb1239581 [0,2,0,0,0,0|1,0,1]=4 889 B13R0.280 CCCCCCCCCCS(O)(=O)=O Amb22348234 [0,2,0,0,0,0|1,0,0]=3 890 B13R0.280 CCCCCCCCCC[N+](C)(C)[O-] Amb22265088 [0,2,0,0,0,0|1,0,1]=4 891 B13R0.280 CCCCCCCCCC[P+](C)(C)[O-] Amb22369691 [0,2,0,0,0,0|1,0,1]=4 892 B13R0.280 CCCCCCCCCC[Si](C)(Cl)Cl Amb19893767 [0,2,0,0,0,0|1,1,0]=4 893 B13R0.280 CCCCCCCCCC[Si](Cl)(Cl)Cl Amb19893769 [0,2,0,0,0,0|1,1,0]=4 894 B13R0.280 [2H]C([2H])([2H])CCCCCCCCCBr Amb22367434 [0,2,0,0,0,0|2,0,0]=4 895 B13R0.280 [2H]C([2H])([2H])CCCCCCCCCO Amb21928619 [0,2,0,0,0,0|1,0,0]=3 896 B13R0.412 CCCCCCCCCC(OC)OC Amb22168244 [0,2,0,0,0,0|2,0,0]=4 897 B13R0.412 OCCCCCCCCN(CC)CC Amb17612759 [0,2,0,0,0,0|1,0,0]=3 898 B11R1.4 CCCCCCC1CCCN1 Amb17659150 [1,0,0,1,0,0|1,0,0]=3 899 B11R1.4 CCCCCCC1CCCO1 Amb10558596 [1,0,0,1,0,0|0,0,0]=2 900 B11R1.4 CCCCCCC1NCCS1 Amb10553776 [1,0,0,1,0,0|1,1,0]=4 901 B11R1.4 CCCCCOC1CNCC1 Amb21957110 [1,0,0,1,0,0|2,0,0]=4 902 B11R1.4 CCCCOCC1CNCC1 Amb21956725 [1,0,0,1,0,0|2,0,0]=4 903 B11R1.4 CCCNCCC1CCCC1 Amb18791696 [1,0,0,1,0,0|1,0,0]=3 904 B11R1.4 CNCCNCC1CCCO1 Amb18791963 [1,0,0,1,0,0|2,0,0]=4 905 B11R1.4 COCCCCC1CNCC1 Amb22011550 [1,0,0,1,0,0|2,0,0]=4 906 B11R1.4 ClCCCNCC1CCCO1 Amb20414361 [1,0,0,1,0,0|2,0,0]=4 907 B11R1.4 NCCCCCN1CCCC1 Amb22728865 [1,0,0,1,0,0|2,0,0]=4 908 B11R1.4 NCCCCCN1CCCC1 Amb22751385 [1,0,0,1,0,0|2,0,0]=4 909 B11R1.4 NCCCNCC1CCCO1 Amb17315282 [1,0,0,1,0,0|2,0,0]=4 910 B11R1.4 NCCCOCC1CCCO1 Amb1154666 [1,0,0,1,0,0|2,0,0]=4 911 B11R1.4 OCCCCCC1OCCO1 Amb25697556 [1,0,0,1,0,0|2,0,0]=4 912 B11R1.4 OCCCCNC1CCCC1 Amb17334419 [1,0,0,1,0,0|1,0,0]=3 913 B11R1.4 OCCCCOC1CCCO1 Amb22641876 [1,0,0,1,0,0|2,0,0]=4 914 B11R1.4 OCCNCCC1CCCC1 Amb18791847 [1,0,0,1,0,0|1,0,0]=3 915 B11R1.4 OCCNCCN1CCCC1 Amb17318026 [1,0,0,1,0,0|2,0,0]=4 916 B11R1.5 C#CCC1CCCCCC1O Amb18182808 [1,0,0,1,0,0|0,0,2]=4 917 B11R1.5 C=CCC1CCCCCC1O Amb18182944 [1,0,0,1,0,0|0,0,2]=4 918 B11R1.5 CC1CCCCCC1=CCO Amb25725438 [1,0,0,1,0,0|0,0,2]=4 919 B11R1.5 CC1CCCCCC1CNC Amb24392715 [1,0,0,1,0,0|1,0,0]=3 920 B11R1.5 CC1CCCCCC1NCC Amb18956637 [1,0,0,1,0,0|1,0,0]=3 921 B11R1.5 CC1CCCCCN1CCBr Amb24441395 [1,0,0,1,0,0|2,0,0]=4 922 B11R1.5 CC1CCCCOC1CCO Amb25119972 [1,0,0,1,0,0|1,0,0]=3 923 B11R1.5 CCCC1CCCCCC1=O Amb18796794 [1,0,0,1,0,0|0,0,2]=4 924 B11R1.5 CCCC1CCCCCC1N Amb18283601 [1,0,0,1,0,0|1,0,0]=3 925 B11R1.5 CCCC1CCCCCC1O Amb18799751 [1,0,0,1,0,0|0,0,0]=2 926 B11R1.5 CCCN1CCCNCC1C Amb17578159 [1,0,0,1,0,0|2,0,0]=4 927 B11R1.5 CCCN1CCNCCC1C Amb17578168 [1,0,0,1,0,0|2,0,0]=4 928 B11R1.5 CCC[C@@H]1CCCCC[C@H]1O Amb24675468 [1,0,0,1,0,0|0,0,0]=2 929 B11R1.5 CCNC1CCCCCC1Cl Amb25731391 [1,0,0,1,0,0|2,0,0]=4 930 B11R1.5 CCNC1CCCCCC1O Amb18950483 [1,0,0,1,0,0|1,0,0]=3 931 B11R1.5 CCOC1CCCCCC1Br Amb24418269 [1,0,0,1,0,0|2,0,0]=4 932 B11R1.5 CCOC1CCCCCC1N Amb1134477 [1,0,0,1,0,0|2,0,0]=4 933 B11R1.5 CCOC1CCCCCC1O Amb18183279 [1,0,0,1,0,0|1,0,0]=3 934 B11R1.5 CCSC1CCCCCC1O Amb25742627 [1,0,0,1,0,0|1,0,0]=3 935 B11R1.5 CN1CCNCCC1CCO Amb24527428 [1,0,0,1,0,0|2,0,0]=4 936 B11R1.5 COCC1CCCCCC1Br Amb25777943 [1,0,0,1,0,0|2,0,0]=4 937 B11R1.5 CONC1CCCCCC1O Amb25151194 [1,0,0,1,0,0|2,0,0]=4 938 B11R1.5 C[C@H]1CCCCO[C@H]1CCO Amb24735187 [1,0,0,1,0,0|1,0,0]=3 939 B11R1.5 NCCC1CCCCCC1O Amb18199945 [1,0,0,1,0,0|1,0,0]=3 940 B11R1.5 O[C@@H]1CCCCO[C@H]1CCO Amb24576619 [1,0,0,1,0,0|2,0,0]=4 941 B11R1.17 C#CCCC1CCCCC1O Amb24574008 [1,0,0,1,0,0|0,0,2]=4 942 B11R1.17 C=C1CCCCC1CCCO Amb25149747 [1,0,0,1,0,0|0,0,2]=4 943 B11R1.17 C=CCCC1CCCCC1O Amb25227048 [1,0,0,1,0,0|0,0,2]=4 944 B11R1.17 CC#CCC1CCCCC1O Amb18181760 [1,0,0,1,0,0|0,0,2]=4 945 B11R1.17 CC1CCCC=C1CCCO Amb24362868 [1,0,0,1,0,0|0,0,2]=4 946 B11R1.17 CC1CCCCC1CCCC Amb24484363 [1,0,0,1,0,0|0,0,0]=2 947 B11R1.17 CC1CCCCC1CNCC Amb18979979 [1,0,0,1,0,0|1,0,0]=3 948 B11R1.17 CC1CCCCC1NCCN Amb18291118 [1,0,0,1,0,0|2,0,0]=4 949 B11R1.17 CC1CCCCC1NOCC Amb24626530 [1,0,0,1,0,0|2,0,0]=4 950 B11R1.17 CC1CCCCC1OCCO Amb18799954 [1,0,0,1,0,0|1,0,0]=3 951 B11R1.17 CC1CCCCN1CCCI Amb25285032 [1,0,0,1,0,0|2,0,0]=4 952 B11R1.17 CC1CCCNC1CCCC Amb25690783 [1,0,0,1,0,0|1,0,0]=3 953 B11R1.17 CC1CCCNC1CCCO Amb24453388 [1,0,0,1,0,0|1,0,0]=3 954 B11R1.17 CC1CCCNC1CNCC Amb24442715 [1,0,0,1,0,0|2,0,0]=4 955 B11R1.17 CC1CCCOC1CCCO Amb24719635 [1,0,0,1,0,0|1,0,0]=3 956 B11R1.17 CC1CCNCC1COCC Amb25795836 [1,0,0,1,0,0|2,0,0]=4 957 B11R1.17 CC1CCNCC1OCCO Amb24564332 [1,0,0,1,0,0|2,0,0]=4 958 B11R1.17 CC1CNCCC1CCCC Amb25096286 [1,0,0,1,0,0|1,0,0]=3 959 B11R1.17 CC1CNCCC1CCOC Amb24568408 [1,0,0,1,0,0|2,0,0]=4 960 B11R1.17 CC1CNCCC1CNCC Amb24463162 [1,0,0,1,0,0|2,0,0]=4 961 B11R1.17 CC1CNCCC1COCC Amb24704999 [1,0,0,1,0,0|2,0,0]=4 962 B11R1.17 CC1CNCCN1CCCO Amb18300097 [1,0,0,1,0,0|2,0,0]=4 963 B11R1.17 CC1COCCC1CNCC Amb24502146 [1,0,0,1,0,0|2,0,0]=4 964 B11R1.17 CC1COCCC1NCCC Amb25149522 [1,0,0,1,0,0|2,0,0]=4 965 B11R1.17 CC1CSCCN1CCCO Amb25769526 [1,0,0,1,0,0|2,0,0]=4 966 B11R1.17 CC1NCCCC1CNCC Amb25371593 [1,0,0,1,0,0|2,0,0]=4 967 B11R1.17 CC1NCCCC1COCC Amb25668678 [1,0,0,1,0,0|2,0,0]=4 968 B11R1.17 CC1NCCCC1NCCC Amb24550714 [1,0,0,1,0,0|2,0,0]=4 969 B11R1.17 CC1NCCCC1NCCO Amb24560373 [1,0,0,1,0,0|2,0,0]=4 970 B11R1.17 CC1NCCCC1OCCC Amb25132489 [1,0,0,1,0,0|2,0,0]=4 971 B11R1.17 CC1SCCCC1NCCC Amb24430180 [1,0,0,1,0,0|2,0,0]=4 972 B11R1.17 CC1SCCCC1NCCO Amb25795653 [1,0,0,1,0,0|2,0,0]=4 973 B11R1.17 CCCCC1=CCCCC1O Amb25832715 [1,0,0,1,0,0|0,0,2]=4 974 B11R1.17 CCCCC1CCCCC1Cl Amb25343212 [1,0,0,1,0,0|1,0,0]=3 975 B11R1.17 CCCCC1CCCCC1N Amb18977609 [1,0,0,1,0,0|1,0,0]=3 976 B11R1.17 CCCCC1CCCCN1C Amb24501690 [1,0,0,1,0,0|1,0,0]=3 977 B11R1.17 CCCCC1CCCCN1O Amb25824048 [1,0,0,1,0,0|1,0,0]=3 978 B11R1.17 CCCCC1CCCC[C@H]1O Amb25686307 [1,0,0,1,0,0|0,0,0]=2 979 B11R1.17 CCCCC1CCNCC1F Amb24601533 [1,0,0,1,0,0|2,0,0]=4 980 B11R1.17 CCCCC1CCNCC1N Amb24566143 [1,0,0,1,0,0|2,0,0]=4 981 B11R1.17 CCCCC1CNCCC1F Amb25202435 [1,0,0,1,0,0|2,0,0]=4 982 B11R1.17 CCCCC1CNCCC1N Amb24565409 [1,0,0,1,0,0|2,0,0]=4 983 B11R1.17 CCCCC1CNCCC1O Amb24099469 [1,0,0,1,0,0|1,0,0]=3 984 B11R1.17 CCCCC1COCCC1Cl Amb17666902 [1,0,0,1,0,0|2,0,0]=4 985 B11R1.17 CCCCC1COCCC1N Amb24642944 [1,0,0,1,0,0|2,0,0]=4 986 B11R1.17 CCCCC1N=CCCC1O Amb24734825 [1,0,0,1,0,0|1,0,1]=4 987 B11R1.17 CCCCC1OCCCC1Cl Amb25693465 [1,0,0,1,0,0|2,0,0]=4 988 B11R1.17 CCCCC1SCCOC1O Amb25845309 [1,0,0,1,0,0|2,0,0]=4 989 B11R1.17 CCCCC1SCCSC1O Amb25150514 [1,0,0,1,0,0|2,0,0]=4 990 B11R1.17 CCCCN1CCNCC1C Amb17232192 [1,0,0,1,0,0|2,0,0]=4 991 B11R1.17 CCCCN1CCNC[C@H]1C Amb24729140 [1,0,0,1,0,0|2,0,0]=4 992 B11R1.17 CCCCN1CCOCC1C Amb25668916 [1,0,0,1,0,0|2,0,0]=4 993 B11R1.17 CCCCN1CCOC[C@H]1C Amb25256483 [1,0,0,1,0,0|2,0,0]=4 994 B11R1.17 CCCC[C@@H]1C=CCC[C@@H]1O Amb24515585 [1,0,0,1,0,0|0,0,2]=4 995 B11R1.17 CCCC[C@@H]1C=CCC[C@H]1O Amb24661095 [1,0,0,1,0,0|0,0,2]=4 996 B11R1.17 CCCC[C@@H]1OCCC[C@@H]1Cl Amb25227471 [1,0,0,1,0,0|2,0,0]=4 997 B11R1.17 CCCC[C@H]1CCCCC1=O Amb24725293 [1,0,0,1,0,0|0,0,2]=4 998 B11R1.17 CCCC[C@H]1CCCCN1C Amb25079621 [1,0,0,1,0,0|1,0,0]=3 999 B11R1.17 CCCC[C@H]1CCCC[C@H]1O Amb24520172 [1,0,0,1,0,0|0,0,0]=2 1000 B11R1.17 CCCNC1CCCCC1Cl Amb25719278 [1,0,0,1,0,0|2,0,0]=4 1001 B11R1.17 CCCNC1CCCCC1N Amb23559103 [1,0,0,1,0,0|2,0,0]=4 1002 B11R1.17 CCCNC1CCCCC1S Amb18647769 [1,0,0,1,0,0|1,1,0]=4 1003 B11R1.17 CCCN[C@@H]1CCCC[C@@H]1O Amb23263413 [1,0,0,1,0,0|1,0,0]=3 1004 B11R1.17 CCCN[C@@H]1CCCC[C@@H]1S Amb24741607 [1,0,0,1,0,0|1,1,0]=4 1005 B11R1.17 CCCN[C@@H]1CCCC[C@H]1O Amb10608055 [1,0,0,1,0,0|1,0,0]=3 1006 B11R1.17 CCCN[C@H]1CCCC[C@@H]1O Amb25789989 [1,0,0,1,0,0|1,0,0]=3 1007 B11R1.17 CCCOC1CCCCC1O Amb18183283 [1,0,0,1,0,0|1,0,0]=3 1008 B11R1.17 CCCOC1COCCC1O Amb18183404 [1,0,0,1,0,0|2,0,0]=4 1009 B11R1.17 CCCOC1OCCCC1O Amb25149750 [1,0,0,1,0,0|2,0,0]=4 1010 B11R1.17 CCCSC1CCCCC1Cl Amb25350498 [1,0,0,1,0,0|2,0,0]=4 1011 B11R1.17 CCCSC1CCCCC1O Amb18180456 [1,0,0,1,0,0|1,0,0]=3 1012 B11R1.17 CCCS[C@@H]1CCCC[C@H]1Cl Amb24726292 [1,0,0,1,0,0|2,0,0]=4 1013 B11R1.17 CCCS[C@@H]1CCCC[C@H]1O Amb25699949 [1,0,0,1,0,0|1,0,0]=3 1014 B11R1.17 CCC\C=C/1\CCCCC1C Amb24595530 [1,0,0,1,0,0|0,0,2]=4 1015 B11R1.17 CCC\C=C/1\CCCCC1O Amb25771137 [1,0,0,1,0,0|0,0,2]=4 1016 B11R1.17 CCC\N=C\1/CCCCC1C Amb10569553 [1,0,0,1,0,0|1,0,1]=4 1017 B11R1.17 CCNCC1CCCCC1N Amb24759660 [1,0,0,1,0,0|2,0,0]=4 1018 B11R1.17 CCNCC1CCCCC1O Amb18644960 [1,0,0,1,0,0|1,0,0]=3 1019 B11R1.17 CCNC[C@@H]1CCCC[C@@H]1O Amb25328818 [1,0,0,1,0,0|1,0,0]=3 1020 B11R1.17 CCON[C@@H]1CCCC[C@H]1O Amb25060477 [1,0,0,1,0,0|2,0,0]=4 1021 B11R1.17 CCSCC1CCCCC1O Amb25027075 [1,0,0,1,0,0|1,0,0]=3 1022 B11R1.17 CN1CCCCC1CCCN Amb18830694 [1,0,0,1,0,0|2,0,0]=4 1023 B11R1.17 CN1CCCCC1CCCO Amb25846934 [1,0,0,1,0,0|1,0,0]=3 1024 B11R1.17 CNCCC1CCCCN1C Amb18989162 [1,0,0,1,0,0|2,0,0]=4 1025 B11R1.17 COCCC1CCCCC1Br Amb24380309 [1,0,0,1,0,0|2,0,0]=4 1026 B11R1.17 COCCC1CCCCC1Cl Amb18808936 [1,0,0,1,0,0|2,0,0]=4 1027 B11R1.17 COCCC1CCCCC1N Amb18294789 [1,0,0,1,0,0|2,0,0]=4 1028 B11R1.17 COCCC1CCCCC1O Amb18799960 [1,0,0,1,0,0|1,0,0]=3 1029 B11R1.17 COCCC1CCCOC1O Amb25032602 [1,0,0,1,0,0|2,0,0]=4 1030 B11R1.17 COCCC1CNCCC1O Amb24413224 [1,0,0,1,0,0|2,0,0]=4 1031 B11R1.17 COCCC1COCCC1O Amb25149508 [1,0,0,1,0,0|2,0,0]=4 1032 B11R1.17 COCCC1NCCCC1O Amb19888421 [1,0,0,1,0,0|2,0,0]=4 1033 B11R1.17 COCO[C@@H]1CCCC[C@@H]1O Amb25369276 [1,0,0,1,0,0|2,0,0]=4 1034 B11R1.17 CSCCC1CCCCC1Br Amb25098906 [1,0,0,1,0,0|2,0,0]=4 1035 B11R1.17 CSCCC1CCCCC1N Amb25733279 [1,0,0,1,0,0|2,0,0]=4 1036 B11R1.17 CSCCC1CCCCC1O Amb24488348 [1,0,0,1,0,0|1,0,0]=3 1037 B11R1.17 CSCCC1CNCCC1O Amb24466444 [1,0,0,1,0,0|2,0,0]=4 1038 B11R1.17 CSCOC1CCCCC1O Amb25092070 [1,0,0,1,0,0|2,0,0]=4 1039 B11R1.17 CSCO[C@@H]1CCCC[C@@H]1O Amb25221559 [1,0,0,1,0,0|2,0,0]=4 1040 B11R1.17 C[C@@H]1CCCCN1CCCN Amb25807782 [1,0,0,1,0,0|2,0,0]=4 1041 B11R1.17 C[C@@H]1CCCN[C@H]1CCCC Amb24677712 [1,0,0,1,0,0|1,0,0]=3 1042 B11R1.17 C[C@H]1CCCCN1CCCN Amb25267536 [1,0,0,1,0,0|2,0,0]=4 1043 B11R1.17 C[C@H]1CCCC[C@H]1NCCC Amb24615688 [1,0,0,1,0,0|1,0,0]=3 1044 B11R1.17 C\C=C\C[C@@H]1CCCC[C@H]1O Amb24569930 [1,0,0,1,0,0|0,0,2]=4 1045 B11R1.17 ClCCCN1CCCCC1C Amb17335100 [1,0,0,1,0,0|2,0,0]=4 1046 B11R1.17 N#CCCC1CCCCC1O Amb18644585 [1,0,0,1,0,0|1,0,1]=4 1047 B11R1.17 N#CCC[C@@H]1CCCC[C@@H]1O Amb24680233 [1,0,0,1,0,0|1,0,1]=4 1048 B11R1.17 NC1CCCCC1CCCBr Amb24752324 [1,0,0,1,0,0|2,0,0]=4 1049 B11R1.17 NC1CCCCC1CCCN Amb24693967 [1,0,0,1,0,0|2,0,0]=4 1050 B11R1.17 NC1CCCCC1NCCO Amb25028180 [1,0,0,1,0,0|2,0,0]=4 1051 B11R1.17 NC1CCCCC1SCCO Amb25151341 [1,0,0,1,0,0|2,0,0]=4 1052 B11R1.17 NCCCC1CCCCC1F Amb24511336 [1,0,0,1,0,0|2,0,0]=4 1053 B11R1.17 NCCNC1CCCCC1O Amb18986527 [1,0,0,1,0,0|2,0,0]=4 1054 B11R1.17 NCCN[C@@H]1CCCC[C@H]1O Amb25719606 [1,0,0,1,0,0|2,0,0]=4 1055 B11R1.17 NCCSC1CCCCC1O Amb18289483 [1,0,0,1,0,0|2,0,0]=4 1056 B11R1.17 N[C@@H]1CCCC[C@H]1OCCO Amb24592642 [1,0,0,1,0,0|2,0,0]=4 1057 B11R1.17 OC1CCCCC1CCCF Amb25115046 [1,0,0,1,0,0|1,0,0]=3 1058 B11R1.17 OC1CCCCC1NCCF Amb25791420 [1,0,0,1,0,0|2,0,0]=4 1059 B11R1.17 OC1CCCCC1NCCO Amb18289319 [1,0,0,1,0,0|2,0,0]=4 1060 B11R1.17 OC1CCCCC1OCCO Amb25152135 [1,0,0,1,0,0|2,0,0]=4 1061 B11R1.17 OC1CCCCC1SCCCl Amb24356745 [1,0,0,1,0,0|2,0,0]=4 1062 B11R1.17 OC1CCCCC1SCCO Amb18795856 [1,0,0,1,0,0|2,0,0]=4 1063 B11R1.17 OC1CCCCC1SCCS Amb24704568 [1,0,0,1,0,0|2,0,0]=4 1064 B11R1.17 OC1CCCCN1CCCCl Amb24487751 [1,0,0,1,0,0|2,0,0]=4 1065 B11R1.17 OC1CCNCC1CCCF Amb25032400 [1,0,0,1,0,0|2,0,0]=4 1066 B11R1.17 OC1CCNCC1CCCO Amb25701211 [1,0,0,1,0,0|2,0,0]=4 1067 B11R1.17 OC1CCOCC1CCCF Amb24573710 [1,0,0,1,0,0|2,0,0]=4 1068 B11R1.17 O[C@@H]1CCCC[C@H]1CCC=O Amb25245324 [1,0,0,1,0,0|1,0,1]=4 1069 B11R1.17 O[C@@H]1CCCC[C@H]1NCCF Amb24532141 [1,0,0,1,0,0|2,0,0]=4 1070 B11R1.17 O[C@@H]1CCCC[C@H]1SCCO Amb24396551 [1,0,0,1,0,0|2,0,0]=4 1071 B11R1.17 O[C@@H]1CCNC[C@@H]1CCCO Amb24760221 [1,0,0,1,0,0|2,0,0]=4 1072 B11R1.17 O[C@H]1CCCC[C@@H]1SCCO Amb25837818 [1,0,0,1,0,0|2,0,0]=4 1073 B11R1.17 O[C@H]1CCCO[C@@H]1CCCO Amb25207037 [1,0,0,1,0,0|2,0,0]=4 1074 B11R1.17 [C-]#[N+]CCC1CCCCC1C Amb25211958 [1,0,0,1,0,0|1,0,1]=4 1075 B11R1.18 CCC1CCCC1=CCCO Amb25285651 [1,0,0,1,0,0|0,0,2]=4 1076 B11R1.18 CCC1CCCC1CNCC Amb24762102 [1,0,0,1,0,0|1,0,0]=3 1077 B11R1.18 CCC1CCCC1NCCN Amb25381925 [1,0,0,1,0,0|2,0,0]=4 1078 B11R1.18 CCC1CCCC1NCCO Amb24761740 [1,0,0,1,0,0|1,0,0]=3 1079 B11R1.18 CCC1CCCN1CCCCl Amb18790722 [1,0,0,1,0,0|2,0,0]=4 1080 B11R1.18 CCC1CCCN1CCCN Amb18304548 [1,0,0,1,0,0|2,0,0]=4 1081 B11R1.18 CCC1CCCN1CCCO Amb18179765 [1,0,0,1,0,0|1,0,0]=3 1082 B11R1.18 CCC1CCCN1CCCS Amb24751261 [1,0,0,1,0,0|1,1,0]=4 1083 B11R1.18 CCC1CCCN1CCNC Amb18312335 [1,0,0,1,0,0|2,0,0]=4 1084 B11R1.18 CCCCC1CCCC1CN Amb24762087 [1,0,0,1,0,0|1,0,0]=3 1085 B11R1.18 CCCCC1CCCC1NC Amb19015846 [1,0,0,1,0,0|1,0,0]=3 1086 B11R1.18 CCCCC1CSCC1NC Amb24755621 [1,0,0,1,0,0|2,0,0]=4 1087 B11R1.18 CCCCN1CCCC1CBr Amb25380025 [1,0,0,1,0,0|2,0,0]=4 1088 B11R1.18 CCCCN1CCCC1CF Amb25380566 [1,0,0,1,0,0|2,0,0]=4 1089 B11R1.18 CCCCN1CCCC1CO Amb18799841 [1,0,0,1,0,0|1,0,0]=3 1090 B11R1.18 CCCC[C@@H]1CCC[C@H]1CO Amb25384683 [1,0,0,1,0,0|0,0,0]=2 1091 B11R1.18 CCCNC1CCCC1CC Amb18787607 [1,0,0,1,0,0|1,0,0]=3 1092 B11R1.18 CCCNC1CCCC1OC Amb18799825 [1,0,0,1,0,0|2,0,0]=4 1093 B11R1.18 CCCNC1CSCC1CC Amb24755617 [1,0,0,1,0,0|2,0,0]=4 1094 B11R1.18 CCCN[C@@H]1CCC[C@@H]1CO Amb25384097 [1,0,0,1,0,0|1,0,0]=3 1095 B11R1.18 CCCOC1CCCC1NC Amb19033703 [1,0,0,1,0,0|2,0,0]=4 1096 B11R1.18 CCN1CCCC1CCCN Amb23541765 [1,0,0,1,0,0|2,0,0]=4 1097 B11R1.18 CCN1CCCC1CCCO Amb18183238 [1,0,0,1,0,0|1,0,0]=3 1098 B11R1.18 CCN1CCC[C@H]1CNCC Amb25383111 [1,0,0,1,0,0|2,0,0]=4 1099 B11R1.18 CC[C@@H]1CCCN1CCCCl Amb25383903 [1,0,0,1,0,0|2,0,0]=4 1100 B11R1.18 CC\C=C\C1CCCC1CO Amb24735024 [1,0,0,1,0,0|0,0,2]=4 1101 B11R1.18 CC\C=C\[C@@H]1CCC[C@@H]1CO Amb25219265 [1,0,0,1,0,0|0,0,2]=4 1102 B11R1.18 CNC1CCCC1CCOC Amb18177552 [1,0,0,1,0,0|2,0,0]=4 1103 B11R1.18 CNCCN1CCCC1CO Amb18177608 [1,0,0,1,0,0|2,0,0]=4 1104 B11R1.18 CNCCN1CCC[C@@H]1CO Amb25383810 [1,0,0,1,0,0|2,0,0]=4 1105 B11R1.18 COC1CCCC1NCCO Amb18800142 [1,0,0,1,0,0|2,0,0]=4 1106 B11R1.18 COCCN1CCCC1CO Amb18800135 [1,0,0,1,0,0|2,0,0]=4 1107 B11R1.18 NCC1CCCC1OCCO Amb25379540 [1,0,0,1,0,0|2,0,0]=4 1108 B11R1.18 NCCCN1CCC[C@H]1CO Amb24764835 [1,0,0,1,0,0|2,0,0]=4 1109 B11R1.18 NCCN[C@@H]1CCC[C@@H]1CO Amb25384098 [1,0,0,1,0,0|2,0,0]=4 1110 B11R1.18 NC[C@H]1CCCN1CCCO Amb24750661 [1,0,0,1,0,0|2,0,0]=4 1111 B11R1.18 OCC1CCCN1CCCCl Amb18790913 [1,0,0,1,0,0|2,0,0]=4 1112 B11R1.18 OCCCC1CCCC1CCl Amb25386257 [1,0,0,1,0,0|1,0,0]=3 1113 B11R1.18 OCCCN1CCCC1CO Amb18177646 [1,0,0,1,0,0|2,0,0]=4 1114 B11R1.18 OCCN[C@@H]1CCC[C@@H]1CO Amb25384218 [1,0,0,1,0,0|2,0,0]=4 1115 B11R1.18 OC[C@@H]1CCC[C@@H]1NCCF Amb25384219 [1,0,0,1,0,0|2,0,0]=4 1116 B11R1.26 C#C[C@H]1CCCCCC[C@@H]1O Amb25317522 [1,0,0,1,0,0|0,0,2]=4 1117 B11R1.26 CCC1C=CCCCCC1O Amb25779413 [1,0,0,1,0,0|0,0,2]=4 1118 B11R1.26 CCC1CNCCCCN1C Amb25131255 [1,0,0,1,0,0|2,0,0]=4 1119 B11R1.26 CC[C@@H]1C=CCCCC[C@@H]1O Amb24515203 [1,0,0,1,0,0|0,0,2]=4 1120 B11R1.26 CC[C@@H]1C=CCCCC[C@H]1O Amb25332502 [1,0,0,1,0,0|0,0,2]=4 1121 B11R1.26 CC[C@H]1C=CCCCC[C@@H]1O Amb24600934 [1,0,0,1,0,0|0,0,2]=4 1122 B11R1.26 CN1CCCCCCC1CO Amb24632097 [1,0,0,1,0,0|1,0,0]=3 1123 B11R1.26 CN[C@@H]1CCCCCC[C@H]1O Amb24656105 [1,0,0,1,0,0|1,0,0]=3 1124 B11R1.26 COC1CCCCCCC1F Amb25309265 [1,0,0,1,0,0|2,0,0]=4 1125 B11R1.26 COC1CCCCCCC1I Amb25693588 [1,0,0,1,0,0|2,0,0]=4 1126 B11R1.26 COC1CCCCCCC1N Amb1132998 [1,0,0,1,0,0|2,0,0]=4 1127 B11R1.26 COC1CCCCCCC1O Amb18183277 [1,0,0,1,0,0|1,0,0]=3 1128 B11R1.26 CO[C@@H]1CCCCCC[C@H]1O Amb25176598 [1,0,0,1,0,0|1,0,0]=3 1129 B11R1.26 CSC1CCCCCCC1Cl Amb24677801 [1,0,0,1,0,0|2,0,0]=4 1130 B11R1.26 CSC1CCCCCCC1N Amb25095420 [1,0,0,1,0,0|2,0,0]=4 1131 B11R1.26 CS[C@@H]1CCCCCC[C@H]1N Amb25257916 [1,0,0,1,0,0|2,0,0]=4 1132 B11R1.26 CS[C@H]1CCCCCC[C@@H]1Cl Amb24617845 [1,0,0,1,0,0|2,0,0]=4 1133 B11R1.26 C\C=C/1\CCCCCCC1O Amb25356293 [1,0,0,1,0,0|0,0,2]=4 1134 B11R1.26 N#CC1CCCCCCC1O Amb25332514 [1,0,0,1,0,0|1,0,1]=4 1135 B11R1.26 NC[C@@H]1CCCCCC[C@@H]1O Amb24656301 [1,0,0,1,0,0|1,0,0]=3 1136 B11R1.26 NNC1CCCCCCC1O Amb24411011 [1,0,0,1,0,0|2,0,0]=4 1137 B11R1.26 NN[C@@H]1CCCCCC[C@H]1O Amb24514796 [1,0,0,1,0,0|2,0,0]=4 1138 B11R1.26 OCC1CCCCCCC1=O Amb25298435 [1,0,0,1,0,0|1,0,1]=4 1139 B11R1.26 OC[C@@H]1CCCCCCC1=O Amb25833647 [1,0,0,1,0,0|1,0,1]=4 1140 B11R1.26 O[C@H]1CCCCCC[C@H]1CO Amb25284276 [1,0,0,1,0,0|1,0,0]=3 1141 B11R1.26 [C-]#[N+]C1CCCCCCC1O Amb25846142 [1,0,0,1,0,0|1,0,1]=4 1142 B11R1.28 BrCCCCC1CCCCC1 Amb21937167 [1,0,0,1,0,0|1,0,0]=3 1143 B11R1.28 BrCCCCC1CCNCC1 Amb10602362 [1,0,0,1,0,0|2,0,0]=4 1144 B11R1.28 BrCCOCC1CCCCC1 Amb24755711 [1,0,0,1,0,0|2,0,0]=4 1145 B11R1.28 C#CCCCC1CCCCC1 Amb24062905 [1,0,0,1,0,0|0,0,2]=4 1146 B11R1.28 C=CCCCC1CCCCC1 Amb24117204 [1,0,0,1,0,0|0,0,2]=4 1147 B11R1.28 CCCCC=C1CCCCC1 Amb24376103 [1,0,0,1,0,0|0,0,2]=4 1148 B11R1.28 CCCCCC1CNCCC1 Amb22642855 [1,0,0,1,0,0|1,0,0]=3 1149 B11R1.28 CCCCCC1CNCCO1 Amb24761722 [1,0,0,1,0,0|1,0,0]=3 1150 B11R1.28 CCCCCN1CCCCC1 Amb10573561 [1,0,0,1,0,0|1,0,0]=3 1151 B11R1.28 CCCCCN1CCNCC1 Amb1995334 [1,0,0,1,0,0|2,0,0]=4 1152 B11R1.28 CCCCCN1CCOCC1 Amb10567809 [1,0,0,1,0,0|2,0,0]=4 1153 B11R1.28 CCCCC[C@@H]1CCCCN1 Amb25380517 [1,0,0,1,0,0|1,0,0]=3 1154 B11R1.28 CCCCN=C1CCCCC1 Amb24595996 [1,0,0,1,0,0|1,0,1]=4 1155 B11R1.28 CCCCNC1CCNCC1 Amb18304906 [1,0,0,1,0,0|2,0,0]=4 1156 B11R1.28 CCCCNC1CNCCC1 Amb18182153 [1,0,0,1,0,0|2,0,0]=4 1157 B11R1.28 CCCCNC1COCCC1 Amb25385885 [1,0,0,1,0,0|2,0,0]=4 1158 B11R1.28 CCCCNC1CSCCC1 Amb18315275 [1,0,0,1,0,0|2,0,0]=4 1159 B11R1.28 CCCCOC1CCNCC1 Amb21954600 [1,0,0,1,0,0|2,0,0]=4 1160 B11R1.28 CCCCSC1CCCCC1 Amb17672783 [1,0,0,1,0,0|1,0,0]=3 1161 B11R1.28 CCCCSC1CCNCC1 Amb17502168 [1,0,0,1,0,0|2,0,0]=4 1162 B11R1.28 CCCCSC1CCOCC1 Amb24755873 [1,0,0,1,0,0|2,0,0]=4 1163 B11R1.28 CCCCSC1CNCCC1 Amb18803882 [1,0,0,1,0,0|2,0,0]=4 1164 B11R1.28 CCCCSC1COCCC1 Amb24755869 [1,0,0,1,0,0|2,0,0]=4 1165 B11R1.28 CCCNCC1CCCCC1 Amb1042518 [1,0,0,1,0,0|1,0,0]=3 1166 B11R1.28 CCCNCC1CCCCC1 Amb2119490 [1,0,0,1,0,0|1,0,0]=3 1167 B11R1.28 CCCNCC1CCCCN1 Amb18305259 [1,0,0,1,0,0|2,0,0]=4 1168 B11R1.28 CCCNCC1CCCCS1 Amb24754590 [1,0,0,1,0,0|1,1,0]=4 1169 B11R1.28 CCCNCC1CCCNC1 Amb17232186 [1,0,0,1,0,0|2,0,0]=4 1170 B11R1.28 CCCNCC1CCNCC1 Amb17232180 [1,0,0,1,0,0|2,0,0]=4 1171 B11R1.28 CCCNCC1CCOCC1 Amb18305890 [1,0,0,1,0,0|2,0,0]=4 1172 B11R1.28 CCCNCC1CCOCO1 Amb24755261 [1,0,0,1,0,0|2,0,0]=4 1173 B11R1.28 CCCNCC1CNCCO1 Amb18799973 [1,0,0,1,0,0|2,0,0]=4 1174 B11R1.28 CCCNCC1COCCC1 Amb19008394 [1,0,0,1,0,0|2,0,0]=4 1175 B11R1.28 CCCNCC1COCCO1 Amb19012809 [1,0,0,1,0,0|2,0,0]=4 1176 B11R1.28 CCCNCC1OCCCO1 Amb24755512 [1,0,0,1,0,0|2,0,0]=4 1177 B11R1.28 CCCOCC1CCCCN1 Amb18797153 [1,0,0,1,0,0|2,0,0]=4 1178 B11R1.28 CCCOCC1CCNCC1 Amb2171583 [1,0,0,1,0,0|2,0,0]=4 1179 B11R1.28 CCCOCC1CNCCC1 Amb18797152 [1,0,0,1,0,0|2,0,0]=4 1180 B11R1.28 CCCSCC1CCCCN1 Amb18803880 [1,0,0,1,0,0|2,0,0]=4 1181 B11R1.28 CCCSCC1CCNCC1 Amb18803881 [1,0,0,1,0,0|2,0,0]=4 1182 B11R1.28 CCCSCC1CNCCC1 Amb18183806 [1,0,0,1,0,0|2,0,0]=4 1183 B11R1.28 CCNCCC1CCCCO1 Amb18312531 [1,0,0,1,0,0|1,0,0]=3 1184 B11R1.28 CCNCCC1CCNCC1 Amb18305123 [1,0,0,1,0,0|2,0,0]=4 1185 B11R1.28 CCNCCC1CCOCC1 Amb19025192 [1,0,0,1,0,0|2,0,0]=4 1186 B11R1.28 CCNCCC1CCSCC1 Amb24755585 [1,0,0,1,0,0|2,0,0]=4 1187 B11R1.28 CCNCCC1CNCCC1 Amb18313379 [1,0,0,1,0,0|2,0,0]=4 1188 B11R1.28 CCNCCC1COCCC1 Amb22411363 [1,0,0,1,0,0|2,0,0]=4 1189 B11R1.28 CCNCCN1CCCCC1 Amb13949073 [1,0,0,1,0,0|2,0,0]=4 1190 B11R1.28 CCOCCC1CCCCN1 Amb17773408 [1,0,0,1,0,0|2,0,0]=4 1191 B11R1.28 CCOCCC1CCCCN1 Amb21955088 [1,0,0,1,0,0|2,0,0]=4 1192 B11R1.28 CCOCCC1CCNCC1 Amb21955112 [1,0,0,1,0,0|2,0,0]=4 1193 B11R1.28 CCOCCC1CNCCC1 Amb19020994 [1,0,0,1,0,0|2,0,0]=4 1194 B11R1.28 CCOCCC1CNCCC1 Amb21955086 [1,0,0,1,0,0|2,0,0]=4 1195 B11R1.28 CCOCSC1CCCCC1 Amb25380608 [1,0,0,1,0,0|2,0,0]=4 1196 B11R1.28 CCSCCC1CCCCC1 Amb24762472 [1,0,0,1,0,0|1,0,0]=3 1197 B11R1.28 CCSCCC1CCCCN1 Amb17503513 [1,0,0,1,0,0|2,0,0]=4 1198 B11R1.28 CCSCCC1CCNCC1 Amb22395684 [1,0,0,1,0,0|2,0,0]=4 1199 B11R1.28 CCSCCC1CNCCC1 Amb18308556 [1,0,0,1,0,0|2,0,0]=4 1200 B11R1.28 CCSCSC1CCCCC1 Amb25380609 [1,0,0,1,0,0|2,0,0]=4 1201 B11R1.28 CNCCCC1CCCCN1 Amb18799769 [1,0,0,1,0,0|2,0,0]=4 1202 B11R1.28 CNCCCC1CCNCC1 Amb18799768 [1,0,0,1,0,0|2,0,0]=4 1203 B11R1.28 CNCCCC1CCOCC1 Amb19025801 [1,0,0,1,0,0|2,0,0]=4 1204 B11R1.28 CNCCCC1CNCCC1 Amb18182155 [1,0,0,1,0,0|2,0,0]=4 1205 B11R1.28 CNCCCN1CCCCC1 Amb24066849 [1,0,0,1,0,0|2,0,0]=4 1206 B11R1.28 CNCCOC1CCCCC1 Amb19024814 [1,0,0,1,0,0|2,0,0]=4 1207 B11R1.28 CNCCSC1CCCCC1 Amb19024678 [1,0,0,1,0,0|2,0,0]=4 1208 B11R1.28 CNNCCC1CCCCC1 Amb24765917 [1,0,0,1,0,0|2,0,0]=4 1209 B11R1.28 COCCCC1CCNCC1 Amb10607554 [1,0,0,1,0,0|2,0,0]=4 1210 B11R1.28 COCCCN1CCCCC1 Amb17232232 [1,0,0,1,0,0|2,0,0]=4 1211 B11R1.28 COCCSC1CCCCC1 Amb25382914 [1,0,0,1,0,0|2,0,0]=4 1212 B11R1.28 CONCCC1CCCCC1 Amb25381674 [1,0,0,1,0,0|2,0,0]=4 1213 B11R1.28 CONCCC1CCCCO1 Amb24762428 [1,0,0,1,0,0|2,0,0]=4 1214 B11R1.28 CSCCNC1CCCCC1 Amb18311192 [1,0,0,1,0,0|2,0,0]=4 1215 B11R1.28 C[NH2+]CCCC1CCCCC1 Amb20648432 [1,0,0,1,0,0|1,0,0]=3 1216 B11R1.28 ClCCCCC1CCNCC1 Amb24764805 [1,0,0,1,0,0|2,0,0]=4 1217 B11R1.28 ClCCCCN1CCCCC1 Amb17335097 [1,0,0,1,0,0|2,0,0]=4 1218 B11R1.28 ClCCNCC1CCCCC1 Amb24754670 [1,0,0,1,0,0|2,0,0]=4 1219 B11R1.28 ClCCOCC1CCCCC1 Amb18804619 [1,0,0,1,0,0|2,0,0]=4 1220 B11R1.28 Cl[Mg]CCCC1CCCCC1 Amb22897279 [1,0,0,1,0,0|2,0,0]=4 1221 B11R1.28 Cl[Zn]CCCC1CCCCC1 Amb22897737 [1,0,0,1,0,0|2,0,0]=4 1222 B11R1.28 FCCNCC1CCCCC1 Amb24764693 [1,0,0,1,0,0|2,0,0]=4 1223 B11R1.28 ICCCNC1CCCCC1 Amb25380340 [1,0,0,1,0,0|2,0,0]=4 1224 B11R1.28 ICCCOC1CCCCC1 Amb25383779 [1,0,0,1,0,0|2,0,0]=4 1225 B11R1.28 ICCCOC1CCCCO1 Amb24761942 [1,0,0,1,0,0|2,0,0]=4 1226 B11R1.28 NCCCCC1CCCCC1 Amb17570025 [1,0,0,1,0,0|1,0,0]=3 1227 B11R1.28 NCCCCC1CCNCC1 Amb10071400 [1,0,0,1,0,0|2,0,0]=4 1228 B11R1.28 NCCCCN1CCCCC1 Amb1094595 [1,0,0,1,0,0|2,0,0]=4 1229 B11R1.28 NCCCOC1CCCCC1 Amb1154583 [1,0,0,1,0,0|2,0,0]=4 1230 B11R1.28 NCCCPC1CCCCC1 Amb25380512 [1,0,0,1,0,0|2,0,0]=4 1231 B11R1.28 NCCCSC1CCCCC1 Amb10608281 [1,0,0,1,0,0|2,0,0]=4 1232 B11R1.28 NCCCSC1CCCCC1 Amb21984186 [1,0,0,1,0,0|2,0,0]=4 1233 B11R1.28 NCCNCC1CCCCC1 Amb19012722 [1,0,0,1,0,0|2,0,0]=4 1234 B11R1.28 NCCNCC1CCCCO1 Amb19014581 [1,0,0,1,0,0|2,0,0]=4 1235 B11R1.28 NCCOCC1CCCCC1 Amb19033755 [1,0,0,1,0,0|2,0,0]=4 1236 B11R1.28 O=CCCCC1CCCCO1 Amb25385814 [1,0,0,1,0,0|1,0,1]=4 1237 B11R1.28 OCC#CCC1CCCCC1 Amb25044812 [1,0,0,1,0,0|0,0,2]=4 1238 B11R1.28 OCCC#CC1CCCCC1 Amb24686695 [1,0,0,1,0,0|0,0,2]=4 1239 B11R1.28 OCCCCC1CCCCN1 Amb22749320 [1,0,0,1,0,0|1,0,0]=3 1240 B11R1.28 OCCCCC1CCNCC1 Amb21858465 [1,0,0,1,0,0|1,0,0]=3 1241 B11R1.28 OCCCCC1CCNCC1 Amb21858466 [1,0,0,1,0,0|1,0,0]=3 1242 B11R1.28 OCCCCC1CCOCC1 Amb24750759 [1,0,0,1,0,0|1,0,0]=3 1243 B11R1.28 OCCCCC1CNCCC1 Amb22749319 [1,0,0,1,0,0|1,0,0]=3 1244 B11R1.28 OCCCCN1CCCCC1 Amb21955136 [1,0,0,1,0,0|1,0,0]=3 1245 B11R1.28 OCCCCN1CCCCO1 Amb24750658 [1,0,0,1,0,0|2,0,0]=4 1246 B11R1.28 OCCCNC1CCNCC1 Amb19008330 [1,0,0,1,0,0|2,0,0]=4 1247 B11R1.28 OCCCNC1CNCCC1 Amb18182377 [1,0,0,1,0,0|2,0,0]=4 1248 B11R1.28 OCCCNC1CSCCC1 Amb18315273 [1,0,0,1,0,0|2,0,0]=4 1249 B11R1.28 OCCCOC1CCCCO1 Amb25383986 [1,0,0,1,0,0|2,0,0]=4 1250 B11R1.28 OCCCOC1CCOCC1 Amb18177686 [1,0,0,1,0,0|2,0,0]=4 1251 B11R1.28 OCCCOC1CCSCC1 Amb24750428 [1,0,0,1,0,0|2,0,0]=4 1252 B11R1.28 OCCCOC1CNCCC1 Amb18797515 [1,0,0,1,0,0|2,0,0]=4 1253 B11R1.28 OCCCO[C@@H]1CNCCC1 Amb25379547 [1,0,0,1,0,0|2,0,0]=4 1254 B11R1.28 OCCCSC1CCCCC1 Amb18795506 [1,0,0,1,0,0|1,0,0]=3 1255 B11R1.28 OCCCSC1CCNCC1 Amb17502190 [1,0,0,1,0,0|2,0,0]=4 1256 B11R1.28 OCCCSC1CCOCC1 Amb18178321 [1,0,0,1,0,0|2,0,0]=4 1257 B11R1.28 OCCN=NC1CCCCC1 Amb24533620 [1,0,0,1,0,0|2,0,0]=4 1258 B11R1.28 OCCNCC1CCCCC1 Amb2119209 [1,0,0,1,0,0|1,0,0]=3 1259 B11R1.28 OCCNCC1CCOCC1 Amb18310605 [1,0,0,1,0,0|2,0,0]=4 1260 B11R1.28 OCCNCC1COCCC1 Amb18792098 [1,0,0,1,0,0|2,0,0]=4 1261 B11R1.28 OCCOCC1CCCCC1 Amb18182365 [1,0,0,1,0,0|1,0,0]=3 1262 B11R1.28 OCCOCC1CCCCO1 Amb18800345 [1,0,0,1,0,0|2,0,0]=4 1263 B11R1.28 OCCOCC1CCOCC1 Amb18182516 [1,0,0,1,0,0|2,0,0]=4 1264 B11R1.28 OCCSCC1CCCCN1 Amb18184000 [1,0,0,1,0,0|2,0,0]=4 1265 B11R1.28 OCCSCC1CCNCC1 Amb18184001 [1,0,0,1,0,0|2,0,0]=4 1266 B11R1.28 OCCSCC1CCOCC1 Amb18804596 [1,0,0,1,0,0|2,0,0]=4 1267 B11R1.28 OCCSCC1CNCCC1 Amb18183999 [1,0,0,1,0,0|2,0,0]=4 1268 B11R1.28 OC\C=C\CC1CCCCC1 Amb25048372 [1,0,0,1,0,0|0,0,2]=4 1269 B11R1.28 SCCNCC1CCCCO1 Amb25386156 [1,0,0,1,0,0|2,0,0]=4 1270 B11R1.41 CCC1CCCCC1C=NO Amb25197569 [1,0,0,1,0,0|1,0,1]=4 1271 B11R1.41 CCC1CCCCC1CC=O Amb25196472 [1,0,0,1,0,0|0,0,2]=4 1272 B11R1.41 CCC1CCCCC1CCC Amb24533062 [1,0,0,1,0,0|0,0,0]=2 1273 B11R1.41 CCC1CCCCC1CCCl Amb24444190 [1,0,0,1,0,0|1,0,0]=3 1274 B11R1.41 CCC1CCCCC1CCN Amb25798044 [1,0,0,1,0,0|1,0,0]=3 1275 B11R1.41 CCC1CCCCC1CNC Amb25264380 [1,0,0,1,0,0|1,0,0]=3 1276 B11R1.41 CCC1CCCCC1CNN Amb25049134 [1,0,0,1,0,0|2,0,0]=4 1277 B11R1.41 CCC1CCCCN1CCBr Amb25374800 [1,0,0,1,0,0|2,0,0]=4 1278 B11R1.41 CCC1CCCCN1CCF Amb25854156 [1,0,0,1,0,0|2,0,0]=4 1279 B11R1.41 CCC1CCCCN1CCI Amb25163152 [1,0,0,1,0,0|2,0,0]=4 1280 B11R1.41 CCC1CNCCC1CCBr Amb24102727 [1,0,0,1,0,0|2,0,0]=4 1281 B11R1.41 CCC1CNCCC1COC Amb25363438 [1,0,0,1,0,0|2,0,0]=4 1282 B11R1.41 CCC1OCCCC1CNC Amb25137396 [1,0,0,1,0,0|2,0,0]=4 1283 B11R1.41 CCCC1CCCCC1C#N Amb24620417 [1,0,0,1,0,0|1,0,1]=4 1284 B11R1.41 CCCC1CCCCC1NC Amb18977610 [1,0,0,1,0,0|1,0,0]=3 1285 B11R1.41 CCCC1CCCCN1CO Amb25345080 [1,0,0,1,0,0|1,0,0]=3 1286 B11R1.41 CCCC1CCNCC1CN Amb25374468 [1,0,0,1,0,0|2,0,0]=4 1287 B11R1.41 CCCC1CCNCC1OC Amb25207881 [1,0,0,1,0,0|2,0,0]=4 1288 B11R1.41 CCCC1CCOCC1CN Amb25350788 [1,0,0,1,0,0|2,0,0]=4 1289 B11R1.41 CCCC1CNCCC1CN Amb25362390 [1,0,0,1,0,0|2,0,0]=4 1290 B11R1.41 CCCC1CNCCC1OC Amb25211913 [1,0,0,1,0,0|2,0,0]=4 1291 B11R1.41 CCCC1OCCCC1CN Amb24538186 [1,0,0,1,0,0|2,0,0]=4 1292 B11R1.41 CCCC1OCCCC1CO Amb25169552 [1,0,0,1,0,0|1,0,0]=3 1293 B11R1.41 CCCN1CCCCC1CBr Amb25741620 [1,0,0,1,0,0|2,0,0]=4 1294 B11R1.41 CCCN1CCCCC1CC Amb10573768 [1,0,0,1,0,0|1,0,0]=3 1295 B11R1.41 CCCN1CCCCC1CO Amb18179768 [1,0,0,1,0,0|1,0,0]=3 1296 B11R1.41 CCCN1CCNCC1CO Amb17578173 [1,0,0,1,0,0|2,0,0]=4 1297 B11R1.41 CCN1CCCCC1CCN Amb18251513 [1,0,0,1,0,0|2,0,0]=4 1298 B11R1.41 CCN1CCCCC1CCO Amb18183195 [1,0,0,1,0,0|1,0,0]=3 1299 B11R1.41 CCNC1CCCCC1CO Amb18126082 [1,0,0,1,0,0|1,0,0]=3 1300 B11R1.41 CCNC1CCOCC1CC Amb25250649 [1,0,0,1,0,0|2,0,0]=4 1301 B11R1.41 CCNC1CCOCC1CO Amb24533065 [1,0,0,1,0,0|2,0,0]=4 1302 B11R1.41 CCN[C@@H]1CCCC[C@H]1CO Amb25201139 [1,0,0,1,0,0|1,0,0]=3 1303 B11R1.41 CCN[C@@H]1CCCC[C@H]1OC Amb24588123 [1,0,0,1,0,0|2,0,0]=4 1304 B11R1.41 CCOC1CCCCC1CO Amb25032591 [1,0,0,1,0,0|1,0,0]=3 1305 B11R1.41 CCOC1CCCCC1NC Amb17606035 [1,0,0,1,0,0|2,0,0]=4 1306 B11R1.41 CCO[C@@H]1CCCC[C@@H]1CO Amb24719718 [1,0,0,1,0,0|1,0,0]=3 1307 B11R1.41 CC[C@@H]1CNCC[C@H]1CCO Amb24594348 [1,0,0,1,0,0|1,0,0]=3 1308 B11R1.41 CC[C@H]1CCCC[C@H]1CCO Amb25285372 [1,0,0,1,0,0|0,0,0]=2 1309 B11R1.41 CNC1CCCCC1CNC Amb25843163 [1,0,0,1,0,0|2,0,0]=4 1310 B11R1.41 CNCC1CCCCC1CN Amb24418974 [1,0,0,1,0,0|2,0,0]=4 1311 B11R1.41 COC1CCCCC1CCBr Amb23538187 [1,0,0,1,0,0|2,0,0]=4 1312 B11R1.41 COC1CCCCC1CCN Amb24538113 [1,0,0,1,0,0|2,0,0]=4 1313 B11R1.41 COC1CCCCC1CCO Amb23538340 [1,0,0,1,0,0|1,0,0]=3 1314 B11R1.41 COC1CNCCC1CCO Amb25350590 [1,0,0,1,0,0|2,0,0]=4 1315 B11R1.41 COCC1CCCCC1CN Amb25331653 [1,0,0,1,0,0|2,0,0]=4 1316 B11R1.41 COCC1CCCCC1CO Amb17593966 [1,0,0,1,0,0|1,0,0]=3 1317 B11R1.41 COC[C@@H]1CCCC[C@@H]1CO Amb24697853 [1,0,0,1,0,0|1,0,0]=3 1318 B11R1.41 COC[C@@H]1CCCC[C@H]1CO Amb17939261 [1,0,0,1,0,0|1,0,0]=3 1319 B11R1.41 CO[C@H]1CCCC[C@H]1CCO Amb24592444 [1,0,0,1,0,0|1,0,0]=3 1320 B11R1.41 ClCCN1CCCCC1CC Amb17335102 [1,0,0,1,0,0|2,0,0]=4 1321 B11R1.41 N#CCC1CCCC[C@@H]1CO Amb24514111 [1,0,0,1,0,0|1,0,1]=4 1322 B11R1.41 NCC1CCCCC1CCN Amb24627871 [1,0,0,1,0,0|2,0,0]=4 1323 B11R1.41 NCC1CCCCN1CCO Amb18294586 [1,0,0,1,0,0|2,0,0]=4 1324 B11R1.41 NCCN1CCCCC1CC Amb1971430 [1,0,0,1,0,0|2,0,0]=4 1325 B11R1.41 OCC1CCCCC1CCO Amb24412084 [1,0,0,1,0,0|1,0,0]=3 1326 B11R1.41 OCC1CCCCN1CCCl Amb18790914 [1,0,0,1,0,0|2,0,0]=4 1327 B11R1.41 OCC1CCCCN1CCF Amb25378550 [1,0,0,1,0,0|2,0,0]=4 1328 B11R1.41 OCC1CCCCN1CCS Amb25769236 [1,0,0,1,0,0|2,0,0]=4 1329 B11R1.41 OCCN1CCCCC1CO Amb18177647 [1,0,0,1,0,0|2,0,0]=4 1330 B11R1.41 OC[C@H]1CCCC[C@H]1CCO Amb25345143 [1,0,0,1,0,0|1,0,0]=3 1331 B11R1.47 OCCNCCCC1CCC1 Amb23570824 [1,0,0,1,0,0|1,0,0]=3 1332 B11R1.51 CCC1CCCCCC1NC Amb18283817 [1,0,0,1,0,0|1,0,0]=3 1333 B11R1.51 CCC1CCNCCC1CN Amb24590352 [1,0,0,1,0,0|2,0,0]=4 1334 B11R1.51 CCC1CNCCCN1CO Amb21955860 [1,0,0,1,0,0|2,0,0]=4 1335 B11R1.51 CCN1CCCCCC1CBr Amb24488215 [1,0,0,1,0,0|2,0,0]=4 1336 B11R1.51 CCN1CCCCCC1CCl Amb25669352 [1,0,0,1,0,0|2,0,0]=4 1337 B11R1.51 CCN1CCCCCC1CN Amb25308610 [1,0,0,1,0,0|2,0,0]=4 1338 B11R1.51 CCN1CCCCCC1CO Amb10817345 [1,0,0,1,0,0|1,0,0]=3 1339 B11R1.51 CNC1CCNCCC1CO Amb24518727 [1,0,0,1,0,0|2,0,0]=4 1340 B11R1.51 CNC1CCOCCC1CO Amb25174741 [1,0,0,1,0,0|2,0,0]=4 1341 B11R1.51 COC1CCCCCC1NC Amb17606040 [1,0,0,1,0,0|2,0,0]=4 1342 B11R1.51 CSC1CCCCCC1CN Amb18281653 [1,0,0,1,0,0|2,0,0]=4 1343 B11R1.51 OCC1CCCCCC1CO Amb24356548 [1,0,0,1,0,0|1,0,0]=3 1344 B11R1.51 OCC1CNCCCN1CC Amb17578175 [1,0,0,1,0,0|2,0,0]=4 1345 B11R1.51 OC[C@@H]1CCCCC[C@@H]1CO Amb22356584 [1,0,0,1,0,0|1,0,0]=3 1346 B11R1.51 OC[C@@H]1CCCCC[C@H]1CCl Amb25179255 [1,0,0,1,0,0|1,0,0]=3 1347 B11R1.51 OC[C@@H]1CCCCC[C@H]1CO Amb24741731 [1,0,0,1,0,0|1,0,0]=3 1348 B11R1.85 C=C1CCCCCCCC1O Amb25769379 [1,0,0,1,0,0|0,0,2]=4 1349 B11R1.85 CC1CCCCCCCC1=O Amb25712223 [1,0,0,1,0,0|0,0,2]=4 1350 B11R1.85 NC1CCCCCCCC1O Amb24392239 [1,0,0,1,0,0|1,0,0]=3 1351 B11R1.85 N[C@@H]1CCCCCCC[C@H]1O Amb24589620 [1,0,0,1,0,0|1,0,0]=3 1352 B11R1.85 N[C@H]1CCCCCCC[C@H]1O Amb25179160 [1,0,0,1,0,0|1,0,0]=3 1353 B11R1.92 C1CCCCCCCCCC1 Amb25060085 [1,0,0,1,0,0|0,0,0]=2 1354 B11R1.92 C1OCCCCCCCCO1 Amb24434714 [1,0,0,1,0,0|1,0,0]=3 1355 B11R1.99 C=CCCCCCC[C@@H]1CO1 Amb22367014 [1,0,0,1,0,0|0,0,2]=4 1356 B11R1.99 CCCCCCCCC1CO1 Amb17771534 [1,0,0,1,0,0|0,0,0]=2 1357 B11R1.99 CCCCCCCC[C@H]1CS1 Amb22366998 [1,0,0,1,0,0|0,1,0]=3 1358 B11R1.99 CCCCCCOC[C@H]1CO1 Amb22388620 [1,0,0,1,0,0|1,0,0]=3 1359 B11R1.99 CCCCCNCCC1CC1 Amb23570765 [1,0,0,1,0,0|1,0,0]=3 1360 B11R1.99 COCCCCNCC1CC1 Amb18183213 [1,0,0,1,0,0|2,0,0]=4 1361 B11R1.99 COCCCNCCC1CC1 Amb23570758 [1,0,0,1,0,0|2,0,0]=4 1362 B11R1.101 CN1CCCCNCCCC1 Amb18200074 [1,0,0,1,0,0|2,0,0]=4 1363 B11R1.101 CN1CCNCCCCCC1 Amb25102538 [1,0,0,1,0,0|2,0,0]=4 1364 B11R1.101 C[C@H]1CNCCCCCCC1 Amb24415300 [1,0,0,1,0,0|1,0,0]=3 1365 B11R1.101 NC1CCCCCCCCC1 Amb17593887 [1,0,0,1,0,0|1,0,0]=3 1366 B11R1.101 OC1CC=CCCCCCC1 Amb24473368 [1,0,0,1,0,0|0,0,2]=4 1367 B11R1.101 OC1CCC#CCCCCC1 Amb25099391 [1,0,0,1,0,0|0,0,2]=4 1368 B11R1.101 OC1CCCCCCCC#C1 Amb25332277 [1,0,0,1,0,0|0,0,2]=4 1369 B11R1.101 OC1CCCCCCCCC1 Amb22008249 [1,0,0,1,0,0|0,0,0]=2 1370 B11R1.101 OC1CCCCCNCCC1 Amb25858834 [1,0,0,1,0,0|1,0,0]=3 1371 B11R1.109 CCCC1CCCC1CNC Amb24762105 [1,0,0,1,0,0|1,0,0]=3 1372 B11R1.109 CCCC1CCCN1CCN Amb18126029 [1,0,0,1,0,0|2,0,0]=4 1373 B11R1.109 CCCC1NCCC1CCO Amb25385582 [1,0,0,1,0,0|1,0,0]=3 1374 B11R1.109 CCNC1CCCC1CCC Amb19013823 [1,0,0,1,0,0|1,0,0]=3 1375 B11R1.109 CCNC1CCCC1OCC Amb17606031 [1,0,0,1,0,0|2,0,0]=4 1376 B11R1.109 CCNC1CSCC1CCC Amb24755616 [1,0,0,1,0,0|2,0,0]=4 1377 B11R1.109 CNCC1CCCC1COC Amb24762104 [1,0,0,1,0,0|2,0,0]=4 1378 B11R1.109 COCC1CCCN1CCO Amb21861106 [1,0,0,1,0,0|2,0,0]=4 1379 B11R1.109 COC[C@@H]1CCCN1CCO Amb22228048 [1,0,0,1,0,0|2,0,0]=4 1380 B11R1.109 ClCC[C@H]1CCC[C@@H]1CCCl Amb25384922 [1,0,0,1,0,0|2,0,0]=4 1381 B11R1.109 NCC[C@@H]1CCC[C@@H]1CCN Amb24764682 [1,0,0,1,0,0|2,0,0]=4 1382 B11R1.109 NCC[C@H]1CCC[C@@H]1CCN Amb24764587 [1,0,0,1,0,0|2,0,0]=4 1383 B11R1.109 OCC[C@H]1CCC[C@@H]1CCO Amb25384779 [1,0,0,1,0,0|1,0,0]=3 1384 B11R1.109 OCC[C@H]1CNC[C@@H]1CCO Amb25386400 [1,0,0,1,0,0|2,0,0]=4 1385 B11R1.117 BrCCN1CCCCCCC1 Amb25826441 [1,0,0,1,0,0|2,0,0]=4 1386 B11R1.117 CCCN1CCCNCCC1 Amb18283143 [1,0,0,1,0,0|2,0,0]=4 1387 B11R1.117 CNCC1CCCCCCC1 Amb19149347 [1,0,0,1,0,0|1,0,0]=3 1388 B11R1.117 CONC1CCCCCCC1 Amb24725831 [1,0,0,1,0,0|2,0,0]=4 1389 B11R1.117 ClCCN1CCCCCCC1 Amb18790727 [1,0,0,1,0,0|2,0,0]=4 1390 B11R1.117 ClCOC1CCCCCCC1 Amb24487812 [1,0,0,1,0,0|2,0,0]=4 1391 B11R1.117 FCCN1CCCCCCC1 Amb24484076 [1,0,0,1,0,0|2,0,0]=4 1392 B11R1.117 NCCC1CCCCCCC1 Amb10607690 [1,0,0,1,0,0|1,0,0]=3 1393 B11R1.117 O=CCC1CCCCCCC1 Amb24382615 [1,0,0,1,0,0|0,0,2]=4 1394 B11R1.117 OCC=C1CCCCCCC1 Amb24687945 [1,0,0,1,0,0|0,0,2]=4 1395 B11R1.117 OCCC1CCCCCC=C1 Amb24475566 [1,0,0,1,0,0|0,0,2]=4 1396 B11R1.117 OCCC1CCCCCCC1 Amb25145747 [1,0,0,1,0,0|0,0,0]=2 1397 B11R1.117 OCCC=1CCCCCCC1 Amb24439590 [1,0,0,1,0,0|0,0,2]=4 1398 B11R1.117 OCCN1CCCNCCC1 Amb25828514 [1,0,0,1,0,0|2,0,0]=4 1399 B11R1.117 ON=CC1CCCCCCC1 Amb24674392 [1,0,0,1,0,0|1,0,1]=4 1400 B11R1.180 C=CCCCC1CCCC1O Amb24762973 [1,0,0,1,0,0|0,0,2]=4 1401 B11R1.180 CC1CCCC1NCCCC Amb24751230 [1,0,0,1,0,0|1,0,0]=3 1402 B11R1.180 CC1CCCC1NCCCN Amb24754665 [1,0,0,1,0,0|2,0,0]=4 1403 B11R1.180 CC1CCCC1NCCCO Amb24750431 [1,0,0,1,0,0|1,0,0]=3 1404 B11R1.180 CC1CCCC1NCCOC Amb24271165 [1,0,0,1,0,0|2,0,0]=4 1405 B11R1.180 CC1CCCN1CCCCCl Amb18184021 [1,0,0,1,0,0|2,0,0]=4 1406 B11R1.180 CC1CCCN1CCCCN Amb19006748 [1,0,0,1,0,0|2,0,0]=4 1407 B11R1.180 CC1CCCN1CCCCO Amb18179762 [1,0,0,1,0,0|1,0,0]=3 1408 B11R1.180 CC1OCCC1SCCCC Amb24755872 [1,0,0,1,0,0|2,0,0]=4 1409 B11R1.180 CC1SCCC1NCCCC Amb25380096 [1,0,0,1,0,0|2,0,0]=4 1410 B11R1.180 CC1SCCC1NCCCO Amb25380098 [1,0,0,1,0,0|2,0,0]=4 1411 B11R1.180 CCC#CCC1CCCC1O Amb24403808 [1,0,0,1,0,0|0,0,2]=4 1412 B11R1.180 CCC#CC[C@@H]1CCC[C@H]1O Amb24661218 [1,0,0,1,0,0|0,0,2]=4 1413 B11R1.180 CCCCCC1=CCCC1O Amb25386087 [1,0,0,1,0,0|0,0,2]=4 1414 B11R1.180 CCCCCC1CCCC1N Amb19015844 [1,0,0,1,0,0|1,0,0]=3 1415 B11R1.180 CCCCCC1CCCC1O Amb18183110 [1,0,0,1,0,0|0,0,0]=2 1416 B11R1.180 CCCCCC1COCC1Cl Amb25383437 [1,0,0,1,0,0|2,0,0]=4 1417 B11R1.180 CCCCCC1CSCC1Br Amb24755620 [1,0,0,1,0,0|2,0,0]=4 1418 B11R1.180 CCCCCC1CSCC1Cl Amb24755629 [1,0,0,1,0,0|2,0,0]=4 1419 B11R1.180 CCCCCC1CSCC1N Amb24755614 [1,0,0,1,0,0|2,0,0]=4 1420 B11R1.180 CCCCCC1CSCC1O Amb24755618 [1,0,0,1,0,0|1,0,0]=3 1421 B11R1.180 CCCCCC1OCCC1Cl Amb25386319 [1,0,0,1,0,0|2,0,0]=4 1422 B11R1.180 CCCCC[C@@H]1CCCC1=O Amb24766745 [1,0,0,1,0,0|0,0,2]=4 1423 B11R1.180 CCCCC[C@H]1CCCC1=O Amb24766930 [1,0,0,1,0,0|0,0,2]=4 1424 B11R1.180 CCCCNC1CCCC1N Amb23559214 [1,0,0,1,0,0|2,0,0]=4 1425 B11R1.180 CCCCNC1CCCC1O Amb18303638 [1,0,0,1,0,0|1,0,0]=3 1426 B11R1.180 CCCCNC1COCC1O Amb19006705 [1,0,0,1,0,0|2,0,0]=4 1427 B11R1.180 CCCCOC1CCCC1Br Amb24761922 [1,0,0,1,0,0|2,0,0]=4 1428 B11R1.180 CCCCOC1CCCC1O Amb18799957 [1,0,0,1,0,0|1,0,0]=3 1429 B11R1.180 CCCCO[C@@H]1OCC[C@H]1O Amb25384786 [1,0,0,1,0,0|2,0,0]=4 1430 B11R1.180 CCCCSC1CCCC1O Amb18180458 [1,0,0,1,0,0|1,0,0]=3 1431 B11R1.180 CCCCS[C@@H]1CCC[C@H]1O Amb25382577 [1,0,0,1,0,0|1,0,0]=3 1432 B11R1.180 CCCC\C=C/1\CCCC1O Amb25206589 [1,0,0,1,0,0|0,0,2]=4 1433 B11R1.180 CCCSCC1CNCC1O Amb25385846 [1,0,0,1,0,0|2,0,0]=4 1434 B11R1.180 CCNCCN1CCCC1C Amb19024682 [1,0,0,1,0,0|2,0,0]=4 1435 B11R1.180 CCOCCC1CCCC1Cl Amb18186040 [1,0,0,1,0,0|2,0,0]=4 1436 B11R1.180 CCOCCC1CCCC1N Amb18314692 [1,0,0,1,0,0|2,0,0]=4 1437 B11R1.180 CCOCCC1CCCC1O Amb18183285 [1,0,0,1,0,0|1,0,0]=3 1438 B11R1.180 CCOCCC1CSCC1O Amb24755625 [1,0,0,1,0,0|2,0,0]=4 1439 B11R1.180 CC\C=C/CC1CCCC1O Amb25123974 [1,0,0,1,0,0|0,0,2]=4 1440 B11R1.180 CN1CCCC1CCCCO Amb24750381 [1,0,0,1,0,0|1,0,0]=3 1441 B11R1.180 CN1CCCC1CNCCO Amb21860733 [1,0,0,1,0,0|2,0,0]=4 1442 B11R1.180 CN1CCCC1COCCO Amb21860576 [1,0,0,1,0,0|2,0,0]=4 1443 B11R1.180 CN1CCC[C@H]1CNCCO Amb22228398 [1,0,0,1,0,0|2,0,0]=4 1444 B11R1.180 CNCCCC1CCCN1C Amb23541770 [1,0,0,1,0,0|2,0,0]=4 1445 B11R1.180 CNCCCN1CCCC1C Amb19024683 [1,0,0,1,0,0|2,0,0]=4 1446 B11R1.180 COCCCC1CCCC1Cl Amb18808937 [1,0,0,1,0,0|2,0,0]=4 1447 B11R1.180 COCCCC1CCCC1N Amb19015843 [1,0,0,1,0,0|2,0,0]=4 1448 B11R1.180 COCCCC1CCCC1O Amb18183284 [1,0,0,1,0,0|1,0,0]=3 1449 B11R1.180 COCCCC1CSCC1O Amb24755635 [1,0,0,1,0,0|2,0,0]=4 1450 B11R1.180 COCCNC1CCCC1O Amb19004850 [1,0,0,1,0,0|2,0,0]=4 1451 B11R1.180 COCCOC1CCCC1O Amb18183403 [1,0,0,1,0,0|2,0,0]=4 1452 B11R1.180 COCCSC1CCCC1O Amb18795857 [1,0,0,1,0,0|2,0,0]=4 1453 B11R1.180 COCCS[C@@H]1CCC[C@H]1O Amb25382578 [1,0,0,1,0,0|2,0,0]=4 1454 B11R1.180 NC1CCCC1OCCCO Amb25379527 [1,0,0,1,0,0|2,0,0]=4 1455 B11R1.180 NCCCNC1CCCC1O Amb18183300 [1,0,0,1,0,0|2,0,0]=4 1456 B11R1.180 NCCNCC1CCCC1O Amb25379709 [1,0,0,1,0,0|2,0,0]=4 1457 B11R1.180 OC1CCCC1CCCC=O Amb25383522 [1,0,0,1,0,0|1,0,1]=4 1458 B11R1.180 OC1CCCC1NCCCF Amb24755099 [1,0,0,1,0,0|2,0,0]=4 1459 B11R1.180 OC1CCCC1NCCCO Amb18303311 [1,0,0,1,0,0|2,0,0]=4 1460 B11R1.180 OC1CSCC1CCCCO Amb24755626 [1,0,0,1,0,0|2,0,0]=4 1461 B11R1.180 O[C@@H]1CCC[C@H]1SCCCO Amb25382579 [1,0,0,1,0,0|2,0,0]=4 1462 B11R1.203 BrCCCC1CCCCCC1 Amb25836156 [1,0,0,1,0,0|1,0,0]=3 1463 B11R1.203 BrCCCN1CCCCCC1 Amb10608791 [1,0,0,1,0,0|2,0,0]=4 1464 B11R1.203 CCCCC1CCCCCN1 Amb2235485 [1,0,0,1,0,0|1,0,0]=3 1465 B11R1.203 CCCCC1COCCCN1 Amb18624996 [1,0,0,1,0,0|2,0,0]=4 1466 B11R1.203 CCCCN1CCCCCC1 Amb22347751 [1,0,0,1,0,0|1,0,0]=3 1467 B11R1.203 CCCCN1CCCOCC1 Amb24415531 [1,0,0,1,0,0|2,0,0]=4 1468 B11R1.203 CCCCN1CCCSCC1 Amb25269005 [1,0,0,1,0,0|2,0,0]=4 1469 B11R1.203 CCCCN1CCNCCC1 Amb1141433 [1,0,0,1,0,0|2,0,0]=4 1470 B11R1.203 CCCNC1CCCCCC1 Amb22587063 [1,0,0,1,0,0|1,0,0]=3 1471 B11R1.203 CCCNC1CCCOCC1 Amb25834501 [1,0,0,1,0,0|2,0,0]=4 1472 B11R1.203 CCCNC1CNCCCC1 Amb18299873 [1,0,0,1,0,0|2,0,0]=4 1473 B11R1.203 CCCOC1CCCNCC1 Amb19514939 [1,0,0,1,0,0|2,0,0]=4 1474 B11R1.203 CCNCC1CCCCCC1 Amb18299570 [1,0,0,1,0,0|1,0,0]=3 1475 B11R1.203 CCNCC1CCCCCN1 Amb24615052 [1,0,0,1,0,0|2,0,0]=4 1476 B11R1.203 CCOCC1CCCCCN1 Amb25683028 [1,0,0,1,0,0|2,0,0]=4 1477 B11R1.203 CCOCC1CNCCCC1 Amb24714984 [1,0,0,1,0,0|2,0,0]=4 1478 B11R1.203 CCOCC1CNCCCO1 Amb25068732 [1,0,0,1,0,0|2,0,0]=4 1479 B11R1.203 CCONC1CCCCCC1 Amb24406516 [1,0,0,1,0,0|2,0,0]=4 1480 B11R1.203 CNCCC1CNCCCC1 Amb25377494 [1,0,0,1,0,0|2,0,0]=4 1481 B11R1.203 CNCCN1CCCCCC1 Amb22586828 [1,0,0,1,0,0|2,0,0]=4 1482 B11R1.203 CSCCC1CCCCCN1 Amb24394678 [1,0,0,1,0,0|2,0,0]=4 1483 B11R1.203 CSCCC1CNCCCC1 Amb25787457 [1,0,0,1,0,0|2,0,0]=4 1484 B11R1.203 CSCCN1CCCCCC1 Amb25329259 [1,0,0,1,0,0|2,0,0]=4 1485 B11R1.203 ClCCCN1CCCCCC1 Amb17335099 [1,0,0,1,0,0|2,0,0]=4 1486 B11R1.203 ClCCNC1CCCCCC1 Amb17335094 [1,0,0,1,0,0|2,0,0]=4 1487 B11R1.203 ClCCOC1CCCCCC1 Amb18795877 [1,0,0,1,0,0|2,0,0]=4 1488 B11R1.203 ClCCOC1CCCCCO1 Amb24366502 [1,0,0,1,0,0|2,0,0]=4 1489 B11R1.203 ClCCSC1CCCCCC1 Amb25109943 [1,0,0,1,0,0|2,0,0]=4 1490 B11R1.203 Cl[Zn]CCC1CCCCCC1 Amb22897735 [1,0,0,1,0,0|2,0,0]=4 1491 B11R1.203 FCCCC1CNCCCC1 Amb24687640 [1,0,0,1,0,0|2,0,0]=4 1492 B11R1.203 FCCCN1CCCCCC1 Amb25189645 [1,0,0,1,0,0|2,0,0]=4 1493 B11R1.203 NCCCC1CCCCCC1 Amb25113900 [1,0,0,1,0,0|1,0,0]=3 1494 B11R1.203 NCCCC1CCCCCN1 Amb24511786 [1,0,0,1,0,0|2,0,0]=4 1495 B11R1.203 NCCCC1CNCCCC1 Amb24511784 [1,0,0,1,0,0|2,0,0]=4 1496 B11R1.203 NCCCN1CCCCCC1 Amb1154115 [1,0,0,1,0,0|2,0,0]=4 1497 B11R1.203 NCCNC1CCCCCC1 Amb17091047 [1,0,0,1,0,0|2,0,0]=4 1498 B11R1.203 NCCOC1CCCCCC1 Amb18290053 [1,0,0,1,0,0|2,0,0]=4 1499 B11R1.203 NCCSC1CCCCCC1 Amb24392577 [1,0,0,1,0,0|2,0,0]=4 1500 B11R1.203 OCCCC1CCCCC=C1 Amb24355173 [1,0,0,1,0,0|0,0,2]=4 1501 B11R1.203 OCCCC1CCCCCN1 Amb18199937 [1,0,0,1,0,0|1,0,0]=3 1502 B11R1.203 OCCCC1CCCNCC1 Amb23453247 [1,0,0,1,0,0|1,0,0]=3 1503 B11R1.203 OCCCC=1CCCCCC1 Amb24638137 [1,0,0,1,0,0|0,0,2]=4 1504 B11R1.203 OCCCN1CCCOCC1 Amb18800144 [1,0,0,1,0,0|2,0,0]=4 1505 B11R1.203 OCCCN1CCCSCC1 Amb18790691 [1,0,0,1,0,0|2,0,0]=4 1506 B11R1.203 OCCNC1CCCNCC1 Amb25758077 [1,0,0,1,0,0|2,0,0]=4 1507 B11R1.203 OCCOC1CCCCCC1 Amb18799958 [1,0,0,1,0,0|1,0,0]=3 1508 B11R1.203 OCCOC1CCCNCC1 Amb24400319 [1,0,0,1,0,0|2,0,0]=4 1509 B11R1.203 OCCOC1CNCCCC1 Amb25277658 [1,0,0,1,0,0|2,0,0]=4 1510 B11R1.248 BrCC1CCCCCCCC1 Amb25780640 [1,0,0,1,0,0|1,0,0]=3 1511 B11R1.248 OCC1CCCCCCC#C1 Amb25263018 [1,0,0,1,0,0|0,0,2]=4 1512 B11R1.248 OCC1CCCCCCCC1 Amb25083477 [1,0,0,1,0,0|0,0,0]=2 1513 B13R1.6 CC1CCCC(C1)CCCCCC Amb22229365 [0,1,0,1,0,0|1,0,0]=3 1514 B13R1.6 CC1CCCC(CNCCCC)N1 Amb20090355 [0,1,0,1,0,0|2,0,0]=4 1515 B13R1.6 CCCCC#CC1CCCC(O)O1 Amb25098655 [0,1,0,1,0,0|0,0,2]=4 1516 B13R1.42 CC(CCC)NCC1CCCCC1 Amb22587064 [0,1,0,1,0,0|2,0,0]=4 1517 B13R1.42 CCCC(=O)OCC1CCCCO1 Amb22831146 [0,1,0,1,0,0|1,0,1]=4 1518 B13R1.42 CN(CCO)CCC1CCCCN1 Amb21957950 [0,1,0,1,0,0|2,0,0]=4 1519 B13R1.42 CN(CCO)CCC1CCNCC1 Amb21958012 [0,1,0,1,0,0|2,0,0]=4 1520 B13R1.42 CN(CCO)CCC1CNCCC1 Amb21957980 [0,1,0,1,0,0|2,0,0]=4 1521 B13R1.119 CCCCCCCCC1OCCO1 Amb22364938 [0,1,0,1,0,0|0,0,0]=2 1522 B13R1.119 CCCCCCNCC1OCCO1 Amb25757018 [0,1,0,1,0,0|1,0,0]=3 1523 B13R1.119 CCCCCC\C=C\C1OCCO1 Amb25703092 [0,1,0,1,0,0|0,0,2]=4 1524 B13R1.119 CCCNCCNCC1CCCO1 Amb19076056 [0,1,0,1,0,0|1,0,0]=3 1525 B13R1.119 CCNCCCNCC1CCCO1 Amb19058771 [0,1,0,1,0,0|1,0,0]=3 1526 B13R1.119 CCOCCSCCC1OCCO1 Amb24449364 [0,1,0,1,0,0|2,0,0]=4 1527 B13R1.119 CC\C=C/CCCCC1OCCO1 Amb25069949 [0,1,0,1,0,0|0,0,2]=4 1528 B13R1.119 CC\C=C\CCCCC1OCCO1 Amb25254624 [0,1,0,1,0,0|0,0,2]=4 1529 B13R1.119 COCCCNCCC1CCCC1 Amb18323410 [0,1,0,1,0,0|1,0,0]=3 1530 B13R1.119 ClCCCNCCCN1CCCC1 Amb20573219 [0,1,0,1,0,0|2,0,0]=4 1531 B13R1.119 NCCCCSCCN1CCCC1 Amb17500963 [0,1,0,1,0,0|2,0,0]=4 1532 B13R1.119 O=CCCCCCCC1OCCO1 Amb24490278 [0,1,0,1,0,0|1,0,1]=4 1533 B13R1.119 OCCCCCCCC1OCCO1 Amb25855845 [0,1,0,1,0,0|1,0,0]=3 1534 B13R1.119 OCCCNCCCN1CCCC1 Amb19075985 [0,1,0,1,0,0|1,0,0]=3 1535 B13R1.119 OCCCSCCNC1CCCC1 Amb24769611 [0,1,0,1,0,0|1,0,0]=3 1536 B13R1.226 OCCC1CCCCCCC(=O)O1 Amb25284567 [0,1,0,1,0,0|1,0,1]=4 1537 B13R1.229 OCCC1CC=CCCCCCC1 Amb25287105 [0,1,0,1,0,0|0,0,1]=3 1538 B13R1.229 OCCN1CCCCCCCCC1 Amb25317623 [0,1,0,1,0,0|0,0,0]=2 1539 B13R1.279 NC1CCCCCCCCCCC1 Amb1116041 [0,1,0,1,0,0|1,0,0]=3 1540 B13R1.279 O=C1CCCCCCCCCCC1 Amb1935123 [0,1,0,1,0,0|0,0,1]=3 1541 B13R1.279 O=C1CCCCCCCCCCN1 Amb22011853 [0,1,0,1,0,0|0,0,2]=4 1542 B13R1.279 OC1CCCCCCCCCCO1 Amb24495296 [0,1,0,1,0,0|0,0,0]=2 1543 B13R1.404 OCCN(CCCC1CCCN1)C Amb17504909 [0,1,0,1,0,0|2,0,0]=4 1544 B13R1.443 CCCC(N)CN1CCCC1CO Amb23511197 [0,1,0,1,0,0|1,0,0]=3 1545 B13R1.463 CC(CCC)C1CCCCCC1=O Amb24657103 [0,1,0,1,0,0|0,0,2]=4 1546 B13R1.463 CC(CCC)C1CCCCCC1Cl Amb25323796 [0,1,0,1,0,0|1,0,0]=3 1547 B13R1.463 CC(CCC)C1CCCCCC1N Amb25692011 [0,1,0,1,0,0|1,0,0]=3 1548 B13R1.463 CC(CCC)C1CCCCCC1O Amb24410525 [0,1,0,1,0,0|0,0,0]=2 1549 B13R1.463 CC(CCO)C1CCCCCC1=O Amb24430985 [0,1,0,1,0,0|1,0,1]=4 1550 B13R1.463 CC(COC)C1CCCCCC1Br Amb24469003 [0,1,0,1,0,0|2,0,0]=4 1551 B13R1.463 CC1CCCCCC1N(C)CCO Amb25769453 [0,1,0,1,0,0|1,0,0]=3 1552 B13R1.463 CC1CCCCCN1C(C)CCN Amb25066479 [0,1,0,1,0,0|2,0,0]=4 1553 B13R1.463 CCCC(=O)C1CCCCCC1N Amb25076939 [0,1,0,1,0,0|1,0,1]=4 1554 B13R1.463 CCCC(C)N1CCCCCC1C Amb25098296 [0,1,0,1,0,0|2,0,0]=4 1555 B13R1.463 CCCN(C)C1CCCCCC1O Amb19075451 [0,1,0,1,0,0|1,0,0]=3 1556 B13R1.463 CCOC(=O)C1CCCCCC1O Amb24391606 [0,1,0,1,0,0|1,0,1]=4 1557 B13R1.463 CCOC(=O)[C@@H]1CCCCC[C@H]1O Amb24593894 [0,1,0,1,0,0|1,0,1]=4 1558 B13R1.463 CCOC(=O)[C@H]1CCCCC[C@@H]1O Amb24556803 [0,1,0,1,0,0|1,0,1]=4 1559 B13R1.463 CCOC(=O)[C@H]1CCCCC[C@H]1O Amb10601393 [0,1,0,1,0,0|1,0,1]=4 1560 B13R1.463 CN(CCN)C1CCCCCC1O Amb25708256 [0,1,0,1,0,0|2,0,0]=4 1561 B13R1.463 CN(CCO)C1CCCCCC1N Amb18290957 [0,1,0,1,0,0|2,0,0]=4 1562 B13R1.464 CCNC(=O)C1CCCCC1CO Amb17335768 [0,1,0,1,0,0|1,0,1]=4 1563 B13R1.470 CCCC(=O)NC1CCCCC1O Amb19069384 [0,1,0,1,0,0|1,0,1]=4 1564 B13R1.470 CCNC(=O)CC1CCCC[C@H]1O Amb24397695 [0,1,0,1,0,0|1,0,1]=4 1565 B13R1.470 CCNC(=O)C[C@@H]1CCCC[C@H]1O Amb25286253 [0,1,0,1,0,0|1,0,1]=4 1566 B13R1.470 CCNC(=O)C[C@H]1CCCC[C@@H]1O Amb25031685 [0,1,0,1,0,0|1,0,1]=4 1567 B13R1.470 CN1CCCCC1CN(C)CCO Amb21865909 [0,1,0,1,0,0|2,0,0]=4 1568 B13R1.488 CCCCN1CCCC(N)CCC1 Amb25804217 [0,1,0,1,0,0|2,0,0]=4 1569 B13R1.603 O=CC1CCCCCCCCC1Cl Amb24469324 [0,1,0,1,0,0|0,0,2]=4 1570 B13R1.632 CN1CCCCCC(CO)CCC1 Amb24448046 [0,1,0,1,0,0|1,0,0]=3 1571 B13R1.654 CCCCC#CC[C@@H]1CCC[C@@H]1O Amb25272000 [0,1,0,1,0,0|0,0,1]=3 1572 B13R1.654 CCCCC#CC[C@@H]1CCC[C@H]1O Amb24581730 [0,1,0,1,0,0|0,0,1]=3 1573 B13R1.654 CCCCCC#CC1OCCC1Cl Amb24722925 [0,1,0,1,0,0|0,0,2]=4 1574 B13R1.654 CCCCCC#C[C@@H]1OCC[C@@H]1Cl Amb25326233 [0,1,0,1,0,0|0,0,2]=4 1575 B13R1.654 CCCCCCCC1CCOC1=O Amb22230225 [0,1,0,1,0,0|0,0,2]=4 1576 B13R1.654 CCCCCCCN1CCCC1=O Amb20621393 [0,1,0,1,0,0|0,0,2]=4 1577 B13R1.654 CCCNCCCC1CCCN1C Amb23541775 [0,1,0,1,0,0|2,0,0]=4 1578 B13R1.654 CCOCCCNC1CCCC1N Amb23559167 [0,1,0,1,0,0|2,0,0]=4 1579 B13R1.657 CCCCC[C@@H]1CC[C@H](N1)CCC Amb10569099 [0,1,0,1,0,0|1,0,0]=3 1580 B13R1.1293 C\C=C\[C@]1(O)CCCCC[C@@H]1CO Amb25179825 [0,1,0,1,0,0|0,0,2]=4 1581 B13R1.1464 C#CCC(N)C1CCCCCCC1 Amb24351263 [0,1,0,1,0,0|1,0,1]=4 1582 B13R1.1464 C#CCC(O)C1CCCCCCC1 Amb25226024 [0,1,0,1,0,0|1,0,1]=4 1583 B13R1.1464 CC(CCN)N1CCCCCCC1 Amb18291132 [0,1,0,1,0,0|2,0,0]=4 1584 B13R1.1464 CC(CCO)N1CCCCCCC1 Amb25357575 [0,1,0,1,0,0|1,0,0]=3 1585 B13R1.1464 CC(NCC)C1CCCCCCC1 Amb25254036 [0,1,0,1,0,0|2,0,0]=4 1586 B13R1.1464 CCCC(Cl)C1CCCCCCC1 Amb25041422 [0,1,0,1,0,0|1,0,0]=3 1587 B13R1.1464 CCCC(O)C=1CCCCCCC1 Amb25047869 [0,1,0,1,0,0|1,0,1]=4 1588 B13R1.1464 CCC[C@H](N)C1CCCCCCC1 Amb24694918 [0,1,0,1,0,0|1,0,0]=3 1589 B13R1.1464 CCC[C@H](O)C1CCCCCCC1 Amb25218114 [0,1,0,1,0,0|1,0,0]=3 1590 B13R1.1464 CN(CCF)C1CCCCCCC1 Amb25668957 [0,1,0,1,0,0|2,0,0]=4 1591 B13R1.1464 CN(CCN)C1CCCCCCC1 Amb18995006 [0,1,0,1,0,0|2,0,0]=4 1592 B13R1.1464 CNCC(O)C1CCCCCCC1 Amb24431169 [0,1,0,1,0,0|2,0,0]=4 1593 B13R1.1464 N#CCC(O)C1CCCCCCC1 Amb25824899 [0,1,0,1,0,0|1,0,1]=4 1594 B13R1.1464 NC(CCO)C1CCCCCCC1 Amb24705063 [0,1,0,1,0,0|0,0,0]=2 1595 B13R1.1464 NCCC(O)C1CCCCCCC1 Amb24645786 [0,1,0,1,0,0|1,0,0]=3 1596 B13R1.1575 C#CCC(O)CC1CCCCCC1 Amb25204444 [0,1,0,1,0,0|1,0,1]=4 1597 B13R1.1575 NCCC(CN1CCCCCC1)C Amb17335716 [0,1,0,1,0,0|2,0,0]=4 1598 B13R1.1575 NCCC(O)CN1CCCCCC1 Amb18564401 [0,1,0,1,0,0|2,0,0]=4 1599 B13R1.1575 OCCC(=O)NC1CCCCCC1 Amb17335767 [0,1,0,1,0,0|1,0,1]=4 1600 B13R1.1892 CCCCNCC1CC(CCC)C1 Amb23537498 [0,1,0,1,0,0|2,0,0]=4 1601 B13R1.2792 OC1CCOC(=O)CCCCCC1 Amb24462040 [0,1,0,1,0,0|1,0,1]=4 1602 B13R1.3516 N#C[C@H]1[C@H](CCCO)CCC[C@@H]1O Amb25369349 [0,1,0,1,0,0|1,0,1]=4 1603 B13R1.3914 CCC1CCCCCC(CCO)O1 Amb24430096 [0,1,0,1,0,0|0,0,0]=2 1604 B13R1.3914 CC[C@@H]1CCCCC[C@H](CCO)O1 Amb24576461 [0,1,0,1,0,0|0,0,0]=2 1605 B13R1.28 CCCCCCCC1CCCCC1 Amb21618900 [0,1,0,1,0,0|1,0,0]=3 1606 B13R1.28 CCCCCCN=C1CCCCC1 Amb10562650 [0,1,0,1,0,0|1,0,1]=4 1607 B13R1.28 CCCCCNCC1CCCCC1 Amb2119509 [0,1,0,1,0,0|1,0,0]=3 1608 B13R1.28 CCCCCNCC1CCOCC1 Amb19069643 [0,1,0,1,0,0|2,0,0]=4 1609 B13R1.28 CCCCCOCC1CCNCC1 Amb21957103 [0,1,0,1,0,0|2,0,0]=4 1610 B13R1.28 CCCCCOCC1CNCCC1 Amb21956882 [0,1,0,1,0,0|2,0,0]=4 1611 B13R1.28 CCCCNCCN1CCCCC1 Amb17234125 [0,1,0,1,0,0|2,0,0]=4 1612 B13R1.28 CCCCOCCC1CCCCN1 Amb21956724 [0,1,0,1,0,0|1,0,0]=3 1613 B13R1.28 CCCCOCCC1CCNCC1 Amb21956722 [0,1,0,1,0,0|2,0,0]=4 1614 B13R1.28 CCCCOCCC1CNCCC1 Amb21956723 [0,1,0,1,0,0|2,0,0]=4 1615 B13R1.28 CCCNCCNC1CCCCC1 Amb19075077 [0,1,0,1,0,0|2,0,0]=4 1616 B13R1.28 CCNCCCNC1CCCCC1 Amb19069154 [0,1,0,1,0,0|2,0,0]=4 1617 B13R1.28 COCCCOCC1CCCNC1 Amb21957375 [0,1,0,1,0,0|2,0,0]=4 1618 B13R1.28 COCCCOCC1CCNCC1 Amb21956744 [0,1,0,1,0,0|2,0,0]=4 1619 B13R1.28 COCCNCCN1CCCCC1 Amb17234337 [0,1,0,1,0,0|2,0,0]=4 1620 B13R1.28 COCCOCCC1CCCCN1 Amb21956705 [0,1,0,1,0,0|2,0,0]=4 1621 B13R1.28 COCCOCCC1CCCNC1 Amb18327468 [0,1,0,1,0,0|2,0,0]=4 1622 B13R1.28 COCCOCCC1CCCNC1 Amb21956704 [0,1,0,1,0,0|2,0,0]=4 1623 B13R1.28 COCCOCCC1CCNCC1 Amb21956703 [0,1,0,1,0,0|2,0,0]=4 1624 B13R1.28 ClCCCNCCN1CCCCC1 Amb20414316 [0,1,0,1,0,0|2,0,0]=4 1625 B13R1.28 ClCCNCCCN1CCCCC1 Amb20573164 [0,1,0,1,0,0|2,0,0]=4 1626 B13R1.28 Cl[Mg]CCCCOC1CCCCO1 Amb22897357 [0,1,0,1,0,0|2,0,0]=4 1627 B13R1.28 NCCCCCOC1CCCCC1 Amb19058200 [0,1,0,1,0,0|1,0,0]=3 1628 B13R1.28 NCCNCCCC1CCCCC1 Amb18104941 [0,1,0,1,0,0|1,0,0]=3 1629 B13R1.28 NCCNCCCN1CCCCC1 Amb20573175 [0,1,0,1,0,0|2,0,0]=4 1630 B13R1.28 OCCCCC#CC1CCCCC1 Amb25831940 [0,1,0,1,0,0|0,0,1]=3 1631 B13R1.28 OCCCCC#CC1CCCCO1 Amb25345082 [0,1,0,1,0,0|0,0,2]=4 1632 B13R1.28 OCCCNCCC1=CCCCC1 Amb17309071 [0,1,0,1,0,0|0,0,2]=4 1633 B13R1.28 OCCCNCCN1CCCCC1 Amb19075997 [0,1,0,1,0,0|1,0,0]=3 1634 B13R1.28 OCCNCCCN1CCCCC1 Amb20414304 [0,1,0,1,0,0|1,0,0]=3 1635 B13R1.28 OCCNCCSC1CCCCC1 Amb23133 [0,1,0,1,0,0|1,0,0]=3 1636 B13R1.28 OCCOCCOC1CCCCO1 Amb17620500 [0,1,0,1,0,0|2,0,0]=4 1637 B13R1.28 SCCNCCCC1CCCCC1 Amb24099180 [0,1,0,1,0,0|0,1,0]=3 1638 B13R1.34 C#CCCCC1CCCCCC1O Amb24688460 [0,1,0,1,0,0|0,0,1]=3 1639 B13R1.34 CC#CCCC1CCCCCC1Br Amb25156200 [0,1,0,1,0,0|1,0,1]=4 1640 B13R1.34 CC#CCCC1CCCCCC1N Amb24667469 [0,1,0,1,0,0|1,0,1]=4 1641 B13R1.34 CC#CCCC1CCCCCC1O Amb24463422 [0,1,0,1,0,0|0,0,1]=3 1642 B13R1.34 CC1CCCCCC1NCCC#C Amb24556278 [0,1,0,1,0,0|1,0,1]=4 1643 B13R1.34 COCCCN1CCCNCC1C Amb18066199 [0,1,0,1,0,0|2,0,0]=4 1644 B13R1.34 COCCCN1CCNCCC1C Amb18066200 [0,1,0,1,0,0|2,0,0]=4 1645 B13R1.34 C\C=C\CNC1CCCCCC1O Amb25142819 [0,1,0,1,0,0|0,0,2]=4 1646 B13R1.34 N#CCCNC1CCCCCC1O Amb25096072 [0,1,0,1,0,0|1,0,1]=4 1647 B13R1.84 CC#CCCN1CCCC[C@H]1CO Amb25741945 [0,1,0,1,0,0|0,0,2]=4 1648 B13R1.84 CCC1CCCCN1CCNCC Amb18318956 [0,1,0,1,0,0|2,0,0]=4 1649 B13R1.84 CCNCCC1CCCCC1OC Amb23538302 [0,1,0,1,0,0|1,0,0]=3 1650 B13R1.84 CCSCCN1CCCCC1CN Amb24769324 [0,1,0,1,0,0|2,0,0]=4 1651 B13R1.137 CCN1CCCC1CCCNCC Amb23541781 [0,1,0,1,0,0|2,0,0]=4 1652 B13R1.154 C#CCOC1CCCCCCC1O Amb25332127 [0,1,0,1,0,0|0,0,2]=4 1653 B13R1.154 C=CCOC1CCCCCCC1O Amb25670731 [0,1,0,1,0,0|0,0,2]=4 1654 B13R1.154 C=CCO[C@@H]1CCCCCC[C@@H]1O Amb24547043 [0,1,0,1,0,0|0,0,2]=4 1655 B13R1.154 CCCCC1CCC=CCCC1O Amb25215274 [0,1,0,1,0,0|0,0,1]=3 1656 B13R1.154 CCCC[C@@H]1CCC=CCC[C@H]1O Amb25343758 [0,1,0,1,0,0|0,0,1]=3 1657 B13R1.154 CCCC[C@H]1C=CCCCC[C@@H]1O Amb24588248 [0,1,0,1,0,0|0,0,1]=3 1658 B13R1.154 CCCOC1CCCCCCC1Br Amb24458051 [0,1,0,1,0,0|1,0,0]=3 1659 B13R1.154 CCCOC1CCCCCCC1I Amb24420928 [0,1,0,1,0,0|1,0,0]=3 1660 B13R1.154 CCCOC1CCCCCCC1O Amb19075956 [0,1,0,1,0,0|0,0,0]=2 1661 B13R1.154 CCCSC1CCCCCCC1N Amb24493803 [0,1,0,1,0,0|1,0,0]=3 1662 B13R1.154 COCOC1CCCCCCC1O Amb24648293 [0,1,0,1,0,0|1,0,0]=3 1663 B13R1.154 OC1CCCCCCC1OCCO Amb25787389 [0,1,0,1,0,0|1,0,0]=3 1664 B13R1.154 OCCCC1CCCCCCC1=O Amb24457861 [0,1,0,1,0,0|0,0,1]=3 1665 B13R1.203 N[C@@H]1CCCCCCCCC[C@H]1O Amb24553817 [0,1,0,1,0,0|0,0,0]=2 1666 B13R1.203 O=C1CCCCCCCCCC1Cl Amb24561040 [0,1,0,1,0,0|0,0,2]=4 1667 B13R1.203 OC1CCCC=CCCCCC1O Amb24431764 [0,1,0,1,0,0|0,0,2]=4 1668 B13R1.203 OC1CCCCCCCCCC1O Amb25680531 [0,1,0,1,0,0|0,0,0]=2 1669 B13R1.203 OC1CCCCOCCCCC1O Amb24474151 [0,1,0,1,0,0|1,0,0]=3 1670 B13R1.207 CCNC1CCCCCCC1OC Amb17606050 [0,1,0,1,0,0|1,0,0]=3 1671 B13R1.207 CCOC1CCCCCCC1NC Amb17606048 [0,1,0,1,0,0|2,0,0]=4 1672 B13R1.207 NCCN1CCCCCCC1CN Amb25063397 [0,1,0,1,0,0|2,0,0]=4 1673 B13R1.225 CCNC1CCCCCC1CC#C Amb18184667 [0,1,0,1,0,0|1,0,1]=4 1674 B13R1.225 CCNC1CCCCCC1OCC Amb17606044 [0,1,0,1,0,0|2,0,0]=4 1675 B13R1.225 N#CCN1CCCCCC1CCO Amb25050995 [0,1,0,1,0,0|1,0,1]=4 1676 B13R1.485 CC#CCN1CCCCC1CCO Amb18805369 [0,1,0,1,0,0|0,0,2]=4 1677 B13R1.485 CCCC1CNCCN1CCOC Amb22059605 [0,1,0,1,0,0|2,0,0]=4 1678 B13R1.485 CNCCN1CCCCC1CCO Amb18319356 [0,1,0,1,0,0|1,0,0]=3 1679 B13R1.485 OCCC1CCCCN1CCCCl Amb20573209 [0,1,0,1,0,0|1,0,0]=3 1680 B13R1.489 CNCCN1CCCCCCCC1 Amb25169098 [0,1,0,1,0,0|2,0,0]=4 1681 B13R1.489 ClCCCN1CCCCCCCC1 Amb25360078 [0,1,0,1,0,0|1,0,0]=3 1682 B13R1.489 NCCCN1CCCCCCCC1 Amb25169090 [0,1,0,1,0,0|1,0,0]=3 1683 B13R1.489 O=CCCN1CCCCCCCC1 Amb24411095 [0,1,0,1,0,0|0,0,2]=4 1684 B13R1.489 OCCCN1CCNCCNCC1 Amb24488930 [0,1,0,1,0,0|2,0,0]=4 1685 B13R1.555 CCCCC#CC1CCCCC1O Amb25734431 [0,1,0,1,0,0|0,0,1]=3 1686 B13R1.555 CCCCC#CC1OCCCC1Cl Amb25190423 [0,1,0,1,0,0|0,0,2]=4 1687 B13R1.555 CCCCC#C[C@@H]1OCCC[C@H]1O Amb24749745 [0,1,0,1,0,0|0,0,2]=4 1688 B13R1.555 CCCCC=C=C1CCCC[C@@H]1O Amb24555128 [0,1,0,1,0,0|0,0,2]=4 1689 B13R1.555 CCCCCCC1CCCCC1=O Amb19045128 [0,1,0,1,0,0|0,0,1]=3 1690 B13R1.555 CCCCCCN1CCNCC1C Amb18326616 [0,1,0,1,0,0|2,0,0]=4 1691 B13R1.555 CCCCCNC1CCCCC1N Amb23559073 [0,1,0,1,0,0|1,0,0]=3 1692 B13R1.555 CCCNCCN1CCCCC1C Amb18318953 [0,1,0,1,0,0|2,0,0]=4 1693 B13R1.555 COCCCNC1CCCCC1N Amb23559106 [0,1,0,1,0,0|2,0,0]=4 1694 B13R1.555 COCCCN[C@@H]1CCCC[C@@H]1O Amb23263430 [0,1,0,1,0,0|1,0,0]=3 1695 B13R1.560 CCCCCNCCCC1CCC1 Amb23570821 [0,1,0,1,0,0|1,0,0]=3 1696 B13R1.560 CCOCCNCCCC1CCC1 Amb23570822 [0,1,0,1,0,0|2,0,0]=4 1697 B13R1.560 COCCNCCOCC1CCC1 Amb23556288 [0,1,0,1,0,0|2,0,0]=4 1698 B13R1.560 NCCCCNCCCC1CCC1 Amb23570830 [0,1,0,1,0,0|1,0,0]=3 1699 B13R1.570 CC#CCC1CCCCCC1CN Amb24609812 [0,1,0,1,0,0|1,0,1]=4 1700 B13R1.570 CC#CCN1CCCCCC1CO Amb24468562 [0,1,0,1,0,0|0,0,2]=4 1701 B13R1.570 CCC1CCCCCN1CCC#C Amb25192435 [0,1,0,1,0,0|1,0,1]=4 1702 B13R1.570 CCC1CCCCCN1CCC#N Amb24540442 [0,1,0,1,0,0|1,0,1]=4 1703 B13R1.570 CCCNC1CCCCCC1C#N Amb18996787 [0,1,0,1,0,0|1,0,1]=4 1704 B13R1.570 N#CC1CCCCCC1NCCO Amb18996807 [0,1,0,1,0,0|1,0,1]=4 1705 B13R1.579 CCCCN1CCCC1CCCN Amb23541768 [0,1,0,1,0,0|1,0,0]=3 1706 B13R1.579 CCCCN1CCCC1CCCO Amb19075562 [0,1,0,1,0,0|0,0,0]=2 1707 B13R1.602 COC/1CCCCCCC\C1=N\O Amb25335497 [0,1,0,1,0,0|1,0,1]=4 1708 B13R1.602 COC1CCCCCCCC1=NO Amb25338402 [0,1,0,1,0,0|1,0,1]=4 1709 B13R1.623 CNC1CCCCCCCCCC1 Amb24595964 [0,1,0,1,0,0|1,0,0]=3 1710 B13R1.623 NCC1CCCCCCCCCC1 Amb25311610 [0,1,0,1,0,0|1,0,0]=3 1711 B13R1.659 CCCCCCCCCC[C@@H]1CO1 Amb22353251 [0,1,0,1,0,0|0,0,0]=2 1712 B13R1.659 CCCCCCCCCC[C@H]1CS1 Amb22367103 [0,1,0,1,0,0|0,1,0]=3 1713 B13R1.671 CCCN1CCCC1CCCNC Amb23541787 [0,1,0,1,0,0|2,0,0]=4 1714 B13R1.671 CCSC1CCCC1NCCCF Amb24271332 [0,1,0,1,0,0|2,0,0]=4 1715 B13R1.1150 N#CCCNC1CCCCCCC1 Amb2300484 [0,1,0,1,0,0|1,0,1]=4 1716 B13R1.1150 NCCCNC1CCCCCCC1 Amb17315276 [0,1,0,1,0,0|1,0,0]=3 1717 B13R1.1150 O=CNCCC1CCCCCCC1 Amb25195820 [0,1,0,1,0,0|0,0,2]=4 1718 B13R1.1150 OCCNN=C1CCCCCCC1 Amb25142511 [0,1,0,1,0,0|1,0,1]=4 1719 B13R1.1887 CCCCCCC1CCCCCN1 Amb2235791 [0,1,0,1,0,0|1,0,0]=3 1720 B13R1.1887 CCCNCCN1CCCCCC1 Amb17234129 [0,1,0,1,0,0|2,0,0]=4 1721 B13R1.1887 CCNCCCN1CCCCCC1 Amb19075029 [0,1,0,1,0,0|2,0,0]=4 1722 B13R1.1887 ClCCNCCN1CCCCCC1 Amb20414386 [0,1,0,1,0,0|2,0,0]=4 1723 B13R1.1887 NCCCCOC1CCCCCC1 Amb19058185 [0,1,0,1,0,0|1,0,0]=3 1724 B13R1.1887 NCCNCCN1CCCCCC1 Amb20573224 [0,1,0,1,0,0|2,0,0]=4 1725 B13R1.1887 OCCNCCN1CCCCCC1 Amb20573591 [0,1,0,1,0,0|1,0,0]=3 1726 B13R1.2883 C1CCCCCCCCCCCC1 Amb22230504 [0,1,0,1,0,0|1,0,0]=3 1727 B13R1.2883 C1CCCCNCCCCCCN1 Amb25805167 [0,1,0,1,0,0|1,0,0]=3 1728 B13R1.2883 C1CCCNCCCCCCCN1 Amb25118804 [0,1,0,1,0,0|1,0,0]=3 1729 B13R1.2883 C1CCNCCCCNCCCN1 Amb21953164 [0,1,0,1,0,0|2,0,0]=4 1730 B13R1.2883 C1CCNCCCCNCCCN1 Amb24488793 [0,1,0,1,0,0|2,0,0]=4 1731 B13R1.2883 C1CCNCCNCCOCCN1 Amb25301224 [0,1,0,1,0,0|2,0,0]=4 1732 B13R1.2883 C1CNCCCCCCNCCN1 Amb21953148 [0,1,0,1,0,0|2,0,0]=4 1733 B13R1.2883 C1CNCCCCCNCCCN1 Amb24364784 [0,1,0,1,0,0|2,0,0]=4 1734 B13R1.24 CC(CNCCS)C1CCCCC1 Amb24105628 [0,1,0,1,0,0|1,1,0]=4 1735 B13R1.24 CCCCCC(=O)C1CCCCN1 Amb23455019 [0,1,0,1,0,0|1,0,1]=4 1736 B13R1.24 CCCCCS(=O)C1CCCCC1 Amb24271364 [0,1,0,1,0,0|2,0,0]=4 1737 B13R1.24 OCCCCC(=O)N1CCCCC1 Amb17234201 [0,1,0,1,0,0|1,0,1]=4 1738 B13R1.24 OCCCCN(C1CCCCC1)C Amb2189175 [0,1,0,1,0,0|1,0,0]=3 1739 B13R1.24 O[C@@H](C#CCCO)C1CCCCC1 Amb24661129 [0,1,0,1,0,0|0,0,2]=4 1740 B13R1.48 CCCCC#C[C@@H](O)[C@@H]1CCCO1 Amb24618773 [0,1,0,1,0,0|0,0,2]=4 1741 B13R1.48 CCCCC#C[C@H](O)[C@@H]1CCCO1 Amb25221432 [0,1,0,1,0,0|0,0,2]=4 1742 B13R1.156 CCCCCC(=O)CC1OCCO1 Amb22000771 [0,1,0,1,0,0|1,0,1]=4 1743 B13R1.156 CCCCCC(N)CC1OCCO1 Amb25043917 [0,1,0,1,0,0|1,0,0]=3 1744 B13R1.156 CCCCCC(O)CC1OCCO1 Amb25833843 [0,1,0,1,0,0|1,0,0]=3 1745 B13R1.156 CCCOCC(N)CC1OCCO1 Amb25328028 [0,1,0,1,0,0|2,0,0]=4 1746 B13R1.156 COCCCC(O)CC1OCCO1 Amb25778573 [0,1,0,1,0,0|2,0,0]=4 1747 B13R1.156 OC(CC1OCCO1)CCCCF Amb25771479 [0,1,0,1,0,0|2,0,0]=4 1748 B13R1.189 CCCCCCN1CC(CO)CC1 Amb19069582 [0,1,0,1,0,0|1,0,0]=3 1749 B13R1.189 OCCCCCN1CC(CC1)CO Amb19070927 [0,1,0,1,0,0|2,0,0]=4 1750 B13R1.486 OCCCC1CCCCCC(=O)N1 Amb18191307 [0,1,0,1,0,0|1,0,1]=4 1751 B13R1.486 OCCCC1CCCCCC(=O)O1 Amb24569922 [0,1,0,1,0,0|1,0,1]=4 1752 B13R1.486 OCCOC1CC(=O)CCCCC1 Amb25226428 [0,1,0,1,0,0|1,0,1]=4 1753 B13R1.556 CCCCN1CC(C)NCC1CO Amb17578464 [0,1,0,1,0,0|2,0,0]=4 1754 B13R1.561 CCCC1CC(O)CN1CCCC Amb23453971 [0,1,0,1,0,0|2,0,0]=4 1755 B13R1.561 CCCCC1CC(O)CN1CCF Amb23453985 [0,1,0,1,0,0|2,0,0]=4 1756 B13R1.561 CCCN1CC(O)CC1CCCC Amb23453981 [0,1,0,1,0,0|2,0,0]=4 1757 B13R1.1148 C#CCCCC1CC(O)CCCC1 Amb25376214 [0,1,0,1,0,0|0,0,2]=4 1758 B13R1.1156 CCCNCC1CC(C1)CCCC Amb23537499 [0,1,0,1,0,0|2,0,0]=4 1759 B13R1.1604 CC1CN(CCCF)C(C)CCC1 Amb25078858 [0,1,0,1,0,0|2,0,0]=4 1760 B13R1.1604 CC1CN(CCCI)C(C)CCC1 Amb24502753 [0,1,0,1,0,0|2,0,0]=4 1761 B13R1.1604 CCCCN1CC(C)CCCC1C Amb24352746 [0,1,0,1,0,0|2,0,0]=4 1762 B13R1.1627 CC1CCCCC(=O)N1CCCO Amb24475117 [0,1,0,1,0,0|1,0,1]=4 1763 B13R1.1627 CCCC[C@@H]1[C@@H](O)CCCCC1=C Amb25212257 [0,1,0,1,0,0|0,0,1]=3 1764 B13R1.2457 CC1CCCCC1(O)CCCC#C Amb24429469 [0,1,0,1,0,0|1,0,1]=4 1765 B13R1.3674 OCCCC#CC1(O)CCCCC1 Amb25058596 [0,1,0,1,0,0|0,0,2]=4 1766 B13R1.3803 NC1CCCCCC(N)CCCC1 Amb24534427 [0,1,0,1,0,0|1,0,0]=3 1767 B13R1.3803 OC1CCCCNC(=O)CCCC1 Amb24694118 [0,1,0,1,0,0|1,0,1]=4 1768 B13R1.27 CCCCCCCC1CCC(=O)O1 Amb1154110 [0,1,0,1,0,0|0,0,1]=3 1769 B13R1.44 CCCCN(C)CC1CCCCN1 Amb21958067 [0,1,0,1,0,0|2,0,0]=4 1770 B13R1.44 CCCNC(=O)CC1CCCCO1 Amb16947816 [0,1,0,1,0,0|1,0,1]=4 1771 B13R1.44 OCCCC(=O)NC1CCCCC1 Amb17234197 [0,1,0,1,0,0|1,0,1]=4 1772 B13R1.153 CCCCN(C)CCC1OCCO1 Amb25663373 [0,1,0,1,0,0|2,0,0]=4 1773 B13R1.153 CCCCN(CCC1CCCN1)C Amb17504863 [0,1,0,1,0,0|2,0,0]=4 1774 B13R1.487 CCCCC1CCCCC(O)CC1 Amb24613399 [0,1,0,1,0,0|1,0,0]=3 1775 B13R1.487 CCCC[C@@H]1CCCC[C@@H](O)CC1 Amb25236160 [0,1,0,1,0,0|1,0,0]=3 1776 B13R1.487 CCCC[C@H]1CCCC[C@H](O)C=C1 Amb25176986 [0,1,0,1,0,0|1,0,1]=4 1777 B13R1.487 N#CCCC1CCCCC(O)CC1 Amb25670767 [0,1,0,1,0,0|1,0,1]=4 1778 B13R1.656 CC1CC(CCC#CC)C(O)CC1 Amb25688853 [0,1,0,1,0,0|0,0,2]=4 1779 B13R1.656 CC1CC(CCCC#C)C(O)CC1 Amb24380024 [0,1,0,1,0,0|0,0,2]=4 1780 B13R1.674 CC1CCCCC1C(N)CCC#C Amb24647561 [0,1,0,1,0,0|1,0,1]=4 1781 B13R1.674 CC1CCCCC1C(O)CCC#C Amb24737228 [0,1,0,1,0,0|1,0,1]=4 1782 B13R1.674 CC1CCCCN1C(C)CCCO Amb21984567 [0,1,0,1,0,0|1,0,0]=3 1783 B13R1.684 CCCCC(=O)N1CCCC1CO Amb17102429 [0,1,0,1,0,0|1,0,1]=4 1784 B13R1.1927 CN1CCN(CCCO)C(C)CC1 Amb25097497 [0,1,0,1,0,0|2,0,0]=4 1785 B13R1.1958 CC1(CCCO)CCCCCC1O Amb24704659 [0,1,0,1,0,0|1,0,0]=3 1786 B13R1.1958 C[C@@]1(CCCO)CCCCC[C@H]1O Amb25332319 [0,1,0,1,0,0|1,0,0]=3 1787 B13R1.1959 CCCCC1(N)CCCCCCC1 Amb24361612 [0,1,0,1,0,0|1,0,0]=3 1788 B13R1.1959 CCNCC1(O)CCCCCCC1 Amb18997487 [0,1,0,1,0,0|2,0,0]=4 1789 B13R1.1959 OC\C=C\C1(O)CCCCCCC1 Amb24431876 [0,1,0,1,0,0|0,0,2]=4 1790 B13R1.2133 CN1CCCCC(CN)CCCC1 Amb25779979 [0,1,0,1,0,0|2,0,0]=4 1791 B13R1.2133 OCC1CCCCC(=O)CCCC1 Amb25725464 [0,1,0,1,0,0|0,0,1]=3 1792 B13R1.2436 CC1(CCCCCCN)OCCO1 Amb25106943 [0,1,0,1,0,0|2,0,0]=4 1793 B13R1.2488 C#CCCC(O)C1CCCCCC1 Amb25760355 [0,1,0,1,0,0|1,0,1]=4 1794 B13R1.2488 CC(CCCCl)N1CCCCCC1 Amb21984563 [0,1,0,1,0,0|2,0,0]=4 1795 B13R1.2488 CC(CCCN)N1CCCCCC1 Amb21984564 [0,1,0,1,0,0|2,0,0]=4 1796 B13R1.2488 CC(CCCO)N1CCCCCC1 Amb21984571 [0,1,0,1,0,0|1,0,0]=3 1797 B13R1.2488 ClCCCN(C1CCCCCC1)C Amb17338049 [0,1,0,1,0,0|2,0,0]=4 1798 B13R1.2488 OCCCC(=O)N1CCCCCC1 Amb17234199 [0,1,0,1,0,0|1,0,1]=4 1799 B13R1.2488 OCCNC(=O)C1CCCCCC1 Amb18326800 [0,1,0,1,0,0|1,0,1]=4 1800 B13R1.4018 CCCC1C(CCCCC1O)CO Amb25344871 [0,1,0,1,0,0|0,0,0]=2 1801 B13R1.90 CC(=O)NCC1CCCCC1CO Amb24400354 [0,1,0,1,0,0|1,0,1]=4 1802 B13R1.90 CCC1CCCCN1CCC(O)=O Amb21955365 [0,1,0,1,0,0|1,0,1]=4 1803 B13R1.224 CC(=O)N1CCCCCC1CCO Amb25077814 [0,1,0,1,0,0|1,0,1]=4 1804 B13R1.224 CC(C)C1CCCCCC1CNC Amb25366826 [0,1,0,1,0,0|2,0,0]=4 1805 B13R1.224 CC(C)C1CCCCCC1NCC Amb19068595 [0,1,0,1,0,0|2,0,0]=4 1806 B13R1.224 CC(C)C1CCCCCN1CCC Amb25079020 [0,1,0,1,0,0|2,0,0]=4 1807 B13R1.224 CC(C)C1CCCCCN1CCF Amb24675146 [0,1,0,1,0,0|2,0,0]=4 1808 B13R1.224 CC(C)C1CCCCCN1CCN Amb24577245 [0,1,0,1,0,0|2,0,0]=4 1809 B13R1.224 CC(C)N1CCCCCC1CCO Amb25741876 [0,1,0,1,0,0|1,0,0]=3 1810 B13R1.224 CCCC1CCCCCC1C(O)=O Amb24377494 [0,1,0,1,0,0|0,0,1]=3 1811 B13R1.224 CCSC1CCCCCC1C(O)=O Amb18303070 [0,1,0,1,0,0|1,0,1]=4 1812 B13R1.280 CC(=C)CCC1CCCCCC1Br Amb25274665 [0,1,0,1,0,0|1,0,1]=4 1813 B13R1.280 CC(=C)CCC1CCCCCC1Cl Amb24389910 [0,1,0,1,0,0|1,0,1]=4 1814 B13R1.280 CC(C)=CCC1CCCCCC1O Amb19074198 [0,1,0,1,0,0|0,0,2]=4 1815 B13R1.280 CC(C)=CC[C@@H]1CCCCC[C@H]1O Amb24588400 [0,1,0,1,0,0|0,0,2]=4 1816 B13R1.280 CC(C)CCC1CCCCCC1=O Amb18324532 [0,1,0,1,0,0|0,0,2]=4 1817 B13R1.280 CC(C)CCC1CCCCCC1Br Amb25088106 [0,1,0,1,0,0|1,0,0]=3 1818 B13R1.280 CC(C)CCC1CCCCCC1N Amb19068553 [0,1,0,1,0,0|1,0,0]=3 1819 B13R1.280 CC(C)CCC1CCCCCC1O Amb18328653 [0,1,0,1,0,0|0,0,0]=2 1820 B13R1.280 CC(C)CCN1CCCCCC1C Amb24505730 [0,1,0,1,0,0|2,0,0]=4 1821 B13R1.280 CC(C)CNC1CCCCCC1C Amb25707145 [0,1,0,1,0,0|2,0,0]=4 1822 B13R1.280 CC(C)CNC1CCCCCC1O Amb18970415 [0,1,0,1,0,0|1,0,0]=3 1823 B13R1.280 CC(C)COC1CCCCCC1I Amb25846489 [0,1,0,1,0,0|2,0,0]=4 1824 B13R1.280 CC(C)COC1CCCCCC1O Amb19075951 [0,1,0,1,0,0|1,0,0]=3 1825 B13R1.280 CC(C)NCC1CCCCCC1C Amb25836495 [0,1,0,1,0,0|2,0,0]=4 1826 B13R1.280 CC(C)OCC1CCCCCC1Cl Amb25677727 [0,1,0,1,0,0|2,0,0]=4 1827 B13R1.280 CC(C)OCC1CCCCCC1N Amb25137647 [0,1,0,1,0,0|2,0,0]=4 1828 B13R1.280 CC(O)CCC1CCCCCC1=O Amb25726182 [0,1,0,1,0,0|0,0,2]=4 1829 B13R1.280 CC(O)CCC1CCCCCC1O Amb24395895 [0,1,0,1,0,0|0,0,0]=2 1830 B13R1.280 CC(O)CNC1CCCCCC1O Amb18323953 [0,1,0,1,0,0|1,0,0]=3 1831 B13R1.280 CC1CCCCCC1NCC(F)F Amb24526645 [0,1,0,1,0,0|2,0,0]=4 1832 B13R1.280 CC1CCCCCC1NCC(O)=O Amb24466628 [0,1,0,1,0,0|1,0,1]=4 1833 B13R1.280 CC1CCCCCC1NC[C@@H](C)O Amb25675053 [0,1,0,1,0,0|1,0,0]=3 1834 B13R1.280 CC1CCCCCN1CCC(C)N Amb24493881 [0,1,0,1,0,0|2,0,0]=4 1835 B13R1.280 CC1CCCCCN1CCC(C)O Amb25340369 [0,1,0,1,0,0|1,0,0]=3 1836 B13R1.280 CC1COCCCN1CCC(C)O Amb24490678 [0,1,0,1,0,0|2,0,0]=4 1837 B13R1.280 CN1CCCCCC1CCC(O)=O Amb18191306 [0,1,0,1,0,0|1,0,1]=4 1838 B13R1.280 CS(=O)CCC1CCCCCC1Br Amb24538787 [0,1,0,1,0,0|2,0,0]=4 1839 B13R1.280 CS(=O)CCC1CCCCCC1N Amb24699696 [0,1,0,1,0,0|2,0,0]=4 1840 B13R1.280 CS(=O)CCC1CCCCCC1O Amb25243805 [0,1,0,1,0,0|1,0,0]=3 1841 B13R1.280 C[C@@H](O)CNC1CCCCCC1O Amb24685648 [0,1,0,1,0,0|1,0,0]=3 1842 B13R1.280 OC1CCCCCC1NCC(F)F Amb24708785 [0,1,0,1,0,0|2,0,0]=4 1843 B13R1.280 OC1CCCCCC1OCC(F)F Amb25691221 [0,1,0,1,0,0|2,0,0]=4 1844 B13R1.283 CC(=O)N[C@@H]1CCCCCC[C@H]1O Amb24656143 [0,1,0,1,0,0|1,0,1]=4 1845 B13R1.283 CC(=O)O[C@@H]1CCCCCC[C@@H]1O Amb25366144 [0,1,0,1,0,0|1,0,1]=4 1846 B13R1.283 CC(C)OC1CCCCCCC1Br Amb25161211 [0,1,0,1,0,0|2,0,0]=4 1847 B13R1.283 CC(OC1CCCCCCC1N)C Amb17606046 [0,1,0,1,0,0|2,0,0]=4 1848 B13R1.337 CC(C)NCCCC1CCCCN1 Amb19075121 [0,1,0,1,0,0|2,0,0]=4 1849 B13R1.337 CC(CNCCN1CCCCC1)O Amb17308670 [0,1,0,1,0,0|2,0,0]=4 1850 B13R1.337 CC(CSCCC1CCCCN1)C Amb17503514 [0,1,0,1,0,0|2,0,0]=4 1851 B13R1.337 OC(=O)CCCCC1CCCCC1 Amb22336378 [0,1,0,1,0,0|0,0,1]=3 1852 B13R1.337 OC(=O)CCCCN1CCCCC1 Amb19373622 [0,1,0,1,0,0|1,0,1]=4 1853 B13R1.343 CC(C)NCCNCC1CCCO1 Amb19058679 [0,1,0,1,0,0|2,0,0]=4 1854 B13R1.343 C[C@@H](O)CCCCCC1OCCO1 Amb22896881 [0,1,0,1,0,0|1,0,0]=3 1855 B13R1.343 C[C@H](O)CCCCCC1OCCO1 Amb25213992 [0,1,0,1,0,0|1,0,0]=3 1856 B13R1.380 CC(=O)N[C@@H]1CCCC[C@H]1CCO Amb25287161 [0,1,0,1,0,0|1,0,1]=4 1857 B13R1.380 CC(N)CN1CCSCC1CCO Amb25387649 [0,1,0,1,0,0|2,0,0]=4 1858 B13R1.380 CCCC1CCCCC1CC(O)=O Amb22339365 [0,1,0,1,0,0|0,0,1]=3 1859 B13R1.380 CCCN1CCCCC1CC(O)=O Amb18304879 [0,1,0,1,0,0|1,0,1]=4 1860 B13R1.380 CCOC1CCCCC1CC(O)=O Amb18191219 [0,1,0,1,0,0|1,0,1]=4 1861 B13R1.380 CN(C)CC1CCCCN1CCO Amb21860124 [0,1,0,1,0,0|2,0,0]=4 1862 B13R1.380 NCCC1CCCCN1CC(C)C Amb10607590 [0,1,0,1,0,0|2,0,0]=4 1863 B13R1.380 OCCC1CNCCN1CC(C)C Amb10607782 [0,1,0,1,0,0|2,0,0]=4 1864 B13R1.380 OCCC1CNCCN1CC(C)C Amb2189163 [0,1,0,1,0,0|2,0,0]=4 1865 B13R1.572 CCCCN1CCCCC1C(=O)O Amb13886354 [0,1,0,1,0,0|1,0,1]=4 1866 B13R1.572 CCCCN1CCCCC1C(=O)O Amb2382770 [0,1,0,1,0,0|1,0,1]=4 1867 B13R1.572 CN(C)C1CCCCC1CCCN Amb18822643 [0,1,0,1,0,0|2,0,0]=4 1868 B13R1.572 CN(C)C1CCCCC1NCCO Amb21862330 [0,1,0,1,0,0|2,0,0]=4 1869 B13R1.586 CC(C)CCCCNCC1CCC1 Amb23569444 [0,1,0,1,0,0|2,0,0]=4 1870 B13R1.586 CC(C)CCNCCCC1CCC1 Amb23570823 [0,1,0,1,0,0|2,0,0]=4 1871 B13R1.610 CC(=C)CC1CCCCCC1CN Amb24715363 [0,1,0,1,0,0|1,0,1]=4 1872 B13R1.610 CC(=O)CN1CCCCCC1CO Amb24417527 [0,1,0,1,0,0|1,0,1]=4 1873 B13R1.610 CC(C)CC1CCCCCC1NC Amb18326148 [0,1,0,1,0,0|2,0,0]=4 1874 B13R1.610 CC(C)CN1CCCCCC1CN Amb25808514 [0,1,0,1,0,0|2,0,0]=4 1875 B13R1.610 CC(C)SC1CCCCCC1CN Amb18969599 [0,1,0,1,0,0|2,0,0]=4 1876 B13R1.610 CC(Cl)CC1CCCCCN1CC Amb24407774 [0,1,0,1,0,0|2,0,0]=4 1877 B13R1.610 CC(N)CN1CCCCCC1CC Amb24349312 [0,1,0,1,0,0|2,0,0]=4 1878 B13R1.610 CC(O)CC1CCCCCN1CC Amb24616222 [0,1,0,1,0,0|1,0,0]=3 1879 B13R1.610 CCC1CCCCCN1CC(O)=O Amb24349311 [0,1,0,1,0,0|1,0,1]=4 1880 B13R1.610 CC[C@@H]1NCCCC[C@H]1CC(O)=O Amb18191310 [0,1,0,1,0,0|1,0,1]=4 1881 B13R1.610 COC1CCCCCC1CC(O)=O Amb18822015 [0,1,0,1,0,0|1,0,1]=4 1882 B13R1.610 C[C@@H](N)CN1CCCCCC1CC Amb24617407 [0,1,0,1,0,0|2,0,0]=4 1883 B13R1.610 C[C@@H](O)CN1CCCCCC1CC Amb25153752 [0,1,0,1,0,0|1,0,0]=3 1884 B13R1.610 C[C@H](O)CN1CCCCCC1CC Amb24617408 [0,1,0,1,0,0|1,0,0]=3 1885 B13R1.610 C[C@H](O)CN1CCCCCC1CO Amb24414231 [0,1,0,1,0,0|1,0,0]=3 1886 B13R1.610 OCC1CCCCCC1CC(O)=O Amb25101626 [0,1,0,1,0,0|1,0,1]=4 1887 B13R1.610 OCC1CNCCCN1CC(C)C Amb17578472 [0,1,0,1,0,0|2,0,0]=4 1888 B13R1.614 CCC1CCCCCCC1C(O)=O Amb24710104 [0,1,0,1,0,0|0,0,1]=3 1889 B13R1.1009 OC(=O)C1CCCCCCCCC1 Amb25061287 [0,1,0,1,0,0|0,0,1]=3 1890 B13R1.1009 OC(=O)C1CCCCNCCCC1 Amb24365928 [0,1,0,1,0,0|1,0,1]=4 1891 B13R1.1022 CC(=O)CCC1CCCCCCC1 Amb25120339 [0,1,0,1,0,0|0,0,2]=4 1892 B13R1.1022 CC(C)NCC1CCCCCCC1 Amb25332788 [0,1,0,1,0,0|2,0,0]=4 1893 B13R1.1022 CC(Cl)CCC1CCCCCCC1 Amb24409444 [0,1,0,1,0,0|1,0,0]=3 1894 B13R1.1022 CC(N)CNC1CCCCCCC1 Amb25202260 [0,1,0,1,0,0|2,0,0]=4 1895 B13R1.1022 CC(O)CCC1CCCCCCC1 Amb25260363 [0,1,0,1,0,0|0,0,0]=2 1896 B13R1.1022 CC(O)CCN1CCCCCCC1 Amb18329034 [0,1,0,1,0,0|1,0,0]=3 1897 B13R1.1022 C[C@@H](O)CNC1CCCCCCC1 Amb25038976 [0,1,0,1,0,0|1,0,0]=3 1898 B13R1.1022 ClC(Cl)CNC1CCCCCCC1 Amb25093445 [0,1,0,1,0,0|2,0,0]=4 1899 B13R1.1022 FC(F)CNC1CCCCCCC1 Amb18321045 [0,1,0,1,0,0|2,0,0]=4 1900 B13R1.1022 OC(=O)CCN1CCCCCCC1 Amb21955684 [0,1,0,1,0,0|1,0,1]=4 1901 B13R1.1022 OC(=O)CSC1CCCCCCC1 Amb25725888 [0,1,0,1,0,0|1,0,1]=4 1902 B13R1.1107 CC(N)CN1CCCCCCCC1 Amb25335596 [0,1,0,1,0,0|2,0,0]=4 1903 B13R1.1107 CC(O)CN1CCCCCCCC1 Amb24749795 [0,1,0,1,0,0|1,0,0]=3 1904 B13R1.1107 C[C@@H](O)CN1CCCCCCCC1 Amb24425026 [0,1,0,1,0,0|1,0,0]=3 1905 B13R1.1107 OC(=O)CC1CCCCCCCC1 Amb25279551 [0,1,0,1,0,0|0,0,1]=3 1906 B13R1.1107 OC(=O)CN1CCCCCCCC1 Amb25169064 [0,1,0,1,0,0|1,0,1]=4 1907 B13R1.1988 OC(=O)CCCN1CCCCCC1 Amb10072744 [0,1,0,1,0,0|1,0,1]=4 1908 B13R1.2433 CCCCCCCC1CC1B(O)O Amb24329636 [0,1,0,1,0,0|1,0,0]=3 1909 B13R1.3712 CC1(O)CCCCCCCCC1O Amb25036035 [0,1,0,1,0,0|0,0,0]=2 1910 B13R1.3816 CN1CCCCCCCC1C(O)=O Amb25365310 [0,1,0,1,0,0|1,0,1]=4 1911 B13R1.3816 NC1CCCCCCCC1C(O)=O Amb24436959 [0,1,0,1,0,0|1,0,1]=4 1912 B13R1.9 CC1CCC(CCCCCC)CC1 Amb22229836 [0,1,0,1,0,0|1,0,0]=3 1913 B13R1.9 NCCCCCC1CCN(CC1)C Amb10576292 [0,1,0,1,0,0|2,0,0]=4 1914 B13R1.9 OCCNCCN1CCC(CC1)C Amb17318039 [0,1,0,1,0,0|2,0,0]=4 1915 B13R1.527 CC(CC)NC1CCCCCC1O Amb18323411 [0,1,0,1,0,0|1,0,0]=3 1916 B13R1.527 CC(CC)N[C@@H]1CCCCC[C@H]1O Amb25740181 [0,1,0,1,0,0|1,0,0]=3 1917 B13R1.527 CC(CC)OC1CCCCCC1Br Amb25154845 [0,1,0,1,0,0|2,0,0]=4 1918 B13R1.527 CC(CC)OC1CCCCCC1N Amb18323415 [0,1,0,1,0,0|2,0,0]=4 1919 B13R1.527 CC(CC)SC1CCCCCC1N Amb25760432 [0,1,0,1,0,0|2,0,0]=4 1920 B13R1.527 CC(CC)SC1CCCCCC1O Amb24391473 [0,1,0,1,0,0|1,0,0]=3 1921 B13R1.527 CC(CC1CCCCCC1=O)CC Amb19074206 [0,1,0,1,0,0|0,0,2]=4 1922 B13R1.527 CC(CC1CCCCCC1Br)CC Amb24469760 [0,1,0,1,0,0|1,0,0]=3 1923 B13R1.527 CC(CC1CCCCCC1Br)OC Amb25272824 [0,1,0,1,0,0|2,0,0]=4 1924 B13R1.527 CC(CC1CCCCCC1N)CC Amb18328402 [0,1,0,1,0,0|1,0,0]=3 1925 B13R1.527 CC(CC1CCCCCC1N)OC Amb24490601 [0,1,0,1,0,0|2,0,0]=4 1926 B13R1.527 CC(CC1CCCCCC1O)CC Amb18328654 [0,1,0,1,0,0|0,0,0]=2 1927 B13R1.527 CC(CC1CCCCCC1O)OC Amb24544139 [0,1,0,1,0,0|1,0,0]=3 1928 B13R1.527 CC(CN)SC1CCCCCC1O Amb24520832 [0,1,0,1,0,0|2,0,0]=4 1929 B13R1.527 CC(CO)NC1CCCCCC1O Amb18323954 [0,1,0,1,0,0|2,0,0]=4 1930 B13R1.527 CC1CCCCCC1NC(C)CO Amb25807690 [0,1,0,1,0,0|1,0,0]=3 1931 B13R1.527 CC1CCCCCN1CC(C)CBr Amb24678080 [0,1,0,1,0,0|2,0,0]=4 1932 B13R1.527 CC1CCCCCN1CC(C)CO Amb25156026 [0,1,0,1,0,0|1,0,0]=3 1933 B13R1.527 CC1CCCCCN1CC(C)CS Amb24677201 [0,1,0,1,0,0|1,1,0]=4 1934 B13R1.527 CC1CCCCCN1CC(F)CC Amb24502782 [0,1,0,1,0,0|2,0,0]=4 1935 B13R1.527 CC1CCCCCN1CC(N)CC Amb25815402 [0,1,0,1,0,0|2,0,0]=4 1936 B13R1.527 CC1CCCCCN1CC(N)CO Amb25844689 [0,1,0,1,0,0|1,0,0]=3 1937 B13R1.527 CC1CCCCCN1CC(O)CBr Amb25034251 [0,1,0,1,0,0|2,0,0]=4 1938 B13R1.527 CC1CCCCCN1CC(O)CCl Amb25084831 [0,1,0,1,0,0|2,0,0]=4 1939 B13R1.527 CC1CCCCCN1CC(O)CO Amb24404195 [0,1,0,1,0,0|1,0,0]=3 1940 B13R1.527 CC1CCCCCN1C[C@@H](N)CC Amb24366986 [0,1,0,1,0,0|2,0,0]=4 1941 B13R1.527 CC1CCCCCN1C[C@@H](O)CN Amb24365000 [0,1,0,1,0,0|2,0,0]=4 1942 B13R1.527 CC1CCCCCN1C[C@H](N)CC Amb24392037 [0,1,0,1,0,0|2,0,0]=4 1943 B13R1.527 CC1CCCCCN1C[C@H](O)CC Amb25310707 [0,1,0,1,0,0|2,0,0]=4 1944 B13R1.527 CC1CCOCCN1CC(O)CO Amb24703836 [0,1,0,1,0,0|2,0,0]=4 1945 B13R1.527 CC1CCSCCN1CC(O)CO Amb24589806 [0,1,0,1,0,0|2,0,0]=4 1946 B13R1.527 CC1CNCCCN1CC(C)CO Amb25232166 [0,1,0,1,0,0|2,0,0]=4 1947 B13R1.527 CC1CNCCCN1CC(O)CO Amb25182589 [0,1,0,1,0,0|2,0,0]=4 1948 B13R1.527 CC1COCCCN1CC(C)CO Amb24470359 [0,1,0,1,0,0|2,0,0]=4 1949 B13R1.527 CC1COCCCN1CC(O)CO Amb24746524 [0,1,0,1,0,0|2,0,0]=4 1950 B13R1.527 CCC(=C)CC1CCCCCC1O Amb25731638 [0,1,0,1,0,0|0,0,1]=3 1951 B13R1.527 CCC(=O)CC1CCCCCC1O Amb24490006 [0,1,0,1,0,0|0,0,1]=3 1952 B13R1.527 CCC(=O)N[C@@H]1CCCCC[C@H]1O Amb24719465 [0,1,0,1,0,0|1,0,1]=4 1953 B13R1.527 CCC(=O)OC1CCCCCC1O Amb25356186 [0,1,0,1,0,0|1,0,1]=4 1954 B13R1.527 CCC(=O)O[C@@H]1CCCCC[C@H]1O Amb25175391 [0,1,0,1,0,0|1,0,1]=4 1955 B13R1.527 CCC(C)NC1CCCCCC1C Amb24396760 [0,1,0,1,0,0|2,0,0]=4 1956 B13R1.527 CCN(C)CC1CCCCCC1N Amb18993662 [0,1,0,1,0,0|2,0,0]=4 1957 B13R1.527 CCN(C)CC1CCCCCC1O Amb18327013 [0,1,0,1,0,0|1,0,0]=3 1958 B13R1.527 OC1CCCCCC1CC(O)CF Amb24620365 [0,1,0,1,0,0|1,0,0]=3 1959 B13R1.536 CC(CSCCC1OCCO1)CC Amb25120571 [0,1,0,1,0,0|2,0,0]=4 1960 B13R1.546 C=CC(O)C1CCCCCCC1O Amb25346070 [0,1,0,1,0,0|0,0,2]=4 1961 B13R1.546 CC(CC)C1CCC=CCCC1O Amb24541594 [0,1,0,1,0,0|0,0,2]=4 1962 B13R1.546 CC(CC)[C@H]1CCC=CCC[C@@H]1O Amb24759063 [0,1,0,1,0,0|0,0,2]=4 1963 B13R1.546 CCN(C)C1CCCCCCC1O Amb19075452 [0,1,0,1,0,0|1,0,0]=3 1964 B13R1.546 COC(=O)C1CCCCCCC1O Amb24495767 [0,1,0,1,0,0|1,0,1]=4 1965 B13R1.546 COC(=O)[C@@H]1CCCCCC[C@@H]1O Amb24619178 [0,1,0,1,0,0|1,0,1]=4 1966 B13R1.611 CC(CC)N1CCCCCC1CCl Amb25760351 [0,1,0,1,0,0|2,0,0]=4 1967 B13R1.611 CC(CN)N1CCCCCC1CC Amb25757663 [0,1,0,1,0,0|2,0,0]=4 1968 B13R1.611 CC(CO)N1CCCCCC1CO Amb25695621 [0,1,0,1,0,0|2,0,0]=4 1969 B13R1.611 CCC(=O)N1CCCCCC1CO Amb24364569 [0,1,0,1,0,0|1,0,1]=4 1970 B13R1.611 CCC(N1CCCNCC1CO)C Amb17578474 [0,1,0,1,0,0|2,0,0]=4 1971 B13R1.611 CCS(=O)N1CCCCCC1CO Amb24753149 [0,1,0,1,0,0|2,0,0]=4 1972 B13R1.718 OC(CC#CC1CCCCC1)CO Amb25357448 [0,1,0,1,0,0|0,0,2]=4 1973 B13R1.1689 CC(CN)N1CCCCCCCC1 Amb25773929 [0,1,0,1,0,0|2,0,0]=4 1974 B13R1.1689 CCC(O)C1CCCCCCC=C1 Amb24688107 [0,1,0,1,0,0|1,0,1]=4 1975 B13R1.1689 CC[C@H](O)[C@H]1CCCCCCC=C1 Amb24592489 [0,1,0,1,0,0|1,0,1]=4 1976 B13R1.1711 NCC(CCN1CCCCCC1)C Amb17335713 [0,1,0,1,0,0|2,0,0]=4 1977 B13R1.1711 NCC(O)CNC1CCCCCC1 Amb18564402 [0,1,0,1,0,0|2,0,0]=4 1978 B13R1.1870 CC(CC1CCCCCCC1)NC Amb25797761 [0,1,0,1,0,0|2,0,0]=4 1979 B13R1.1870 CC(CF)NC1CCCCCCC1 Amb24675239 [0,1,0,1,0,0|2,0,0]=4 1980 B13R1.1870 CC(CO)CN1CCCCCCC1 Amb25155853 [0,1,0,1,0,0|1,0,0]=3 1981 B13R1.1870 CCC(C)CN1CCCCCCC1 Amb24719378 [0,1,0,1,0,0|2,0,0]=4 1982 B13R1.1870 CCC(F)CN1CCCCCCC1 Amb25725203 [0,1,0,1,0,0|2,0,0]=4 1983 B13R1.1870 CCC(N)CC1CCCCCCC1 Amb24431170 [0,1,0,1,0,0|1,0,0]=3 1984 B13R1.1870 CCC(O)CN1CCCCCCC1 Amb19058145 [0,1,0,1,0,0|2,0,0]=4 1985 B13R1.1870 CCN(C)CC1CCCCCCN1 Amb25699402 [0,1,0,1,0,0|2,0,0]=4 1986 B13R1.1870 CC[C@H](O)CN1CCCCCCC1 Amb25319309 [0,1,0,1,0,0|2,0,0]=4 1987 B13R1.1870 NC(CO)CN1CCCCCCC1 Amb25081738 [0,1,0,1,0,0|1,0,0]=3 1988 B13R1.1870 NC[C@@H](O)CN1CCCCCCC1 Amb24533343 [0,1,0,1,0,0|2,0,0]=4 1989 B13R1.1870 NC[C@H](O)CN1CCCCCCC1 Amb25129947 [0,1,0,1,0,0|2,0,0]=4 1990 B13R1.1870 OC(CCl)CN1CCCCCCC1 Amb24716580 [0,1,0,1,0,0|2,0,0]=4 1991 B13R1.1870 OC(CF)CN1CCCCCCC1 Amb24582967 [0,1,0,1,0,0|2,0,0]=4 1992 B13R1.1870 OCC(O)CN1CCCCCCC1 Amb25190272 [0,1,0,1,0,0|1,0,0]=3 1993 B13R1.1885 CCC(O)C1OC1CCCCCC Amb22365938 [0,1,0,1,0,0|2,0,0]=4 1994 B13R1.3115 NCC1(O)CCCCCCCCC1 Amb25743744 [0,1,0,1,0,0|1,0,0]=3 1995 B13R1.3908 C=CC1(O)CCCCCC1CCO Amb25296106 [0,1,0,1,0,0|0,0,2]=4 1996 B13R1.3908 C=C[C@]1(O)CCCCC[C@@H]1CCO Amb25206650 [0,1,0,1,0,0|0,0,2]=4 1997 B13R1.3908 C=C[C@]1(O)CCCCC[C@H]1CCO Amb25236138 [0,1,0,1,0,0|0,0,2]=4 1998 B13R2.1 CCCC1CCC2NCCCN21 Amb24342224 [0,0,0,2,0,0|2,0,0]=4 1999 B13R2.1 ClCCN1CCC2CCCCC12 Amb25232648 [0,0,0,2,0,0|2,0,0]=4 2000 B13R2.1 ClCCN1CC[C@@H]2CCCC[C@H]12 Amb25213276 [0,0,0,2,0,0|2,0,0]=4 2001 B13R2.1 ICCN1CCC2CCCCC12 Amb24439226 [0,0,0,2,0,0|2,0,0]=4 2002 B13R2.1 NCCC1CCN2CCCCC21 Amb18826273 [0,0,0,2,0,0|2,0,0]=4 2003 B13R2.1 OCCC1COC2CCCCC21 Amb25048598 [0,0,0,2,0,0|1,0,0]=3 2004 B13R2.1 OCCN1CCC2CCCCC12 Amb24437387 [0,0,0,2,0,0|1,0,0]=3 2005 B13R2.1 OCCN1CC[C@@H]2CCCC[C@H]12 Amb24539140 [0,0,0,2,0,0|1,0,0]=3 2006 B13R2.1 OCCN1CC[C@H]2CCCC[C@@H]12 Amb24685927 [0,0,0,2,0,0|1,0,0]=3 2007 B13R2.3 C1CCC(CC1)C2=CCCCC2 Amb17673647 [0,0,0,2,0,0|1,0,1]=4 2008 B13R2.3 C1CCC(CC1)C2CCCCN2 Amb10068916 [0,0,0,2,0,0|1,0,0]=3 2009 B13R2.3 C1CCC(CC1)C2CCCCN2 Amb2237212 [0,0,0,2,0,0|1,0,0]=3 2010 B13R2.3 C1CCC(CC1)C2CCCNC2 Amb10068919 [0,0,0,2,0,0|2,0,0]=4 2011 B13R2.3 C1CCC(CC1)C2CCNCC2 Amb10068920 [0,0,0,2,0,0|2,0,0]=4 2012 B13R2.3 C1CCC(NC1)C2CCCCN2 Amb15690622 [0,0,0,2,0,0|2,0,0]=4 2013 B13R2.3 C1CCC(NC1)C2CCCNC2 Amb17594224 [0,0,0,2,0,0|2,0,0]=4 2014 B13R2.3 C1CCCCN1C2CCCCN2 Amb25858788 [0,0,0,2,0,0|2,0,0]=4 2015 B13R2.3 C1CCCN[C@@H]1[C@H]2CCCCN2 Amb25804252 [0,0,0,2,0,0|2,0,0]=4 2016 B13R2.3 C1CN(CCN1)C2CCCCO2 Amb25069022 [0,0,0,2,0,0|2,0,0]=4 2017 B13R2.3 C1CNCCC1C2CCCCN2 Amb24743570 [0,0,0,2,0,0|2,0,0]=4 2018 B13R2.3 C1COB(OC1)C2CCCCC2 Amb10068981 [0,0,0,2,0,0|2,0,0]=4 2019 B13R2.3 C1COCCC1C2CCCCN2 Amb24566959 [0,0,0,2,0,0|2,0,0]=4 2020 B13R2.3 C1NCCCC1C2CCCCC2 Amb18199363 [0,0,0,2,0,0|2,0,0]=4 2021 B13R2.3 C1NCCCC1C2CCCCO2 Amb25377354 [0,0,0,2,0,0|1,0,0]=3 2022 B13R2.3 C1NCCCC1C2OCCCO2 Amb24563999 [0,0,0,2,0,0|2,0,0]=4 2023 B13R2.3 C1NCCCC1N2CCCCO2 Amb25034872 [0,0,0,2,0,0|2,0,0]=4 2024 B13R2.3 C1NCCCC1[C@@H]2CCCCN2 Amb25790454 [0,0,0,2,0,0|2,0,0]=4 2025 B13R2.3 C1NCCC[C@H]1C2CCCCC2 Amb25807019 [0,0,0,2,0,0|2,0,0]=4 2026 B13R2.3 C1NCCC[C@H]1[C@H]2CCCCN2 Amb24663173 [0,0,0,2,0,0|2,0,0]=4 2027 B13R2.3 C1NCCNC1C2CCCCC2 Amb18647082 [0,0,0,2,0,0|2,0,0]=4 2028 B13R2.3 C1NCCOC1C2CCCCC2 Amb22236078 [0,0,0,2,0,0|1,0,0]=3 2029 B13R2.3 C1NCCOC1C2CCOCC2 Amb24709970 [0,0,0,2,0,0|2,0,0]=4 2030 B13R2.3 C1OCCCC1C2CNCCO2 Amb24485461 [0,0,0,2,0,0|2,0,0]=4 2031 B13R2.3 C1OCCNC1C2CCCCC2 Amb18563913 [0,0,0,2,0,0|2,0,0]=4 2032 B13R2.3 C1OCCN[C@@H]1C2CCCCC2 Amb22746812 [0,0,0,2,0,0|2,0,0]=4 2033 B13R2.3 C1OCCN[C@H]1C2CCCCC2 Amb24657314 [0,0,0,2,0,0|2,0,0]=4 2034 B13R2.3 C1OCCOC1C2CCNCC2 Amb24364592 [0,0,0,2,0,0|2,0,0]=4 2035 B13R2.3 C1SCCNC1C2CCCCC2 Amb25697749 [0,0,0,2,0,0|2,0,0]=4 2036 B13R2.3 N1CCC(CC1)C2OCCCO2 Amb17506096 [0,0,0,2,0,0|2,0,0]=4 2037 B13R2.6 BrCC1CCCC12CCCCC2 Amb25773006 [0,0,0,2,0,0|1,0,0]=3 2038 B13R2.6 CCC1CCCC12CNCCO2 Amb25736792 [0,0,0,2,0,0|1,0,0]=3 2039 B13R2.6 CCC1CCCC12COCCN2 Amb24646759 [0,0,0,2,0,0|2,0,0]=4 2040 B13R2.6 CNC1CCCC12CCCCC2 Amb24514531 [0,0,0,2,0,0|2,0,0]=4 2041 B13R2.6 ClCC1CCCC12CCOCC2 Amb25079360 [0,0,0,2,0,0|2,0,0]=4 2042 B13R2.6 N#CC1CCCC12CCCCC2 Amb25684889 [0,0,0,2,0,0|1,0,1]=4 2043 B13R2.6 NCC1CCCC12CCOCC2 Amb25822739 [0,0,0,2,0,0|2,0,0]=4 2044 B13R2.6 NCC1CCCC12OCCCO2 Amb18063742 [0,0,0,2,0,0|2,0,0]=4 2045 B13R2.6 NNC1CCCC12CCCCC2 Amb24470193 [0,0,0,2,0,0|2,0,0]=4 2046 B13R2.6 OCC1CCCC12CCCCC2 Amb24415504 [0,0,0,2,0,0|0,0,0]=2 2047 B13R2.6 OCC1NCCC12CCCCC2 Amb25851658 [0,0,0,2,0,0|1,0,0]=3 2048 B13R2.6 OCC1NCCC12CCSCC2 Amb24353903 [0,0,0,2,0,0|2,0,0]=4 2049 B13R2.6 OCC1NCCC12COCCC2 Amb25680771 [0,0,0,2,0,0|2,0,0]=4 2050 B13R2.6 OC[C@H]1CCC[C@]12CCCCN2 Amb25268211 [0,0,0,2,0,0|1,0,0]=3 2051 B13R2.6 ON=C1CCCC12CCCCC2 Amb24634401 [0,0,0,2,0,0|1,0,1]=4 2052 B13R2.14 CC1CCCCC12CCNCC2 Amb25187475 [0,0,0,2,0,0|2,0,0]=4 2053 B13R2.14 CC1CCCCC12CNCCO2 Amb24440663 [0,0,0,2,0,0|1,0,0]=3 2054 B13R2.14 CC1CCCCC12COCCN2 Amb25262805 [0,0,0,2,0,0|2,0,0]=4 2055 B13R2.14 C[C@H]1CCCC[C@@]12NCCCO2 Amb25337650 [0,0,0,2,0,0|1,0,0]=3 2056 B13R2.14 NC1CCCCC12OCCCO2 Amb25363974 [0,0,0,2,0,0|2,0,0]=4 2057 B13R2.14 OC1CCCCC12CC=CCC2 Amb25156761 [0,0,0,2,0,0|0,0,2]=4 2058 B13R2.14 OC1CCCCC12CCCCC2 Amb24497790 [0,0,0,2,0,0|0,0,0]=2 2059 B13R2.14 OC1CCCCC12CNCCC2 Amb18647219 [0,0,0,2,0,0|1,0,0]=3 2060 B13R2.14 OC1CCCOC12CCCCO2 Amb24493238 [0,0,0,2,0,0|2,0,0]=4 2061 B13R2.14 OC1CCCOC12CCNCC2 Amb22233184 [0,0,0,2,0,0|2,0,0]=4 2062 B13R2.14 OC1CCCOC12CNCCC2 Amb25212854 [0,0,0,2,0,0|2,0,0]=4 2063 B13R2.14 OC1CCNCC12CCCCC2 Amb18825873 [0,0,0,2,0,0|1,0,0]=3 2064 B13R2.14 OC1CCNCC12CCOCC2 Amb18198552 [0,0,0,2,0,0|2,0,0]=4 2065 B13R2.14 OC1CCNCC12CCSCC2 Amb18821319 [0,0,0,2,0,0|2,0,0]=4 2066 B13R2.14 OC1CCNCC12COCCC2 Amb18198551 [0,0,0,2,0,0|2,0,0]=4 2067 B13R2.14 OC1CCNCC12CSCCC2 Amb18821320 [0,0,0,2,0,0|2,0,0]=4 2068 B13R2.14 OC1CCOCC12COCCC2 Amb18198279 [0,0,0,2,0,0|2,0,0]=4 2069 B13R2.14 OC1OCCCC12CCCCC2 Amb25734408 [0,0,0,2,0,0|1,0,0]=3 2070 B13R2.14 O[C@@H]1CCCC[C@@]12CCCCN2 Amb24744796 [0,0,0,2,0,0|1,0,0]=3 2071 B13R2.14 O[C@@H]1CCCC[C@]12CNCCC2 Amb24629733 [0,0,0,2,0,0|1,0,0]=3 2072 B13R2.14 O[C@H]1CCCC[C@@]12CCCCN2 Amb24617334 [0,0,0,2,0,0|1,0,0]=3 2073 B13R2.15 BrC1CCCC1C2CCCCC2 Amb25131893 [0,0,0,2,0,0|1,0,0]=3 2074 B13R2.15 CC1CCCC1C2CCCCC2 Amb24079996 [0,0,0,2,0,0|1,0,0]=3 2075 B13R2.15 CC1NCCC1C2CCCCC2 Amb18279875 [0,0,0,2,0,0|2,0,0]=4 2076 B13R2.15 CN1CCCC1C2CCCCC2 Amb24352032 [0,0,0,2,0,0|2,0,0]=4 2077 B13R2.15 CN1CCCC1C2CCCCN2 Amb18826251 [0,0,0,2,0,0|2,0,0]=4 2078 B13R2.15 C[C@@H]1CCN[C@H]1C2CCCCC2 Amb18826820 [0,0,0,2,0,0|2,0,0]=4 2079 B13R2.15 ClC1CCCC1C2COCCC2 Amb24673706 [0,0,0,2,0,0|2,0,0]=4 2080 B13R2.15 Cl[C@@H]1CCC[C@H]1N2CCCCC2 Amb25233424 [0,0,0,2,0,0|2,0,0]=4 2081 B13R2.15 Cl[C@H]1CCC[C@@H]1N2CCCCC2 Amb24677685 [0,0,0,2,0,0|2,0,0]=4 2082 B13R2.15 NC1CCCC1C2CCCCC2 Amb18947761 [0,0,0,2,0,0|1,0,0]=3 2083 B13R2.15 NC1CCCC1N2CCCCC2 Amb1142185 [0,0,0,2,0,0|2,0,0]=4 2084 B13R2.15 NC1CCOC1C2CCCCC2 Amb25769812 [0,0,0,2,0,0|2,0,0]=4 2085 B13R2.15 NN1CCCC1C2CCCCC2 Amb25303091 [0,0,0,2,0,0|2,0,0]=4 2086 B13R2.15 N[C@@H]1CCC[C@H]1N2CCCCC2 Amb24678114 [0,0,0,2,0,0|2,0,0]=4 2087 B13R2.15 N[C@H]1CCC[C@@H]1C2CCCCC2 Amb24512071 [0,0,0,2,0,0|1,0,0]=3 2088 B13R2.15 O=C1CCCC1C2CCCCC2 Amb18798696 [0,0,0,2,0,0|0,0,2]=4 2089 B13R2.15 O=C1CCCC1C2CCCCO2 Amb25808120 [0,0,0,2,0,0|1,0,1]=4 2090 B13R2.15 OC1CC=CC1C2CCCCC2 Amb25787284 [0,0,0,2,0,0|0,0,2]=4 2091 B13R2.15 OC1CCCC1C2CCCCC2 Amb18799275 [0,0,0,2,0,0|0,0,0]=2 2092 B13R2.15 OC1CCCC1C2CNCCC2 Amb24492834 [0,0,0,2,0,0|1,0,0]=3 2093 B13R2.15 OC1CCCC1C2COCCC2 Amb25158136 [0,0,0,2,0,0|1,0,0]=3 2094 B13R2.15 OC1CCCC1C2OCCCO2 Amb24576451 [0,0,0,2,0,0|2,0,0]=4 2095 B13R2.15 OC1CCCC1N2CCCCC2 Amb18806252 [0,0,0,2,0,0|1,0,0]=3 2096 B13R2.15 OC1CCCC1N2CCCCN2 Amb24592867 [0,0,0,2,0,0|2,0,0]=4 2097 B13R2.15 OC1CCCC1N2CCNCC2 Amb18278362 [0,0,0,2,0,0|2,0,0]=4 2098 B13R2.15 OC1CCCC1N2CCSCC2 Amb25148622 [0,0,0,2,0,0|2,0,0]=4 2099 B13R2.15 OC1CCNC1C2CCOCC2 Amb18198534 [0,0,0,2,0,0|2,0,0]=4 2100 B13R2.15 OC1CCNC1C2CCSCC2 Amb18821313 [0,0,0,2,0,0|2,0,0]=4 2101 B13R2.15 OC1CCNC1C2CNCCC2 Amb18825549 [0,0,0,2,0,0|2,0,0]=4 2102 B13R2.15 OC1COCC1C2CNCCC2 Amb24493653 [0,0,0,2,0,0|2,0,0]=4 2103 B13R2.15 OC1OCOC1C2CCCCC2 Amb24608877 [0,0,0,2,0,0|2,0,0]=4 2104 B13R2.15 O[C@@H]1CC=C[C@H]1C2CCCCC2 Amb25206637 [0,0,0,2,0,0|0,0,2]=4 2105 B13R2.15 O[C@@H]1CCC[C@H]1C2CCCCC2 Amb25261897 [0,0,0,2,0,0|0,0,0]=2 2106 B13R2.15 O[C@@H]1CCC[C@H]1C2OCCCO2 Amb24705841 [0,0,0,2,0,0|2,0,0]=4 2107 B13R2.15 O[C@@H]1CCC[C@H]1N2CCCCC2 Amb16230283 [0,0,0,2,0,0|1,0,0]=3 2108 B13R2.15 O[C@@H]1CCC[C@H]1N2CCNCC2 Amb24584799 [0,0,0,2,0,0|2,0,0]=4 2109 B13R2.15 O[C@@H]1CCC[C@H]1N2CCOCC2 Amb24464107 [0,0,0,2,0,0|2,0,0]=4 2110 B13R2.15 O[C@@H]1CNC[C@H]1N2CCCCC2 Amb22748753 [0,0,0,2,0,0|2,0,0]=4 2111 B13R2.15 O[C@@H]1CNC[C@H]1N2CCCCC2 Amb24631021 [0,0,0,2,0,0|2,0,0]=4 2112 B13R2.15 O[C@@H]1COCC1N2CCCCC2 Amb24686024 [0,0,0,2,0,0|2,0,0]=4 2113 B13R2.15 O[C@H]1CC=C[C@H]1C2CCCCC2 Amb25311288 [0,0,0,2,0,0|0,0,2]=4 2114 B13R2.15 O[C@H]1CCC[C@@H]1N2CCCCC2 Amb24591941 [0,0,0,2,0,0|1,0,0]=3 2115 B13R2.15 O[C@H]1CCC[C@@H]1N2CCSCC2 Amb25252660 [0,0,0,2,0,0|2,0,0]=4 2116 B13R2.15 O[C@H]1CNC[C@@H]1N2CCCCC2 Amb10608239 [0,0,0,2,0,0|2,0,0]=4 2117 B13R2.17 CC1CC1CNC2CCCCC2 Amb18289856 [0,0,0,2,0,0|2,0,0]=4 2118 B13R2.17 CC1CC1NCC2CCCCC2 Amb18990705 [0,0,0,2,0,0|2,0,0]=4 2119 B13R2.17 CC1CC1NCC2CCCCN2 Amb18799308 [0,0,0,2,0,0|2,0,0]=4 2120 B13R2.17 CC1CC1NCC2CCCCO2 Amb18801433 [0,0,0,2,0,0|1,0,0]=3 2121 B13R2.17 CC1CC1NCC2CNCCO2 Amb18801943 [0,0,0,2,0,0|2,0,0]=4 2122 B13R2.17 CC1CC1NC[C@@H]2CCCCN2 Amb24493491 [0,0,0,2,0,0|2,0,0]=4 2123 B13R2.17 CC1CC1NC[C@H]2CCCCN2 Amb24493490 [0,0,0,2,0,0|2,0,0]=4 2124 B13R2.25 CNCC1CC1C2CCCCC2 Amb18302679 [0,0,0,2,0,0|2,0,0]=4 2125 B13R2.25 NCCC1CC1C2CCCCC2 Amb25174567 [0,0,0,2,0,0|1,0,0]=3 2126 B13R2.27 CC1CCN1CC2CCCCN2 Amb24645698 [0,0,0,2,0,0|2,0,0]=4 2127 B13R2.27 N[C@@H]1CC[C@H]1SC2CCCCO2 Amb24607290 [0,0,0,2,0,0|2,0,0]=4 2128 B13R2.27 O=C1CCC1CC2CCCCC2 Amb25713657 [0,0,0,2,0,0|0,0,2]=4 2129 B13R2.27 O[C@@H]1CC[C@H]1NC2COCCC2 Amb25683238 [0,0,0,2,0,0|2,0,0]=4 2130 B13R2.40 CCNCC1CC12CCCCC2 Amb18300525 [0,0,0,2,0,0|2,0,0]=4 2131 B13R2.40 FCCNC1CC12CCCCC2 Amb24565010 [0,0,0,2,0,0|2,0,0]=4 2132 B13R2.50 CCC1CC1NC2CCCCC2 Amb24524872 [0,0,0,2,0,0|2,0,0]=4 2133 B13R2.50 ClCC1CC1CC2CCCCC2 Amb24703706 [0,0,0,2,0,0|1,0,0]=3 2134 B13R2.50 NCC1CC1CC2CCOCC2 Amb25239179 [0,0,0,2,0,0|2,0,0]=4 2135 B13R2.50 OCC1CC1CC2CCCCC2 Amb25141297 [0,0,0,2,0,0|0,0,0]=2 2136 B13R2.50 OCC1CC1CN2CCOCC2 Amb23538673 [0,0,0,2,0,0|2,0,0]=4 2137 B13R2.50 OCC1CC1NC2CCOCC2 Amb24734584 [0,0,0,2,0,0|2,0,0]=4 2138 B13R2.50 OCC1CC1OC2CCCCC2 Amb24672584 [0,0,0,2,0,0|1,0,0]=3 2139 B13R2.50 OC[C@@H]1C[C@H]1NC2CCOCC2 Amb24526378 [0,0,0,2,0,0|2,0,0]=4 2140 B13R2.50 OC[C@@H]1C[C@H]1NC2COCCC2 Amb24351232 [0,0,0,2,0,0|2,0,0]=4 2141 B13R2.50 OC[C@@H]1C[C@H]1NC2CSCCC2 Amb24747071 [0,0,0,2,0,0|2,0,0]=4 2142 B13R2.50 OC[C@@H]1O[C@H]1CC2CCCCC2 Amb25220499 [0,0,0,2,0,0|1,0,0]=3 2143 B13R2.56 CCC1NCC1C2CCCCC2 Amb24545534 [0,0,0,2,0,0|2,0,0]=4 2144 B13R2.56 NCC1CCC1C2CCCCC2 Amb25375329 [0,0,0,2,0,0|1,0,0]=3 2145 B13R2.56 NCC1CCC1C2CCOCC2 Amb24654504 [0,0,0,2,0,0|2,0,0]=4 2146 B13R2.64 C(C1CCCC1)C2CCNCC2 Amb18959765 [0,0,0,2,0,0|2,0,0]=4 2147 B13R2.64 C(C1CCCC1)N2CCCCN2 Amb24618501 [0,0,0,2,0,0|2,0,0]=4 2148 B13R2.64 C(C1CCCCC1)C2CCCC2 Amb25347705 [0,0,0,2,0,0|1,0,0]=3 2149 B13R2.64 C(C1CCCCN1)C2CCCC2 Amb18959764 [0,0,0,2,0,0|1,0,0]=3 2150 B13R2.64 C(C1CCCCN1)C2CCCO2 Amb18967410 [0,0,0,2,0,0|1,0,0]=3 2151 B13R2.64 C(C1CCCCN1)N2CCCC2 Amb21958062 [0,0,0,2,0,0|2,0,0]=4 2152 B13R2.64 C(C1CCCCN1)N2CCCO2 Amb24497717 [0,0,0,2,0,0|2,0,0]=4 2153 B13R2.64 C(C1CCCCO1)N2CCCC2 Amb25711169 [0,0,0,2,0,0|1,0,0]=3 2154 B13R2.64 C(C1CCCN1)C2CCOCC2 Amb24364982 [0,0,0,2,0,0|2,0,0]=4 2155 B13R2.64 C(C1CCCN1)C2CCSCC2 Amb25251695 [0,0,0,2,0,0|2,0,0]=4 2156 B13R2.64 C(C1CCCN1)N2CCCCC2 Amb21957943 [0,0,0,2,0,0|2,0,0]=4 2157 B13R2.64 C(C1CCCN1)N2CCCCO2 Amb25359235 [0,0,0,2,0,0|2,0,0]=4 2158 B13R2.64 C(C1CCCO1)C2CCCCC2 Amb24472262 [0,0,0,2,0,0|0,0,0]=2 2159 B13R2.64 C(C1CCCO1)C2CCNCC2 Amb25135356 [0,0,0,2,0,0|1,0,0]=3 2160 B13R2.64 C(C1CCCO1)N2CCCCC2 Amb24493098 [0,0,0,2,0,0|1,0,0]=3 2161 B13R2.64 C(C1CCCO1)N2CCCCN2 Amb24549039 [0,0,0,2,0,0|2,0,0]=4 2162 B13R2.64 C(C1CCNCC1)N2CCCO2 Amb25280596 [0,0,0,2,0,0|2,0,0]=4 2163 B13R2.64 C(C1CNCCO1)C2CCCC2 Amb21965100 [0,0,0,2,0,0|1,0,0]=3 2164 B13R2.64 C(C1COCCN1)C2CCCC2 Amb25675564 [0,0,0,2,0,0|2,0,0]=4 2165 B13R2.64 C(C1NCCCS1)C2CCCC2 Amb24693038 [0,0,0,2,0,0|1,1,0]=4 2166 B13R2.64 C(C1OCCO1)N2CCCCC2 Amb25711809 [0,0,0,2,0,0|2,0,0]=4 2167 B13R2.64 C([C@@H]1CCCN1)N2CCCCC2 Amb24077503 [0,0,0,2,0,0|2,0,0]=4 2168 B13R2.64 C([C@@H]1CCCO1)N2CCNCC2 Amb24435645 [0,0,0,2,0,0|2,0,0]=4 2169 B13R2.64 C([C@H]1CCCO1)N2CCCCC2 Amb24532112 [0,0,0,2,0,0|1,0,0]=3 2170 B13R2.64 C([C@H]1CCCO1)N2CCSCC2 Amb25087088 [0,0,0,2,0,0|2,0,0]=4 2171 B13R2.64 C1CCC(C1)SC2CCCCC2 Amb17672787 [0,0,0,2,0,0|2,0,0]=4 2172 B13R2.64 C1CCC(CC1)CN2CCCC2 Amb17232658 [0,0,0,2,0,0|2,0,0]=4 2173 B13R2.64 C1CCC(CC1)NC2CCCC2 Amb17622429 [0,0,0,2,0,0|2,0,0]=4 2174 B13R2.64 C1CCC(NC1)CN2CCCC2 Amb1102392 [0,0,0,2,0,0|2,0,0]=4 2175 B13R2.64 C1CCCCC1OC2CCCO2 Amb22752555 [0,0,0,2,0,0|1,0,0]=3 2176 B13R2.64 C1CCN(CC1)CC2CCCC2 Amb17232657 [0,0,0,2,0,0|2,0,0]=4 2177 B13R2.64 C1CCN(CC1)CC2CCCN2 Amb2234474 [0,0,0,2,0,0|2,0,0]=4 2178 B13R2.64 C1CCOC1OC2CCCCO2 Amb25327570 [0,0,0,2,0,0|2,0,0]=4 2179 B13R2.64 C1NCCC1CC2CCCCC2 Amb21959201 [0,0,0,2,0,0|2,0,0]=4 2180 B13R2.64 C1NCCC1O[C@@H]2CCCCO2 Amb24447013 [0,0,0,2,0,0|2,0,0]=4 2181 B13R2.64 C1NCCC1O[C@H]2CCCCO2 Amb24093411 [0,0,0,2,0,0|2,0,0]=4 2182 B13R2.64 C1NCCCC1CC2CCCC2 Amb18285006 [0,0,0,2,0,0|2,0,0]=4 2183 B13R2.64 C1NCCCC1CC2CCCO2 Amb21959216 [0,0,0,2,0,0|1,0,0]=3 2184 B13R2.64 C1NCCOC1CN2CCCC2 Amb22756358 [0,0,0,2,0,0|2,0,0]=4 2185 B13R2.64 C1NCC[C@@H]1OC2CCCCO2 Amb22748243 [0,0,0,2,0,0|2,0,0]=4 2186 B13R2.64 C1OCCC1CC2CCCCN2 Amb25854507 [0,0,0,2,0,0|2,0,0]=4 2187 B13R2.64 C1OCCCC1CC2CCCN2 Amb24409109 [0,0,0,2,0,0|2,0,0]=4 2188 B13R2.64 N1CCN(CC1)CC2CCCO2 Amb1154234 [0,0,0,2,0,0|2,0,0]=4 2189 B13R2.67 C1CCCC2NCCCCCC21 Amb25088439 [0,0,0,2,0,0|1,0,0]=3 2190 B13R2.67 C1CCCN2C(CN1)CCCC2 Amb17578191 [0,0,0,2,0,0|2,0,0]=4 2191 B13R2.67 C1CCN2CCCCCCC2N1 Amb25667052 [0,0,0,2,0,0|2,0,0]=4 2192 B13R2.67 C1NCCN2CCCCCCC21 Amb24752363 [0,0,0,2,0,0|2,0,0]=4 2193 B13R2.256 OCCN1CCN2CCC1CC2 Amb25218579 [0,0,0,2,0,0|2,0,0]=4 2194 B13R2.510 BrCCCN1CC2CCC1CC2 Amb25206766 [0,0,0,2,0,0|2,0,0]=4 2195 B13R2.510 CCNCC1CC2CCC1CC2 Amb24497839 [0,0,0,2,0,0|2,0,0]=4 2196 B13R2.510 NCCCC1CN2CCC1CC2 Amb25682641 [0,0,0,2,0,0|2,0,0]=4 2197 B13R2.510 NCCCN1CC2CCC1CC2 Amb25152393 [0,0,0,2,0,0|2,0,0]=4 2198 B13R2.510 NCCNC1CC2CCC1CC2 Amb25857189 [0,0,0,2,0,0|2,0,0]=4 2199 B13R2.510 OCCCC1CN2CCC1CC2 Amb24078274 [0,0,0,2,0,0|1,0,0]=3 2200 B13R2.510 OCCCN1CC2CCC1CC2 Amb25037525 [0,0,0,2,0,0|1,0,0]=3 2201 B13R2.510 OCCNC1CC2CCC1CC2 Amb25099905 [0,0,0,2,0,0|1,0,0]=3 2202 B13R2.733 CCCC1CCC2BC1CCC2 Amb24436692 [0,0,0,2,0,0|1,0,0]=3 2203 B13R2.733 NCCC1CCN2CC1CCC2 Amb24691421 [0,0,0,2,0,0|2,0,0]=4 2204 B13R2.733 OCCC1COC2CC1CCO2 Amb24493232 [0,0,0,2,0,0|2,0,0]=4 2205 B13R2.1028 CCCCN1CC2CCCCC12 Amb24430647 [0,0,0,2,0,0|2,0,0]=4 2206 B13R2.1028 CCCCN1C[C@H]2CCCC[C@@H]12 Amb25718133 [0,0,0,2,0,0|2,0,0]=4 2207 B13R2.1028 CCCNC1CC2OCCCC21 Amb25226174 [0,0,0,2,0,0|1,0,0]=3 2208 B13R2.1028 ICCCN1C[C@H]2CCCC[C@@H]12 Amb25087936 [0,0,0,2,0,0|2,0,0]=4 2209 B13R2.1028 OCCNC1CC2OCCCC21 Amb25848250 [0,0,0,2,0,0|2,0,0]=4 2210 B13R2.1613 BrCC1CCCN2CCCCC21 Amb22757815 [0,0,0,2,0,0|2,0,0]=4 2211 B13R2.1613 BrC[C@@H]1CCCN2[C@@H]1CCCC2 Amb1981144 [0,0,0,2,0,0|2,0,0]=4 2212 B13R2.1613 CCC1CCCC2CNCCN21 Amb25288560 [0,0,0,2,0,0|2,0,0]=4 2213 B13R2.1613 CCC1CNCC2CCCCN21 Amb18826263 [0,0,0,2,0,0|2,0,0]=4 2214 B13R2.1613 CCC1NCCN2CCCCC21 Amb18826246 [0,0,0,2,0,0|2,0,0]=4 2215 B13R2.1613 ClCC1CCCC2CCCCN21 Amb25159293 [0,0,0,2,0,0|2,0,0]=4 2216 B13R2.1613 ClC[C@@H]1CCCN2[C@@H]1CCCC2 Amb19135721 [0,0,0,2,0,0|2,0,0]=4 2217 B13R2.1613 ClC[C@H]1CCCN2CCCC[C@@H]21 Amb24545973 [0,0,0,2,0,0|2,0,0]=4 2218 B13R2.1613 ClC[C@H]1CCC[C@H]2CCCCN21 Amb24677589 [0,0,0,2,0,0|2,0,0]=4 2219 B13R2.1613 NCC1CCCC2OCOCC21 Amb24638227 [0,0,0,2,0,0|2,0,0]=4 2220 B13R2.1613 NCC1CCCN2C1CCCC2 Amb1101983 [0,0,0,2,0,0|2,0,0]=4 2221 B13R2.1613 NCC1CCCN2C1CCCC2 Amb17622271 [0,0,0,2,0,0|2,0,0]=4 2222 B13R2.1613 NCC1CCCN2CCCC[C@@H]21 Amb18826291 [0,0,0,2,0,0|2,0,0]=4 2223 B13R2.1613 NCC1CCCN2CCCC[C@@H]21 Amb24055724 [0,0,0,2,0,0|2,0,0]=4 2224 B13R2.1613 NC[C@@H]1CCCN2CCCCC21 Amb24343311 [0,0,0,2,0,0|2,0,0]=4 2225 B13R2.1613 NC[C@@H]1CCCN2[C@@H]1CCCC2 Amb1047324 [0,0,0,2,0,0|2,0,0]=4 2226 B13R2.1613 NC[C@@H]1CCCN2[C@@H]1CCCC2 Amb19135543 [0,0,0,2,0,0|2,0,0]=4 2227 B13R2.1613 NC[C@@H]1CCCN2[C@@H]1CCCC2 Amb1981145 [0,0,0,2,0,0|2,0,0]=4 2228 B13R2.1613 NNC1CCCC2CCCCC21 Amb25710106 [0,0,0,2,0,0|2,0,0]=4 2229 B13R2.1613 O=CC1CCCC2CCCCC21 Amb25044373 [0,0,0,2,0,0|0,0,2]=4 2230 B13R2.1613 OCC1CC=CC2CCCCC21 Amb25845413 [0,0,0,2,0,0|0,0,2]=4 2231 B13R2.1613 OCC1CCC=C2CCCCC21 Amb25072418 [0,0,0,2,0,0|0,0,2]=4 2232 B13R2.1613 OCC1CCCC2CCCNC21 Amb24595799 [0,0,0,2,0,0|1,0,0]=3 2233 B13R2.1613 OCC1CCCC2CCCOC21 Amb24403840 [0,0,0,2,0,0|1,0,0]=3 2234 B13R2.1613 OCC1CCCC2CNCCN21 Amb25336343 [0,0,0,2,0,0|2,0,0]=4 2235 B13R2.1613 OCC1CCCN2C1CCCC2 Amb1794828 [0,0,0,2,0,0|1,0,0]=3 2236 B13R2.1613 OCC1CCCN2CCOCC21 Amb25069645 [0,0,0,2,0,0|2,0,0]=4 2237 B13R2.1613 OCC1CCNC2CCCCC21 Amb24497488 [0,0,0,2,0,0|1,0,0]=3 2238 B13R2.1613 OCC1CNCC2CCCCN21 Amb25212620 [0,0,0,2,0,0|2,0,0]=4 2239 B13R2.1613 OC[C@@H]1CC=C[C@@H]2CCCC[C@H]21 Amb24520461 [0,0,0,2,0,0|0,0,2]=4 2240 B13R2.1613 OC[C@@H]1CCC=C2CCCC[C@@H]21 Amb25343757 [0,0,0,2,0,0|0,0,2]=4 2241 B13R2.1613 OC[C@@H]1CCCN2CCCC[C@H]21 Amb22757986 [0,0,0,2,0,0|1,0,0]=3 2242 B13R2.1613 OC[C@@H]1CCCN2[C@@H]1CCCC2 Amb1048127 [0,0,0,2,0,0|1,0,0]=3 2243 B13R2.1613 OC[C@@H]1CCC[C@H]2CCCCN21 Amb24539336 [0,0,0,2,0,0|1,0,0]=3 2244 B13R2.1613 OC[C@H]1CCC=C2CCCC[C@@H]21 Amb25296212 [0,0,0,2,0,0|0,0,2]=4 2245 B13R2.1613 OC[C@H]1CCCN2[C@@H]1CCCC2 Amb10072578 [0,0,0,2,0,0|1,0,0]=3 2246 B13R2.1613 OC[C@H]1CCC[C@@H]2CCCN[C@@H]21 Amb24617830 [0,0,0,2,0,0|1,0,0]=3 2247 B13R2.1613 OC[C@H]1CCC[C@@H]2CNCCN21 Amb25231966 [0,0,0,2,0,0|2,0,0]=4 2248 B13R2.1613 OC[C@H]1CCC[C@@H]2N1CCNC2 Amb13886064 [0,0,0,2,0,0|2,0,0]=4 2249 B13R2.1613 OC[C@H]1CCC[C@H]2CCCN[C@H]21 Amb24595435 [0,0,0,2,0,0|1,0,0]=3 2250 B13R2.1613 ON=C1CCCC2CCCCC12 Amb24516987 [0,0,0,2,0,0|1,0,1]=4 2251 B13R2.1613 [O-]CC1CCCN2C1CCCC2 Amb16449001 [0,0,0,2,0,0|1,0,1]=4 2252 B13R2.2382 C(OCC1CCCCN1)C2CC2 Amb18801411 [0,0,0,2,0,0|2,0,0]=4 2253 B13R2.2382 C(OCC1CNCCO1)C2CC2 Amb24271222 [0,0,0,2,0,0|2,0,0]=4 2254 B13R2.2382 C1CC1OCCC2CCCCN2 Amb23556549 [0,0,0,2,0,0|2,0,0]=4 2255 B13R2.2382 C1OC1CCC=C2CCCCC2 Amb24701497 [0,0,0,2,0,0|0,0,2]=4 2256 B13R2.2383 C(CN1CCC1)C2CCCCN2 Amb24647153 [0,0,0,2,0,0|2,0,0]=4 2257 B13R2.2383 C(CN1CCC1)C2OCCCO2 Amb25351173 [0,0,0,2,0,0|2,0,0]=4 2258 B13R2.2383 C(CN1CCCCN1)C2CCC2 Amb25292538 [0,0,0,2,0,0|2,0,0]=4 2259 B13R2.2383 C(NC1CCC1)C2CCCCC2 Amb18805748 [0,0,0,2,0,0|2,0,0]=4 2260 B13R2.2383 C(NC1CCC1)C2CCCCN2 Amb18298113 [0,0,0,2,0,0|2,0,0]=4 2261 B13R2.2383 C(NC1CCC1)C2CCCCO2 Amb18989525 [0,0,0,2,0,0|1,0,0]=3 2262 B13R2.2383 C(NC1CCC1)C2CCCCS2 Amb25048752 [0,0,0,2,0,0|1,1,0]=4 2263 B13R2.2383 C(NC1CCC1)[C@@H]2CCCCN2 Amb24424332 [0,0,0,2,0,0|2,0,0]=4 2264 B13R2.2383 C(NC1CCC1)[C@H]2CCCCN2 Amb24493426 [0,0,0,2,0,0|2,0,0]=4 2265 B13R2.2383 C(OC1CCC1)C2CCCCN2 Amb18295645 [0,0,0,2,0,0|2,0,0]=4 2266 B13R2.2383 C(OC1CNC1)C2CCCCO2 Amb18997212 [0,0,0,2,0,0|2,0,0]=4 2267 B13R2.2383 C(SC1CCCCC1)C2CCC2 Amb25333163 [0,0,0,2,0,0|2,0,0]=4 2268 B13R2.2383 C1CC(CCN2CCCCC2)N1 Amb25223607 [0,0,0,2,0,0|2,0,0]=4 2269 B13R2.2383 C1CCCCC1CCC2CCN2 Amb25310519 [0,0,0,2,0,0|1,0,0]=3 2270 B13R2.2383 C1NCC1CCC2CCCCC2 Amb24544147 [0,0,0,2,0,0|2,0,0]=4 2271 B13R2.2383 C1NCC1COC2CCCCO2 Amb25290394 [0,0,0,2,0,0|2,0,0]=4 2272 B13R2.2383 C1NCC1NCC2CCCCO2 Amb24375977 [0,0,0,2,0,0|2,0,0]=4 2273 B13R2.2383 C1NCCCC1CCC2CCC2 Amb24542961 [0,0,0,2,0,0|2,0,0]=4 2274 B13R2.2383 C1NCCOC1CNC2CCC2 Amb18298105 [0,0,0,2,0,0|2,0,0]=4 2275 B13R2.2383 C1NCCOC1COC2CCC2 Amb25212845 [0,0,0,2,0,0|2,0,0]=4 2276 B13R2.2383 C1OC(CNC2CCC2)CCO1 Amb24443416 [0,0,0,2,0,0|2,0,0]=4 2277 B13R2.2383 C1OCCOC1CNC2CCC2 Amb18982504 [0,0,0,2,0,0|2,0,0]=4 2278 B13R2.5252 CC1CCNCC2CCCCN21 Amb25228184 [0,0,0,2,0,0|2,0,0]=4 2279 B13R2.5252 CC1CNCCC2CCCCN21 Amb18826261 [0,0,0,2,0,0|2,0,0]=4 2280 B13R2.5252 CC1NCCCN2CCCCC21 Amb18826249 [0,0,0,2,0,0|2,0,0]=4 2281 B13R2.5252 O=C1CCCCC2CCCCC12 Amb25712919 [0,0,0,2,0,0|0,0,2]=4 2282 B13R2.5252 O=C1CCCCC2OCCCC12 Amb25319992 [0,0,0,2,0,0|1,0,1]=4 2283 B13R2.5252 O=C1CCCC[C@H]2CCCC[C@H]12 Amb25263095 [0,0,0,2,0,0|0,0,2]=4 2284 B13R2.5252 OC1CCCCC2CCCCC21 Amb25107683 [0,0,0,2,0,0|0,0,0]=2 2285 B13R2.5252 OC1CCCCN2CCCCC21 Amb25157910 [0,0,0,2,0,0|1,0,0]=3 2286 B13R2.5252 O[C@H]1CCCC[C@H]2CCCC[C@@H]21 Amb25345052 [0,0,0,2,0,0|0,0,0]=2 2287 B13R2.8001 C1CC2(CCCCC2)SCCN1 Amb22642275 [0,0,0,2,0,0|1,1,0]=4 2288 B13R2.8001 C1CC2(CCCN1)CCCCC2 Amb18826822 [0,0,0,2,0,0|2,0,0]=4 2289 B13R2.8001 C1CC2(CCCN1)OCCCO2 Amb22896424 [0,0,0,2,0,0|2,0,0]=4 2290 B13R2.8001 C1CC2(CCCN1)OCCCO2 Amb25200144 [0,0,0,2,0,0|2,0,0]=4 2291 B13R2.8001 C1CC2(CCCO1)CCCCN2 Amb18825875 [0,0,0,2,0,0|2,0,0]=4 2292 B13R2.8001 C1CC2(CCN1)CCCCCC2 Amb18199364 [0,0,0,2,0,0|2,0,0]=4 2293 B13R2.8001 C1CC2(CCN1)OCCCCO2 Amb25108520 [0,0,0,2,0,0|2,0,0]=4 2294 B13R2.8001 C1CC2(CCNCCO2)CCO1 Amb24733284 [0,0,0,2,0,0|2,0,0]=4 2295 B13R2.8001 C1CCCC2(CC1)CNCCN2 Amb16192543 [0,0,0,2,0,0|2,0,0]=4 2296 B13R2.8001 C1CCCC2(CCCCCC2)N1 Amb18826824 [0,0,0,2,0,0|1,0,0]=3 2297 B13R2.8001 C1CCCCC12NCCCCS2 Amb25061710 [0,0,0,2,0,0|1,1,0]=4 2298 B13R2.8001 C1CCSC2(CCCCCC2)N1 Amb25283501 [0,0,0,2,0,0|1,1,0]=4 2299 B13R2.8001 C1NCCCC12CCCCCC2 Amb18826823 [0,0,0,2,0,0|2,0,0]=4 2300 B13R2.8001 C1NCCCNC12CCCCC2 Amb18826266 [0,0,0,2,0,0|2,0,0]=4 2301 B13R2.8001 C1NCCOC12CCCCCC2 Amb18943836 [0,0,0,2,0,0|1,0,0]=3 2302 B13R2.208 BrC1CCCCCC12OCCO2 Amb21927760 [0,0,0,2,0,0|2,0,0]=4 2303 B13R2.208 CC1CCCCCC12CNCC2 Amb25223502 [0,0,0,2,0,0|2,0,0]=4 2304 B13R2.208 O=C1CCCCCC12CCCC2 Amb25202509 [0,0,0,2,0,0|0,0,2]=4 2305 B13R2.208 O=C1CCCCCC12CCCO2 Amb25839242 [0,0,0,2,0,0|1,0,1]=4 2306 B13R2.208 OC1CCCCCC12CCCC2 Amb24517519 [0,0,0,2,0,0|0,0,0]=2 2307 B13R2.208 OC1CCCCCC12CNCC2 Amb18825880 [0,0,0,2,0,0|1,0,0]=3 2308 B13R2.248 CC1CC2CCCC1C2NCC Amb25212249 [0,0,0,2,0,0|2,0,0]=4 2309 B13R2.344 CC=1CCC2CC1CCCC2O Amb25136233 [0,0,0,2,0,0|0,0,2]=4 2310 B13R2.344 CC=1CC[C@H]2CC1CCC[C@H]2O Amb25332414 [0,0,0,2,0,0|0,0,2]=4 2311 B13R2.499 CC12CC1CCCC2NCCF Amb25829743 [0,0,0,2,0,0|2,0,0]=4 2312 B13R2.499 CCCNC1CCCC2CC21C Amb24473679 [0,0,0,2,0,0|2,0,0]=4 2313 B13R2.995 CCCC[C@@H]1[C@@H](O)C[C@H]2CC[C@H]21 Amb25344939 [0,0,0,2,0,0|0,0,0]=2 2314 B13R2.1035 CCCCC1CC2CCC2C1O Amb24430867 [0,0,0,2,0,0|0,0,0]=2 2315 B13R2.1243 CCCNC1CCC2CCC1O2 Amb25197622 [0,0,0,2,0,0|1,0,0]=3 2316 B13R2.1243 CCONC1CCC2CCC1O2 Amb24630650 [0,0,0,2,0,0|2,0,0]=4 2317 B13R2.1243 NCCNC1CCC2CCC1O2 Amb25197623 [0,0,0,2,0,0|2,0,0]=4 2318 B13R2.1243 OCCCN1CCN2CC1CC2 Amb25300947 [0,0,0,2,0,0|2,0,0]=4 2319 B13R2.1243 OCCNC1CCN2CC1CC2 Amb25738353 [0,0,0,2,0,0|2,0,0]=4 2320 B13R2.1243 OCCOC1CCC2CC1CC2 Amb25285553 [0,0,0,2,0,0|1,0,0]=3 2321 B13R2.1515 NCC1CC2CCCCCN2C1 Amb25243283 [0,0,0,2,0,0|2,0,0]=4 2322 B13R2.1515 OC[C@@H]1C[C@H]2CCCCCN2O1 Amb24632505 [0,0,0,2,0,0|2,0,0]=4 2323 B13R2.1515 OC[C@H]1C[C@H]2CCCCCN2O1 Amb25221115 [0,0,0,2,0,0|2,0,0]=4 2324 B13R2.2295 C1CC2CCCCCN2CCN1 Amb18199158 [0,0,0,2,0,0|2,0,0]=4 2325 B13R2.2295 C1CCCN[C@@H]2CCNCC[C@H]21 Amb18826305 [0,0,0,2,0,0|2,0,0]=4 2326 B13R2.2295 C1NCCCC2CCCCNC21 Amb25311216 [0,0,0,2,0,0|2,0,0]=4 2327 B13R2.2295 C1NCCC[C@@H]2CCCCN[C@H]21 Amb18826307 [0,0,0,2,0,0|2,0,0]=4 2328 B13R2.2295 C1NCCC[C@@H]2NCCCC[C@H]21 Amb18826310 [0,0,0,2,0,0|2,0,0]=4 2329 B13R2.2438 CCCCC12CC1CCCC2=O Amb24378373 [0,0,0,2,0,0|0,0,2]=4 2330 B13R2.2438 CCCC[C@@]12C[C@@H]1CCCC2=O Amb24551556 [0,0,0,2,0,0|0,0,2]=4 2331 B13R2.2438 CCCC[C@@]12O[C@@H]1CCC[C@@H]2O Amb25236511 [0,0,0,2,0,0|1,0,0]=3 2332 B13R2.2443 OCCOC12CC1CCCCC2 Amb25105947 [0,0,0,2,0,0|1,0,0]=3 2333 B13R2.2453 CCCC[C@H]1[C@@H]2CCC[C@@H]2C1=O Amb25236971 [0,0,0,2,0,0|0,0,2]=4 2334 B13R2.3045 CC1CCCCCC1NC2CC2 Amb25702879 [0,0,0,2,0,0|2,0,0]=4 2335 B13R2.3045 CC1CCCCCN1C[C@@H]2CO2 Amb24493389 [0,0,0,2,0,0|1,0,0]=3 2336 B13R2.3045 CC1CCCCCN1C[C@H]2CO2 Amb24600693 [0,0,0,2,0,0|1,0,0]=3 2337 B13R2.3045 CC1COCCCN1C[C@@H]2CO2 Amb24597397 [0,0,0,2,0,0|2,0,0]=4 2338 B13R2.3045 CC1COCCCN1C[C@H]2CO2 Amb24569029 [0,0,0,2,0,0|2,0,0]=4 2339 B13R2.3045 OC1CCCCCC1NC2CC2 Amb18950569 [0,0,0,2,0,0|1,0,0]=3 2340 B13R2.3045 O[C@H]1CCCCC[C@@H]1NC2CC2 Amb25326007 [0,0,0,2,0,0|1,0,0]=3 2341 B13R2.3729 CC1CC2CCCCNC2CC1 Amb25694717 [0,0,0,2,0,0|2,0,0]=4 2342 B13R2.3729 CC1CN2CCCCCC2CN1 Amb25288320 [0,0,0,2,0,0|2,0,0]=4 2343 B13R2.3729 CC1CNC2CCCCCC2S1 Amb24537726 [0,0,0,2,0,0|1,1,0]=4 2344 B13R2.3729 CC1CSC2CCCCCC2N1 Amb24696181 [0,0,0,2,0,0|2,0,0]=4 2345 B13R2.3729 C[C@@H]1CN2CCCCCC2CN1 Amb18826274 [0,0,0,2,0,0|2,0,0]=4 2346 B13R2.3729 C[C@H]1CN2CCCCCC2CN1 Amb24579467 [0,0,0,2,0,0|2,0,0]=4 2347 B13R2.3729 NC1C[C@H]2CCCCC[C@H]2CC1 Amb24714895 [0,0,0,2,0,0|1,0,0]=3 2348 B13R2.3729 N[C@H]1C[C@H]2CCCCC[C@H]2CC1 Amb24670338 [0,0,0,2,0,0|1,0,0]=3 2349 B13R2.3729 O=C1C[C@@H]2CCCCC[C@@H]2CC1 Amb25233750 [0,0,0,2,0,0|0,0,2]=4 2350 B13R2.3729 O=C1C[C@H]2CCCCC[C@@H]2CC1 Amb24512411 [0,0,0,2,0,0|0,0,2]=4 2351 B13R2.3729 OC1CC2CCCCCC2CC1 Amb25725466 [0,0,0,2,0,0|0,0,0]=2 2352 B13R2.3729 OC1CC2CCCCC[C@@H]2CC1 Amb24630763 [0,0,0,2,0,0|0,0,0]=2 2353 B13R2.3729 OC1C[C@H]2CCCC=C[C@H]2CC1 Amb25254175 [0,0,0,2,0,0|0,0,2]=4 2354 B13R2.3729 O[C@@H]1C[C@H]2CCCCC[C@@H]2CC1 Amb25234376 [0,0,0,2,0,0|0,0,0]=2 2355 B13R2.3729 O[C@H]1CC2CCCCCC2CC1 Amb25734414 [0,0,0,2,0,0|0,0,0]=2 2356 B13R2.3757 OC1CCC2CCCCCC12O Amb24544342 [0,0,0,2,0,0|1,0,0]=3 2357 B13R2.3757 O[C@]12CCCCC[C@@H]1CCC2=O Amb24608604 [0,0,0,2,0,0|1,0,1]=4 2358 B13R2.3893 O=C1C2CCCCC1CCCC2 Amb25066455 [0,0,0,2,0,0|0,0,2]=4 2359 B13R2.3893 O=C1[C@@H]2CCCC[C@@H]1CCCC2 Amb25128939 [0,0,0,2,0,0|0,0,2]=4 2360 B13R2.3893 O=C1[C@@H]2CCCC[C@H]1CCCC2 Amb25319985 [0,0,0,2,0,0|0,0,2]=4 2361 B13R2.4901 CC1CCCCCN1C2CCC2 Amb25295966 [0,0,0,2,0,0|2,0,0]=4 2362 B13R2.4901 ClC1CCCCCC1C2CCC2 Amb24711004 [0,0,0,2,0,0|1,0,0]=3 2363 B13R2.4901 O=C1CCCCCC1C2CCC2 Amb24712009 [0,0,0,2,0,0|0,0,2]=4 2364 B13R2.4901 OC1CCCCCC1C2CCC2 Amb24566011 [0,0,0,2,0,0|0,0,0]=2 2365 B13R2.8150 CCCOC12CCCCC1C2Cl Amb25159286 [0,0,0,2,0,0|2,0,0]=4 2366 B13R2.8150 CCCO[C@]12CCCC[C@@H]1[C@H]2Cl Amb25249093 [0,0,0,2,0,0|2,0,0]=4 2367 B13R2.5 BrCC1CCCCC12CCCC2 Amb25117066 [0,0,0,2,0,0|1,0,0]=3 2368 B13R2.5 CCC1CCCCC12CNCC2 Amb25273730 [0,0,0,2,0,0|2,0,0]=4 2369 B13R2.5 ClCC1CCCCC12CCCC2 Amb25224808 [0,0,0,2,0,0|1,0,0]=3 2370 B13R2.5 NCC1CCCCC12OCCO2 Amb18561434 [0,0,0,2,0,0|2,0,0]=4 2371 B13R2.5 O=CC1CCCCC12CCCC2 Amb18646650 [0,0,0,2,0,0|0,0,2]=4 2372 B13R2.5 OCC1CCCCC12OCCO2 Amb22363973 [0,0,0,2,0,0|2,0,0]=4 2373 B13R2.5 ONC1CCCCC12CCCC2 Amb25852956 [0,0,0,2,0,0|1,0,0]=3 2374 B13R2.18 CC1CCCCC1C2CNCC2 Amb25302429 [0,0,0,2,0,0|2,0,0]=4 2375 B13R2.18 CC1CCCNC1C2CCCC2 Amb24436223 [0,0,0,2,0,0|2,0,0]=4 2376 B13R2.18 CC1CNCCC1C2CCCC2 Amb25067729 [0,0,0,2,0,0|2,0,0]=4 2377 B13R2.18 CC1CNCCC1C2CCCO2 Amb24735387 [0,0,0,2,0,0|1,0,0]=3 2378 B13R2.18 CN1CCCCC1C2CCCN2 Amb2234913 [0,0,0,2,0,0|2,0,0]=4 2379 B13R2.18 FC1CCCNC1C2CCCC2 Amb25223270 [0,0,0,2,0,0|2,0,0]=4 2380 B13R2.18 NC1CCCCC1C2CCCC2 Amb18947755 [0,0,0,2,0,0|1,0,0]=3 2381 B13R2.18 NC1CCCCC1C2CCCN2 Amb25117253 [0,0,0,2,0,0|2,0,0]=4 2382 B13R2.18 NC1CCCCC1C2COCC2 Amb25697854 [0,0,0,2,0,0|2,0,0]=4 2383 B13R2.18 NC1CNCCC1C2CCCC2 Amb25255696 [0,0,0,2,0,0|2,0,0]=4 2384 B13R2.18 N[C@@H]1CCCC[C@@H]1C2CCCC2 Amb25344804 [0,0,0,2,0,0|1,0,0]=3 2385 B13R2.18 N[C@H]1CCCC[C@H]1C2CCCC2 Amb24512713 [0,0,0,2,0,0|1,0,0]=3 2386 B13R2.18 N[C@H]1CCCC[C@H]1N2CCCC2 Amb24551871 [0,0,0,2,0,0|2,0,0]=4 2387 B13R2.18 O=C1CCCCC1C2CCCC2 Amb18798695 [0,0,0,2,0,0|0,0,2]=4 2388 B13R2.18 O=C1CCCCC1C2CCCO2 Amb25370820 [0,0,0,2,0,0|1,0,1]=4 2389 B13R2.18 OC1CCCCC1C2CCCC2 Amb18799274 [0,0,0,2,0,0|0,0,0]=2 2390 B13R2.18 OC1CCCCC1C2CCCN2 Amb25088113 [0,0,0,2,0,0|1,0,0]=3 2391 B13R2.18 OC1CCCCC1C2COCC2 Amb25266207 [0,0,0,2,0,0|1,0,0]=3 2392 B13R2.18 OC1CCNCC1C2CCCC2 Amb25066512 [0,0,0,2,0,0|1,0,0]=3 2393 B13R2.18 OC1CCOCC1C2CCCN2 Amb25299907 [0,0,0,2,0,0|2,0,0]=4 2394 B13R2.18 OC1CCOCC1C2COCC2 Amb24360994 [0,0,0,2,0,0|2,0,0]=4 2395 B13R2.18 OC1CCOCC1N2CCCC2 Amb18806913 [0,0,0,2,0,0|2,0,0]=4 2396 B13R2.18 O[C@@H]1CCCC[C@H]1N2CCCC2 Amb16230285 [0,0,0,2,0,0|1,0,0]=3 2397 B13R2.18 O[C@@H]1CCNC[C@H]1C2CCCC2 Amb25274269 [0,0,0,2,0,0|1,0,0]=3 2398 B13R2.18 O[C@H]1CCCC[C@@H]1C2OCCO2 Amb24520428 [0,0,0,2,0,0|2,0,0]=4 2399 B13R2.29 BrC1CCCC1CC2COCC2 Amb24538804 [0,0,0,2,0,0|2,0,0]=4 2400 B13R2.29 BrC1CSCC1CC2CCCC2 Amb24493096 [0,0,0,2,0,0|2,0,0]=4 2401 B13R2.29 BrC1CSCC1CC2CCCO2 Amb25340052 [0,0,0,2,0,0|2,0,0]=4 2402 B13R2.29 CC1CCCN1CC2CCCC2 Amb25115679 [0,0,0,2,0,0|2,0,0]=4 2403 B13R2.29 CC1CCCN1CC2CCCN2 Amb18950679 [0,0,0,2,0,0|2,0,0]=4 2404 B13R2.29 CC1CCCN1CC2OCCO2 Amb25136065 [0,0,0,2,0,0|2,0,0]=4 2405 B13R2.29 CC1CCCN1C[C@@H]2CCCN2 Amb24649930 [0,0,0,2,0,0|2,0,0]=4 2406 B13R2.29 CC1OCCC1SC2CCCO2 Amb25763672 [0,0,0,2,0,0|2,0,0]=4 2407 B13R2.29 C[C@@H]1CCCN1C[C@@H]2CCCN2 Amb22745131 [0,0,0,2,0,0|2,0,0]=4 2408 B13R2.29 C[C@@H]1CCCN1C[C@@H]2CCCN2 Amb22745139 [0,0,0,2,0,0|2,0,0]=4 2409 B13R2.29 C[C@H]1CCC[C@@H]1NC2CCCC2 Amb25208873 [0,0,0,2,0,0|2,0,0]=4 2410 B13R2.29 ClC1CCCC1CC2CCCO2 Amb19072172 [0,0,0,2,0,0|1,0,0]=3 2411 B13R2.29 ClC1CCCC1CC2COCC2 Amb24538803 [0,0,0,2,0,0|2,0,0]=4 2412 B13R2.29 ClC1CSCC1CC2CCCC2 Amb24580607 [0,0,0,2,0,0|2,0,0]=4 2413 B13R2.29 ClC1CSCC1CC2CCCO2 Amb24525145 [0,0,0,2,0,0|2,0,0]=4 2414 B13R2.29 FC1CNCC1CC2CCCC2 Amb24651324 [0,0,0,2,0,0|2,0,0]=4 2415 B13R2.29 F[C@@H]1CCC[C@@H]1NC2CCCC2 Amb25032045 [0,0,0,2,0,0|2,0,0]=4 2416 B13R2.29 F[C@H]1CCC[C@H]1NC2CCCC2 Amb25323537 [0,0,0,2,0,0|2,0,0]=4 2417 B13R2.29 NC1CCCC1CC2CCCC2 Amb18955321 [0,0,0,2,0,0|1,0,0]=3 2418 B13R2.29 NC1CCCC1CC2CCCO2 Amb18801471 [0,0,0,2,0,0|1,0,0]=3 2419 B13R2.29 NC1CCCC1CN2CCCC2 Amb17490253 [0,0,0,2,0,0|2,0,0]=4 2420 B13R2.29 NC1CCCC1NC2CCCC2 Amb23596686 [0,0,0,2,0,0|2,0,0]=4 2421 B13R2.29 NC1CCCC1OC2CCCC2 Amb1138295 [0,0,0,2,0,0|2,0,0]=4 2422 B13R2.29 NC1CCCC1SC2CCCC2 Amb25330347 [0,0,0,2,0,0|2,0,0]=4 2423 B13R2.29 NC1CCOC1CC2CCCC2 Amb25336946 [0,0,0,2,0,0|2,0,0]=4 2424 B13R2.29 NC1CSCC1CC2CCCC2 Amb25816435 [0,0,0,2,0,0|2,0,0]=4 2425 B13R2.29 O=C1CCCC1CC2CCCC2 Amb18177839 [0,0,0,2,0,0|0,0,2]=4 2426 B13R2.29 O=C1CCCC1CC2CCCO2 Amb18799108 [0,0,0,2,0,0|1,0,1]=4 2427 B13R2.29 OC1CCCC1CC2CCCC2 Amb18805996 [0,0,0,2,0,0|0,0,0]=2 2428 B13R2.29 OC1CCCC1CC2CCCO2 Amb18801884 [0,0,0,2,0,0|1,0,0]=3 2429 B13R2.29 OC1CCCC1CN2CCCC2 Amb18801464 [0,0,0,2,0,0|1,0,0]=3 2430 B13R2.29 OC1CCCC1NC2CCCC2 Amb18950099 [0,0,0,2,0,0|1,0,0]=3 2431 B13R2.29 OC1CCCC1NC2COCC2 Amb25343155 [0,0,0,2,0,0|2,0,0]=4 2432 B13R2.29 OC1CNCC1SC2CCCC2 Amb25667136 [0,0,0,2,0,0|2,0,0]=4 2433 B13R2.29 OC1COCC1NC2CCCC2 Amb18281486 [0,0,0,2,0,0|2,0,0]=4 2434 B13R2.29 O[C@@H]1CCC[C@H]1NC2CCCC2 Amb24697497 [0,0,0,2,0,0|1,0,0]=3 2435 B13R2.29 O[C@@H]1CCC[C@H]1NC2COCC2 Amb25362786 [0,0,0,2,0,0|2,0,0]=4 2436 B13R2.29 O[C@@H]1CCC[C@H]1NC2CSCC2 Amb24739138 [0,0,0,2,0,0|2,0,0]=4 2437 B13R2.29 O[C@@H]1CCC[C@H]1SC2CCCC2 Amb25735684 [0,0,0,2,0,0|1,0,0]=3 2438 B13R2.29 O[C@@H]1CNC[C@H]1NC2CCCC2 Amb25371280 [0,0,0,2,0,0|2,0,0]=4 2439 B13R2.29 O[C@H]1CCC[C@@H]1CC2OCCO2 Amb25176833 [0,0,0,2,0,0|2,0,0]=4 2440 B13R2.29 O[C@H]1CCC[C@@H]1NC2CCCC2 Amb25310695 [0,0,0,2,0,0|1,0,0]=3 2441 B13R2.37 CCCN1CCCC12CCCC2 Amb25851981 [0,0,0,2,0,0|2,0,0]=4 2442 B13R2.37 CCNC1CCCC12CCCC2 Amb24601726 [0,0,0,2,0,0|2,0,0]=4 2443 B13R2.37 FCCN1CCCC12CCCC2 Amb24686150 [0,0,0,2,0,0|2,0,0]=4 2444 B13R2.37 ICCN1CCCC12CCCC2 Amb24685970 [0,0,0,2,0,0|2,0,0]=4 2445 B13R2.37 NCCC1CCCC12OCCO2 Amb24390859 [0,0,0,2,0,0|2,0,0]=4 2446 B13R2.37 NCCN1CCCC12CCCC2 Amb24427110 [0,0,0,2,0,0|2,0,0]=4 2447 B13R2.37 OCCC1NCCC12CCCC2 Amb24679442 [0,0,0,2,0,0|1,0,0]=3 2448 B13R2.39 CCCNC1CCC12CCCC2 Amb25681109 [0,0,0,2,0,0|2,0,0]=4 2449 B13R2.39 FCCNC1CCC12CCCC2 Amb25283853 [0,0,0,2,0,0|2,0,0]=4 2450 B13R2.39 OCCNC1CCC12CCCC2 Amb24671988 [0,0,0,2,0,0|1,0,0]=3 2451 B13R2.61 CCC1CCCC1C2CNCC2 Amb24628403 [0,0,0,2,0,0|2,0,0]=4 2452 B13R2.61 CCC1CCCC1N2CCCC2 Amb24706510 [0,0,0,2,0,0|2,0,0]=4 2453 B13R2.61 CCC1NCCC1C2CCCC2 Amb18961067 [0,0,0,2,0,0|2,0,0]=4 2454 B13R2.61 CCC1OCCC1C2CCCN2 Amb24394785 [0,0,0,2,0,0|2,0,0]=4 2455 B13R2.61 CCN1CCCC1C2CCCN2 Amb18285902 [0,0,0,2,0,0|2,0,0]=4 2456 B13R2.61 CCN1CCCC1C2CCCO2 Amb24414828 [0,0,0,2,0,0|1,0,0]=3 2457 B13R2.61 CNC1CCCC1C2CCCC2 Amb18286604 [0,0,0,2,0,0|2,0,0]=4 2458 B13R2.61 CNC1CCCC1C2CCCN2 Amb25677194 [0,0,0,2,0,0|2,0,0]=4 2459 B13R2.61 COC1CCCC1C2CCCN2 Amb25733413 [0,0,0,2,0,0|2,0,0]=4 2460 B13R2.61 FCC1CCCN1C2CCCC2 Amb25094154 [0,0,0,2,0,0|2,0,0]=4 2461 B13R2.61 N#CC1CCCC1C2CCCC2 Amb24403959 [0,0,0,2,0,0|1,0,1]=4 2462 B13R2.61 NCC1CCCC1C2CCCC2 Amb25674273 [0,0,0,2,0,0|1,0,0]=3 2463 B13R2.61 NCC1CCCN1C2CCCC2 Amb18908766 [0,0,0,2,0,0|2,0,0]=4 2464 B13R2.61 NCC1CCNC1C2CCCC2 Amb18826295 [0,0,0,2,0,0|2,0,0]=4 2465 B13R2.61 NCC1CCOC1C2CCCC2 Amb25198414 [0,0,0,2,0,0|2,0,0]=4 2466 B13R2.61 NCC1CCOC1C2CCCO2 Amb24704952 [0,0,0,2,0,0|2,0,0]=4 2467 B13R2.61 OCC1CCCN1C2CCCC2 Amb18806282 [0,0,0,2,0,0|1,0,0]=3 2468 B13R2.61 OCC1CCCN1C2CNCC2 Amb17134928 [0,0,0,2,0,0|2,0,0]=4 2469 B13R2.61 OCC1CCNC1C2CCCC2 Amb24654980 [0,0,0,2,0,0|1,0,0]=3 2470 B13R2.61 OCC1CCOC1C2COCC2 Amb25857331 [0,0,0,2,0,0|2,0,0]=4 2471 B13R2.61 OC[C@@H]1CCCN1C2CCSC2 Amb25072201 [0,0,0,2,0,0|2,0,0]=4 2472 B13R2.61 OC[C@@H]1CCC[C@@H]1N2CCCC2 Amb25361490 [0,0,0,2,0,0|1,0,0]=3 2473 B13R2.62 CCC1CCC1NC2CCCC2 Amb25136009 [0,0,0,2,0,0|2,0,0]=4 2474 B13R2.62 CCC1CCN1CC2CCCO2 Amb24633097 [0,0,0,2,0,0|1,0,0]=3 2475 B13R2.158 CC1CCC1NCC2CCCC2 Amb24718934 [0,0,0,2,0,0|2,0,0]=4 2476 B13R2.158 CC1CCC1NCC2CCCN2 Amb24743165 [0,0,0,2,0,0|2,0,0]=4 2477 B13R2.158 CC1CCC1NCC2CCCO2 Amb25719141 [0,0,0,2,0,0|1,0,0]=3 2478 B13R2.183 C(CC1CCCN1)C2CCCN2 Amb23456069 [0,0,0,2,0,0|2,0,0]=4 2479 B13R2.183 C(CC1CCCN1)C2CCCO2 Amb25093262 [0,0,0,2,0,0|1,0,0]=3 2480 B13R2.183 C(CC=1CCCC1)C2CCCC2 Amb25265425 [0,0,0,2,0,0|1,0,1]=4 2481 B13R2.183 C(CN1CCCC1)[C@@H]2CCCN2 Amb25205891 [0,0,0,2,0,0|2,0,0]=4 2482 B13R2.183 C(CN1CCCN1)C2CCCC2 Amb25281057 [0,0,0,2,0,0|2,0,0]=4 2483 B13R2.183 C(CN1CCCO1)C2CCCC2 Amb24407947 [0,0,0,2,0,0|1,0,0]=3 2484 B13R2.183 C(NC1CCCC1)C2CCCO2 Amb21953988 [0,0,0,2,0,0|1,0,0]=3 2485 B13R2.183 C(NC1CCCC1)[C@@H]2CCCO2 Amb25739161 [0,0,0,2,0,0|1,0,0]=3 2486 B13R2.183 C(NC1CCCC1)[C@H]2CCCN2 Amb24493425 [0,0,0,2,0,0|2,0,0]=4 2487 B13R2.183 C(OC1CCCC1)[C@H]2CCCN2 Amb24367018 [0,0,0,2,0,0|2,0,0]=4 2488 B13R2.183 C(OC1CCCO1)C2CCCC2 Amb22752557 [0,0,0,2,0,0|1,0,0]=3 2489 B13R2.183 C(SC1CCCC1)C2CCCC2 Amb24625165 [0,0,0,2,0,0|2,0,0]=4 2490 B13R2.183 C(SC1CCCO1)C2CCCO2 Amb24458296 [0,0,0,2,0,0|2,0,0]=4 2491 B13R2.183 C1CCC(C1)NCC2CCCN2 Amb17232682 [0,0,0,2,0,0|2,0,0]=4 2492 B13R2.183 C1CCC(C1)[NH2+]CC2CCCC2 Amb10558681 [0,0,0,2,0,0|2,0,0]=4 2493 B13R2.183 C1CCCC1CCC2CCCN2 Amb20668231 [0,0,0,2,0,0|1,0,0]=3 2494 B13R2.183 C1CCN(C1)CCC2CCCN2 Amb17504835 [0,0,0,2,0,0|2,0,0]=4 2495 B13R2.183 C1CN[C@@H](C1)COC2CCCC2 Amb17083729 [0,0,0,2,0,0|2,0,0]=4 2496 B13R2.183 C1NCC(COC2CCCC2)O1 Amb24451721 [0,0,0,2,0,0|2,0,0]=4 2497 B13R2.183 C1NCCC1NCC2CCCO2 Amb25346964 [0,0,0,2,0,0|2,0,0]=4 2498 B13R2.183 C1NCCC1OCC2CCCO2 Amb18994641 [0,0,0,2,0,0|2,0,0]=4 2499 B13R2.183 C1OCCC1CCC2CCCN2 Amb24630695 [0,0,0,2,0,0|2,0,0]=4 2500 B13R2.183 C1OCCC1NCC2CCCO2 Amb25115177 [0,0,0,2,0,0|2,0,0]=4 2501 B13R2.292 CCNC1CCCC2OCCC21 Amb23560386 [0,0,0,2,0,0|1,0,0]=3 2502 B13R2.292 ClCCN1CCCC2CCCC12 Amb25222531 [0,0,0,2,0,0|2,0,0]=4 2503 B13R2.292 FCCN1CCCC2CCCC12 Amb25845756 [0,0,0,2,0,0|2,0,0]=4 2504 B13R2.292 NCCC1CCCN2CCCC21 Amb18826272 [0,0,0,2,0,0|2,0,0]=4 2505 B13R2.292 NCCN1CCCC2CCCC12 Amb24475984 [0,0,0,2,0,0|2,0,0]=4 2506 B13R2.292 OCCN1CCCC2CCCC12 Amb24425927 [0,0,0,2,0,0|1,0,0]=3 2507 B13R2.292 OCCN1CCCC2CNCC12 Amb24657831 [0,0,0,2,0,0|2,0,0]=4 2508 B13R2.292 OCCN1CCOC2CCCC12 Amb18802269 [0,0,0,2,0,0|2,0,0]=4 2509 B13R2.292 OCC[C@@H]1CCC[C@@H]2CCCN21 Amb24598283 [0,0,0,2,0,0|1,0,0]=3 2510 B13R2.468 FCCCN1CCC2CCCC12 Amb24497954 [0,0,0,2,0,0|2,0,0]=4 2511 B13R2.468 ICCCN1CCC2CCCC12 Amb25845066 [0,0,0,2,0,0|2,0,0]=4 2512 B13R2.468 NCCCN1CCC2CCCC12 Amb25838521 [0,0,0,2,0,0|2,0,0]=4 2513 B13R2.468 OCCCC1CCC2CCCN21 Amb24362724 [0,0,0,2,0,0|1,0,0]=3 2514 B13R2.468 OCCCN1CCC2CCCC12 Amb25043440 [0,0,0,2,0,0|1,0,0]=3 2515 B13R2.468 OCCNC1CCN2CCCC21 Amb18985005 [0,0,0,2,0,0|2,0,0]=4 2516 B13R2.468 SCCCN1CCC2CCCC12 Amb25059499 [0,0,0,2,0,0|1,1,0]=4 2517 B13R2.628 CCC1NCCCN2CCCC21 Amb18826248 [0,0,0,2,0,0|2,0,0]=4 2518 B13R2.676 C1OCCCCOC2CC1CC2 Amb24093566 [0,0,0,2,0,0|1,0,0]=3 2519 B13R2.677 C1CC(CCCN1)N2CCCO2 Amb25034871 [0,0,0,2,0,0|2,0,0]=4 2520 B13R2.677 C1CCC(C1)N2CCCCCC2 Amb17940334 [0,0,0,2,0,0|2,0,0]=4 2521 B13R2.677 C1CCCCCC1C2CCCN2 Amb18799000 [0,0,0,2,0,0|1,0,0]=3 2522 B13R2.677 C1CCCN1C2CCCCCC2 Amb25277983 [0,0,0,2,0,0|2,0,0]=4 2523 B13R2.677 C1CCNC(CC1)C2CCCC2 Amb2235833 [0,0,0,2,0,0|1,0,0]=3 2524 B13R2.677 C1CCNC(CC1)C2CCCC2 Amb2237248 [0,0,0,2,0,0|1,0,0]=3 2525 B13R2.677 C1CNCCCC1C2CCCC2 Amb25256199 [0,0,0,2,0,0|2,0,0]=4 2526 B13R2.677 C1NCCC1C2CCCCCC2 Amb24610366 [0,0,0,2,0,0|2,0,0]=4 2527 B13R2.677 C1NCCCCC1C2CCCC2 Amb25679428 [0,0,0,2,0,0|2,0,0]=4 2528 B13R2.2380 C(NCCC1CC1)C2CCCC2 Amb23570766 [0,0,0,2,0,0|2,0,0]=4 2529 B13R2.2380 C(NCCC1CC1)C2CCCO2 Amb18180228 [0,0,0,2,0,0|1,0,0]=3 2530 B13R2.2380 C1CC1CCCNC2CCCC2 Amb23570693 [0,0,0,2,0,0|2,0,0]=4 2531 B13R2.2381 C(OCC1CCCO1)C2CCN2 Amb21959287 [0,0,0,2,0,0|2,0,0]=4 2532 B13R2.2381 C1NCC1COCC2CCCO2 Amb21959285 [0,0,0,2,0,0|2,0,0]=4 2533 B13R2.2520 CCCCNC1CC2CC1CC2 Amb18788723 [0,0,0,2,0,0|2,0,0]=4 2534 B13R2.2520 NCCCCC1CC2CC1CC2 Amb2371667 [0,0,0,2,0,0|1,0,0]=3 2535 B13R2.2520 OCCC#CC1CC2CCC1C2 Amb24412057 [0,0,0,2,0,0|0,0,2]=4 2536 B13R2.4131 OCCN1CCNC2CC1CC2 Amb25242831 [0,0,0,2,0,0|2,0,0]=4 2537 B13R2.8000 C1CCCCCCC12NCCO2 Amb24355328 [0,0,0,2,0,0|1,0,0]=3 2538 B13R2.8000 C1CCCCCCC12NCCS2 Amb24693909 [0,0,0,2,0,0|1,1,0]=4 2539 B13R2.8000 C1NCCC12CCCCCCC2 Amb18278143 [0,0,0,2,0,0|2,0,0]=4 2540 B13R2.70 C\C=C\C1CC2CCCC2C1O Amb25129679 [0,0,0,2,0,0|0,0,2]=4 2541 B13R2.70 OCCC1CC2CCCC2C1=O Amb25306796 [0,0,0,2,0,0|1,0,1]=4 2542 B13R2.84 CC[C@H]1CCN2CCC[C@H]2[C@@H]1O Amb25234792 [0,0,0,2,0,0|1,0,0]=3 2543 B13R2.84 CC[C@H]1CCN2CCC[C@H]2[C@H]1O Amb25261866 [0,0,0,2,0,0|1,0,0]=3 2544 B13R2.84 CN1C(CN)CCC2CCCC12 Amb25126486 [0,0,0,2,0,0|2,0,0]=4 2545 B13R2.85 CCC1CNC2CCCC2CO1 Amb24757387 [0,0,0,2,0,0|1,0,0]=3 2546 B13R2.104 CC1CCCC12CCNC2CO Amb25044106 [0,0,0,2,0,0|1,0,0]=3 2547 B13R2.105 CC1CCN1C2CCCC2CN Amb25086924 [0,0,0,2,0,0|2,0,0]=4 2548 B13R2.105 CC1CCN1[C@@H]2CCC[C@@H]2CO Amb24738921 [0,0,0,2,0,0|1,0,0]=3 2549 B13R2.209 C[C@@H]1[C@H]2CCC[C@@H]2CCCC1=O Amb25263622 [0,0,0,2,0,0|0,0,2]=4 2550 B13R2.209 C[C@H]1[C@H]2CCC[C@@H]2CCCC1=O Amb24583050 [0,0,0,2,0,0|0,0,2]=4 2551 B13R2.210 O=C1CCC2CCCC2CCC1 Amb25707525 [0,0,0,2,0,0|0,0,2]=4 2552 B13R2.449 CCCC1CN2CCCC2CN1 Amb21964710 [0,0,0,2,0,0|2,0,0]=4 2553 B13R2.449 CCOC1CCC2CCCC2O1 Amb24083959 [0,0,0,2,0,0|1,0,0]=3 2554 B13R2.449 CNCC1CC2CCCC2CC1 Amb24664741 [0,0,0,2,0,0|2,0,0]=4 2555 B13R2.449 COCC1CCC2CCCC2N1 Amb25773475 [0,0,0,2,0,0|2,0,0]=4 2556 B13R2.449 COC[C@@H]1CC[C@H]2NCC[C@H]2O1 Amb22173242 [0,0,0,2,0,0|2,0,0]=4 2557 B13R2.449 COC[C@H]1CC[C@H]2NCC[C@H]2O1 Amb22173048 [0,0,0,2,0,0|2,0,0]=4 2558 B13R2.449 NCCC1CC2CCCN2CC1 Amb18826243 [0,0,0,2,0,0|2,0,0]=4 2559 B13R2.449 OCCN1CC2CCCN2CC1 Amb24487630 [0,0,0,2,0,0|2,0,0]=4 2560 B13R2.449 OCCN1CC2CCNC2CC1 Amb24497933 [0,0,0,2,0,0|2,0,0]=4 2561 B13R2.595 CC1CC1CN2CCCC2CC Amb24674896 [0,0,0,2,0,0|2,0,0]=4 2562 B13R2.595 CC1CC1CN2CCCC2CN Amb24473998 [0,0,0,2,0,0|2,0,0]=4 2563 B13R2.595 CC1CC1CN2CCC[C@@H]2CO Amb24397789 [0,0,0,2,0,0|1,0,0]=3 2564 B13R2.595 C[C@@H]1C[C@H]1NC2CCCC2CC Amb25220859 [0,0,0,2,0,0|2,0,0]=4 2565 B13R2.1650 OCC1CCCC1\C=C\C2CC2 Amb25796299 [0,0,0,2,0,0|0,0,2]=4 2566 B13R2.1650 OC[C@@H]1CCC[C@@H]1\C=C\C2CC2 Amb24588369 [0,0,0,2,0,0|0,0,2]=4 2567 B13R2.1680 CCC1CCCN1CC2CCC2 Amb25763778 [0,0,0,2,0,0|2,0,0]=4 2568 B13R2.1680 NCC1CCCC1NC2CCC2 Amb25335168 [0,0,0,2,0,0|2,0,0]=4 2569 B13R2.1680 NC[C@@H]1CCCN1CC2CCC2 Amb25674094 [0,0,0,2,0,0|2,0,0]=4 2570 B13R2.1680 NC[C@H]1CCCN1CC2CCC2 Amb24700189 [0,0,0,2,0,0|2,0,0]=4 2571 B13R2.1680 OCC1CCCC1NC2CCC2 Amb24727784 [0,0,0,2,0,0|1,0,0]=3 2572 B13R2.1680 OCC1CCCC1NC2CNC2 Amb25724800 [0,0,0,2,0,0|2,0,0]=4 2573 B13R2.1680 OC[C@@H]1CCCN1CC2CCC2 Amb24666183 [0,0,0,2,0,0|1,0,0]=3 2574 B13R2.1680 OC[C@@H]1CCC[C@@H]1NC2CNC2 Amb25772291 [0,0,0,2,0,0|2,0,0]=4 2575 B13R2.1680 OC[C@@H]1CCC[C@@H]1NC2COC2 Amb24443225 [0,0,0,2,0,0|2,0,0]=4 2576 B13R2.2093 OCC1CON2CCCCCC21 Amb24354302 [0,0,0,2,0,0|2,0,0]=4 2577 B13R2.2351 N#C[C@]12CCC[C@H]1CCC[C@H]2O Amb25221521 [0,0,0,2,0,0|1,0,1]=4 2578 B13R2.2356 OCC1CC1N2CCCC2CO Amb25845005 [0,0,0,2,0,0|2,0,0]=4 2579 B13R2.2356 OCC1CC1N2CCC[C@@H]2CO Amb25042515 [0,0,0,2,0,0|2,0,0]=4 2580 B13R2.2401 CCNC1CC2CC1CC2CC Amb24419743 [0,0,0,2,0,0|2,0,0]=4 2581 B13R2.2401 CCN[C@H]1C[C@@H]2C[C@H]1C[C@@H]2CC Amb25302211 [0,0,0,2,0,0|2,0,0]=4 2582 B13R2.2488 OC[C@H]1C[C@@H]2C[C@H]1CC[C@@H]2C=O Amb25245404 [0,0,0,2,0,0|1,0,1]=4 2583 B13R2.6697 C\C=C/1\CCC2CCCC12CO Amb25280260 [0,0,0,2,0,0|0,0,2]=4 2584 B13R2.9417 CCN1C2CCC1CCCC2O Amb24450991 [0,0,0,2,0,0|1,0,0]=3 2585 B13R2.9417 CCN1C2CCC1CCC[C@@H]2O Amb25787386 [0,0,0,2,0,0|1,0,0]=3 2586 B13R2.283 C\C=C\C1C2CCCC2CC1O Amb25266425 [0,0,0,2,0,0|0,0,2]=4 2587 B13R2.372 O=C1CCCCCCC1C2CC2 Amb25768528 [0,0,0,2,0,0|0,0,2]=4 2588 B13R2.1573 CCN1CC2CCCCCCC12 Amb25105559 [0,0,0,2,0,0|2,0,0]=4 2589 B13R2.2956 CCC[C@H]1[C@@H]2CCCC[C@@H]2C1=O Amb24612437 [0,0,0,2,0,0|0,0,2]=4 2590 B13R2.3312 OC12CCCCCCC1CC2=O Amb24537748 [0,0,0,2,0,0|1,0,1]=4 2591 B13R2.3312 O[C@@H]1C[C@@H]2CCCCCC[C@]12O Amb24698621 [0,0,0,2,0,0|1,0,0]=3 2592 B13R2.3680 O=C1CCC2CCCC1CCC2 Amb24591402 [0,0,0,2,0,0|0,0,2]=4 2593 B13R2.3907 OC1[C@H]2CCC[C@H]1CCCCC2 Amb25356311 [0,0,0,2,0,0|0,0,0]=2 2594 B13R2.4137 CC12CCCC1OCC2CCO Amb25280305 [0,0,0,2,0,0|1,0,0]=3 2595 B13R2.4137 C[C@@]12CCC[C@@H]1OC[C@@H]2CCO Amb24625289 [0,0,0,2,0,0|1,0,0]=3 2596 B13R2.4688 OC1CC2CCCCCCC2=C1 Amb25115934 [0,0,0,2,0,0|0,0,2]=4 2597 B13R2.4688 OC1CC2CCCCCCC2C1 Amb24362736 [0,0,0,2,0,0|0,0,0]=2 2598 B13R2.4688 OC1CC2CCCCCCC2O1 Amb25686182 [0,0,0,2,0,0|1,0,0]=3 2599 B13R2.7787 C=C[C@@H]1[C@H]2[C@H](O)CCCCC[C@H]21 Amb24515387 [0,0,0,2,0,0|0,0,2]=4 2600 B13R2.7802 CC12CCC=CCCC1C2CO Amb25676695 [0,0,0,2,0,0|0,0,2]=4 2601 B13R2.7802 C[C@]12CCC=CCC[C@H]1[C@@H]2CO Amb25276868 [0,0,0,2,0,0|0,0,2]=4 2602 B13R2.45 CC1C(CO)CC2CCCCN21 Amb24341687 [0,0,0,2,0,0|1,0,0]=3 2603 B13R2.45 OC1C2CCCCC2CC1CO Amb24748213 [0,0,0,2,0,0|1,0,0]=3 2604 B13R2.45 OCC1CC2CCCCC2C1=O Amb25347607 [0,0,0,2,0,0|1,0,1]=4 2605 B13R2.45 O[C@H]1[C@H]2CCCC[C@H]2C[C@H]1CO Amb25306519 [0,0,0,2,0,0|1,0,0]=3 2606 B13R2.135 CC1ON2CCCCC2C1CO Amb24430130 [0,0,0,2,0,0|2,0,0]=4 2607 B13R2.135 CCC1C2CCCCC2CC1=O Amb25053002 [0,0,0,2,0,0|0,0,2]=4 2608 B13R2.135 CN1CC2CCCCC2C1CN Amb25694164 [0,0,0,2,0,0|2,0,0]=4 2609 B13R2.135 O[C@@H]1C[C@H]2CCCC[C@H]2[C@H]1CO Amb25175231 [0,0,0,2,0,0|1,0,0]=3 2610 B13R2.135 O[C@H]1C[C@H]2CCCC[C@H]2[C@H]1CO Amb25175232 [0,0,0,2,0,0|1,0,0]=3 2611 B13R2.386 CC1CCCCC2CCC1C2=O Amb25839284 [0,0,0,2,0,0|0,0,2]=4 2612 B13R2.386 O[C@H]1CCCC[C@@H]2CC[C@H]1C2=O Amb24512648 [0,0,0,2,0,0|1,0,1]=4 2613 B13R2.599 CC1CC2CCCC2CC1CN Amb25719492 [0,0,0,2,0,0|1,0,0]=3 2614 B13R2.599 COC1CC2CCCC2CC1O Amb25198867 [0,0,0,2,0,0|1,0,0]=3 2615 B13R2.599 N#CC1CC2CCCC2CC1O Amb24688051 [0,0,0,2,0,0|1,0,1]=4 2616 B13R2.2352 C=C1CCC2CCCCC12CO Amb24493581 [0,0,0,2,0,0|0,0,2]=4 2617 B13R2.2352 C[C@@H]1CC[C@@H]2CCCC[C@@]21CO Amb25205051 [0,0,0,2,0,0|0,0,0]=2 2618 B13R2.2352 C[C@H]1CC[C@@H]2CCCC[C@@]21C=O Amb25358894 [0,0,0,2,0,0|0,0,2]=4 2619 B13R2.2352 N#CC12CCCCC1CCC2O Amb24379816 [0,0,0,2,0,0|1,0,1]=4 2620 B13R2.2721 CC1C2CCCCCC2C1NC Amb25674318 [0,0,0,2,0,0|2,0,0]=4 2621 B13R2.2721 CCC1C(N)C2CCCCCC21 Amb24445880 [0,0,0,2,0,0|1,0,0]=3 2622 B13R2.3625 OC1CCCCCCCC12CC2 Amb25156912 [0,0,0,2,0,0|0,0,0]=2 2623 B13R2.4787 O=C1CC2CCCCCCCC12 Amb24434617 [0,0,0,2,0,0|0,0,2]=4 2624 B13R2.32 CC1C(O)CCC2CCCCN21 Amb25676669 [0,0,0,2,0,0|1,0,0]=3 2625 B13R2.32 CC1C(O)CCC2CCNCC21 Amb24537738 [0,0,0,2,0,0|1,0,0]=3 2626 B13R2.32 CC1C2CCCCC2CCC1=O Amb24059409 [0,0,0,2,0,0|0,0,2]=4 2627 B13R2.32 CC1CCC=2CCCCC2C1O Amb24630825 [0,0,0,2,0,0|0,0,2]=4 2628 B13R2.32 CC1CC[C@H]2CCCC[C@@H]2C1=O Amb24512415 [0,0,0,2,0,0|0,0,2]=4 2629 B13R2.32 CC1[C@@H]2CCCC[C@H]2CCC1=O Amb24736227 [0,0,0,2,0,0|0,0,2]=4 2630 B13R2.32 CC=1C(O)CCC2CCCCC12 Amb25058463 [0,0,0,2,0,0|0,0,2]=4 2631 B13R2.32 CC=1[C@@H](O)CC[C@H]2CCCCC12 Amb25221039 [0,0,0,2,0,0|0,0,2]=4 2632 B13R2.32 C[C@@H]1CC[C@H]2CCCC[C@@H]2[C@H]1N Amb25238245 [0,0,0,2,0,0|1,0,0]=3 2633 B13R2.32 C[C@H]1CCC2=CCCC[C@@H]2[C@@H]1O Amb24576960 [0,0,0,2,0,0|0,0,2]=4 2634 B13R2.32 C[C@H]1CC[C@@H]2CCCC[C@@H]2[C@@H]1N Amb24695163 [0,0,0,2,0,0|1,0,0]=3 2635 B13R2.32 C[C@H]1[C@H](O)CC[C@H]2CCCC[C@@H]21 Amb24748354 [0,0,0,2,0,0|0,0,0]=2 2636 B13R2.32 NC1CC[C@H]2CCCC[C@@H]2[C@H]1O Amb24610214 [0,0,0,2,0,0|1,0,0]=3 2637 B13R2.32 OC1CCC2CCCCC2C1=O Amb24647786 [0,0,0,2,0,0|1,0,1]=4 2638 B13R2.32 OC1CCC2CCCCC2C1Cl Amb25311196 [0,0,0,2,0,0|1,0,0]=3 2639 B13R2.32 OC1CCC2CCCCC2C1F Amb25056889 [0,0,0,2,0,0|1,0,0]=3 2640 B13R2.32 OC1CCC2CCCCC2C1O Amb25206579 [0,0,0,2,0,0|1,0,0]=3 2641 B13R2.32 O[C@@H]1CC[C@H]2CCCC[C@@H]2[C@H]1Cl Amb25228499 [0,0,0,2,0,0|1,0,0]=3 2642 B13R2.32 O[C@@H]1CC[C@H]2CCCC[C@@H]2[C@H]1F Amb24515508 [0,0,0,2,0,0|1,0,0]=3 2643 B13R2.32 O[C@@H]1[C@H](Cl)CC[C@H]2CCCC[C@@H]21 Amb24519205 [0,0,0,2,0,0|1,0,0]=3 2644 B13R2.32 O[C@H]1CC[C@H]2CCCC[C@@H]2[C@H]1Cl Amb25172920 [0,0,0,2,0,0|1,0,0]=3 2645 B13R2.32 O[C@H]1[C@@H](Cl)CC[C@H]2CCCC[C@@H]21 Amb24617758 [0,0,0,2,0,0|1,0,0]=3 2646 B13R2.32 O[C@H]1[C@@H](F)CC[C@H]2CCCC[C@@H]21 Amb24705848 [0,0,0,2,0,0|1,0,0]=3 2647 B13R2.33 CC1CCC2CCCCN2CO1 Amb25143997 [0,0,0,2,0,0|1,0,0]=3 2648 B13R2.33 CC1CCN2CCCCC2CN1 Amb25212511 [0,0,0,2,0,0|2,0,0]=4 2649 B13R2.33 CC1CNC2CCCCC2CO1 Amb25156599 [0,0,0,2,0,0|1,0,0]=3 2650 B13R2.33 O=C1CCC2CCCCC2CC1 Amb24723947 [0,0,0,2,0,0|0,0,2]=4 2651 B13R2.57 BrCC1CC2CCCCC2CC1 Amb25719940 [0,0,0,2,0,0|1,0,0]=3 2652 B13R2.57 CCC1CN2CCCCC2CN1 Amb20623228 [0,0,0,2,0,0|2,0,0]=4 2653 B13R2.57 CCC1CNC2CCCCC2N1 Amb25824685 [0,0,0,2,0,0|2,0,0]=4 2654 B13R2.57 COC1CCC2CCNCC2O1 Amb25327251 [0,0,0,2,0,0|2,0,0]=4 2655 B13R2.57 ICC1CC2CCCCC2CC1 Amb25323964 [0,0,0,2,0,0|1,0,0]=3 2656 B13R2.57 N#CC1CC2CCCCC2CC1 Amb24362114 [0,0,0,2,0,0|1,0,1]=4 2657 B13R2.57 NCC1CC2CCCCN2CC1 Amb18826244 [0,0,0,2,0,0|2,0,0]=4 2658 B13R2.57 NCC1CN2CCCCC2CC1 Amb18647081 [0,0,0,2,0,0|2,0,0]=4 2659 B13R2.57 NCC1OCC2N(C1)CCCC2 Amb17138663 [0,0,0,2,0,0|2,0,0]=4 2660 B13R2.57 NC[C@@H]1CN2CCCC[C@@H]2CC1 Amb24590222 [0,0,0,2,0,0|2,0,0]=4 2661 B13R2.57 NC[C@@H]1CN2CCCC[C@H]2CC1 Amb24616841 [0,0,0,2,0,0|2,0,0]=4 2662 B13R2.57 NNC1CC2CCCCC2CC1 Amb25244363 [0,0,0,2,0,0|2,0,0]=4 2663 B13R2.57 O=CC1C[C@H]2CCCC[C@H]2CC1 Amb25216160 [0,0,0,2,0,0|0,0,2]=4 2664 B13R2.57 OCC1CC2CCCCC2CN1 Amb25068328 [0,0,0,2,0,0|1,0,0]=3 2665 B13R2.57 OCC1CC2CCCCC2NC1 Amb24732073 [0,0,0,2,0,0|1,0,0]=3 2666 B13R2.57 OCC1CC2CCOCC2CC1 Amb25198849 [0,0,0,2,0,0|1,0,0]=3 2667 B13R2.57 OCC1CC2CSCCC2NC1 Amb25122086 [0,0,0,2,0,0|2,0,0]=4 2668 B13R2.57 OCC1CN2CCCCC2CC1 Amb24537796 [0,0,0,2,0,0|1,0,0]=3 2669 B13R2.57 OCC1C[C@H]2CCCC[C@H]2CC1 Amb25343826 [0,0,0,2,0,0|0,0,0]=2 2670 B13R2.57 OCC1NCC2N(C1)CCCC2 Amb17578194 [0,0,0,2,0,0|2,0,0]=4 2671 B13R2.57 OC[C@@H]1CCN2CCCC[C@@H]2O1 Amb24583733 [0,0,0,2,0,0|2,0,0]=4 2672 B13R2.57 OC[C@@H]1CN2CCCCC2CC1 Amb25043833 [0,0,0,2,0,0|1,0,0]=3 2673 B13R2.57 OC[C@@H]1CN2CCNCC2CC1 Amb24425464 [0,0,0,2,0,0|2,0,0]=4 2674 B13R2.57 OC[C@@H]1CN2CCNC[C@H]2CC1 Amb22746557 [0,0,0,2,0,0|2,0,0]=4 2675 B13R2.57 OC[C@@H]1C[C@@H]2CCCC[C@@H]2CN1 Amb24682531 [0,0,0,2,0,0|1,0,0]=3 2676 B13R2.57 OC[C@H]1CN2CCCC[C@@H]2CC1 Amb24588426 [0,0,0,2,0,0|1,0,0]=3 2677 B13R2.57 OC[C@H]1CN2CCNC[C@@H]2CC1 Amb25328633 [0,0,0,2,0,0|2,0,0]=4 2678 B13R2.57 OC[C@H]1CN2CCNC[C@H]2CC1 Amb24613885 [0,0,0,2,0,0|2,0,0]=4 2679 B13R2.57 OC[C@H]1C[C@H]2CCCCN2CC1 Amb25233456 [0,0,0,2,0,0|1,0,0]=3 2680 B13R2.57 ON=C1CC2CCCCC2CC1 Amb24440150 [0,0,0,2,0,0|1,0,1]=4 2681 B13R2.89 CCC1CCCCC12CC2CCl Amb24372202 [0,0,0,2,0,0|1,0,0]=3 2682 B13R2.89 CCC1CCCCC12CC2CO Amb25039106 [0,0,0,2,0,0|0,0,0]=2 2683 B13R2.89 COC1CCCCC12CC2CCl Amb25139853 [0,0,0,2,0,0|2,0,0]=4 2684 B13R2.489 BrCCCN1C2CCCC1CC2 Amb24636086 [0,0,0,2,0,0|2,0,0]=4 2685 B13R2.489 FCCCN1C2CCCC1CC2 Amb25071377 [0,0,0,2,0,0|2,0,0]=4 2686 B13R2.489 OCCCN1C2CCCC1CC2 Amb24492993 [0,0,0,2,0,0|1,0,0]=3 2687 B13R2.489 SCCCN1C2CCCC1CC2 Amb24601604 [0,0,0,2,0,0|1,1,0]=4 2688 B13R2.509 CCCC[C@@H]1C[C@H]2CC[C@@H]1C2O Amb24632547 [0,0,0,2,0,0|0,0,0]=2 2689 B13R2.571 CCC1CN2CCC1CC2CN Amb25779262 [0,0,0,2,0,0|2,0,0]=4 2690 B13R2.571 CCC1CN2CCC1CC2CO Amb22338998 [0,0,0,2,0,0|1,0,0]=3 2691 B13R2.571 CCC1CN2CCN1CC2CO Amb25831914 [0,0,0,2,0,0|2,0,0]=4 2692 B13R2.571 CC[C@H]1CN2CCC1C[C@H]2CN Amb22338999 [0,0,0,2,0,0|2,0,0]=4 2693 B13R2.571 CC[C@H]1CN2CC[C@H]1C[C@H]2CO Amb13886393 [0,0,0,2,0,0|1,0,0]=3 2694 B13R2.571 OC[C@@H]1C[C@H]2CC[C@@H]1C[C@H]2CO Amb25256649 [0,0,0,2,0,0|1,0,0]=3 2695 B13R2.573 CC1CCC2C1CCC=C2CO Amb25317401 [0,0,0,2,0,0|0,0,2]=4 2696 B13R2.573 CC[C@H]1CCC[C@H]2[C@@H]1CCC2=O Amb25179745 [0,0,0,2,0,0|0,0,2]=4 2697 B13R2.573 COC1CCCC2C(O)CCC21 Amb24362743 [0,0,0,2,0,0|1,0,0]=3 2698 B13R2.573 COC1CCC[C@@H]2[C@@H](O)CC[C@H]21 Amb24733224 [0,0,0,2,0,0|1,0,0]=3 2699 B13R2.573 COC1CCC[C@@H]2[C@H](O)CC[C@H]21 Amb25306470 [0,0,0,2,0,0|1,0,0]=3 2700 B13R2.573 C[C@H]1CC[C@H]2[C@@H]1CCC=C2CO Amb25175189 [0,0,0,2,0,0|0,0,2]=4 2701 B13R2.573 OC[C@H]1CCC[C@H]2[C@@H]1CCC2=O Amb25263054 [0,0,0,2,0,0|1,0,1]=4 2702 B13R2.621 BrCC1CCCCN1CC2CC2 Amb23450093 [0,0,0,2,0,0|2,0,0]=4 2703 B13R2.621 CCC1CCCCC1NC2CC2 Amb25304981 [0,0,0,2,0,0|2,0,0]=4 2704 B13R2.621 CCC1CCCCN1C[C@@H]2CO2 Amb24493641 [0,0,0,2,0,0|1,0,0]=3 2705 B13R2.621 CCC1COCCN1C[C@H]2CO2 Amb24674685 [0,0,0,2,0,0|2,0,0]=4 2706 B13R2.621 ClCC1CCCCN1CC2CC2 Amb25257245 [0,0,0,2,0,0|2,0,0]=4 2707 B13R2.621 NCC1CCCCC1NC2CC2 Amb24453065 [0,0,0,2,0,0|2,0,0]=4 2708 B13R2.621 NCC1CCCCN1CC2CC2 Amb18982916 [0,0,0,2,0,0|2,0,0]=4 2709 B13R2.621 OCC1CCCCN1CC2CC2 Amb18806277 [0,0,0,2,0,0|1,0,0]=3 2710 B13R2.621 OCC1CCCCN1CC2CO2 Amb18789476 [0,0,0,2,0,0|2,0,0]=4 2711 B13R2.621 OCC1CCCCN1C[C@@H]2CO2 Amb24353243 [0,0,0,2,0,0|2,0,0]=4 2712 B13R2.621 OCC1CCCNC1CC2CC2 Amb25133844 [0,0,0,2,0,0|1,0,0]=3 2713 B13R2.2528 CCC1CCCCC1C2CCN2 Amb25197485 [0,0,0,2,0,0|1,0,0]=3 2714 B13R2.2528 CCC1CCCCC1C2CNC2 Amb25238078 [0,0,0,2,0,0|2,0,0]=4 2715 B13R2.2528 CCC1CCCCC1N2CCC2 Amb24362543 [0,0,0,2,0,0|2,0,0]=4 2716 B13R2.2528 CCC1CNCCC1C2CCC2 Amb25669492 [0,0,0,2,0,0|2,0,0]=4 2717 B13R2.2528 NCC1CCCCC1C2CCC2 Amb25101045 [0,0,0,2,0,0|1,0,0]=3 2718 B13R2.2528 NCC1CCCCC1N2CCC2 Amb25838882 [0,0,0,2,0,0|2,0,0]=4 2719 B13R2.2528 NCC1CCNCC1C2CCC2 Amb25255697 [0,0,0,2,0,0|2,0,0]=4 2720 B13R2.2528 OCC1CCCCN1C2CCC2 Amb24497981 [0,0,0,2,0,0|1,0,0]=3 2721 B13R2.2528 OCC1CCCOC1C2CCC2 Amb25827944 [0,0,0,2,0,0|1,0,0]=3 2722 B13R2.4048 CCCN1C2CCC1CC2CO Amb24473568 [0,0,0,2,0,0|1,0,0]=3 2723 B13R2.4048 OCC1CC2CCC1N2CCF Amb24497979 [0,0,0,2,0,0|2,0,0]=4 2724 B13R2.4048 OCC1CC2CCC1N2CCO Amb25279710 [0,0,0,2,0,0|2,0,0]=4 2725 B13R2.7258 NCC12CCCCC1CCCC2 Amb25211729 [0,0,0,2,0,0|1,0,0]=3 2726 B13R2.7258 NC[C@]12CCCC[C@@H]1CCCC2 Amb24709372 [0,0,0,2,0,0|1,0,0]=3 2727 B13R2.7258 O=C[C@@]12CCCC[C@@H]1CCCC2 Amb25119298 [0,0,0,2,0,0|0,0,2]=4 2728 B13R2.7258 OCC12CC=CCC1CCCC2 Amb25188282 [0,0,0,2,0,0|0,0,2]=4 2729 B13R2.7258 OCC12CCCNC1CCCC2 Amb25072672 [0,0,0,2,0,0|1,0,0]=3 2730 B13R2.7258 OCC12COCCC1NCCC2 Amb25800458 [0,0,0,2,0,0|2,0,0]=4 2731 B13R2.7258 OC[C@@]12CCCN[C@H]1CCCC2 Amb24573647 [0,0,0,2,0,0|1,0,0]=3 2732 B13R2.7258 OC[C@@]12COCC[C@H]1NCCC2 Amb24606128 [0,0,0,2,0,0|2,0,0]=4 2733 B13R2.7258 OC[C@]12CCCC[C@@H]1CCCC2 Amb24687989 [0,0,0,2,0,0|0,0,0]=2 2734 B13R2.369 CC1CC2CCCCC2CC1O Amb24534398 [0,0,0,2,0,0|0,0,0]=2 2735 B13R2.369 CC1CC=2CCCCC2CC1O Amb24431042 [0,0,0,2,0,0|0,0,2]=4 2736 B13R2.369 CC1C[C@@H]2CCCC[C@H]2CC1=O Amb24736301 [0,0,0,2,0,0|0,0,2]=4 2737 B13R2.369 CC1C[C@H]2CCCC[C@@H]2CC1=O Amb24690677 [0,0,0,2,0,0|0,0,2]=4 2738 B13R2.369 CC1OC2CCCCC2CC1O Amb25182930 [0,0,0,2,0,0|1,0,0]=3 2739 B13R2.369 CC1OC2CCCOC2CC1O Amb25356104 [0,0,0,2,0,0|2,0,0]=4 2740 B13R2.369 C[C@@H]1CC2CCCCC2CC1=O Amb25358979 [0,0,0,2,0,0|0,0,2]=4 2741 B13R2.369 C[C@@H]1C[C@H]2CCCC[C@@H]2C[C@@H]1O Amb25176943 [0,0,0,2,0,0|0,0,0]=2 2742 B13R2.369 C[C@@H]1O[C@@H]2CCCO[C@H]2C[C@H]1O Amb24544074 [0,0,0,2,0,0|2,0,0]=4 2743 B13R2.369 C[C@H]1C[C@H]2CCCC[C@@H]2C[C@@H]1O Amb25176603 [0,0,0,2,0,0|0,0,0]=2 2744 B13R2.369 C[C@H]1O[C@H]2CCCC[C@@H]2C[C@@H]1O Amb24719660 [0,0,0,2,0,0|1,0,0]=3 2745 B13R2.369 C[C@H]1O[C@H]2CCCO[C@@H]2C[C@@H]1O Amb24719771 [0,0,0,2,0,0|2,0,0]=4 2746 B13R2.369 ClC1CC2CCCCC2CC1Cl Amb24639179 [0,0,0,2,0,0|2,0,0]=4 2747 B13R2.369 NC1CC2CCCCC2CC1N Amb25223127 [0,0,0,2,0,0|2,0,0]=4 2748 B13R2.369 N[C@@H]1C[C@H]2CCCC[C@@H]2C[C@@H]1N Amb24519175 [0,0,0,2,0,0|2,0,0]=4 2749 B13R2.369 N[C@@H]1C[C@H]2CCCC[C@@H]2C[C@H]1O Amb24563793 [0,0,0,2,0,0|1,0,0]=3 2750 B13R2.369 N[C@H]1C[C@H]2CCCC[C@@H]2C[C@@H]1O Amb25201507 [0,0,0,2,0,0|1,0,0]=3 2751 B13R2.369 N[C@H]1C[C@H]2CCCC[C@H]2C[C@H]1O Amb24519157 [0,0,0,2,0,0|1,0,0]=3 2752 B13R2.369 OC1CC2CCCSC2CC1O Amb25817211 [0,0,0,2,0,0|2,0,0]=4 2753 B13R2.369 O[C@@H]1C[C@@H]2CCCC[C@@H]2C[C@@H]1O Amb25225982 [0,0,0,2,0,0|1,0,0]=3 2754 B13R2.369 O[C@@H]1C[C@H]2CCCC[C@@H]2C[C@H]1Cl Amb25210831 [0,0,0,2,0,0|1,0,0]=3 2755 B13R2.369 O[C@@H]1C[C@H]2CCCC[C@@H]2C[C@H]1S Amb24618733 [0,0,0,2,0,0|1,0,0]=3 2756 B13R2.369 O[C@H]1CC2CCCCC2C[C@@H]1Cl Amb24519206 [0,0,0,2,0,0|1,0,0]=3 2757 B13R2.369 O[C@H]1C[C@H]2CCCC[C@@H]2C[C@@H]1F Amb25266723 [0,0,0,2,0,0|1,0,0]=3 2758 B13R2.369 O[C@H]1C[C@H]2CCCC[C@@H]2C[C@H]1Cl Amb25210843 [0,0,0,2,0,0|1,0,0]=3 2759 B13R2.369 O[C@H]1C[C@H]2CCCC[C@@H]2C[C@H]1F Amb25256527 [0,0,0,2,0,0|1,0,0]=3 2760 B13R2.4745 CC1C(O)O[C@@H]2CCCCC[C@@H]21 Amb25236189 [0,0,0,2,0,0|1,0,0]=3 2761 B13R2.4745 CC1C(O)O[C@H]2CCCCC[C@@H]21 Amb24619147 [0,0,0,2,0,0|1,0,0]=3 2762 B13R2.4745 OC1CC2CCCCCC2C1O Amb25357353 [0,0,0,2,0,0|1,0,0]=3 2763 B13R2.4745 OC1CN2CCCCCC2C1O Amb25056907 [0,0,0,2,0,0|2,0,0]=4 2764 B13R2.4821 CC12CCC=CC1CCCC2O Amb25078026 [0,0,0,2,0,0|0,0,2]=4 2765 B13R2.4821 CC12CCCCC1=CCCC2O Amb25822960 [0,0,0,2,0,0|0,0,2]=4 2766 B13R2.4821 CC12CCCCC1CCCC2=O Amb25077647 [0,0,0,2,0,0|0,0,2]=4 2767 B13R2.4821 CC12CCCCC1CCCC2N Amb25336332 [0,0,0,2,0,0|1,0,0]=3 2768 B13R2.4821 CC12CCCCC1NCCC2O Amb24758859 [0,0,0,2,0,0|1,0,0]=3 2769 B13R2.4821 CC12CCCNC1CCCC2O Amb25068963 [0,0,0,2,0,0|1,0,0]=3 2770 B13R2.4821 CC1CCCC2[N+]1(C)CCCC2 Amb10553382 [0,0,0,2,0,0|2,0,0]=4 2771 B13R2.4821 C[C@@]12CCCCC1CCC[C@@H]2O Amb24618786 [0,0,0,2,0,0|0,0,0]=2 2772 B13R2.4821 C[C@@]12CCCC[C@@H]1CCCC2=O Amb25262768 [0,0,0,2,0,0|0,0,2]=4 2773 B13R2.4821 C[C@@]12CCCC[C@@H]1CCCC2N Amb25321885 [0,0,0,2,0,0|1,0,0]=3 2774 B13R2.4821 C[C@@]12CCCC[C@H]1CCCC2=O Amb24714916 [0,0,0,2,0,0|0,0,2]=4 2775 B13R2.4821 C[C@]12CC=CC[C@H]1CCC[C@H]2O Amb25206679 [0,0,0,2,0,0|0,0,2]=4 2776 B13R2.4821 C[C@]12CCCC[C@@H]1CCCC2=O Amb25179516 [0,0,0,2,0,0|0,0,2]=4 2777 B13R2.4821 C[C@]12CCCC[C@H]1CCCC2=O Amb24706902 [0,0,0,2,0,0|0,0,2]=4 2778 B13R2.4821 C[C@]12CCCC[C@H]1CCCC2N Amb25238246 [0,0,0,2,0,0|1,0,0]=3 2779 B13R2.4821 C[C@]12CCCC[C@H]1CCC[C@@H]2O Amb25272286 [0,0,0,2,0,0|0,0,0]=2 2780 B13R2.4821 C[C@]12CCCC[C@H]1CCC[C@H]2O Amb25220988 [0,0,0,2,0,0|0,0,0]=2 2781 B13R2.4821 C[C@]12CCCO[C@H]1CCC[C@H]2O Amb24569984 [0,0,0,2,0,0|1,0,0]=3 2782 B13R2.4821 N[C@H]1CCC[C@@H]2CCCC[C@]21O Amb24632648 [0,0,0,2,0,0|1,0,0]=3 2783 B13R2.4821 N[C@H]1CCC[C@H]2CCCC[C@]21O Amb24613878 [0,0,0,2,0,0|1,0,0]=3 2784 B13R2.4821 OC1CCCC2CCCCC12O Amb24407449 [0,0,0,2,0,0|1,0,0]=3 2785 B13R2.4821 OC1CCCC2CCCCC21F Amb25343678 [0,0,0,2,0,0|1,0,0]=3 2786 B13R2.4821 O[C@@H]1CCC[C@H]2CCCC[C@@]21F Amb24515498 [0,0,0,2,0,0|1,0,0]=3 2787 B13R2.4821 O[C@@]12CCCC[C@@H]1CCCC2=O Amb24697735 [0,0,0,2,0,0|1,0,1]=4 2788 B13R2.4821 O[C@H]1CCC[C@@H]2NCCC[C@]12O Amb24603820 [0,0,0,2,0,0|2,0,0]=4 2789 B13R2.4821 O[C@H]1CCC[C@H]2CCCC[C@@]21F Amb24515500 [0,0,0,2,0,0|1,0,0]=3 2790 B13R2.5226 OC1C#CCCCCCC2CC21 Amb25226274 [0,0,0,2,0,0|0,0,2]=4 2791 B13R2.5226 OC1CCCCCCCC2CC21 Amb25048534 [0,0,0,2,0,0|0,0,0]=2 2792 B13R2.5226 O[C@@H]1CCCCCCC[C@@H]2C[C@H]21 Amb25175284 [0,0,0,2,0,0|0,0,0]=2 2793 B13R2.5254 CC12CCCC1CCCCC2=O Amb24724075 [0,0,0,2,0,0|0,0,2]=4 2794 B13R2.5254 C[C@]12CCC[C@H]1CCCCC2=O Amb24655093 [0,0,0,2,0,0|0,0,2]=4 2795 B13R2.5254 OC1CCCCC2CCCC12O Amb25344919 [0,0,0,2,0,0|1,0,0]=3 2796 B13R2.5254 O[C@]12CCC[C@@H]1CCCCC2=O Amb24512689 [0,0,0,2,0,0|1,0,1]=4 2797 B13R2.163 CC1CNC[C@H]2CCCC[C@@H]2O1 Amb25210563 [0,0,0,2,0,0|1,0,0]=3 2798 B13R2.268 CCCC1CNCCC1C2CC2 Amb25098507 [0,0,0,2,0,0|2,0,0]=4 2799 B13R2.268 CCNC1CCCCC1C2CC2 Amb24700719 [0,0,0,2,0,0|2,0,0]=4 2800 B13R2.268 CNCC1CCCCC1C2CC2 Amb25777278 [0,0,0,2,0,0|2,0,0]=4 2801 B13R2.268 NCCC1CCCCN1C2CC2 Amb18826296 [0,0,0,2,0,0|2,0,0]=4 2802 B13R2.268 OCCC1CCCCN1C2CC2 Amb25762665 [0,0,0,2,0,0|1,0,0]=3 2803 B13R2.268 OCCC1COCCN1C2CC2 Amb24559513 [0,0,0,2,0,0|2,0,0]=4 2804 B13R2.747 CCCC1CNCCC12CCC2 Amb24455928 [0,0,0,2,0,0|2,0,0]=4 2805 B13R2.747 NCCC1CCCCC12CCC2 Amb25248826 [0,0,0,2,0,0|1,0,0]=3 2806 B13R2.747 NCCC1CCOCC12CCC2 Amb18825872 [0,0,0,2,0,0|2,0,0]=4 2807 B13R2.747 NCCC1CCSCC12CCC2 Amb18822268 [0,0,0,2,0,0|2,0,0]=4 2808 B13R2.4079 ICCN1C2CCCC1CCC2 Amb25283848 [0,0,0,2,0,0|2,0,0]=4 2809 B13R2.4079 N#CCC1C2CCCC1CCC2 Amb25269727 [0,0,0,2,0,0|1,0,1]=4 2810 B13R2.4079 OCCN1C2CNCC1CCC2 Amb25268199 [0,0,0,2,0,0|2,0,0]=4 2811 B13R2.9743 OCCC12CCC=C1CCCC2 Amb25817084 [0,0,0,2,0,0|0,0,2]=4 2812 B13R2.9743 OCCC12CCCC1=CCCC2 Amb24380005 [0,0,0,2,0,0|0,0,2]=4 2813 B13R2.26 BrCCN1C[C@@H]2CCCC[C@@H]2C1 Amb24694727 [0,0,0,2,0,0|2,0,0]=4 2814 B13R2.26 CCOC1CC2CCCCN2O1 Amb25034632 [0,0,0,2,0,0|2,0,0]=4 2815 B13R2.26 CNCC1CC2CCCCC2N1 Amb18793230 [0,0,0,2,0,0|2,0,0]=4 2816 B13R2.26 ClCCN1CC2CCCCC2C1 Amb24354757 [0,0,0,2,0,0|2,0,0]=4 2817 B13R2.26 ClCCN1C[C@@H]2CCCC[C@@H]2C1 Amb24531152 [0,0,0,2,0,0|2,0,0]=4 2818 B13R2.26 ICCN1CC2CCCCC2C1 Amb25762708 [0,0,0,2,0,0|2,0,0]=4 2819 B13R2.26 N#CCC1CC2CCCCC2C1 Amb25350667 [0,0,0,2,0,0|1,0,1]=4 2820 B13R2.26 N#CCC1CC2CCCCC2O1 Amb25372793 [0,0,0,2,0,0|1,0,1]=4 2821 B13R2.26 NCCC1CC2CCCCC2C1 Amb24514413 [0,0,0,2,0,0|1,0,0]=3 2822 B13R2.26 NCCC1CC2CCCCC2N1 Amb23560223 [0,0,0,2,0,0|2,0,0]=4 2823 B13R2.26 NCCC1CC2CCCCC2O1 Amb25093558 [0,0,0,2,0,0|1,0,0]=3 2824 B13R2.26 NCCN1CC2CCCCC2C1 Amb18647085 [0,0,0,2,0,0|2,0,0]=4 2825 B13R2.26 NCCN1C[C@@H]2CCCC[C@@H]2C1 Amb24501311 [0,0,0,2,0,0|2,0,0]=4 2826 B13R2.26 NOCC1CC2CCCCC2O1 Amb24631379 [0,0,0,2,0,0|2,0,0]=4 2827 B13R2.26 O=CCC1CC2CCCCC2O1 Amb24707015 [0,0,0,2,0,0|1,0,1]=4 2828 B13R2.26 OCCC1CC2CCCCN2C1 Amb24675521 [0,0,0,2,0,0|1,0,0]=3 2829 B13R2.26 OCCN1CC2CCCNC2C1 Amb24622854 [0,0,0,2,0,0|2,0,0]=4 2830 B13R2.26 OCCN1CC2CCNCC2C1 Amb24741377 [0,0,0,2,0,0|2,0,0]=4 2831 B13R2.26 SCCN1C[C@@H]2CCCC[C@@H]2C1 Amb25340201 [0,0,0,2,0,0|1,1,0]=4 2832 B13R2.4106 OCC[C@@H]1[C@@H]2CCC=CCC[C@@H]21 Amb24403928 [0,0,0,2,0,0|0,0,2]=4 2833 B13R2.4106 OCC[C@@H]1[C@H]2CCC=CCC[C@H]21 Amb25832675 [0,0,0,2,0,0|0,0,2]=4 2834 B13R2.9439 OCC1C2C=CCCCCCC21 Amb25680534 [0,0,0,2,0,0|0,0,2]=4 2835 B13R2.9439 OCC1[C@@H]2C=CCCCCC[C@@H]21 Amb24515447 [0,0,0,2,0,0|0,0,2]=4 2836 B13R2.218 OC1CC2CCCC2CC=CC1 Amb25080238 [0,0,0,2,0,0|0,0,2]=4 2837 B13R2.218 O[C@H]1C[C@H]2CCC[C@H]2CC=CC1 Amb25346199 [0,0,0,2,0,0|0,0,2]=4 2838 B13R2.3342 O=C1CC2CC2CCCCCC1 Amb24706951 [0,0,0,2,0,0|0,0,2]=4 2839 B13R2.3672 OC1CCC=2CCCCCCC21 Amb25071697 [0,0,0,2,0,0|0,0,2]=4 2840 B13R2.3672 O[C@H]1OC[C@@H]2CCCCCC[C@@H]21 Amb25195868 [0,0,0,2,0,0|1,0,0]=3 2841 B13R2.3914 NC1C2CCCCCCCCC21 Amb25700887 [0,0,0,2,0,0|1,0,0]=3 2842 B13R2.4820 NC1CCOC2CCCCCC21 Amb18825896 [0,0,0,2,0,0|2,0,0]=4 2843 B13R2.4820 O=C1CCCC2CCCCCC12 Amb25370732 [0,0,0,2,0,0|0,0,2]=4 2844 B13R2.4820 O=C1CCC[C@@H]2CCCCC[C@H]12 Amb24698878 [0,0,0,2,0,0|0,0,2]=4 2845 B13R2.4820 OC1CCCC=2CCCCCC21 Amb25369490 [0,0,0,2,0,0|0,0,2]=4 2846 B13R2.4820 OC1CCC[C@@H]2CCCCC[C@@H]21 Amb25215408 [0,0,0,2,0,0|0,0,0]=2 2847 B13R2.4820 OC1CCNC2CCCCCC21 Amb24638897 [0,0,0,2,0,0|1,0,0]=3 2848 B13R2.4820 OC1CCNC2CCSCCC21 Amb25700118 [0,0,0,2,0,0|2,0,0]=4 2849 B13R2.4820 OC1CCOC2CCCCCC21 Amb18825576 [0,0,0,2,0,0|1,0,0]=3 2850 B13R2.168 CC1CCCC12CCCCC2=O Amb17594143 [0,0,0,2,0,0|0,0,2]=4 2851 B13R2.168 CC1CCCCC12CCCC2O Amb25215412 [0,0,0,2,0,0|0,0,0]=2 2852 B13R2.168 CC1CCCCC12CNCC2C Amb24599692 [0,0,0,2,0,0|2,0,0]=4 2853 B13R2.168 CN1CCC[C@@]12CCCC[C@@H]2N Amb24590118 [0,0,0,2,0,0|2,0,0]=4 2854 B13R2.168 C[C@@H]1CCCCC12CCCC2=O Amb24551494 [0,0,0,2,0,0|0,0,2]=4 2855 B13R2.168 C[C@H]1CCCC12CCCCC2=O Amb25347423 [0,0,0,2,0,0|0,0,2]=4 2856 B13R2.168 C[C@H]1CCCCC12CCCC2=O Amb25713056 [0,0,0,2,0,0|0,0,2]=4 2857 B13R2.168 OC1CCCC12CCCCC2=O Amb25730128 [0,0,0,2,0,0|1,0,1]=4 2858 B13R2.168 OC1CCCCC12CCCC2O Amb25852881 [0,0,0,2,0,0|1,0,0]=3 2859 B13R2.168 O[C@@H]1CCC[C@@]12CCCCC2=O Amb25371896 [0,0,0,2,0,0|1,0,1]=4 2860 B13R2.168 O[C@H]1CCC[C@@]12CCCCC2=O Amb24590950 [0,0,0,2,0,0|1,0,1]=4 2861 B13R2.215 CC1CCN1C2CCCCC2O Amb25044694 [0,0,0,2,0,0|1,0,0]=3 2862 B13R2.215 CC1CCN1[C@@H]2CCCC[C@H]2N Amb25027782 [0,0,0,2,0,0|2,0,0]=4 2863 B13R2.305 CC1CCCCC12CC2CNC Amb18799005 [0,0,0,2,0,0|2,0,0]=4 2864 B13R2.320 CCO[C@H]1C[C@@H]2O[C@H]1CC[C@@H]2O Amb25289162 [0,0,0,2,0,0|2,0,0]=4 2865 B13R2.342 CC1CCCC=2C(O)CCCC21 Amb24661164 [0,0,0,2,0,0|0,0,2]=4 2866 B13R2.342 CC1CCNC2C(O)CCCC21 Amb24704813 [0,0,0,2,0,0|1,0,0]=3 2867 B13R2.342 CC=1CCCC2C(O)CCCC12 Amb24525576 [0,0,0,2,0,0|0,0,2]=4 2868 B13R2.342 CN1CCC[C@H]2[C@H](O)CCC[C@@H]12 Amb25257185 [0,0,0,2,0,0|1,0,0]=3 2869 B13R2.342 C[C@H]1CCC[C@@H]2[C@H]1NCC[C@@H]2C Amb24617771 [0,0,0,2,0,0|2,0,0]=4 2870 B13R2.342 OC1CCCC2C1CCCC2=O Amb24408312 [0,0,0,2,0,0|1,0,1]=4 2871 B13R2.342 OC1CCC[C@H]2[C@H]1CCCC2=O Amb25322859 [0,0,0,2,0,0|1,0,1]=4 2872 B13R2.342 O[C@@H]1CCC[C@@H]2[C@@H]1CCCC2=O Amb24512567 [0,0,0,2,0,0|1,0,1]=4 2873 B13R2.342 O[C@H]1CCC[C@H]2[C@@H]1CCC[C@@H]2O Amb25317575 [0,0,0,2,0,0|1,0,0]=3 2874 B13R2.377 CC1CC1NC2CCCCC2O Amb18801434 [0,0,0,2,0,0|1,0,0]=3 2875 B13R2.377 CC1CCCCC1NC2CC2C Amb18798997 [0,0,0,2,0,0|2,0,0]=4 2876 B13R2.377 CC1CCCCC1N[C@@H]2C[C@H]2C Amb25332946 [0,0,0,2,0,0|2,0,0]=4 2877 B13R2.377 CC1CCCCN1CC2CC2C Amb25344558 [0,0,0,2,0,0|2,0,0]=4 2878 B13R2.377 C[C@@H]1O[C@H]1C[C@@H]2CCCC[C@H]2O Amb24748526 [0,0,0,2,0,0|1,0,0]=3 2879 B13R2.377 C[C@H]1O[C@@H]1C[C@@H]2CCCC[C@H]2O Amb24698616 [0,0,0,2,0,0|1,0,0]=3 2880 B13R2.567 CC1CCCCC1C2CC2CN Amb24602564 [0,0,0,2,0,0|1,0,0]=3 2881 B13R2.567 CC1CSCCN1C2CC2CO Amb25345603 [0,0,0,2,0,0|2,0,0]=4 2882 B13R2.567 CN1CCCCC1C2CC2CCl Amb24474264 [0,0,0,2,0,0|2,0,0]=4 2883 B13R2.567 CN1CCCCC1C2CC2CN Amb25092810 [0,0,0,2,0,0|2,0,0]=4 2884 B13R2.567 CN1CCCCC1C2CC2CS Amb25106050 [0,0,0,2,0,0|1,1,0]=4 2885 B13R2.2411 OCCC1CC2CCCC1C2=O Amb25332767 [0,0,0,2,0,0|1,0,1]=4 2886 B13R2.3587 CC1CCCCC1OC[C@@H]2CO2 Amb24525744 [0,0,0,2,0,0|1,0,0]=3 2887 B13R2.3587 CC1CCCCN1CCC2CO2 Amb24353234 [0,0,0,2,0,0|1,0,0]=3 2888 B13R2.3587 CC1CCNCC1CCC2CC2 Amb25678011 [0,0,0,2,0,0|2,0,0]=4 2889 B13R2.3587 CC1CNCCC1CCC2CC2 Amb25076419 [0,0,0,2,0,0|2,0,0]=4 2890 B13R2.3587 CC1COCCN1CCC2CO2 Amb25686654 [0,0,0,2,0,0|2,0,0]=4 2891 B13R2.3587 CC1CSCCN1CCC2CO2 Amb25332610 [0,0,0,2,0,0|2,0,0]=4 2892 B13R2.3587 ClC1CCCCC1NCC2CC2 Amb24758411 [0,0,0,2,0,0|2,0,0]=4 2893 B13R2.3587 OC1CCCCC1CNC2CC2 Amb25820228 [0,0,0,2,0,0|1,0,0]=3 2894 B13R2.3587 OC1CCCCC1NCC2CC2 Amb18301859 [0,0,0,2,0,0|1,0,0]=3 2895 B13R2.3587 OC1CCCCC1OCC2CC2 Amb18806554 [0,0,0,2,0,0|1,0,0]=3 2896 B13R2.3587 OC1CCCCC1SCC2CC2 Amb24389554 [0,0,0,2,0,0|1,0,0]=3 2897 B13R2.3587 OC1CCOCC1CCC2CC2 Amb25728500 [0,0,0,2,0,0|1,0,0]=3 2898 B13R2.3587 OC1CCOCC1OCC2CC2 Amb18807325 [0,0,0,2,0,0|2,0,0]=4 2899 B13R2.5225 BrC1CCCCC1OC2CCC2 Amb25139842 [0,0,0,2,0,0|2,0,0]=4 2900 B13R2.5225 CC1CCCCC1CC2CNC2 Amb25210090 [0,0,0,2,0,0|2,0,0]=4 2901 B13R2.5225 CC1CCCCC1NC2CCC2 Amb18805746 [0,0,0,2,0,0|2,0,0]=4 2902 B13R2.5225 CC1CCCNC1CC2CCC2 Amb25756298 [0,0,0,2,0,0|2,0,0]=4 2903 B13R2.5225 CC1CNCCC1CC2CCC2 Amb25319131 [0,0,0,2,0,0|2,0,0]=4 2904 B13R2.5225 FC1CNCCC1CC2CCC2 Amb24743874 [0,0,0,2,0,0|2,0,0]=4 2905 B13R2.5225 NC1CCCCC1OC2CCC2 Amb18284773 [0,0,0,2,0,0|2,0,0]=4 2906 B13R2.5225 NC1CNCCC1CC2CCC2 Amb25267729 [0,0,0,2,0,0|2,0,0]=4 2907 B13R2.5225 OC1CCCCC1NC2CCC2 Amb18961133 [0,0,0,2,0,0|1,0,0]=3 2908 B13R2.5225 OC1CCCCC1OC2CCC2 Amb18793668 [0,0,0,2,0,0|1,0,0]=3 2909 B13R2.5225 OC1CCCCC1OC2CNC2 Amb25796251 [0,0,0,2,0,0|2,0,0]=4 2910 B13R2.5225 OC1CCCCC1SC2COC2 Amb24513499 [0,0,0,2,0,0|2,0,0]=4 2911 B13R2.5225 OC1CCNCC1CC2CCC2 Amb25039308 [0,0,0,2,0,0|1,0,0]=3 2912 B13R2.5225 OC1CCOCC1CC2CCC2 Amb25093055 [0,0,0,2,0,0|1,0,0]=3 2913 B13R2.5225 OC1CCOCC1OC2CCC2 Amb18794330 [0,0,0,2,0,0|2,0,0]=4 2914 B13R2.5225 O[C@@H]1CCCC[C@@H]1NC2COC2 Amb25855356 [0,0,0,2,0,0|2,0,0]=4 2915 B13R2.5225 O[C@@H]1CCCC[C@H]1NC2CCC2 Amb25310766 [0,0,0,2,0,0|1,0,0]=3 2916 B13R2.5225 O[C@@H]1CCCC[C@H]1NC2COC2 Amb25700734 [0,0,0,2,0,0|2,0,0]=4 2917 B13R2.5225 O[C@@H]1CCCC[C@H]1NC2CSC2 Amb24339929 [0,0,0,2,0,0|2,0,0]=4 2918 B13R2.5225 O[C@H]1CCCC[C@@H]1NC2COC2 Amb25111976 [0,0,0,2,0,0|2,0,0]=4 2919 B13R2.5225 O[C@H]1CCCC[C@@H]1NC2CSC2 Amb24606616 [0,0,0,2,0,0|2,0,0]=4 2920 B13R2.5225 O[C@H]1CCCC[C@@H]1SC2COC2 Amb24646007 [0,0,0,2,0,0|2,0,0]=4 2921 B13R2.179 C=C1CC1CCC2CCCC2O Amb24430011 [0,0,0,2,0,0|0,0,2]=4 2922 B13R2.179 CC1CC1CNC2CCCC2O Amb24425823 [0,0,0,2,0,0|1,0,0]=3 2923 B13R2.179 CC1CC1CNC2COCC2O Amb25066672 [0,0,0,2,0,0|2,0,0]=4 2924 B13R2.179 CC1CC1CN[C@@H]2CCC[C@H]2O Amb24635392 [0,0,0,2,0,0|1,0,0]=3 2925 B13R2.179 CC1CC1NCC2CCCC2N Amb25765114 [0,0,0,2,0,0|2,0,0]=4 2926 B13R2.3426 NC1CC1C2CCCCCCC2 Amb25796468 [0,0,0,2,0,0|1,0,0]=3 2927 B13R2.3443 CC1CC1NC2CCCCCC2 Amb18798996 [0,0,0,2,0,0|2,0,0]=4 2928 B13R2.775 CCNC1CCCC1C2CCC2 Amb24724127 [0,0,0,2,0,0|2,0,0]=4 2929 B13R2.775 CNCC1CCCC1C2CCC2 Amb25762265 [0,0,0,2,0,0|2,0,0]=4 2930 B13R2.775 NCCC1CCCC1N2CCC2 Amb24638268 [0,0,0,2,0,0|2,0,0]=4 2931 B13R2.775 NCCN1CCCC1C2CCC2 Amb24722248 [0,0,0,2,0,0|2,0,0]=4 2932 B13R2.775 OCCC1CCCN1C2CNC2 Amb24644525 [0,0,0,2,0,0|2,0,0]=4 2933 B13R2.1261 CCCNC1CCCC12CCC2 Amb25201256 [0,0,0,2,0,0|2,0,0]=4 2934 B13R2.1261 ICCCN1CCCC12CCC2 Amb24717945 [0,0,0,2,0,0|2,0,0]=4 2935 B13R2.1261 OCCCN1CCCC12CCC2 Amb25722907 [0,0,0,2,0,0|1,0,0]=3 2936 B13R2.1261 OCCNC1CCCC12CCC2 Amb24709445 [0,0,0,2,0,0|1,0,0]=3 2937 B13R2.3152 CC1CCCC1CNC2CCC2 Amb25735026 [0,0,0,2,0,0|2,0,0]=4 2938 B13R2.3152 NC1CCCC1CNC2CCC2 Amb25064917 [0,0,0,2,0,0|2,0,0]=4 2939 B13R2.3152 NC1CCCC1OCC2CCC2 Amb25852256 [0,0,0,2,0,0|2,0,0]=4 2940 B13R2.3152 O=C1CCCC1CCC2CCC2 Amb24542953 [0,0,0,2,0,0|0,0,2]=4 2941 B13R2.3152 OC1CCCC1CNC2CNC2 Amb24665451 [0,0,0,2,0,0|2,0,0]=4 2942 B13R2.3152 OC1CCCC1CNC2CSC2 Amb25248091 [0,0,0,2,0,0|2,0,0]=4 2943 B13R2.3152 OC1CCCC1NCC2CCC2 Amb18969648 [0,0,0,2,0,0|1,0,0]=3 2944 B13R2.3152 OC1CCCC1SCC2CNC2 Amb25148803 [0,0,0,2,0,0|2,0,0]=4 2945 B13R2.3152 OC1COCC1NCC2CCC2 Amb18970447 [0,0,0,2,0,0|2,0,0]=4 2946 B13R2.3159 C(NCCCC1CC1)C2CCC2 Amb23570692 [0,0,0,2,0,0|2,0,0]=4 2947 B13R2.6840 C(C1CCCCCC1)N2CCC2 Amb24371882 [0,0,0,2,0,0|2,0,0]=4 2948 B13R2.6840 C(C1CCCCCN1)C2CCC2 Amb25222490 [0,0,0,2,0,0|1,0,0]=3 2949 B13R2.6840 C1CCC1NC2CCCCCC2 Amb18805747 [0,0,0,2,0,0|2,0,0]=4 2950 B13R2.6840 C1NCC1CC2CCCCCC2 Amb25667338 [0,0,0,2,0,0|2,0,0]=4 2951 B13R2.6844 C1CCC1N2CCCCCCC2 Amb25182945 [0,0,0,2,0,0|2,0,0]=4 2952 B13R2.6844 C1CCN1C2CCCCCCC2 Amb24673589 [0,0,0,2,0,0|2,0,0]=4 2953 B13R2.255 COCC1CCC2CCC1C2Cl Amb25124890 [0,0,0,2,0,0|2,0,0]=4 2954 B13R2.255 COCC1CCC2CCC1C2O Amb24362701 [0,0,0,2,0,0|1,0,0]=3 2955 B13R2.255 COC[C@@H]1CC[C@@H]2CC[C@H]1[C@H]2Cl Amb25361087 [0,0,0,2,0,0|2,0,0]=4 2956 B13R2.273 OCCN1[C@H]2CCNC[C@@H]1CC2 Amb24598303 [0,0,0,2,0,0|2,0,0]=4 2957 B13R2.594 OCC1CCCCCN1C2CC2 Amb24663635 [0,0,0,2,0,0|1,0,0]=3 2958 B13R2.4128 NCCC1CCCCCC12CC2 Amb18826814 [0,0,0,2,0,0|1,0,0]=3 2959 B13R2.4128 OCCN1CCCOCC12CC2 Amb25084067 [0,0,0,2,0,0|2,0,0]=4 2960 B13R2.4440 CNCC1CC12CCCCCC2 Amb18963644 [0,0,0,2,0,0|2,0,0]=4 2961 B13R2.4440 NCCC1CC12CCCCCC2 Amb25174566 [0,0,0,2,0,0|1,0,0]=3 2962 B13R2.4440 NCCC1CC12CCCNCC2 Amb25300676 [0,0,0,2,0,0|2,0,0]=4 2963 B13R2.251 CCC[C@H]1CN[C@@H]2[C@@H](O)CO[C@@H]21 Amb24692954 [0,0,0,2,0,0|2,0,0]=4 2964 B13R2.251 COCC1CCC2C(Cl)CCC12 Amb24753678 [0,0,0,2,0,0|2,0,0]=4 2965 B13R2.251 COC[C@@H]1CC[C@@H]2[C@@H](Cl)CC[C@H]12 Amb24635760 [0,0,0,2,0,0|2,0,0]=4 2966 B13R2.251 COC[C@@H]1CC[C@@H]2[C@@H](O)CC[C@H]12 Amb25257085 [0,0,0,2,0,0|1,0,0]=3 2967 B13R2.515 CC1CC2CC1CC2OCCO Amb25317298 [0,0,0,2,0,0|1,0,0]=3 2968 B13R2.515 CCCC[C@@H]1C[C@@H]2C[C@H]1C[C@@H]2O Amb24520273 [0,0,0,2,0,0|0,0,0]=2 2969 B13R2.515 CCCC[C@@H]1C[C@@H]2C[C@H]1C[C@H]2O Amb25317518 [0,0,0,2,0,0|0,0,0]=2 2970 B13R2.600 CCN1CC2CCCC2C1CN Amb25794200 [0,0,0,2,0,0|2,0,0]=4 2971 B13R2.600 COC1C(CO)CC2CNCC21 Amb25054015 [0,0,0,2,0,0|2,0,0]=4 2972 B13R2.600 CO[C@@H]1[C@H](CO)C[C@@H]2CNC[C@@H]21 Amb25295341 [0,0,0,2,0,0|2,0,0]=4 2973 B13R2.600 OCC1C2CCOC2CC1CO Amb25036162 [0,0,0,2,0,0|2,0,0]=4 2974 B13R2.8173 CCNCC12CNCC1CCO2 Amb25708417 [0,0,0,2,0,0|2,0,0]=4 2975 B13R2.8173 OCCCC12CCCN1CCC2 Amb25787387 [0,0,0,2,0,0|1,0,0]=3 2976 B13R2.506 OCCCC1CC2C1CCC2=O Amb25751569 [0,0,0,2,0,0|1,0,1]=4 2977 B13R2.164 BrCCCN1CC2CCCC2C1 Amb24374025 [0,0,0,2,0,0|2,0,0]=4 2978 B13R2.164 FCCCN1CC2CCCC2C1 Amb25246157 [0,0,0,2,0,0|2,0,0]=4 2979 B13R2.164 NCCCN1CC2CCCC2C1 Amb25363475 [0,0,0,2,0,0|2,0,0]=4 2980 B13R2.164 OCCCC1CC2CCCN2O1 Amb25069617 [0,0,0,2,0,0|2,0,0]=4 2981 B13R2.164 OCCCN1CC2CNCC2C1 Amb24574649 [0,0,0,2,0,0|2,0,0]=4 2982 B13R2.164 OCCCN1C[C@@H]2CCN[C@@H]2C1 Amb25307503 [0,0,0,2,0,0|2,0,0]=4 2983 B13R2.164 OCCCN1C[C@@H]2CNC[C@@H]2C1 Amb24410872 [0,0,0,2,0,0|2,0,0]=4 2984 B13R2.164 SCCCN1CC2CCCC2C1 Amb25159584 [0,0,0,2,0,0|1,1,0]=4 2985 B13R2.911 ClCCOC1C2CCCCCC21 Amb24710241 [0,0,0,2,0,0|2,0,0]=4 2986 B13R2.911 ClCCOC1[C@H]2CCCCC[C@H]21 Amb25088419 [0,0,0,2,0,0|2,0,0]=4 2987 B13R2.911 ClCCO[C@@H]1[C@H]2CCCCC[C@H]21 Amb25088341 [0,0,0,2,0,0|2,0,0]=4 2988 B13R2.911 NCCCC1[C@H]2CCCCC[C@H]21 Amb25194961 [0,0,0,2,0,0|1,0,0]=3 2989 B13R2.911 O=CCCC1[C@H]2CCCCC[C@H]21 Amb24610734 [0,0,0,2,0,0|0,0,2]=4 2990 B13R2.1320 ClCC1CC12CCCCCCC2 Amb25789170 [0,0,0,2,0,0|1,0,0]=3 2991 B13R2.1320 NCC1CC12CCCCCCC2 Amb18948994 [0,0,0,2,0,0|1,0,0]=3 2992 B13R2.6839 C1CCCCC(CC1)NC2CC2 Amb1117196 [0,0,0,2,0,0|2,0,0]=4 2993 B13R2.6839 C1O[C@@H]1CN2CCCCCCC2 Amb25817442 [0,0,0,2,0,0|1,0,0]=3 2994 B13R2.181 CC1CCCN1C2CCCC2N Amb18793222 [0,0,0,2,0,0|2,0,0]=4 2995 B13R2.181 CC1CCCN1C2CCCC2O Amb18793474 [0,0,0,2,0,0|1,0,0]=3 2996 B13R2.181 CC1CCCN1C2CNCC2O Amb25148530 [0,0,0,2,0,0|2,0,0]=4 2997 B13R2.181 CC1CCCN1C2COCC2O Amb24531436 [0,0,0,2,0,0|2,0,0]=4 2998 B13R2.181 CC1CCCN1C2COC[C@H]2O Amb25130201 [0,0,0,2,0,0|2,0,0]=4 2999 B13R2.181 CC1CCCN1[C@@H]2CNC[C@H]2O Amb24732808 [0,0,0,2,0,0|2,0,0]=4 3000 B13R2.181 OC1CCCC1C2CCCC2=O Amb25127075 [0,0,0,2,0,0|1,0,1]=4 3001 B13R2.181 OC1CCCC1C2CSCC2O Amb25118172 [0,0,0,2,0,0|2,0,0]=4 3002 B13R2.181 O[C@@H]1CCC[C@H]1[C@H]2CCC[C@@H]2O Amb24556819 [0,0,0,2,0,0|1,0,0]=3 3003 B13R2.181 O[C@H]1CCC[C@@H]1[C@H]2CCC[C@@H]2O Amb24557135 [0,0,0,2,0,0|1,0,0]=3 3004 B13R2.181 O[C@H]1CCC[C@H]1[C@H]2CCC[C@H]2O Amb24520246 [0,0,0,2,0,0|1,0,0]=3 3005 B13R2.360 CC1CCC1NC2CCCC2C Amb25817220 [0,0,0,2,0,0|2,0,0]=4 3006 B13R2.360 CC1CCC1NC2COCC2O Amb25759919 [0,0,0,2,0,0|2,0,0]=4 3007 B13R2.360 CC1CCC1N[C@@H]2COC[C@H]2O Amb24508836 [0,0,0,2,0,0|2,0,0]=4 3008 B13R2.360 CC1CCCC1N[C@@H]2CC[C@H]2O Amb25220839 [0,0,0,2,0,0|1,0,0]=3 3009 B13R2.360 CC1OCCC1N[C@@H]2CC[C@H]2O Amb24431471 [0,0,0,2,0,0|2,0,0]=4 3010 B13R2.550 CC1CCCC1NC2CC2CC Amb24361188 [0,0,0,2,0,0|2,0,0]=4 3011 B13R2.550 CC1CCCC1NC2CC2CO Amb24430739 [0,0,0,2,0,0|1,0,0]=3 3012 B13R2.550 CC1SCCC1N[C@@H]2C[C@H]2CO Amb24576842 [0,0,0,2,0,0|2,0,0]=4 3013 B13R2.550 CCC1CC1NC2CCCC2O Amb24701548 [0,0,0,2,0,0|1,0,0]=3 3014 B13R2.3130 CN1CCCC12CCCCCC2 Amb25853315 [0,0,0,2,0,0|2,0,0]=4 3015 B13R2.646 CCC1CCC1N[C@@H]2CC[C@H]2O Amb24593779 [0,0,0,2,0,0|1,0,0]=3 3016 B13R2.2290 C1NC1CCCCCCC2CO2 Amb24056763 [0,0,0,2,0,0|1,0,0]=3 3017 B13R2.2290 C1O[C@@H]1CCCCCC[C@@H]2CO2 Amb22367119 [0,0,0,2,0,0|1,0,0]=3 3018 B13R2.6841 C(CN1CCCCCC1)C2CC2 Amb25313988 [0,0,0,2,0,0|2,0,0]=4 3019 B13R2.6841 C(NC1CC1)C2CCCCCC2 Amb18799001 [0,0,0,2,0,0|2,0,0]=4 3020 B13R2.6841 C(OC1CCCCCC1)C2CO2 Amb18793662 [0,0,0,2,0,0|1,0,0]=3 3021 B13R2.6841 C1CC1CCC2CCCCCN2 Amb25267268 [0,0,0,2,0,0|1,0,0]=3 3022 B13R2.6841 C1OC1CCN2CCCSCC2 Amb25787718 [0,0,0,2,0,0|2,0,0]=4 3023 B13R2.4880 NC1CCC1C2CCCCCC2 Amb25773500 [0,0,0,2,0,0|1,0,0]=3 3024 B13R2.4880 OC1CCC1N2CCCCCC2 Amb25801791 [0,0,0,2,0,0|1,0,0]=3 3025 B13R2.1411 BrCC1CC1C2CCCCCC2 Amb25099530 [0,0,0,2,0,0|1,0,0]=3 3026 B13R2.1411 CCC1CC1C2CCCCCN2 Amb24606716 [0,0,0,2,0,0|1,0,0]=3 3027 B13R2.1411 ClCC1CC1C2CCCCCC2 Amb24341906 [0,0,0,2,0,0|1,0,0]=3 3028 B13R2.1411 OCC1CC1C2CCCCCC2 Amb25334148 [0,0,0,2,0,0|0,0,0]=2 3029 B13R2.1411 OCC1CC1N2CCSCCC2 Amb24685988 [0,0,0,2,0,0|2,0,0]=4