0 B11R0.148 C#CCCCCCCCC(=O)O Amb22388895 [0,0,0,0,0,0|2,0,2]=4 1 B11R0.148 C=C(Br)CCCCCCCCC Amb6298936 [0,0,0,0,0,0|2,0,1]=3 2 B11R0.148 C=C(C)CCCCCCCC#N Amb6298909 [0,0,0,0,0,0|3,0,1]=4 3 B11R0.148 C=C(C)CCCCCCCCC Amb6298942 [0,0,0,0,0,0|2,0,0]=2 4 B11R0.148 C=C(Cl)CCCCCCCCC Amb6298930 [0,0,0,0,0,0|2,0,1]=3 5 B11R0.148 C=CCCCCCCCC(=O)O Amb2686677 [0,0,0,0,0,0|2,0,2]=4 6 B11R0.148 CC(=O)NCCCNCCC#N Amb17315329 [0,0,0,0,0,0|3,0,1]=4 7 B11R0.148 CC(=O)OCCCCCCC=O Amb22364796 [0,0,0,0,0,0|1,0,1]=2 8 B11R0.148 CC(C)OCCCNCCCN Amb17315299 [0,0,0,0,0,0|3,0,1]=4 9 B11R0.148 CC(C)OCCCOCCCO Amb35796436 [0,0,0,0,0,0|3,0,1]=4 10 B11R0.148 CC(O)CCCCCCCCO Amb33331053 [0,0,0,0,0,0|2,0,2]=4 11 B11R0.148 CCCCCCCCCC(=O)Cl Amb8513576 [0,0,0,0,0,0|2,0,0]=2 12 B11R0.148 CCCCCCCCCC(=O)O Amb5718031 [0,0,0,0,0,0|2,0,0]=2 13 B11R0.148 CCCCCCCCCC(C)=O Amb6307417 [0,0,0,0,0,0|1,0,0]=1 14 B11R0.148 CCCCCCCCCC(C)C Amb22043228 [0,0,0,0,0,0|2,0,1]=3 15 B11R0.148 CCCCCCCCCC(C)N Amb6366423 [0,0,0,0,0,0|2,0,1]=3 16 B11R0.148 CCCCCCCCCC(N)=O Amb6366435 [0,0,0,0,0,0|2,0,0]=2 17 B11R0.148 CCCCCCCCCC(N)=S Amb7794719 [0,0,0,0,0,0|2,1,0]=3 18 B11R0.148 CCCCCCCCCS(=O)Cl Amb32720537 [0,0,0,0,0,0|3,0,0]=3 19 B11R0.148 CCCCCCCCCS(=O)[O-] Amb32755589 [0,0,0,0,0,0|3,0,0]=3 20 B11R0.148 CCCCCCCCCS(N)=O Amb32720538 [0,0,0,0,0,0|3,0,0]=3 21 B11R0.148 CCCCCCCCNC(C)=O Amb33551736 [0,0,0,0,0,0|1,0,0]=1 22 B11R0.148 CCCCCCCCNC(N)=S Amb1152183 [0,0,0,0,0,0|2,1,0]=3 23 B11R0.148 CCCCCCCCOC(=O)Cl Amb8515453 [0,0,0,0,0,0|1,0,0]=1 24 B11R0.148 CCCCCCCCOC(C)=O Amb8515405 [0,0,0,0,0,0|0,0,0]=0 25 B11R0.148 CCCCCCCNCC(=O)O Amb19373457 [0,0,0,0,0,0|3,0,0]=3 26 B11R0.148 CCCCCCCNCC(=O)O Amb8827566 [0,0,0,0,0,0|3,0,0]=3 27 B11R0.148 CCCCCCCNCC(C)C Amb7757190 [0,0,0,0,0,0|3,0,1]=4 28 B11R0.148 CCCCCCC\C=C\C(=O)O Amb6336657 [0,0,0,0,0,0|2,0,1]=3 29 B11R0.148 CCCCCCNCCC(=O)O Amb8830823 [0,0,0,0,0,0|3,0,0]=3 30 B11R0.148 CCCCCCNCCC(C)C Amb6620655 [0,0,0,0,0,0|3,0,1]=4 31 B11R0.148 CCCCCC\C=C/C=C(C)C Amb22546455 [0,0,0,0,0,0|2,0,2]=4 32 B11R0.148 CCCCC\C=C\CCC(=O)O Amb24079160 [0,0,0,0,0,0|2,0,2]=4 33 B11R0.148 CCCCC\C=C\COC(C)=O Amb30988128 [0,0,0,0,0,0|0,0,2]=2 34 B11R0.148 CCCCOCCOCC(=O)O Amb9204477 [0,0,0,0,0,0|4,0,0]=4 35 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [0,0,0,0,0,0|3,0,0]=3 36 B11R0.148 CCC\C=C\CCCCC(=O)O Amb24063196 [0,0,0,0,0,0|2,0,2]=4 37 B11R0.148 CCNCCOCCCC(=O)O Amb18110845 [0,0,0,0,0,0|4,0,0]=4 38 B11R0.148 CCOCCOCCCC(=O)O Amb6262117 [0,0,0,0,0,0|4,0,0]=4 39 B11R0.148 CCOCCOCCOC(C)=O Amb8514868 [0,0,0,0,0,0|2,0,0]=2 40 B11R0.148 CCOCCOCCOC(N)=O Amb29674648 [0,0,0,0,0,0|3,0,0]=3 41 B11R0.148 CN(C)CCCCCCCCN Amb24117500 [0,0,0,0,0,0|4,0,0]=4 42 B11R0.148 CNCCCNCCCC(=O)O Amb28963363 [0,0,0,0,0,0|4,0,0]=4 43 B11R0.148 CNCCCNCCCC(=O)O Amb33470189 [0,0,0,0,0,0|4,0,0]=4 44 B11R0.148 COCCOCCCCC(=O)O Amb9207792 [0,0,0,0,0,0|4,0,0]=4 45 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [0,0,0,0,0,0|4,0,0]=4 46 B11R0.148 O=C(O)CCCCCCCCBr Amb8631538 [0,0,0,0,0,0|3,0,0]=3 47 B11R0.148 O=C(O)CCCCCCCCO Amb3372037 [0,0,0,0,0,0|3,0,0]=3 48 B10R0.4 C=C(Br)CCCCCCCC Amb6298935 [1,0,0,0,0,0|1,0,1]=3 49 B10R0.4 C=C(Br)CCCCCCCCl Amb6298886 [1,0,0,0,0,0|2,0,1]=4 50 B10R0.4 C=C(C)CCCCCCC#N Amb6298908 [1,0,0,0,0,0|2,0,1]=4 51 B10R0.4 C=C(C)CCCCCCCC Amb6298941 [1,0,0,0,0,0|1,0,0]=2 52 B10R0.4 C=C(C)CNCCCCCC Amb17308745 [1,0,0,0,0,0|2,0,0]=3 53 B10R0.4 C=C(C)\C=C\CCCCCC Amb22546604 [1,0,0,0,0,0|1,0,2]=4 54 B10R0.4 C=C(Cl)CCCCCCCC Amb6298929 [1,0,0,0,0,0|1,0,1]=3 55 B10R0.4 CC(=O)CCCCC#CCBr Amb27673518 [1,0,0,0,0,0|1,0,2]=4 56 B10R0.4 CC(=O)CCCCC#CCO Amb28080242 [1,0,0,0,0,0|1,0,2]=4 57 B10R0.4 CC(=O)NCCCCCC=O Amb24113371 [1,0,0,0,0,0|2,0,1]=4 58 B10R0.4 CC(=O)NCCCCCCN Amb5786933 [1,0,0,0,0,0|2,0,0]=3 59 B10R0.4 CC(=O)NCCCCCCO Amb24113372 [1,0,0,0,0,0|2,0,0]=3 60 B10R0.4 CC(=O)OCCCCCCBr Amb24063174 [1,0,0,0,0,0|1,0,0]=2 61 B10R0.4 CC(=O)OCCCCC[Zn]Br Amb22000479 [1,0,0,0,0,0|2,0,0]=3 62 B10R0.4 CC(=O)SCCCCCCN Amb31031026 [1,0,0,0,0,0|1,1,0]=3 63 B10R0.4 CC(=O)SCCCCCCN Amb33276211 [1,0,0,0,0,0|1,1,0]=3 64 B10R0.4 CC(C)CCCCCCCBr Amb32689357 [1,0,0,0,0,0|2,0,1]=4 65 B10R0.4 CC(C)CCCCCCCCl Amb32689356 [1,0,0,0,0,0|2,0,1]=4 66 B10R0.4 CCC#CCCCCC(=O)O Amb27269519 [1,0,0,0,0,0|1,0,2]=4 67 B10R0.4 CCC#CCCCCC(N)=O Amb28079386 [1,0,0,0,0,0|1,0,2]=4 68 B10R0.4 CCCC#CCCCC(=O)O Amb27269520 [1,0,0,0,0,0|1,0,2]=4 69 B10R0.4 CCCC#CCCCC(N)=O Amb28079638 [1,0,0,0,0,0|1,0,2]=4 70 B10R0.4 CCCCC#CCCC(C)=O Amb27269937 [1,0,0,0,0,0|0,0,2]=3 71 B10R0.4 CCCCC#CCCC(N)=O Amb28079736 [1,0,0,0,0,0|1,0,2]=4 72 B10R0.4 CCCCCC#CCC(=O)Cl Amb27672073 [1,0,0,0,0,0|1,0,2]=4 73 B10R0.4 CCCCCCC#CC(=O)O Amb2780028 [1,0,0,0,0,0|1,0,2]=4 74 B10R0.4 CCCCCCC#CC(C)=O Amb27672631 [1,0,0,0,0,0|0,0,2]=3 75 B10R0.4 CCCCCCCCB(O)O Amb2456044 [1,0,0,0,0,0|2,0,1]=4 76 B10R0.4 CCCCCCCCC(=O)Cl Amb3941485 [1,0,0,0,0,0|1,0,0]=2 77 B10R0.4 CCCCCCCCC(=O)O Amb3940373 [1,0,0,0,0,0|1,0,0]=2 78 B10R0.4 CCCCCCCCC(=O)[O-] Amb22729912 [1,0,0,0,0,0|1,0,0]=2 79 B10R0.4 CCCCCCCCC(C)=O Amb8513861 [1,0,0,0,0,0|0,0,0]=1 80 B10R0.4 CCCCCCCCC(C)Br Amb22731670 [1,0,0,0,0,0|1,0,1]=3 81 B10R0.4 CCCCCCCCC(C)C Amb20241015 [1,0,0,0,0,0|1,0,1]=3 82 B10R0.4 CCCCCCCCC(N)=O Amb8999041 [1,0,0,0,0,0|1,0,0]=2 83 B10R0.4 CCCCCCCCN(C)C Amb2778778 [1,0,0,0,0,0|2,0,0]=3 84 B10R0.4 CCCCCCCC[C@@H](C)O Amb19929333 [1,0,0,0,0,0|0,0,2]=3 85 B10R0.4 CCCCCCCC[S@@+](C)[O-] Amb17779184 [1,0,0,0,0,0|1,0,1]=3 86 B10R0.4 CCCCCCCNC(N)=S Amb2688655 [1,0,0,0,0,0|2,1,0]=4 87 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [1,0,0,0,0,0|1,0,0]=2 88 B10R0.4 CCCCCCCOC(C)=O Amb6366320 [1,0,0,0,0,0|0,0,0]=1 89 B10R0.4 CCCCCCCOC(C)Cl Amb32715989 [1,0,0,0,0,0|1,0,1]=3 90 B10R0.4 CCCCCCCOC(N)=O Amb32668733 [1,0,0,0,0,0|1,0,0]=2 91 B10R0.4 CCCCCCCSC(=N)N Amb22487432 [1,0,0,0,0,0|2,1,0]=4 92 B10R0.4 CCCCCCNCC(=O)O Amb8827565 [1,0,0,0,0,0|2,0,0]=3 93 B10R0.4 CCCCCCNCC(C)C Amb6730526 [1,0,0,0,0,0|2,0,1]=4 94 B10R0.4 CCCCCCNCC(C)O Amb9247474 [1,0,0,0,0,0|1,0,2]=4 95 B10R0.4 CCCCCCOCC(=O)O Amb7790032 [1,0,0,0,0,0|2,0,0]=3 96 B10R0.4 CCCCCC\C=C\C(=O)O Amb3940553 [1,0,0,0,0,0|1,0,2]=4 97 B10R0.4 CCCCCC\C=C\C(C)=O Amb22052629 [1,0,0,0,0,0|0,0,2]=3 98 B10R0.4 CCCCCNCCC(=O)O Amb7755694 [1,0,0,0,0,0|2,0,0]=3 99 B10R0.4 CCCCC\C=C\NC(C)=O Amb28080162 [1,0,0,0,0,0|1,0,2]=4 100 B10R0.4 CCCCNCCCN(C)C Amb6699375 [1,0,0,0,0,0|3,0,0]=4 101 B10R0.4 CCCCSCCCC(=O)O Amb9280591 [1,0,0,0,0,0|2,0,0]=3 102 B10R0.4 CCCNCCCOC(C)=O Amb18924647 [1,0,0,0,0,0|1,0,0]=2 103 B10R0.4 CCC\C=C\CCCC(=O)O Amb33079428 [1,0,0,0,0,0|1,0,2]=4 104 B10R0.4 CCNCCOCCC(C)=O Amb18630736 [1,0,0,0,0,0|2,0,0]=3 105 B10R0.4 CCOCCCCCC(=O)O Amb22234334 [1,0,0,0,0,0|2,0,0]=3 106 B10R0.4 CCOCCOCCC(=O)O Amb6273854 [1,0,0,0,0,0|3,0,0]=4 107 B10R0.4 CCOCCOCCC(N)=O Amb18797953 [1,0,0,0,0,0|3,0,0]=4 108 B10R0.4 CN(C)CCCCCCCN Amb6715652 [1,0,0,0,0,0|3,0,0]=4 109 B10R0.4 CNCCOCCCC(=O)O Amb18106300 [1,0,0,0,0,0|3,0,0]=4 110 B10R0.4 COCCCNCCC(=O)O Amb8841109 [1,0,0,0,0,0|3,0,0]=4 111 B10R0.4 COCCCNCCC(C)=O Amb32675820 [1,0,0,0,0,0|2,0,0]=3 112 B10R0.4 COCCCOCCC(=O)O Amb18180046 [1,0,0,0,0,0|3,0,0]=4 113 B10R0.4 COCCNCCNC(C)=O Amb9256125 [1,0,0,0,0,0|3,0,0]=4 114 B10R0.4 COCCOCCCC(=O)O Amb6271198 [1,0,0,0,0,0|3,0,0]=4 115 B10R0.4 CSCCCCCCC(=O)O Amb28652939 [1,0,0,0,0,0|2,0,0]=3 116 B10R0.4 NCCCCCCCC(=O)O Amb19929586 [1,0,0,0,0,0|2,0,0]=3 117 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [1,0,0,0,0,0|2,0,0]=3 118 B10R0.4 NCCCCCCNC(=O)O Amb22494605 [1,0,0,0,0,0|3,0,0]=4 119 B10R0.4 NCCCNCCCC(=O)O Amb18183427 [1,0,0,0,0,0|3,0,0]=4 120 B10R0.4 NCCCNCCCC(=O)O Amb33172775 [1,0,0,0,0,0|3,0,0]=4 121 B10R0.4 NCCCOCCCC(=O)O Amb18111568 [1,0,0,0,0,0|3,0,0]=4 122 B10R0.4 NCCCSCCCC(=O)O Amb17500719 [1,0,0,0,0,0|3,0,0]=4 123 B10R0.4 O=C(O)CCCCCCCBr Amb3940372 [1,0,0,0,0,0|2,0,0]=3 124 B10R0.4 O=C(O)CCCCCCCO Amb2688777 [1,0,0,0,0,0|2,0,0]=3 125 B10R0.4 O=C(O)CCCCOCCO Amb7782972 [1,0,0,0,0,0|3,0,0]=4 126 B10R0.4 O=C(O)CCCSCCCO Amb17502860 [1,0,0,0,0,0|3,0,0]=4 127 B10R0.4 O=C([O-])CCCCCCCO Amb33513015 [1,0,0,0,0,0|2,0,0]=3 128 B10R0.71 C=CCCCCCCCC=O Amb22734770 [1,0,0,0,0,0|1,0,2]=4 129 B10R0.71 C=CCCCCCCCCBr Amb9786895 [1,0,0,0,0,0|2,0,1]=4 130 B10R0.71 C=CCCCCCCCCN Amb28652858 [1,0,0,0,0,0|2,0,1]=4 131 B10R0.71 C=CCCCCCCCCN Amb32653011 [1,0,0,0,0,0|2,0,1]=4 132 B10R0.71 C=CCCCCCCCCO Amb6364973 [1,0,0,0,0,0|2,0,1]=4 133 B10R0.71 C=COCCOCCOCC Amb4035046 [1,0,0,0,0,0|2,0,1]=4 134 B10R0.71 CCCCC#CCCNC=O Amb27272587 [1,0,0,0,0,0|1,0,2]=4 135 B10R0.71 CCCCCCCCCC=O Amb3940437 [1,0,0,0,0,0|1,0,0]=2 136 B10R0.71 CCCCCCCCCCBr Amb2721517 [1,0,0,0,0,0|2,0,1]=4 137 B10R0.71 CCCCCCCCCCCl Amb8513081 [1,0,0,0,0,0|2,0,1]=4 138 B10R0.71 CCCCCCCCCCF Amb2688085 [1,0,0,0,0,0|2,0,1]=4 139 B10R0.71 CCCCCCCCCCI Amb3940280 [1,0,0,0,0,0|2,0,1]=4 140 B10R0.71 CCCCCCCCCCN Amb3940460 [1,0,0,0,0,0|2,0,1]=4 141 B10R0.71 CCCCCCCCCCO Amb3940390 [1,0,0,0,0,0|1,0,2]=4 142 B10R0.71 CCCCCCCCCCS Amb9787174 [1,0,0,0,0,0|1,1,1]=4 143 B10R0.71 CCCCCCCCCNC Amb10609826 [1,0,0,0,0,0|2,0,0]=3 144 B10R0.71 CCCCCCCCCNC Amb7761761 [1,0,0,0,0,0|2,0,0]=3 145 B10R0.71 CCCCCCCCN=C=O Amb3940552 [1,0,0,0,0,0|1,0,1]=3 146 B10R0.71 CCCCCCCCN=C=S Amb6572519 [1,0,0,0,0,0|1,1,1]=4 147 B10R0.71 CCCCCCCCNC=O Amb9787543 [1,0,0,0,0,0|1,0,0]=2 148 B10R0.71 CCCCCCCCOCC Amb9787535 [1,0,0,0,0,0|0,0,1]=2 149 B10R0.71 CCCCCCCCOCCl Amb22230404 [1,0,0,0,0,0|1,0,1]=3 150 B10R0.71 CCCCCCCCSCC Amb17672979 [1,0,0,0,0,0|0,1,1]=3 151 B10R0.71 CCCCCCCNCCC Amb4313521 [1,0,0,0,0,0|2,0,1]=4 152 B10R0.71 CCCCCCC\C=C\C=O Amb8517160 [1,0,0,0,0,0|1,0,1]=3 153 B10R0.71 CCCCCCNCCCC Amb6730566 [1,0,0,0,0,0|2,0,1]=4 154 B10R0.71 CCCCCCNCCOC Amb7760715 [1,0,0,0,0,0|3,0,0]=4 155 B10R0.71 CCCCCNCCCCC Amb3941371 [1,0,0,0,0,0|2,0,1]=4 156 B10R0.71 CCCCCNCCCOC Amb6730381 [1,0,0,0,0,0|3,0,0]=4 157 B10R0.71 CCCCCSCCCCC Amb4020127 [1,0,0,0,0,0|2,0,1]=4 158 B10R0.71 CCCCC\C=C\CCC=O Amb33512982 [1,0,0,0,0,0|1,0,2]=4 159 B10R0.71 CCCNCCCCCOC Amb18797681 [1,0,0,0,0,0|3,0,0]=4 160 B10R0.71 CCOCCCNCCCN Amb17315298 [1,0,0,0,0,0|2,0,1]=4 161 B10R0.71 CCOCCNCCOCC Amb9279288 [1,0,0,0,0,0|2,0,1]=4 162 B10R0.71 CCOCCOCCOCC Amb8383649 [1,0,0,0,0,0|2,0,1]=4 163 B10R0.71 C\C=C/C\C=C/CCCCC Amb22546768 [1,0,0,0,0,0|1,0,2]=4 164 B10R0.71 C\C=C\C=C\CCCCCC Amb22546597 [1,0,0,0,0,0|1,0,2]=4 165 B10R0.71 C\C=C\CNCCCCCO Amb32454907 [1,0,0,0,0,0|3,0,0]=4 166 B12R0.4 CCCCCCCC(=O)CC(C)=O Amb19068864 [0,1,0,0,0,0|1,0,1]=3 167 B12R0.4 CCCCCCCC(C)OC(C)=O Amb22734609 [0,1,0,0,0,0|0,0,0]=1 168 B12R0.4 CCCCCCCC(N)CC(=O)O Amb32666363 [0,1,0,0,0,0|2,0,0]=3 169 B12R0.4 CCCCCCCC(N)CC(=O)O Amb33141063 [0,1,0,0,0,0|2,0,0]=3 170 B12R0.4 CCCCCCCC(N)CC(=O)O Amb33533164 [0,1,0,0,0,0|2,0,0]=3 171 B12R0.4 CCCCCCCC(N)CC(N)=O Amb33253906 [0,1,0,0,0,0|2,0,0]=3 172 B12R0.4 CCCCCCCC(O)CC(=O)O Amb19071697 [0,1,0,0,0,0|2,0,0]=3 173 B12R0.4 CCCCCCCC(O)CC(C)C Amb19070434 [0,1,0,0,0,0|2,0,1]=4 174 B12R0.4 CCCCCCC[C@@H](N)CC(=O)O Amb33172824 [0,1,0,0,0,0|2,0,0]=3 175 B12R0.4 CCCCCCC[C@@H](N)CC(=O)O Amb33172825 [0,1,0,0,0,0|2,0,0]=3 176 B12R0.4 CCCCCCC[C@H](O)CC(=O)O Amb33620732 [0,1,0,0,0,0|2,0,0]=3 177 B12R0.4 CCCCCCOC(C)NC(C)=O Amb24096324 [0,1,0,0,0,0|2,0,0]=3 178 B12R0.95 CCCCC(=O)CCCCC(=O)O Amb6305232 [0,1,0,0,0,0|2,0,1]=4 179 B12R0.119 CC(C)(C)OCCCCCCCBr Amb33620515 [0,1,0,0,0,0|2,0,1]=4 180 B12R0.119 CCCCCCCCCS(=O)(=O)Cl Amb22387375 [0,1,0,0,0,0|3,0,0]=4 181 B12R0.119 CCCCCCCCCS(=O)(=O)F Amb32755112 [0,1,0,0,0,0|3,0,0]=4 182 B12R0.119 CCCCCCCCCS(=O)(=O)[O-] Amb8515940 [0,1,0,0,0,0|3,0,0]=4 183 B12R0.119 CCCCCCCCCS(N)(=O)=O Amb32715391 [0,1,0,0,0,0|3,0,0]=4 184 B12R0.119 CCCCCCCCOS(=O)(=O)[O-] Amb8516739 [0,1,0,0,0,0|2,0,0]=3 185 B12R0.233 CCCCCC(=O)CCCC(=O)O Amb6305235 [0,1,0,0,0,0|2,0,1]=4 186 B12R0.234 C#CCCCCCCCCC(=O)O Amb536933 [0,1,0,0,0,0|2,0,1]=4 187 B12R0.234 C=C(Br)CCCCCCCCCC Amb6298937 [0,1,0,0,0,0|2,0,1]=4 188 B12R0.234 C=C(Cl)CCCCCCCCCC Amb6298931 [0,1,0,0,0,0|2,0,1]=4 189 B12R0.234 C=CCCCCCCCCC(=O)Cl Amb2721637 [0,1,0,0,0,0|2,0,1]=4 190 B12R0.234 C=CCCCCCCCCC(=O)O Amb533736 [0,1,0,0,0,0|2,0,1]=4 191 B12R0.234 CC#CCCCCCCCC(=O)O Amb6565389 [0,1,0,0,0,0|2,0,1]=4 192 B12R0.234 CC(=O)NCCCNCCCCN Amb22641893 [0,1,0,0,0,0|2,0,0]=3 193 B12R0.234 CC(=O)NCCCNCCCON Amb24072109 [0,1,0,0,0,0|3,0,0]=4 194 B12R0.234 CC(=O)NCCNCCNCCN Amb24073038 [0,1,0,0,0,0|3,0,0]=4 195 B12R0.234 CC(=O)NCCOCCOCCN Amb24073127 [0,1,0,0,0,0|3,0,0]=4 196 B12R0.234 CC(=O)NOCCCNCCCN Amb24073412 [0,1,0,0,0,0|2,0,0]=3 197 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [0,1,0,0,0,0|0,0,0]=1 198 B12R0.234 CCCCCCCCCCC(=O)Cl Amb9787304 [0,1,0,0,0,0|2,0,0]=3 199 B12R0.234 CCCCCCCCCCC(=O)O Amb3941499 [0,1,0,0,0,0|2,0,0]=3 200 B12R0.234 CCCCCCCCCCC(C)=O Amb6366439 [0,1,0,0,0,0|1,0,0]=2 201 B12R0.234 CCCCCCCCCCC(C)N Amb8869702 [0,1,0,0,0,0|2,0,1]=4 202 B12R0.234 CCCCCCCCCCN(C)C Amb9787202 [0,1,0,0,0,0|3,0,0]=4 203 B12R0.234 CCCCCCCCCOC(=S)[S-] Amb534232 [0,1,0,0,0,0|1,1,0]=3 204 B12R0.234 CCCCCCCCCOC(C)=O Amb6366259 [0,1,0,0,0,0|0,0,0]=1 205 B12R0.234 CCCCCCCCOCC(=O)O Amb7790043 [0,1,0,0,0,0|1,0,0]=2 206 B12R0.234 CCCCCCCC\C=C\C(=O)O Amb33987634 [0,1,0,0,0,0|2,0,0]=3 207 B12R0.234 CCOCCOCCCCC(=O)O Amb9207787 [0,1,0,0,0,0|3,0,0]=4 208 B12R0.234 N#CCCCCCCCCC(=O)O Amb4008315 [0,1,0,0,0,0|2,0,1]=4 209 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [0,1,0,0,0,0|2,0,0]=3 210 B12R0.234 NCCCCCCCCCC(=O)O Amb31030991 [0,1,0,0,0,0|2,0,0]=3 211 B12R0.234 O=C(O)CCCCCCCCCBr Amb4014619 [0,1,0,0,0,0|2,0,0]=3 212 B12R0.234 O=C(O)CCCCCCCCCO Amb3940517 [0,1,0,0,0,0|2,0,0]=3 213 B12R0.234 O=C(O)\C=C\CCCCCCCO Amb33757093 [0,1,0,0,0,0|2,0,1]=4 214 B12R0.248 C=CC(=O)NCCCCCCCC Amb28556071 [0,1,0,0,0,0|1,0,1]=3 215 B12R0.248 C=CC(=O)OCCCCCCCC Amb2778626 [0,1,0,0,0,0|0,0,1]=2 216 B12R0.248 C=CC(=O)OCCOCCOCC Amb8394562 [0,1,0,0,0,0|2,0,1]=4 217 B12R0.248 C=CCCCCCCCC(=O)OC Amb533244 [0,1,0,0,0,0|1,0,2]=4 218 B12R0.248 CCCCCCCCCC(=O)NN Amb6530432 [0,1,0,0,0,0|2,0,0]=3 219 B12R0.248 CCCCCCCCCC(=O)NO Amb33548521 [0,1,0,0,0,0|2,0,0]=3 220 B12R0.248 CCCCCCCCCC(=O)OC Amb4378003 [0,1,0,0,0,0|1,0,0]=2 221 B12R0.248 CCCCCCCCCC(C)C=O Amb3940427 [0,1,0,0,0,0|1,0,1]=3 222 B12R0.248 CCCCCCCCNC(=O)CBr Amb17329848 [0,1,0,0,0,0|1,0,0]=2 223 B12R0.248 CCCCCCCCNC(=O)CCl Amb9786173 [0,1,0,0,0,0|1,0,0]=2 224 B12R0.248 CCCCCCCCNC(=O)CN Amb24115163 [0,1,0,0,0,0|1,0,0]=2 225 B12R0.248 CCCCCCCCNC(=S)NN Amb2689974 [0,1,0,0,0,0|2,1,0]=4 226 B12R0.248 CCCCCCCCOC(=O)CN Amb2688623 [0,1,0,0,0,0|0,0,0]=1 227 B12R0.248 CCCCCCCCOC(=O)C[NH3+] Amb22049491 [0,1,0,0,0,0|0,0,0]=1 228 B12R0.248 CCCCC\C=C/CCC(=O)OC Amb24093816 [0,1,0,0,0,0|1,0,2]=4 229 B12R0.248 CCCCOCCCNC(=O)CBr Amb17329849 [0,1,0,0,0,0|2,0,0]=3 230 B12R0.248 CCCCOCCCNC(=O)CN Amb24115103 [0,1,0,0,0,0|2,0,0]=3 231 B12R0.248 CCNCCOCCCC(=O)OC Amb18107249 [0,1,0,0,0,0|3,0,0]=4 232 B12R0.248 COC(=O)CCCCCCCC=O Amb8391799 [0,1,0,0,0,0|2,0,1]=4 233 B12R0.248 COC(=O)CCCCCCCCBr Amb34913614 [0,1,0,0,0,0|2,0,0]=3 234 B12R0.248 COC(=O)CCCCCCCCO Amb17616943 [0,1,0,0,0,0|2,0,0]=3 235 B12R0.248 COC(=O)CCCSCCCCN Amb17500973 [0,1,0,0,0,0|3,0,0]=4 236 B12R0.248 COCCCCCNCC(=O)OC Amb33133279 [0,1,0,0,0,0|3,0,0]=4 237 B12R0.248 COCCOCCCNC(=O)CCl Amb21848289 [0,1,0,0,0,0|3,0,0]=4 238 B12R0.251 CCCCCCCCC(Br)C(=O)O Amb22347926 [0,1,0,0,0,0|2,0,0]=3 239 B12R0.251 CCCCCCCCC(C)C(=O)O Amb19058533 [0,1,0,0,0,0|2,0,0]=3 240 B12R0.251 CCCCCCCCC(F)=C(F)F Amb10840896 [0,1,0,0,0,0|3,0,0]=4 241 B12R0.251 CCCCCCCCC(N)C(=O)O Amb4134809 [0,1,0,0,0,0|2,0,0]=3 242 B12R0.251 CCCCCCCCC(N)C(N)=O Amb32937043 [0,1,0,0,0,0|2,0,0]=3 243 B12R0.251 CCCCCCCCC(O)C(=O)O Amb6295799 [0,1,0,0,0,0|2,0,0]=3 244 B12R0.251 CCCCCCCCN(C)C(C)=O Amb24096791 [0,1,0,0,0,0|1,0,0]=2 245 B12R0.251 CCCCCCCC[C@@H](N)C(=O)O Amb22745440 [0,1,0,0,0,0|2,0,0]=3 246 B12R0.251 CCCCCCCC[C@H](N)C(=O)O Amb28974737 [0,1,0,0,0,0|2,0,0]=3 247 B12R0.251 CCCCCCCSC(C)C(=O)O Amb7794235 [0,1,0,0,0,0|3,0,0]=4 248 B12R0.255 CCCCCCC(O)CCC(=O)O Amb19071689 [0,1,0,0,0,0|2,0,0]=3 249 B12R0.255 CCCCCCC(O)CCC(=O)[O-] Amb19149307 [0,1,0,0,0,0|2,0,0]=3 250 B12R0.255 CCCCCCC(O)CCC(=O)[O-] Amb31145472 [0,1,0,0,0,0|2,0,0]=3 251 B12R0.268 CC(=O)CCCCCCCC(=O)O Amb17938671 [0,1,0,0,0,0|2,0,1]=4 252 B12R0.268 CC(=O)NCCCCCNC(C)=O Amb10549447 [0,1,0,0,0,0|2,0,1]=4 253 B12R0.268 CC(=O)OCCNCCOC(C)=O Amb32405122 [0,1,0,0,0,0|2,0,1]=4 254 B12R0.268 CC(C)CCCCCCCC(=O)O Amb24117911 [0,1,0,0,0,0|2,0,0]=3 255 B12R0.268 CC(C)CCOCCCCC(=O)O Amb9207788 [0,1,0,0,0,0|3,0,0]=4 256 B12R0.268 CC(C)SCCCCCCC(=O)O Amb32410629 [0,1,0,0,0,0|3,0,0]=4 257 B12R0.277 CCCC(=O)CCCCCC(=O)O Amb6305242 [0,1,0,0,0,0|2,0,1]=4 258 B12R1.7 CCCCCCC1CCC(=O)O1 Amb569753 [0,0,0,1,0,0|2,0,0]=3 259 B12R1.28 C#CCCCC1CCCC(=O)C1 Amb28126616 [0,0,0,1,0,0|1,0,2]=4 260 B12R1.28 CCCCCC1CCCC(=O)O1 Amb4493671 [0,0,0,1,0,0|2,0,0]=3 261 B12R1.28 CCCNCC1CCCC(=O)N1 Amb32721825 [0,0,0,1,0,0|3,0,0]=4 262 B12R1.28 CCCOCC1CCNC(=O)C1 Amb32654949 [0,0,0,1,0,0|2,0,0]=3 263 B12R1.28 N#CCCCN1CCOC(=O)C1 Amb28196485 [0,0,0,1,0,0|2,0,1]=4 264 B12R1.75 C=C(C)CC1CCCCC1CN Amb27468140 [0,0,0,1,0,0|3,0,0]=4 265 B12R1.75 CC(=O)CN1CCCCC1CO Amb18806940 [0,0,0,1,0,0|3,0,0]=4 266 B12R1.75 CC(=O)C[C@H]1CCCC[C@H]1C=O Amb28429561 [0,0,0,1,0,0|2,0,1]=4 267 B12R1.75 CC(=O)NC1CCCCC1C#N Amb27590960 [0,0,0,1,0,0|2,0,1]=4 268 B12R1.75 CC(=O)NC1CCCCC1C=O Amb28120088 [0,0,0,1,0,0|2,0,1]=4 269 B12R1.75 CC(=O)NC1CCCCC1CN Amb27257787 [0,0,0,1,0,0|2,0,0]=3 270 B12R1.75 CC(=O)NC1CCCCC1CO Amb27868462 [0,0,0,1,0,0|2,0,0]=3 271 B12R1.75 CC(=O)N[C@@H]1CCCC[C@H]1C=O Amb27776856 [0,0,0,1,0,0|2,0,1]=4 272 B12R1.75 CC(=O)N[C@H]1CCCC[C@H]1CO Amb28428478 [0,0,0,1,0,0|2,0,0]=3 273 B12R1.75 CC(=O)OC1C=CCCC1CO Amb28190214 [0,0,0,1,0,0|1,0,2]=4 274 B12R1.75 CC(=O)OC1CCCCC1C=O Amb18647323 [0,0,0,1,0,0|1,0,1]=3 275 B12R1.75 CC(=O)OC1CCCCN1N=O Amb27954681 [0,0,0,1,0,0|3,0,0]=4 276 B12R1.75 CC(=O)O[C@H]1CCCC[C@@H]1CO Amb27420620 [0,0,0,1,0,0|1,0,0]=2 277 B12R1.75 CC(=S)OC1CCCCC1CO Amb28065110 [0,0,0,1,0,0|1,1,0]=3 278 B12R1.75 CC(=S)O[C@H]1CCCC[C@@H]1CO Amb28255711 [0,0,0,1,0,0|1,1,0]=3 279 B12R1.75 CCC1CCCCC1CC(=O)O Amb25152261 [0,0,0,1,0,0|2,0,0]=3 280 B12R1.75 CCC1CCCCC1CC(C)=O Amb27495385 [0,0,0,1,0,0|1,0,0]=2 281 B12R1.75 CCC1CCCCC1NC(=O)Cl Amb35625776 [0,0,0,1,0,0|2,0,0]=3 282 B12R1.75 CCC1CCCCC1NC(N)=S Amb19058801 [0,0,0,1,0,0|2,1,0]=4 283 B12R1.75 CCC1CCCCC1OC(=O)Cl Amb27181224 [0,0,0,1,0,0|1,0,0]=2 284 B12R1.75 CCC1CCCCC1OC(C)=O Amb27766398 [0,0,0,1,0,0|0,0,0]=1 285 B12R1.75 CCC1CCCCN1CC(=O)Cl Amb17143064 [0,0,0,1,0,0|3,0,0]=4 286 B12R1.75 CCC1CCCCN1CC(=O)O Amb5380767 [0,0,0,1,0,0|3,0,0]=4 287 B12R1.75 CCC1CCCCN1CC(N)=O Amb17142913 [0,0,0,1,0,0|3,0,0]=4 288 B12R1.75 CCC1CCCC\C1=C\C(=O)O Amb33468654 [0,0,0,1,0,0|2,0,1]=4 289 B12R1.75 CCC1CCCC\C1=N/S(C)=O Amb35692831 [0,0,0,1,0,0|2,0,1]=4 290 B12R1.75 CCC1CCNCC1NC(C)=O Amb32677496 [0,0,0,1,0,0|2,0,0]=3 291 B12R1.75 CC[C@@H]1NCCC[C@H]1CC(=O)O Amb18198537 [0,0,0,1,0,0|3,0,0]=4 292 B12R1.75 CC[C@H]1CNCC[C@H]1CC(=O)Cl Amb28291338 [0,0,0,1,0,0|3,0,0]=4 293 B12R1.75 CC[C@H]1NCCC[C@@H]1CC(=O)O Amb27654051 [0,0,0,1,0,0|3,0,0]=4 294 B12R1.75 COC1CCCCC1NC(N)=O Amb27211770 [0,0,0,1,0,0|3,0,0]=4 295 B12R1.75 COC1CCCNC1CC(C)=O Amb18647523 [0,0,0,1,0,0|3,0,0]=4 296 B12R1.75 CO[C@@H]1CCCC[C@@H]1NC(C)=O Amb28074111 [0,0,0,1,0,0|2,0,0]=3 297 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(C)=O Amb27956180 [0,0,0,1,0,0|2,0,0]=3 298 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(N)=O Amb28349618 [0,0,0,1,0,0|3,0,0]=4 299 B12R1.75 CS(=O)NC1CCCCC1CO Amb27859323 [0,0,0,1,0,0|3,0,0]=4 300 B12R1.75 CSC1CCCCC1NC(=O)Cl Amb35633414 [0,0,0,1,0,0|3,0,0]=4 301 B12R1.75 CSC1CCCCC1NC(C)=N Amb28244179 [0,0,0,1,0,0|3,0,0]=4 302 B12R1.75 CSC1CCCCC1NC(C)=O Amb28067814 [0,0,0,1,0,0|2,0,0]=3 303 B12R1.75 NC(=O)N[C@@H]1CCCC[C@H]1CO Amb27163786 [0,0,0,1,0,0|3,0,0]=4 304 B12R1.75 NCC1CCCCC1CC(=O)O Amb10843836 [0,0,0,1,0,0|3,0,0]=4 305 B12R1.75 NCC1CCCCC1NC(N)=O Amb27208284 [0,0,0,1,0,0|3,0,0]=4 306 B12R1.75 NCC1CCCCC1OC(N)=O Amb28195875 [0,0,0,1,0,0|2,0,0]=3 307 B12R1.75 O=C(O)CC1CCCCC1CO Amb27392264 [0,0,0,1,0,0|3,0,0]=4 308 B12R1.81 CC(=O)NCC1CCCC1CBr Amb27178312 [0,0,0,1,0,0|2,0,0]=3 309 B12R1.81 CC(=O)OCN1CCCC1CN Amb33495354 [0,0,0,1,0,0|2,0,0]=3 310 B12R1.81 CC(=O)OCN1CCC[C@@H]1CN Amb33495382 [0,0,0,1,0,0|2,0,0]=3 311 B12R1.81 CC(=O)OCN1CCC[C@H]1CN Amb33495396 [0,0,0,1,0,0|2,0,0]=3 312 B12R1.81 CCC1OCCC1CNC(=O)Cl Amb35633570 [0,0,0,1,0,0|3,0,0]=4 313 B12R1.81 CCN1CCCC1CNC(=O)Cl Amb35614612 [0,0,0,1,0,0|3,0,0]=4 314 B12R1.81 CCN1CCCC1CNC(N)=O Amb9708648 [0,0,0,1,0,0|3,0,0]=4 315 B12R1.81 COC1CCCC1C\N=C(/C)N Amb27829228 [0,0,0,1,0,0|3,0,0]=4 316 B12R1.125 C=C(C)CCC1CCCCC1N Amb27979472 [0,0,0,1,0,0|3,0,0]=4 317 B12R1.125 C=C(C)CCC1CCCCC1O Amb28062579 [0,0,0,1,0,0|3,0,0]=4 318 B12R1.125 C=C(C)CC[C@@H]1CCCC[C@H]1O Amb32950339 [0,0,0,1,0,0|3,0,0]=4 319 B12R1.125 C=C(C)CNC1CCCCC1C Amb17309025 [0,0,0,1,0,0|3,0,0]=4 320 B12R1.125 C=C1CCCCC1CCC(C)=O Amb27861159 [0,0,0,1,0,0|1,0,2]=4 321 B12R1.125 CC(=O)CCC1CCCCN1C Amb25034626 [0,0,0,1,0,0|2,0,0]=3 322 B12R1.125 CC(=O)CCC1OCCCC1O Amb28322044 [0,0,0,1,0,0|3,0,0]=4 323 B12R1.125 CC(=O)CCN1CCCCC1C Amb7755660 [0,0,0,1,0,0|2,0,0]=3 324 B12R1.125 CC(=O)CC[C@@H]1CCCCC1=O Amb28202304 [0,0,0,1,0,0|2,0,1]=4 325 B12R1.125 CC(=O)NCC1CCCCC1N Amb27190710 [0,0,0,1,0,0|2,0,0]=3 326 B12R1.125 CC(=O)NCC1CCCCC1O Amb27760777 [0,0,0,1,0,0|2,0,0]=3 327 B12R1.125 CC(=O)NCC1CCCCN1C Amb28201206 [0,0,0,1,0,0|2,0,0]=3 328 B12R1.125 CC(=O)NCC1CCNCC1C Amb26626243 [0,0,0,1,0,0|2,0,0]=3 329 B12R1.125 CC(=O)NCC1COCCN1C Amb27391708 [0,0,0,1,0,0|3,0,0]=4 330 B12R1.125 CC(=O)NC[C@H]1CCCC[C@@H]1O Amb27790347 [0,0,0,1,0,0|2,0,0]=3 331 B12R1.125 CC(=O)NC[C@H]1CCCC[C@H]1O Amb27208254 [0,0,0,1,0,0|2,0,0]=3 332 B12R1.125 CC(=O)N\N=C1/CCCCC1C Amb27220027 [0,0,0,1,0,0|2,0,1]=4 333 B12R1.125 CC(=O)OCC1=CCCCC1O Amb27484622 [0,0,0,1,0,0|1,0,2]=4 334 B12R1.125 CC(=O)\C=C\C1CCCCN1C Amb33322455 [0,0,0,1,0,0|2,0,1]=4 335 B12R1.125 CC(=S)OC[C@H]1CCCC[C@@H]1O Amb27463359 [0,0,0,1,0,0|1,1,0]=3 336 B12R1.125 CC(C)=CCC1CCCCC1O Amb18805990 [0,0,0,1,0,0|3,0,0]=4 337 B12R1.125 CC(C)=CCN1CCCCC1C Amb27662086 [0,0,0,1,0,0|3,0,0]=4 338 B12R1.125 CC(C)=CC[C@H]1CCCC[C@H]1O Amb28194191 [0,0,0,1,0,0|3,0,0]=4 339 B12R1.125 CC(C)OCC1CCCCC1Cl Amb27592109 [0,0,0,1,0,0|2,0,1]=4 340 B12R1.125 CC(C)OCC1CCCCC1N Amb28197522 [0,0,0,1,0,0|2,0,1]=4 341 B12R1.125 CC(C)OCC1CCCCC1O Amb25692005 [0,0,0,1,0,0|2,0,1]=4 342 B12R1.125 CC(C)OCC1CCNCC1C Amb28388884 [0,0,0,1,0,0|2,0,1]=4 343 B12R1.125 CC(C)OCC1NCCCC1C Amb28046423 [0,0,0,1,0,0|2,0,1]=4 344 B12R1.125 CC(C)OC[C@@H]1CCCC[C@H]1O Amb32945198 [0,0,0,1,0,0|2,0,1]=4 345 B12R1.125 CC(C)OC[C@H]1CCCC[C@@H]1Cl Amb28245239 [0,0,0,1,0,0|2,0,1]=4 346 B12R1.125 CC(O)CCC1CCCCC1C Amb27874287 [0,0,0,1,0,0|1,0,2]=4 347 B12R1.125 CC1CCCCC1CNC(=O)Cl Amb35625849 [0,0,0,1,0,0|2,0,0]=3 348 B12R1.125 CC1CCCCC1OCC(=O)O Amb9726703 [0,0,0,1,0,0|3,0,0]=4 349 B12R1.125 CC1CCCCC1OCC(N)=O Amb18802286 [0,0,0,1,0,0|3,0,0]=4 350 B12R1.125 CC1CCCCC1\C=N\S(C)=O Amb35722138 [0,0,0,1,0,0|2,0,1]=4 351 B12R1.125 CC1CCCCN1CCC(=O)Cl Amb17143073 [0,0,0,1,0,0|3,0,0]=4 352 B12R1.125 CC1CCCCN1CCC(=O)O Amb21953915 [0,0,0,1,0,0|3,0,0]=4 353 B12R1.125 CC1CCCCN1CCC(=O)O Amb2693037 [0,0,0,1,0,0|3,0,0]=4 354 B12R1.125 CC1CCCCN1CCC(N)=O Amb17142919 [0,0,0,1,0,0|3,0,0]=4 355 B12R1.125 CC1CCCNC1CCS(C)=O Amb35677548 [0,0,0,1,0,0|3,0,0]=4 356 B12R1.125 CC1CCNCC1CNC(N)=O Amb27175423 [0,0,0,1,0,0|3,0,0]=4 357 B12R1.125 CC1CNCCC1CCC(=O)O Amb27858642 [0,0,0,1,0,0|3,0,0]=4 358 B12R1.125 CN1CCCCC1CCC(=O)O Amb10607785 [0,0,0,1,0,0|3,0,0]=4 359 B12R1.125 CN1CCCCC1CCC(=O)O Amb13949149 [0,0,0,1,0,0|3,0,0]=4 360 B12R1.125 CN1CCCCC1CCC(=O)O Amb28555723 [0,0,0,1,0,0|3,0,0]=4 361 B12R1.125 CN1CCCCC1CNC(=O)Cl Amb35625872 [0,0,0,1,0,0|3,0,0]=4 362 B12R1.125 CN1CCCCC1COC(=O)Cl Amb33297321 [0,0,0,1,0,0|2,0,0]=3 363 B12R1.125 CS(=O)CCC1CCCCC1N Amb27855611 [0,0,0,1,0,0|3,0,0]=4 364 B12R1.125 CS(=O)CCC1CCCCC1O Amb27628181 [0,0,0,1,0,0|3,0,0]=4 365 B12R1.125 CS(=O)NCC1CCCCC1O Amb28144931 [0,0,0,1,0,0|3,0,0]=4 366 B12R1.125 NC1CCCCC1CCC(=O)O Amb28872362 [0,0,0,1,0,0|3,0,0]=4 367 B12R1.125 NC1CCCCC1CCC(=O)O Amb6739962 [0,0,0,1,0,0|3,0,0]=4 368 B12R1.125 O=C(O)CCC1CCCCC1F Amb27636457 [0,0,0,1,0,0|3,0,0]=4 369 B12R1.125 O=C(O)CCC1CCCCC1O Amb27426758 [0,0,0,1,0,0|3,0,0]=4 370 B12R1.125 O=C(O)CC[C@@H]1CCCC[C@@H]1O Amb27210572 [0,0,0,1,0,0|3,0,0]=4 371 B12R1.125 O=C(O)CC[C@H]1CCCC[C@H]1O Amb27444151 [0,0,0,1,0,0|3,0,0]=4 372 B12R1.130 CC(=N)NCCC1CCCN1C Amb29859278 [0,0,0,1,0,0|3,0,0]=4 373 B12R1.130 CC(=O)CCCC1CCCN1C Amb33320329 [0,0,0,1,0,0|2,0,0]=3 374 B12R1.130 CC(=O)NCCC1CCCC1=O Amb27793453 [0,0,0,1,0,0|2,0,1]=4 375 B12R1.130 CC(=O)NCCC1CCCN1C Amb35682238 [0,0,0,1,0,0|2,0,0]=3 376 B12R1.130 CC(=O)NCC[C@@H]1CNC[C@H]1C Amb32696178 [0,0,0,1,0,0|2,0,0]=3 377 B12R1.130 CC(=O)\C=C\CC1CCCN1C Amb33320331 [0,0,0,1,0,0|2,0,1]=4 378 B12R1.130 CC(C)=CCCC1CCCC1Br Amb35618150 [0,0,0,1,0,0|3,0,0]=4 379 B12R1.130 CC(C)=CCCC1CCCC1Cl Amb35618149 [0,0,0,1,0,0|3,0,0]=4 380 B12R1.130 CC(C)=CCCC1CCCC1N Amb35744195 [0,0,0,1,0,0|3,0,0]=4 381 B12R1.130 CC(C)=CCCC1CCCC1O Amb33212805 [0,0,0,1,0,0|3,0,0]=4 382 B12R1.130 CC(C)=CCC[C@@H]1CCC[C@H]1O Amb32950032 [0,0,0,1,0,0|3,0,0]=4 383 B12R1.130 CC(C)=CCNC1CCCC1C Amb27830225 [0,0,0,1,0,0|3,0,0]=4 384 B12R1.130 CC1OCCC1CCCC(=O)O Amb33429902 [0,0,0,1,0,0|3,0,0]=4 385 B12R1.130 CN1CCCC1CCCC(=O)O Amb33322235 [0,0,0,1,0,0|3,0,0]=4 386 B12R1.130 CN1CCCC1CCNC(=O)Cl Amb35625606 [0,0,0,1,0,0|3,0,0]=4 387 B12R1.130 CN1CCCC1CCNC(N)=O Amb35691980 [0,0,0,1,0,0|3,0,0]=4 388 B12R1.141 C=C1CCCCCCCC(O)C1 Amb28345283 [0,0,0,1,0,0|3,0,0]=4 389 B12R1.141 CC1=CC(=O)CCCCCCC1 Amb28253959 [0,0,0,1,0,0|1,0,2]=4 390 B12R1.141 CC1CCCCCCCC(=O)N1 Amb27616243 [0,0,0,1,0,0|2,0,0]=3 391 B12R1.141 CC1CCCCNCCC(=O)N1 Amb32657052 [0,0,0,1,0,0|3,0,0]=4 392 B12R1.141 O=C1CCCCCCCC(O)C1 Amb27262870 [0,0,0,1,0,0|2,0,0]=3 393 B12R1.141 O=C1CCCCCCOC(=O)C1 Amb27177481 [0,0,0,1,0,0|1,0,1]=3 394 B12R1.170 C=CCC1CCCCCC(=O)C1 Amb28253648 [0,0,0,1,0,0|1,0,2]=4 395 B12R1.170 CCOC1CCCCCC(=O)C1 Amb27177931 [0,0,0,1,0,0|2,0,0]=3 396 B12R1.170 O=C1CN(CCO)CCCCN1 Amb27982969 [0,0,0,1,0,0|3,0,0]=4 397 B12R1.210 C=C(C)CC1CCCCCC1O Amb18805991 [0,0,0,1,0,0|3,0,0]=4 398 B12R1.210 C=C(C)C[C@@H]1CCCCC[C@H]1O Amb32950057 [0,0,0,1,0,0|3,0,0]=4 399 B12R1.210 CC(=O)CC1CCCCCC1Cl Amb28047319 [0,0,0,1,0,0|2,0,0]=3 400 B12R1.210 CC(=O)CC1CCCCCN1C Amb27458157 [0,0,0,1,0,0|2,0,0]=3 401 B12R1.210 CC(=O)C[C@H]1CCCC=C[C@H]1C Amb27781987 [0,0,0,1,0,0|1,0,2]=4 402 B12R1.210 CC(=O)C[C@H]1CCCCC[C@@H]1Cl Amb27844358 [0,0,0,1,0,0|2,0,0]=3 403 B12R1.210 CC(=O)NC1CCCCCC1Br Amb28370391 [0,0,0,1,0,0|2,0,0]=3 404 B12R1.210 CC(=O)NC1CCCCCC1C Amb27489458 [0,0,0,1,0,0|1,0,0]=2 405 B12R1.210 CC(=O)NC1CCCCCC1N Amb27266098 [0,0,0,1,0,0|2,0,0]=3 406 B12R1.210 CC(=O)N[C@@H]1CCNCC[C@H]1O Amb30530928 [0,0,0,1,0,0|3,0,0]=4 407 B12R1.210 CC(=O)OC1CCCC=CC1Cl Amb27393032 [0,0,0,1,0,0|1,0,2]=4 408 B12R1.210 CC(=O)OC1CCCCC=C1Br Amb27797800 [0,0,0,1,0,0|1,0,2]=4 409 B12R1.210 CC(=O)OC1CCCCNC1=O Amb27840746 [0,0,0,1,0,0|2,0,1]=4 410 B12R1.210 CC(=O)O[C@@H]1CCCCCC1=O Amb27177916 [0,0,0,1,0,0|1,0,1]=3 411 B12R1.210 CC(=O)\C=C1/CCCCCC1C Amb35734060 [0,0,0,1,0,0|1,0,1]=3 412 B12R1.210 CC(C)=CC1CCCCCC1O Amb32945193 [0,0,0,1,0,0|3,0,0]=4 413 B12R1.210 CC(C)=C[C@@H]1CCCCC[C@H]1O Amb32950758 [0,0,0,1,0,0|3,0,0]=4 414 B12R1.210 CC(C)OC1CCCCCC1Br Amb26970910 [0,0,0,1,0,0|2,0,1]=4 415 B12R1.210 CC(C)OC1CCCCCC1I Amb25944246 [0,0,0,1,0,0|2,0,1]=4 416 B12R1.210 CC1CCCCCC1CC(=O)O Amb29865063 [0,0,0,1,0,0|2,0,0]=3 417 B12R1.210 CC1CCCCCC1NC(=O)Cl Amb35633242 [0,0,0,1,0,0|2,0,0]=3 418 B12R1.210 CC1CCCCCC1NN(C)C Amb35726893 [0,0,0,1,0,0|3,0,0]=4 419 B12R1.210 CC1CCCCC\C1=C/C(=O)O Amb35721698 [0,0,0,1,0,0|2,0,1]=4 420 B12R1.210 CC1CCCCC\C1=N/S(C)=O Amb35722114 [0,0,0,1,0,0|2,0,1]=4 421 B12R1.210 CC1NCCCCC1CC(=O)O Amb27792876 [0,0,0,1,0,0|3,0,0]=4 422 B12R1.210 CN1CCCCCC1CC(=O)O Amb28250660 [0,0,0,1,0,0|3,0,0]=4 423 B12R1.210 CS(=O)CC1CCCCCC1O Amb27978240 [0,0,0,1,0,0|3,0,0]=4 424 B12R1.210 CS(=O)NC1CCCCCC1O Amb27777987 [0,0,0,1,0,0|3,0,0]=4 425 B12R1.210 C[C@@H]1NCCCC[C@H]1CC(=O)O Amb18198536 [0,0,0,1,0,0|3,0,0]=4 426 B12R1.210 C[C@H]1NCCCC[C@@H]1CC(=O)O Amb27420235 [0,0,0,1,0,0|3,0,0]=4 427 B12R1.210 NC(=O)NC1CCCCCC1N Amb27249850 [0,0,0,1,0,0|3,0,0]=4 428 B12R1.210 NC(=O)NC1CCCCCC1O Amb27770817 [0,0,0,1,0,0|3,0,0]=4 429 B12R1.210 NC1CCCCCC1CC(=O)O Amb27178104 [0,0,0,1,0,0|3,0,0]=4 430 B12R1.210 N[C@@H]1CCCCC[C@@H]1CC(=O)O Amb27816143 [0,0,0,1,0,0|3,0,0]=4 431 B12R1.210 O=C(O)CC1CCCCCC1O Amb18198284 [0,0,0,1,0,0|3,0,0]=4 432 B12R1.212 CC(=O)C1=C(O)CCCCCC1 Amb27854664 [0,0,0,1,0,0|2,0,1]=4 433 B12R1.212 CC(=O)C1CCCCCCC1N Amb33447098 [0,0,0,1,0,0|2,0,0]=3 434 B12R1.212 NC(=O)C1CCCCCCC1N Amb28292092 [0,0,0,1,0,0|3,0,0]=4 435 B12R1.212 NC(=O)C1CCCCCCC1O Amb27178181 [0,0,0,1,0,0|3,0,0]=4 436 B12R1.212 NC(=O)[C@@H]1CCCCCC[C@@H]1O Amb27974099 [0,0,0,1,0,0|3,0,0]=4 437 B12R1.212 NC(=O)[C@H]1CCCCCC[C@@H]1O Amb28323009 [0,0,0,1,0,0|3,0,0]=4 438 B12R1.212 NC1CCCCCCC1C(=O)O Amb20667806 [0,0,0,1,0,0|3,0,0]=4 439 B12R1.212 NC1CCCCCCC1C(=O)O Amb22059713 [0,0,0,1,0,0|3,0,0]=4 440 B12R1.212 N[C@@H]1CCCCCC[C@@H]1C(=O)O Amb1993853 [0,0,0,1,0,0|3,0,0]=4 441 B12R1.212 N[C@@H]1CCCCCC[C@@H]1C(=O)O Amb1994005 [0,0,0,1,0,0|3,0,0]=4 442 B12R1.212 N[C@H]1CCCCCC[C@H]1C(=O)O Amb1993854 [0,0,0,1,0,0|3,0,0]=4 443 B12R1.215 O=C1CCC#CCCCCCC1 Amb27869824 [0,0,0,1,0,0|1,0,2]=4 444 B12R1.215 O=C1CCCC#CCCCCC1 Amb27234351 [0,0,0,1,0,0|1,0,2]=4 445 B12R1.215 O=C1CCCCCCCCCC1 Amb2778534 [0,0,0,1,0,0|1,0,0]=2 446 B12R1.215 O=C1CCCCCCCCCN1 Amb26068652 [0,0,0,1,0,0|1,0,0]=2 447 B12R1.215 O=C1CCCCCOCCCC1 Amb27177976 [0,0,0,1,0,0|2,0,0]=3 448 B12R1.215 O=C1CCNCCCCCCN1 Amb25704380 [0,0,0,1,0,0|2,0,0]=3 449 B12R1.252 CC(=N)NCCC1CCCCO1 Amb27770921 [0,0,0,1,0,0|3,0,0]=4 450 B12R1.252 CC(=O)CCC=C1CCCCC1 Amb2610904 [0,0,0,1,0,0|1,0,2]=4 451 B12R1.252 CC(=O)CCCC1CCCCC1 Amb33359306 [0,0,0,1,0,0|1,0,0]=2 452 B12R1.252 CC(=O)CCNC1CCCCC1 Amb18647221 [0,0,0,1,0,0|2,0,0]=3 453 B12R1.252 CC(=O)NCCC1=CCCCC1 Amb8332956 [0,0,0,1,0,0|1,0,2]=4 454 B12R1.252 CC(=O)NCCC1CCCCN1 Amb9725754 [0,0,0,1,0,0|2,0,0]=3 455 B12R1.252 CC(=O)NCCC1CCCNC1 Amb18982294 [0,0,0,1,0,0|2,0,0]=3 456 B12R1.252 CC(=O)NCCC1CCCNC1 Amb21960598 [0,0,0,1,0,0|2,0,0]=3 457 B12R1.252 CC(=O)NCCC1CCNCC1 Amb1080251 [0,0,0,1,0,0|2,0,0]=3 458 B12R1.252 CC(=O)NCCC1CNCCO1 Amb27389464 [0,0,0,1,0,0|3,0,0]=4 459 B12R1.252 CC(=O)NCCN1CCNCC1 Amb8852477 [0,0,0,1,0,0|3,0,0]=4 460 B12R1.252 CC(=O)NCNC1CCCCC1 Amb27770101 [0,0,0,1,0,0|2,0,0]=3 461 B12R1.252 CC(=O)NOCC1CCCCO1 Amb28065582 [0,0,0,1,0,0|3,0,0]=4 462 B12R1.252 CC(=O)OCCC1CC=CCC1 Amb24105649 [0,0,0,1,0,0|0,0,2]=3 463 B12R1.252 CC(=O)\C=C\CC1CCCCC1 Amb32953373 [0,0,0,1,0,0|1,0,1]=3 464 B12R1.252 CC(=O)\C=N\NC1CCCCC1 Amb27444785 [0,0,0,1,0,0|3,0,0]=4 465 B12R1.252 CC(C)=CCCC1CCCCC1 Amb35582921 [0,0,0,1,0,0|2,0,0]=3 466 B12R1.252 CC(C)=CCCC1CCCCN1 Amb35744179 [0,0,0,1,0,0|3,0,0]=4 467 B12R1.252 CC(C)=CCCC1CCCNC1 Amb35624125 [0,0,0,1,0,0|3,0,0]=4 468 B12R1.252 CC(C)=CCCC1CCOCC1 Amb35582922 [0,0,0,1,0,0|3,0,0]=4 469 B12R1.252 CC(C)=CCCN1CCCCC1 Amb30023690 [0,0,0,1,0,0|3,0,0]=4 470 B12R1.252 CC(C)OCCC1CCCCN1 Amb19431309 [0,0,0,1,0,0|2,0,1]=4 471 B12R1.252 CC(C)OCCC1CCCCN1 Amb9212461 [0,0,0,1,0,0|2,0,1]=4 472 B12R1.252 CC(C)OCCC1CCCNC1 Amb18308549 [0,0,0,1,0,0|2,0,1]=4 473 B12R1.252 CC(C)OCCC1CCNCC1 Amb9212462 [0,0,0,1,0,0|2,0,1]=4 474 B12R1.252 CC(N)CCCC1CCCCC1 Amb33079349 [0,0,0,1,0,0|2,0,1]=4 475 B12R1.252 CC(O)CCCC1CCCCC1 Amb33449617 [0,0,0,1,0,0|1,0,2]=4 476 B12R1.252 CS(=O)\N=C\CC1CCCCC1 Amb35693165 [0,0,0,1,0,0|2,0,1]=4 477 B12R1.252 C[C@@H](N)CCCC1CCCCC1 Amb33422428 [0,0,0,1,0,0|2,0,1]=4 478 B12R1.252 C[C@@H](O)CCCC1CCCCC1 Amb33422430 [0,0,0,1,0,0|1,0,2]=4 479 B12R1.252 C[C@H](N)CCCC1CCCCC1 Amb33422427 [0,0,0,1,0,0|2,0,1]=4 480 B12R1.252 C[C@H](O)CCCC1CCCCC1 Amb33422431 [0,0,0,1,0,0|1,0,2]=4 481 B12R1.252 C\C(Cl)=C/CNC1CCCCC1 Amb27420006 [0,0,0,1,0,0|3,0,0]=4 482 B12R1.252 NC(=O)CCCN1CCCCC1 Amb17142921 [0,0,0,1,0,0|3,0,0]=4 483 B12R1.252 NC(=O)CCNC1CCCCC1 Amb8437701 [0,0,0,1,0,0|3,0,0]=4 484 B12R1.252 NC(=O)CNCC1CCCCC1 Amb1113547 [0,0,0,1,0,0|3,0,0]=4 485 B12R1.252 NC(=O)NOCC1CCCCC1 Amb28193569 [0,0,0,1,0,0|3,0,0]=4 486 B12R1.252 NC(=S)NCCC1CCCCC1 Amb19058785 [0,0,0,1,0,0|2,1,0]=4 487 B12R1.252 O=C(Cl)NCCC1CCCCC1 Amb35625747 [0,0,0,1,0,0|2,0,0]=3 488 B12R1.252 O=C(Cl)NCCC1CCCCO1 Amb35633405 [0,0,0,1,0,0|3,0,0]=4 489 B12R1.252 O=C(Cl)NCCC1CCOCC1 Amb35625737 [0,0,0,1,0,0|3,0,0]=4 490 B12R1.252 O=C(Cl)OCCC1CCCCC1 Amb33297326 [0,0,0,1,0,0|1,0,0]=2 491 B12R1.252 O=C(Cl)OCCC1CCCCO1 Amb33297112 [0,0,0,1,0,0|2,0,0]=3 492 B12R1.252 O=C(Cl)OCCN1CCOCC1 Amb33296999 [0,0,0,1,0,0|3,0,0]=4 493 B12R1.252 O=C(O)C#CCC1CCCCC1 Amb27170004 [0,0,0,1,0,0|2,0,1]=4 494 B12R1.252 O=C(O)CCCC1CCCCC1 Amb4007236 [0,0,0,1,0,0|2,0,0]=3 495 B12R1.252 O=C(O)CCCC1CCCCN1 Amb1101084 [0,0,0,1,0,0|3,0,0]=4 496 B12R1.252 O=C(O)CCCC1CCCCN1 Amb22284114 [0,0,0,1,0,0|3,0,0]=4 497 B12R1.252 O=C(O)CCCC1CCCCO1 Amb33377395 [0,0,0,1,0,0|3,0,0]=4 498 B12R1.252 O=C(O)CCCC1CCCOC1 Amb33358265 [0,0,0,1,0,0|3,0,0]=4 499 B12R1.252 O=C(O)CCCC1CCCSC1 Amb33079061 [0,0,0,1,0,0|3,0,0]=4 500 B12R1.252 O=C(O)CCCC1CCNCC1 Amb1101085 [0,0,0,1,0,0|3,0,0]=4 501 B12R1.252 O=C(O)CCCC1CCNCC1 Amb2720095 [0,0,0,1,0,0|3,0,0]=4 502 B12R1.252 O=C(O)CCCC1CCOCC1 Amb28555790 [0,0,0,1,0,0|3,0,0]=4 503 B12R1.252 O=C(O)CCCN1CCCCC1 Amb5718374 [0,0,0,1,0,0|3,0,0]=4 504 B12R1.252 O=C(O)CCCN1CCCCC1 Amb5762298 [0,0,0,1,0,0|3,0,0]=4 505 B12R1.252 O=C(O)CCNC1CCCCC1 Amb33484265 [0,0,0,1,0,0|3,0,0]=4 506 B12R1.252 O=C(O)CCNC1CCCCC1 Amb3940614 [0,0,0,1,0,0|3,0,0]=4 507 B12R1.252 O=C(O)CCSC1CCCCC1 Amb3318888 [0,0,0,1,0,0|3,0,0]=4 508 B12R1.252 O=C(O)COCC1CCCCC1 Amb19032022 [0,0,0,1,0,0|3,0,0]=4 509 B12R1.252 O=C(O)\C=C\CC1CCCCC1 Amb26527903 [0,0,0,1,0,0|2,0,1]=4 510 B12R1.252 O=C([O-])CCCC1CCCCC1 Amb8516780 [0,0,0,1,0,0|2,0,0]=3 511 B12R1.252 O=[N+]([O-])CCCC1CCCCC1 Amb33422420 [0,0,0,1,0,0|3,0,0]=4 512 B12R1.255 CC(=O)CCCCC1CCCC1 Amb33448571 [0,0,0,1,0,0|1,0,0]=2 513 B12R1.255 CC(=O)CCCCN1CCCC1 Amb9659031 [0,0,0,1,0,0|2,0,0]=3 514 B12R1.255 CC(=O)NCCNC1CCSC1 Amb32652145 [0,0,0,1,0,0|3,0,0]=4 515 B12R1.255 CC(=O)NCCNC1CCSC1 Amb6732500 [0,0,0,1,0,0|3,0,0]=4 516 B12R1.255 CC(=O)\C=C\CCC1CCCC1 Amb33379446 [0,0,0,1,0,0|1,0,1]=3 517 B12R1.255 CC(=O)\C=C\CCN1CCCC1 Amb33274871 [0,0,0,1,0,0|2,0,1]=4 518 B12R1.255 CC(N)CCCCC1CCCC1 Amb33481739 [0,0,0,1,0,0|2,0,1]=4 519 B12R1.255 CC(O)CCCCC1CCCC1 Amb33359674 [0,0,0,1,0,0|1,0,2]=4 520 B12R1.255 C[C@@H](N)CCCCC1CCCC1 Amb33375617 [0,0,0,1,0,0|2,0,1]=4 521 B12R1.255 C[C@@H](O)CCCCC1CCCC1 Amb33375589 [0,0,0,1,0,0|1,0,2]=4 522 B12R1.255 C[C@H](N)CCCCC1CCCC1 Amb33375616 [0,0,0,1,0,0|2,0,1]=4 523 B12R1.255 C[C@H](O)CCCCC1CCCC1 Amb33375619 [0,0,0,1,0,0|1,0,2]=4 524 B12R1.255 O=C(O)CCCCC1CCCC1 Amb33229242 [0,0,0,1,0,0|2,0,0]=3 525 B12R1.255 O=C(O)CCCCC1CCOC1 Amb33229236 [0,0,0,1,0,0|3,0,0]=4 526 B12R1.255 O=C(O)CCCCN1CCCC1 Amb33552798 [0,0,0,1,0,0|3,0,0]=4 527 B12R1.255 O=C(O)CCCCN1CCCC1 Amb7783148 [0,0,0,1,0,0|3,0,0]=4 528 B12R1.255 O=C(O)COCCC1CCCC1 Amb32954482 [0,0,0,1,0,0|3,0,0]=4 529 B12R1.255 O=C(O)\C=C\CCC1CCCC1 Amb33374577 [0,0,0,1,0,0|2,0,1]=4 530 B12R1.255 O=[N+]([O-])CCCCC1CCCC1 Amb33380265 [0,0,0,1,0,0|3,0,0]=4 531 B12R1.283 C#CCC1CCCCC1C(C)=O Amb25996388 [0,0,0,1,0,0|1,0,2]=4 532 B12R1.283 C#CC[C@@H]1CCCC[C@H]1C(C)=O Amb25273888 [0,0,0,1,0,0|1,0,2]=4 533 B12R1.283 C#CC[C@H]1CCCC[C@H]1C(C)=O Amb26554032 [0,0,0,1,0,0|1,0,2]=4 534 B12R1.283 C=CCC1CCCCN1C(C)=O Amb27206388 [0,0,0,1,0,0|1,0,2]=4 535 B12R1.283 CC(=O)N1CCCCC1CCBr Amb17103917 [0,0,0,1,0,0|2,0,0]=3 536 B12R1.283 CC(=O)N1CCCCC1CCCl Amb17103644 [0,0,0,1,0,0|2,0,0]=3 537 B12R1.283 CC(=O)N1CCCCC1CCN Amb17046292 [0,0,0,1,0,0|2,0,0]=3 538 B12R1.283 CC(=O)N1CCCCC1CCO Amb5797426 [0,0,0,1,0,0|2,0,0]=3 539 B12R1.283 CC(=O)N1CCCC[C@@H]1CCO Amb25295318 [0,0,0,1,0,0|2,0,0]=3 540 B12R1.283 CC(=O)N1CCCC[C@H]1CCO Amb25700843 [0,0,0,1,0,0|2,0,0]=3 541 B12R1.283 CC(=O)N1CCOCC1CCBr Amb35742287 [0,0,0,1,0,0|3,0,0]=4 542 B12R1.283 CC(=O)N1CCOCC1CCCl Amb35621225 [0,0,0,1,0,0|3,0,0]=4 543 B12R1.283 CC(=O)N1CCOCC1CCN Amb35743373 [0,0,0,1,0,0|3,0,0]=4 544 B12R1.283 CC(=O)[C@@H]1CCCC[C@H]1CC#N Amb26427085 [0,0,0,1,0,0|2,0,1]=4 545 B12R1.283 CC(=O)[C@@H]1CCCC[C@H]1CC=O Amb27195918 [0,0,0,1,0,0|2,0,1]=4 546 B12R1.283 CCCC1=C(C(C)=O)CCCC1 Amb27614636 [0,0,0,1,0,0|1,0,1]=3 547 B12R1.283 CCCC1CCCCC1C(C)=O Amb27762565 [0,0,0,1,0,0|1,0,0]=2 548 B12R1.283 CCCC1CCCNC1C(=O)O Amb27178215 [0,0,0,1,0,0|3,0,0]=4 549 B12R1.283 CCCC1CNCCN1C(C)=O Amb28285684 [0,0,0,1,0,0|2,0,0]=3 550 B12R1.283 CCCC1OCCCC1C(=O)O Amb10609660 [0,0,0,1,0,0|3,0,0]=4 551 B12R1.283 CCCN1CCCCC1C(=O)O Amb1110568 [0,0,0,1,0,0|3,0,0]=4 552 B12R1.283 CCCN1CCCCC1C(=O)O Amb33552437 [0,0,0,1,0,0|3,0,0]=4 553 B12R1.283 CCCN1CCCCC1C(N)=O Amb26003555 [0,0,0,1,0,0|3,0,0]=4 554 B12R1.283 CCCN1CCCC[C@H]1C(N)=O Amb28291427 [0,0,0,1,0,0|3,0,0]=4 555 B12R1.283 CCNC1CCCCC1S(C)=O Amb28291089 [0,0,0,1,0,0|3,0,0]=4 556 B12R1.283 CCO[C@@H]1CCCC[C@H]1C(C)=O Amb28248007 [0,0,0,1,0,0|2,0,0]=3 557 B12R1.283 COCC1CCCCN1C(=O)Cl Amb32863950 [0,0,0,1,0,0|3,0,0]=4 558 B12R1.283 COCC1CNCCN1C(C)=O Amb33041227 [0,0,0,1,0,0|3,0,0]=4 559 B12R1.283 C\C=C\C1CCCCC1C(C)=O Amb25282802 [0,0,0,1,0,0|1,0,2]=4 560 B12R1.283 NC(=O)N1CCCCC1CCO Amb28281163 [0,0,0,1,0,0|3,0,0]=4 561 B12R1.283 NCCC1CCCCN1C(N)=O Amb28381340 [0,0,0,1,0,0|3,0,0]=4 562 B12R1.289 C=CCC1CCCC1NC(C)=O Amb27784894 [0,0,0,1,0,0|1,0,2]=4 563 B12R1.289 C=CC[C@@H]1CCC[C@@H]1NC(C)=O Amb27786944 [0,0,0,1,0,0|1,0,2]=4 564 B12R1.289 CC(=O)CC1CCCC1CC#N Amb27164722 [0,0,0,1,0,0|2,0,1]=4 565 B12R1.289 CC(=O)C[C@@H]1CCC[C@H]1CC#N Amb27620440 [0,0,0,1,0,0|2,0,1]=4 566 B12R1.289 CC(=O)OC1CCCC1SC#N Amb25350316 [0,0,0,1,0,0|2,0,1]=4 567 B12R1.289 CCCC1COCC1NC(=O)Cl Amb35636915 [0,0,0,1,0,0|3,0,0]=4 568 B12R1.289 CCCC1COCC1NC(C)=N Amb35632736 [0,0,0,1,0,0|3,0,0]=4 569 B12R1.289 CCCC1COCC1NC(C)=O Amb35617217 [0,0,0,1,0,0|2,0,0]=3 570 B12R1.289 CCCC1COCC1NC(N)=O Amb35613744 [0,0,0,1,0,0|3,0,0]=4 571 B12R1.289 CCCC1COC\C1=C/C(C)=O Amb35616357 [0,0,0,1,0,0|2,0,1]=4 572 B12R1.289 CCNC1CCCC1OC(C)C Amb17606033 [0,0,0,1,0,0|2,0,1]=4 573 B12R1.289 CCSC1CCCC1NC(=O)Cl Amb35633550 [0,0,0,1,0,0|3,0,0]=4 574 B12R1.321 C=CCCC1CCCCC(=O)C1 Amb27951458 [0,0,0,1,0,0|1,0,2]=4 575 B12R1.321 CCCCC1CC(=O)NCCN1 Amb27950409 [0,0,0,1,0,0|2,0,0]=3 576 B12R1.321 CCCCC1CCCCC(=O)N1 Amb4011804 [0,0,0,1,0,0|2,0,0]=3 577 B12R1.321 CCCCC1CCCCC(=O)O1 Amb22230135 [0,0,0,1,0,0|2,0,0]=3 578 B12R1.321 CCCCC1CCCCC(Br)C1 Amb27599861 [0,0,0,1,0,0|2,0,1]=4 579 B12R1.321 CCCCC1CCCCC(Cl)C1 Amb27428526 [0,0,0,1,0,0|2,0,1]=4 580 B12R1.321 CCCCN1CCCNC(=O)C1 Amb25938139 [0,0,0,1,0,0|2,0,0]=3 581 B12R1.321 CCCCN1CCCOC(C)C1 Amb27650107 [0,0,0,1,0,0|2,0,1]=4 582 B12R1.321 CCONC1CCCNC(=O)C1 Amb27389276 [0,0,0,1,0,0|3,0,0]=4 583 B12R1.321 COCCN1CCCNC(=O)C1 Amb27178817 [0,0,0,1,0,0|3,0,0]=4 584 B12R1.321 CSCCN1CCCNC(=O)C1 Amb27762174 [0,0,0,1,0,0|3,0,0]=4 585 B12R1.321 N#CCCC1CCCCC(=O)C1 Amb28202067 [0,0,0,1,0,0|2,0,1]=4 586 B12R1.321 N#CCCN1CCCOC(=O)C1 Amb27186202 [0,0,0,1,0,0|2,0,1]=4 587 B12R1.321 NCCCC1CCCCC(=O)N1 Amb18825523 [0,0,0,1,0,0|3,0,0]=4 588 B12R1.321 O=C1CC(NCCF)CCCN1 Amb28140889 [0,0,0,1,0,0|3,0,0]=4 589 B12R1.321 O=C1CC(NCCO)CCCN1 Amb27425216 [0,0,0,1,0,0|3,0,0]=4 590 B12R1.321 O=C1CCCCC(CCCCl)O1 Amb27974145 [0,0,0,1,0,0|3,0,0]=4 591 B12R1.321 O=C1CCCCC(CCCO)N1 Amb18825414 [0,0,0,1,0,0|3,0,0]=4 592 B12R1.321 O=C1CCCCC(CCCO)O1 Amb27206114 [0,0,0,1,0,0|3,0,0]=4 593 B12R1.384 CCCCC1CCCCC1(C)O Amb32945487 [0,0,0,1,0,0|1,0,2]=4 594 B12R1.384 CCCCC1NCCOC1(C)C Amb33216247 [0,0,0,1,0,0|2,0,1]=4 595 B12R1.384 CCCC[C@@H]1CCCC[C@@]1(C)O Amb33213620 [0,0,0,1,0,0|1,0,2]=4 596 B12R1.386 CC(=O)N1CCCC1CCC#N Amb27808603 [0,0,0,1,0,0|2,0,1]=4 597 B12R1.386 CC(=O)N1CCCC1CCCN Amb31161636 [0,0,0,1,0,0|2,0,0]=3 598 B12R1.386 CCNCC1CCCN1C(C)=O Amb21861191 [0,0,0,1,0,0|2,0,0]=3 599 B12R1.386 C\C(N)=[N+]1\CCCC1CCCO Amb28183091 [0,0,0,1,0,0|3,0,0]=4 600 B12R1.390 O=C(O)CCCCOCC1CC1 Amb9207802 [0,0,0,1,0,0|3,0,0]=4 601 B12R1.390 O=C(O)CNCCCCC1CC1 Amb32675856 [0,0,0,1,0,0|3,0,0]=4 602 B12R1.405 C#C[C@H]1CCCCCN1C(C)=O Amb25152645 [0,0,0,1,0,0|1,0,2]=4 603 B12R1.405 CC(=O)C1CCCCCC1C#N Amb25918242 [0,0,0,1,0,0|2,0,1]=4 604 B12R1.405 CC(=O)N1CCCCCC1CN Amb24671055 [0,0,0,1,0,0|2,0,0]=3 605 B12R1.405 CCC1CCCCCC1C(C)Br Amb35721290 [0,0,0,1,0,0|2,0,1]=4 606 B12R1.405 CCC1CCCCCC1C(C)Cl Amb35721288 [0,0,0,1,0,0|2,0,1]=4 607 B12R1.405 CCC1CCCCCC1C(C)N Amb35671754 [0,0,0,1,0,0|2,0,1]=4 608 B12R1.405 CCC1CCCCCC1C(C)O Amb35672751 [0,0,0,1,0,0|1,0,2]=4 609 B12R1.405 CC[C@@H]1NCCCC[C@H]1C(=O)O Amb18198539 [0,0,0,1,0,0|3,0,0]=4 610 B12R1.405 CC[C@H]1NCCCC[C@@H]1C(=O)O Amb28247202 [0,0,0,1,0,0|3,0,0]=4 611 B12R1.405 CNC1CCCCCC1C(N)=O Amb27833351 [0,0,0,1,0,0|3,0,0]=4 612 B12R1.405 CO[C@H]1CCCCC[C@H]1C(=O)O Amb27489023 [0,0,0,1,0,0|3,0,0]=4 613 B12R1.405 CS(=O)C1CCCCCC1CN Amb27181216 [0,0,0,1,0,0|3,0,0]=4 614 B12R1.405 CSC1CCCCCC1C(=O)O Amb18967402 [0,0,0,1,0,0|3,0,0]=4 615 B12R1.407 COC1CCCCCCC(=O)N1 Amb28184682 [0,0,0,1,0,0|3,0,0]=4 616 B12R1.906 CC1(N)CCCCCCCCC1 Amb28056747 [0,0,0,1,0,0|2,0,1]=4 617 B12R1.1335 CC(=N)N1CCCCCCCC1 Amb27607308 [0,0,0,1,0,0|2,0,0]=3 618 B12R1.1335 CC(=O)N1CCCCCCCC1 Amb25169087 [0,0,0,1,0,0|1,0,0]=2 619 B12R1.1335 CC(=O)N1CCCNCNCC1 Amb26045664 [0,0,0,1,0,0|3,0,0]=4 620 B12R1.1335 NC(=S)N1CCCCCCCC1 Amb28282880 [0,0,0,1,0,0|2,1,0]=4 621 B12R1.1335 O=C(Cl)N1CCCCCCCC1 Amb27802970 [0,0,0,1,0,0|2,0,0]=3 622 B12R1.1335 O=C(O)C1=CCCCCCCC1 Amb28325718 [0,0,0,1,0,0|2,0,1]=4 623 B12R1.1335 O=C(O)C1CCCCCCCN1 Amb27171757 [0,0,0,1,0,0|3,0,0]=4 624 B12R1.1343 C=C(C)CCN1CCCCCC1 Amb27955088 [0,0,0,1,0,0|3,0,0]=4 625 B12R1.1343 CC(=N)NCC1CCCCCC1 Amb28193193 [0,0,0,1,0,0|2,0,0]=3 626 B12R1.1343 CC(=N)NCC1CCCSCC1 Amb29884321 [0,0,0,1,0,0|3,0,0]=4 627 B12R1.1343 CC(=O)CCC1CCCCCC1 Amb27468725 [0,0,0,1,0,0|1,0,0]=2 628 B12R1.1343 CC(=O)CCN1CCCCCC1 Amb1136685 [0,0,0,1,0,0|2,0,0]=3 629 B12R1.1343 CC(=O)CCN1CCCOCC1 Amb18806959 [0,0,0,1,0,0|3,0,0]=4 630 B12R1.1343 CC(=O)NCC1CCCCCC1 Amb27208386 [0,0,0,1,0,0|1,0,0]=2 631 B12R1.1343 CC(=O)NCC1CCCCCN1 Amb33038736 [0,0,0,1,0,0|2,0,0]=3 632 B12R1.1343 CC(=O)NCC1CCCCNC1 Amb26605896 [0,0,0,1,0,0|2,0,0]=3 633 B12R1.1343 CC(=O)NCC1CCCSCC1 Amb29883281 [0,0,0,1,0,0|2,0,0]=3 634 B12R1.1343 CC(=O)\C=C\C1CCCCCC1 Amb27968526 [0,0,0,1,0,0|1,0,1]=3 635 B12R1.1343 CC(=O)\C=C\N1CCCCCC1 Amb22524689 [0,0,0,1,0,0|2,0,1]=4 636 B12R1.1343 CC(C)OCC1CCCCCN1 Amb27777841 [0,0,0,1,0,0|2,0,1]=4 637 B12R1.1343 CC(C)OCC1CCCNCC1 Amb28139285 [0,0,0,1,0,0|2,0,1]=4 638 B12R1.1343 CC(C)ONC1CCCCCC1 Amb28128379 [0,0,0,1,0,0|2,0,1]=4 639 B12R1.1343 CC(Cl)CCC1CCCCCC1 Amb27436680 [0,0,0,1,0,0|2,0,1]=4 640 B12R1.1343 CC(N)CCC1CCCCCC1 Amb25115183 [0,0,0,1,0,0|2,0,1]=4 641 B12R1.1343 CC(O)CCC1CCCCCC1 Amb26370751 [0,0,0,1,0,0|1,0,2]=4 642 B12R1.1343 CN(C)NCC1CCCCCC1 Amb27806570 [0,0,0,1,0,0|3,0,0]=4 643 B12R1.1343 CS(=O)\N=C\C1CCCCCC1 Amb35693177 [0,0,0,1,0,0|2,0,1]=4 644 B12R1.1343 C[C@@H](N)CCC1CCCCCC1 Amb33267870 [0,0,0,1,0,0|2,0,1]=4 645 B12R1.1343 C[C@@H](O)CCC1CCCCCC1 Amb33267286 [0,0,0,1,0,0|1,0,2]=4 646 B12R1.1343 C[C@H](N)CCC1CCCCCC1 Amb33224813 [0,0,0,1,0,0|2,0,1]=4 647 B12R1.1343 C[C@H](O)CCC1CCCCCC1 Amb33267288 [0,0,0,1,0,0|1,0,2]=4 648 B12R1.1343 N=C(N)NCC1CCCCCC1 Amb27983875 [0,0,0,1,0,0|3,0,0]=4 649 B12R1.1343 NC(=O)CCN1CCCCCC1 Amb17142920 [0,0,0,1,0,0|3,0,0]=4 650 B12R1.1343 NC(=O)CNC1CCCCCC1 Amb1114001 [0,0,0,1,0,0|3,0,0]=4 651 B12R1.1343 NC(=O)NCC1CCCSCC1 Amb30030704 [0,0,0,1,0,0|3,0,0]=4 652 B12R1.1343 NC(=O)OCC1CCCCNC1 Amb35647544 [0,0,0,1,0,0|2,0,0]=3 653 B12R1.1343 NC(=S)NCC1CCCCCC1 Amb28193224 [0,0,0,1,0,0|2,1,0]=4 654 B12R1.1343 O=C(Cl)NCC1CCCCCC1 Amb35625593 [0,0,0,1,0,0|2,0,0]=3 655 B12R1.1343 O=C(Cl)NCC1CCCSCC1 Amb35627018 [0,0,0,1,0,0|3,0,0]=4 656 B12R1.1343 O=C(O)C#CC1CCCCCC1 Amb24556561 [0,0,0,1,0,0|2,0,1]=4 657 B12R1.1343 O=C(O)CCC1CCCCCC1 Amb18825578 [0,0,0,1,0,0|2,0,0]=3 658 B12R1.1343 O=C(O)CCC1CCCCCN1 Amb18198528 [0,0,0,1,0,0|3,0,0]=4 659 B12R1.1343 O=C(O)CCC1CCCNCC1 Amb18198557 [0,0,0,1,0,0|3,0,0]=4 660 B12R1.1343 O=C(O)CCC1CCCOCC1 Amb18825358 [0,0,0,1,0,0|3,0,0]=4 661 B12R1.1343 O=C(O)CCC1CCCSCC1 Amb18820668 [0,0,0,1,0,0|3,0,0]=4 662 B12R1.1343 O=C(O)CCN1CCCCCC1 Amb2721891 [0,0,0,1,0,0|3,0,0]=4 663 B12R1.1343 O=C(O)CCN1CCCCCC1 Amb33552757 [0,0,0,1,0,0|3,0,0]=4 664 B12R1.1343 O=C(O)CNC1CCCCCC1 Amb8428138 [0,0,0,1,0,0|3,0,0]=4 665 B12R1.1343 O=C(O)COC1CCCCCC1 Amb18972071 [0,0,0,1,0,0|3,0,0]=4 666 B12R1.1343 O=C(O)\C=C\C1CCCCCC1 Amb24715822 [0,0,0,1,0,0|2,0,1]=4 667 B12R1.1343 O=[N+]([O-])CCC1CCCCCC1 Amb33268613 [0,0,0,1,0,0|3,0,0]=4 668 B12R1.1392 CC(=O)C=C1CCCCCCC1 Amb28253982 [0,0,0,1,0,0|1,0,1]=3 669 B12R1.1392 CC(=O)CC1CCCCCCN1 Amb27395289 [0,0,0,1,0,0|2,0,0]=3 670 B12R1.1392 CC(=O)NC1C=CCCCCC1 Amb27268481 [0,0,0,1,0,0|1,0,2]=4 671 B12R1.1392 CC(=O)NC1CC=CCCCC1 Amb27850624 [0,0,0,1,0,0|1,0,2]=4 672 B12R1.1392 CC(=O)NC1CCCCCCC1 Amb5797421 [0,0,0,1,0,0|1,0,0]=2 673 B12R1.1392 CC(=O)NC1CCCCCNC1 Amb32659965 [0,0,0,1,0,0|2,0,0]=3 674 B12R1.1392 CC(=O)N[C@@H]1C=CCCCCC1 Amb28434672 [0,0,0,1,0,0|1,0,2]=4 675 B12R1.1392 CC(=O)OC1=CCCCCCC1 Amb3994643 [0,0,0,1,0,0|0,0,2]=3 676 B12R1.1392 CC(=O)OC1C=CCCCCC1 Amb6359572 [0,0,0,1,0,0|0,0,2]=3 677 B12R1.1392 CC(=O)OC1CCCCCCC1 Amb4016350 [0,0,0,1,0,0|0,0,0]=1 678 B12R1.1392 CC(C)NC1CCCCCCC1 Amb6685390 [0,0,0,1,0,0|2,0,1]=4 679 B12R1.1392 CN(C)CC1CCCCCCC1 Amb27973635 [0,0,0,1,0,0|3,0,0]=4 680 B12R1.1392 CN(C)NC1CCCCCCC1 Amb27170932 [0,0,0,1,0,0|3,0,0]=4 681 B12R1.1392 CS(=O)N=C1CCCCCCC1 Amb35681706 [0,0,0,1,0,0|2,0,1]=4 682 B12R1.1392 N=C(N)NC1CCCCCCC1 Amb18801546 [0,0,0,1,0,0|3,0,0]=4 683 B12R1.1392 O=C(Cl)NC1CCCCCCC1 Amb35637075 [0,0,0,1,0,0|2,0,0]=3 684 B12R1.1392 O=C(Cl)OC1CCC=CCCC1 Amb33297258 [0,0,0,1,0,0|1,0,2]=4 685 B12R1.1392 O=C(Cl)OC1CCCCCCC1 Amb27480779 [0,0,0,1,0,0|1,0,0]=2 686 B12R1.1392 O=C(O)C=C1CCCCCCC1 Amb6749166 [0,0,0,1,0,0|2,0,1]=4 687 B12R1.1392 O=C(O)CC1CCCCCCC1 Amb6749259 [0,0,0,1,0,0|2,0,0]=3 688 B12R1.1392 O=C(O)CC1CCCCCCO1 Amb27634953 [0,0,0,1,0,0|3,0,0]=4 689 B12R1.1392 O=C(O)CN1CCCCCCC1 Amb6613276 [0,0,0,1,0,0|3,0,0]=4 690 B12R1.1392 O=C(O)C[C@H]1CCCCCCN1 Amb27985858 [0,0,0,1,0,0|3,0,0]=4 691 B12R1.1409 C=CCCC[C@@H]1C[C@H]1OC(C)=O Amb33717012 [0,0,0,1,0,0|0,0,2]=3 692 B12R1.1755 CCCCCC[C@@H]1C[C@H]1C(=O)O Amb33098453 [0,0,0,1,0,0|2,0,0]=3 693 B12R1.1755 CCCCCC[C@H]1C[C@H]1C(=O)O Amb33098421 [0,0,0,1,0,0|2,0,0]=3 694 B9R0.2 C#CCCCCCC(C)=O Amb28053988 [2,0,0,0,0,0|0,0,2]=4 695 B9R0.2 C=C(C)CCCCCCC Amb6298940 [2,0,0,0,0,0|1,0,0]=3 696 B9R0.2 C=C(C)CCCCCCCl Amb6298888 [2,0,0,0,0,0|2,0,0]=4 697 B9R0.2 C=C(C)CCCCCNC Amb27489967 [2,0,0,0,0,0|2,0,0]=4 698 B9R0.2 C=C(C)CCSCCCC Amb27199306 [2,0,0,0,0,0|2,0,0]=4 699 B9R0.2 C=C(C)CNCCCCC Amb17308711 [2,0,0,0,0,0|2,0,0]=4 700 B9R0.2 C=C(C)COCCCCC Amb27862423 [2,0,0,0,0,0|2,0,0]=4 701 B9R0.2 C=C(C)CSCCCCC Amb27977453 [2,0,0,0,0,0|2,0,0]=4 702 B9R0.2 C=CCCCCCC(C)=O Amb33544200 [2,0,0,0,0,0|0,0,2]=4 703 B9R0.2 C=CCCCCOC(C)=O Amb10842183 [2,0,0,0,0,0|0,0,2]=4 704 B9R0.2 CC(=O)CCCCCCN Amb25147578 [2,0,0,0,0,0|1,0,0]=3 705 B9R0.2 CC(=O)CCCCCCN Amb32663700 [2,0,0,0,0,0|1,0,0]=3 706 B9R0.2 CC(=O)CCCSCCO Amb9660259 [2,0,0,0,0,0|2,0,0]=4 707 B9R0.2 CC(=O)CNCCCCN Amb33483477 [2,0,0,0,0,0|2,0,0]=4 708 B9R0.2 CC(=O)CNCCCCN Amb33483478 [2,0,0,0,0,0|2,0,0]=4 709 B9R0.2 CC(=O)CSCCCCF Amb27952719 [2,0,0,0,0,0|2,0,0]=4 710 B9R0.2 CC(=O)CSCCCCN Amb17500952 [2,0,0,0,0,0|2,0,0]=4 711 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [2,0,0,0,0,0|2,0,0]=4 712 B9R0.2 CC(=O)NCCCCCN Amb18102716 [2,0,0,0,0,0|2,0,0]=4 713 B9R0.2 CC(=O)OCCCCC=O Amb26505388 [2,0,0,0,0,0|1,0,1]=4 714 B9R0.2 CC(=O)OCCCCCBr Amb8516155 [2,0,0,0,0,0|1,0,0]=3 715 B9R0.2 CC(=O)OCCCCCCl Amb2778974 [2,0,0,0,0,0|1,0,0]=3 716 B9R0.2 CC(=O)OCCCC[Zn]Br Amb22000480 [2,0,0,0,0,0|2,0,0]=4 717 B9R0.2 CC(=O)OCCNCCCl Amb28142296 [2,0,0,0,0,0|2,0,0]=4 718 B9R0.2 CC(=O)OCCOCCCl Amb9787226 [2,0,0,0,0,0|2,0,0]=4 719 B9R0.2 CC(=O)OCCOCCI Amb28050483 [2,0,0,0,0,0|2,0,0]=4 720 B9R0.2 CC(=O)OCCSCCO Amb27825930 [2,0,0,0,0,0|2,0,0]=4 721 B9R0.2 CCC#CCCCC(C)=O Amb27836855 [2,0,0,0,0,0|0,0,2]=4 722 B9R0.2 CCC#CCCOC(C)=O Amb22641578 [2,0,0,0,0,0|0,0,2]=4 723 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [2,0,0,0,0,0|1,0,0]=3 724 B9R0.2 CCCCCCCC(=O)O Amb3940371 [2,0,0,0,0,0|1,0,0]=3 725 B9R0.2 CCCCCCCC(=O)S Amb10561702 [2,0,0,0,0,0|1,0,0]=3 726 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [2,0,0,0,0,0|1,0,0]=3 727 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [2,0,0,0,0,0|1,0,0]=3 728 B9R0.2 CCCCCCCC(C)=O Amb6891951 [2,0,0,0,0,0|0,0,0]=2 729 B9R0.2 CCCCCCCC(C)Br Amb3940567 [2,0,0,0,0,0|1,0,1]=4 730 B9R0.2 CCCCCCCC(C)C Amb6366303 [2,0,0,0,0,0|1,0,1]=4 731 B9R0.2 CCCCCCCC(C)S Amb7795228 [2,0,0,0,0,0|0,1,1]=4 732 B9R0.2 CCCCCCCC(N)=O Amb8999028 [2,0,0,0,0,0|1,0,0]=3 733 B9R0.2 CCCCCCCS(=O)Cl Amb32720351 [2,0,0,0,0,0|2,0,0]=4 734 B9R0.2 CCCCCCCS(=O)[O-] Amb32754186 [2,0,0,0,0,0|2,0,0]=4 735 B9R0.2 CCCCCCCS(N)=O Amb32720352 [2,0,0,0,0,0|2,0,0]=4 736 B9R0.2 CCCCCCC[C@@H](C)Br Amb28252396 [2,0,0,0,0,0|1,0,1]=4 737 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [2,0,0,0,0,0|1,0,1]=4 738 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [2,0,0,0,0,0|0,0,2]=4 739 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [2,0,0,0,0,0|1,0,1]=4 740 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [2,0,0,0,0,0|0,0,2]=4 741 B9R0.2 CCCCCCC[N+](=O)[O-] Amb17672611 [2,0,0,0,0,0|2,0,0]=4 742 B9R0.2 CCCCCCNC(C)=O Amb3368460 [2,0,0,0,0,0|1,0,0]=3 743 B9R0.2 CCCCCCNC(N)=O Amb23569596 [2,0,0,0,0,0|2,0,0]=4 744 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [2,0,0,0,0,0|1,0,0]=3 745 B9R0.2 CCCCCCOC(=S)[S-] Amb594881 [2,0,0,0,0,0|1,1,0]=4 746 B9R0.2 CCCCCCOC(C)=O Amb8513414 [2,0,0,0,0,0|0,0,0]=2 747 B9R0.2 CCCCCCOC(C)C Amb28320041 [2,0,0,0,0,0|1,0,1]=4 748 B9R0.2 CCCCCCOC(C)Cl Amb25662692 [2,0,0,0,0,0|1,0,1]=4 749 B9R0.2 CCCCCCOC(C)O Amb28347016 [2,0,0,0,0,0|0,0,2]=4 750 B9R0.2 CCCCCCOC(N)=O Amb22495526 [2,0,0,0,0,0|1,0,0]=3 751 B9R0.2 CCCCCCO[N+](=O)[O-] Amb27233862 [2,0,0,0,0,0|2,0,0]=4 752 B9R0.2 CCCCCCSC(=O)Cl Amb28421765 [2,0,0,0,0,0|1,1,0]=4 753 B9R0.2 CCCCCCSC(C)=O Amb27837874 [2,0,0,0,0,0|0,1,0]=3 754 B9R0.2 CCCCCC\C=C(\C)I Amb28464058 [2,0,0,0,0,0|1,0,1]=4 755 B9R0.2 CCCCCNCC(N)=O Amb6708061 [2,0,0,0,0,0|2,0,0]=4 756 B9R0.2 CCCCCOCC(=O)O Amb8902706 [2,0,0,0,0,0|2,0,0]=4 757 B9R0.2 CCCCCSCC(=O)O Amb6249571 [2,0,0,0,0,0|2,0,0]=4 758 B9R0.2 CCCCNCCC(=O)O Amb7755713 [2,0,0,0,0,0|2,0,0]=4 759 B9R0.2 CCCCNCCC(C)=O Amb26381876 [2,0,0,0,0,0|1,0,0]=3 760 B9R0.2 CCCCNCCC(N)=O Amb8841106 [2,0,0,0,0,0|2,0,0]=4 761 B9R0.2 CCCCOCCC(N)=O Amb27480748 [2,0,0,0,0,0|2,0,0]=4 762 B9R0.2 CCCCSCCC(=O)O Amb1032992 [2,0,0,0,0,0|2,0,0]=4 763 B9R0.2 CCCC\C=C/CC(C)=O Amb26493143 [2,0,0,0,0,0|0,0,2]=4 764 B9R0.2 CCCC\C=C\OC(C)=O Amb25293926 [2,0,0,0,0,0|0,0,2]=4 765 B9R0.2 CCCNCCCC(=O)O Amb1109953 [2,0,0,0,0,0|2,0,0]=4 766 B9R0.2 CCCNCCOC(N)=O Amb27828395 [2,0,0,0,0,0|2,0,0]=4 767 B9R0.2 CCCOCCCC(=O)O Amb8874517 [2,0,0,0,0,0|2,0,0]=4 768 B9R0.2 CCCOCCOC(=O)Cl Amb26963668 [2,0,0,0,0,0|2,0,0]=4 769 B9R0.2 CCCOCCOC(C)=O Amb25354004 [2,0,0,0,0,0|1,0,0]=3 770 B9R0.2 CCCOCCOC(N)=O Amb27265626 [2,0,0,0,0,0|2,0,0]=4 771 B9R0.2 CCCSCCCC(=O)O Amb6680215 [2,0,0,0,0,0|2,0,0]=4 772 B9R0.2 CCCSCCCC(C)=O Amb9660304 [2,0,0,0,0,0|1,0,0]=3 773 B9R0.2 CCC\C=C\CCC(C)=O Amb33359154 [2,0,0,0,0,0|0,0,2]=4 774 B9R0.2 CCC\C=C\COC(C)=O Amb8515402 [2,0,0,0,0,0|0,0,2]=4 775 B9R0.2 CCNCCCCC(=O)O Amb24385094 [2,0,0,0,0,0|2,0,0]=4 776 B9R0.2 CCNCCCCC(=O)O Amb32686610 [2,0,0,0,0,0|2,0,0]=4 777 B9R0.2 CCNCCCCC(C)=O Amb27951143 [2,0,0,0,0,0|1,0,0]=3 778 B9R0.2 CCNCCCCC(N)=O Amb27964384 [2,0,0,0,0,0|2,0,0]=4 779 B9R0.2 CCOCCCCC(=O)O Amb9207786 [2,0,0,0,0,0|2,0,0]=4 780 B9R0.2 CCOCCCCC(C)=O Amb9659807 [2,0,0,0,0,0|1,0,0]=3 781 B9R0.2 CCOCCCNC(C)=O Amb3886591 [2,0,0,0,0,0|2,0,0]=4 782 B9R0.2 CCOCCCOC(C)=O Amb22733319 [2,0,0,0,0,0|1,0,0]=3 783 B9R0.2 CCSCCCCC(=O)O Amb7782874 [2,0,0,0,0,0|2,0,0]=4 784 B9R0.2 CCSCCCOC(C)=O Amb27605064 [2,0,0,0,0,0|1,0,0]=3 785 B9R0.2 CC\C=C\CCOC(C)=O Amb9134795 [2,0,0,0,0,0|0,0,2]=4 786 B9R0.2 CNCCCCCC(C)=O Amb25728176 [2,0,0,0,0,0|1,0,0]=3 787 B9R0.2 CNCCCCCC(N)=O Amb27625362 [2,0,0,0,0,0|2,0,0]=4 788 B9R0.2 CNCCOCCC(C)=O Amb18630756 [2,0,0,0,0,0|2,0,0]=4 789 B9R0.2 COCCCCCC(=O)O Amb10607872 [2,0,0,0,0,0|2,0,0]=4 790 B9R0.2 COCCCCCC(C)=O Amb27227265 [2,0,0,0,0,0|1,0,0]=3 791 B9R0.2 COCCCCNC(C)=O Amb27170819 [2,0,0,0,0,0|2,0,0]=4 792 B9R0.2 COCCCCOC(C)=O Amb24325176 [2,0,0,0,0,0|1,0,0]=3 793 B9R0.2 COCCNCCC(C)=O Amb24473587 [2,0,0,0,0,0|2,0,0]=4 794 B9R0.2 COCCOCOC(C)=O Amb28126918 [2,0,0,0,0,0|2,0,0]=4 795 B9R0.2 CS(=O)CCCCCCO Amb27771220 [2,0,0,0,0,0|2,0,0]=4 796 B9R0.2 CSCCCCCC(=O)O Amb27444761 [2,0,0,0,0,0|2,0,0]=4 797 B9R0.2 CSCCCCNC(C)=O Amb28325257 [2,0,0,0,0,0|2,0,0]=4 798 B9R0.2 CSCCCCOC(C)=O Amb28041805 [2,0,0,0,0,0|1,0,0]=3 799 B9R0.2 CSCCCSCC(C)=O Amb28059012 [2,0,0,0,0,0|2,0,0]=4 800 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [2,0,0,0,0,0|2,0,0]=4 801 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [2,0,0,0,0,0|0,0,2]=4 802 B9R0.2 NC(=O)CCCCCCBr Amb27654995 [2,0,0,0,0,0|2,0,0]=4 803 B9R0.2 NC(=O)CCCCCCCl Amb27254212 [2,0,0,0,0,0|2,0,0]=4 804 B9R0.2 NCCCCCCC(=O)O Amb1151254 [2,0,0,0,0,0|2,0,0]=4 805 B9R0.2 NCCCCCCC(=O)O Amb16232099 [2,0,0,0,0,0|2,0,0]=4 806 B9R0.2 NCCCCCCC(=O)[O-] Amb32663972 [2,0,0,0,0,0|2,0,0]=4 807 B9R0.2 O=C(F)OCCCCCCl Amb27391688 [2,0,0,0,0,0|2,0,0]=4 808 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [2,0,0,0,0,0|2,0,0]=4 809 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [2,0,0,0,0,0|2,0,0]=4 810 B9R0.2 O=C(O)CCCCCCF Amb25132501 [2,0,0,0,0,0|2,0,0]=4 811 B9R0.2 O=C(O)CCCCCCO Amb9787028 [2,0,0,0,0,0|2,0,0]=4 812 B9R0.2 O=C(O)CCCCCCS Amb24710334 [2,0,0,0,0,0|2,0,0]=4 813 B9R0.45 C#CCCCCCCCC Amb2721541 [2,0,0,0,0,0|0,0,2]=4 814 B9R0.45 C=CCCCCCCC=O Amb28193259 [2,0,0,0,0,0|0,0,2]=4 815 B9R0.45 C=CCCCCCCCBr Amb19895211 [2,0,0,0,0,0|1,0,1]=4 816 B9R0.45 C=CCCCCCCCC Amb3940503 [2,0,0,0,0,0|0,0,1]=3 817 B9R0.45 C=CCCCCCCCCl Amb6298880 [2,0,0,0,0,0|1,0,1]=4 818 B9R0.45 C=CCCCCCCCN Amb24763980 [2,0,0,0,0,0|1,0,1]=4 819 B9R0.45 C=CCCCCCCCN Amb32653343 [2,0,0,0,0,0|1,0,1]=4 820 B9R0.45 C=CCCCCCCCO Amb22733549 [2,0,0,0,0,0|1,0,1]=4 821 B9R0.45 C=CCCCCCCNC Amb28120535 [2,0,0,0,0,0|1,0,1]=4 822 B9R0.45 C=CCCCCCSCC Amb27396740 [2,0,0,0,0,0|1,0,1]=4 823 B9R0.45 C=CCCCCNCCC Amb26576689 [2,0,0,0,0,0|1,0,1]=4 824 B9R0.45 C=CCCCNCCCC Amb27799206 [2,0,0,0,0,0|1,0,1]=4 825 B9R0.45 C=CCCNCCCCC Amb27838999 [2,0,0,0,0,0|1,0,1]=4 826 B9R0.45 C=CCNCCCCCC Amb7756950 [2,0,0,0,0,0|1,0,1]=4 827 B9R0.45 C=CCOCCCCCC Amb17933923 [2,0,0,0,0,0|1,0,1]=4 828 B9R0.45 C=CCSCCCCCC Amb22733767 [2,0,0,0,0,0|1,0,1]=4 829 B9R0.45 C=COCCCCCCO Amb26931083 [2,0,0,0,0,0|1,0,1]=4 830 B9R0.45 C=COCCNCCCC Amb28364273 [2,0,0,0,0,0|1,0,1]=4 831 B9R0.45 CC#CCCCCCC=O Amb28198592 [2,0,0,0,0,0|0,0,2]=4 832 B9R0.45 CC#CCCCCCCC Amb2721539 [2,0,0,0,0,0|0,0,2]=4 833 B9R0.45 CCCCC#CCCC=O Amb27790685 [2,0,0,0,0,0|0,0,2]=4 834 B9R0.45 CCCCCCCCC#N Amb7764626 [2,0,0,0,0,0|1,0,1]=4 835 B9R0.45 CCCCCCCCCBr Amb3940224 [2,0,0,0,0,0|1,0,1]=4 836 B9R0.45 CCCCCCCCCC Amb7757835 [2,0,0,0,0,0|0,0,1]=3 837 B9R0.45 CCCCCCCCCCl Amb6652537 [2,0,0,0,0,0|1,0,1]=4 838 B9R0.45 CCCCCCCCCF Amb8515361 [2,0,0,0,0,0|1,0,1]=4 839 B9R0.45 CCCCCCCCCI Amb3940284 [2,0,0,0,0,0|1,0,1]=4 840 B9R0.45 CCCCCCCCCN Amb3987584 [2,0,0,0,0,0|1,0,1]=4 841 B9R0.45 CCCCCCCCCO Amb3940342 [2,0,0,0,0,0|0,0,2]=4 842 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [2,0,0,0,0,0|1,0,1]=4 843 B9R0.45 CCCCCCCCNC Amb7757640 [2,0,0,0,0,0|1,0,0]=3 844 B9R0.45 CCCCCCCCNN Amb7786451 [2,0,0,0,0,0|2,0,0]=4 845 B9R0.45 CCCCCCCCNO Amb28069968 [2,0,0,0,0,0|1,0,1]=4 846 B9R0.45 CCCCCCCCON Amb2818885 [2,0,0,0,0,0|1,0,0]=3 847 B9R0.45 CCCCCCCCSC Amb10553780 [2,0,0,0,0,0|0,1,0]=3 848 B9R0.45 CCCCCCCN=C=O Amb3940866 [2,0,0,0,0,0|1,0,1]=4 849 B9R0.45 CCCCCCCNC=O Amb27170738 [2,0,0,0,0,0|1,0,0]=3 850 B9R0.45 CCCCCCCOC=O Amb9787223 [2,0,0,0,0,0|0,0,0]=2 851 B9R0.45 CCCCCCCOCC Amb26332517 [2,0,0,0,0,0|0,0,1]=3 852 B9R0.45 CCCCCCNCCC Amb6730565 [2,0,0,0,0,0|1,0,1]=4 853 B9R0.45 CCCCCCOCC=O Amb26624223 [2,0,0,0,0,0|1,0,0]=3 854 B9R0.45 CCCCCCOCCC Amb27838831 [2,0,0,0,0,0|1,0,1]=4 855 B9R0.45 CCCCCC\C=C\C=O Amb24061310 [2,0,0,0,0,0|0,0,2]=4 856 B9R0.45 CCCCCC\C=C\OC Amb30621739 [2,0,0,0,0,0|0,0,2]=4 857 B9R0.45 CCCCCNCCCC Amb6688183 [2,0,0,0,0,0|1,0,1]=4 858 B9R0.45 CCCCCNCCNC Amb2691992 [2,0,0,0,0,0|2,0,0]=4 859 B9R0.45 CCCCCNCCOC Amb6708081 [2,0,0,0,0,0|1,0,0]=3 860 B9R0.45 CCCCCOCCC=O Amb27628424 [2,0,0,0,0,0|1,0,0]=3 861 B9R0.45 CCCCCSCCSC Amb28282346 [2,0,0,0,0,0|1,1,0]=4 862 B9R0.45 CCCCNCCCNC Amb24502382 [2,0,0,0,0,0|2,0,0]=4 863 B9R0.45 CCCCNCCCOC Amb6730310 [2,0,0,0,0,0|1,0,0]=3 864 B9R0.45 CCCCNCCOCC Amb9241010 [2,0,0,0,0,0|1,0,1]=4 865 B9R0.45 CCCCOCCCON Amb27212384 [2,0,0,0,0,0|2,0,0]=4 866 B9R0.45 CCCCOCCOCC Amb25248413 [2,0,0,0,0,0|1,0,1]=4 867 B9R0.45 CCCCSCCCOC Amb27651352 [2,0,0,0,0,0|1,0,0]=3 868 B9R0.45 CCCCSCCOCC Amb10669603 [2,0,0,0,0,0|1,0,1]=4 869 B9R0.45 CCCC\C=C\CCC=O Amb27966384 [2,0,0,0,0,0|0,0,2]=4 870 B9R0.45 CCCNCCCCSC Amb18798068 [2,0,0,0,0,0|1,1,0]=4 871 B9R0.45 CCCOCCCNC=O Amb27453700 [2,0,0,0,0,0|2,0,0]=4 872 B9R0.45 CCC\C=C\CCCC=O Amb33361614 [2,0,0,0,0,0|0,0,2]=4 873 B9R0.45 CCNCCCCCOC Amb28186272 [2,0,0,0,0,0|1,0,0]=3 874 B9R0.45 CCNCCCCCSC Amb27167121 [2,0,0,0,0,0|1,1,0]=4 875 B9R0.45 CCNCCOCCOC Amb24672932 [2,0,0,0,0,0|2,0,0]=4 876 B9R0.45 CCNCCSCCOC Amb18788239 [2,0,0,0,0,0|2,0,0]=4 877 B9R0.45 CCOCCCCCCS Amb27834959 [2,0,0,0,0,0|1,0,1]=4 878 B9R0.45 CCOCCCCNC=O Amb27634560 [2,0,0,0,0,0|2,0,0]=4 879 B9R0.45 CCOCCCCOCC Amb10807403 [2,0,0,0,0,0|1,0,1]=4 880 B9R0.45 CCOCCOCCC=O Amb27167183 [2,0,0,0,0,0|2,0,0]=4 881 B9R0.45 CCOCCOCCOC Amb8394637 [2,0,0,0,0,0|2,0,0]=4 882 B9R0.45 CNCCCCCCNC Amb9826092 [2,0,0,0,0,0|2,0,0]=4 883 B9R0.45 CNCCCNCCOC Amb20171974 [2,0,0,0,0,0|2,0,0]=4 884 B9R0.45 CNCCCOCCOC Amb27768848 [2,0,0,0,0,0|2,0,0]=4 885 B9R0.45 CNCCOCCCOC Amb21954035 [2,0,0,0,0,0|2,0,0]=4 886 B9R0.45 COCCCCCCCCl Amb28066514 [2,0,0,0,0,0|1,0,0]=3 887 B9R0.45 COCCCCCCOC Amb10807404 [2,0,0,0,0,0|1,0,0]=3 888 B9R0.45 COCCCCNCCBr Amb27847371 [2,0,0,0,0,0|2,0,0]=4 889 B9R0.45 COCCCCNCCO Amb28368980 [2,0,0,0,0,0|2,0,0]=4 890 B9R0.45 COCCCCOCCN Amb28047109 [2,0,0,0,0,0|2,0,0]=4 891 B9R0.45 COCCCCSCCN Amb27951686 [2,0,0,0,0,0|2,0,0]=4 892 B9R0.45 COCCCNCCCN Amb17315264 [2,0,0,0,0,0|2,0,0]=4 893 B9R0.45 COCCCNCCCO Amb17308606 [2,0,0,0,0,0|2,0,0]=4 894 B9R0.45 COCCCNCCOC Amb8841615 [2,0,0,0,0,0|2,0,0]=4 895 B9R0.45 COCCCNCCSC Amb18800727 [2,0,0,0,0,0|2,0,0]=4 896 B9R0.45 COCCCOCCCN Amb28196278 [2,0,0,0,0,0|2,0,0]=4 897 B9R0.45 COCCCOCCCO Amb20242414 [2,0,0,0,0,0|2,0,0]=4 898 B9R0.45 COCCCSCCCCl Amb27393495 [2,0,0,0,0,0|2,0,0]=4 899 B9R0.45 COCCCSCCCS Amb28058832 [2,0,0,0,0,0|2,0,0]=4 900 B9R0.45 COCCCSCCOC Amb28064860 [2,0,0,0,0,0|2,0,0]=4 901 B9R0.45 COCCNCCCSC Amb6719616 [2,0,0,0,0,0|2,0,0]=4 902 B9R0.45 COCCOCCCCBr Amb8855450 [2,0,0,0,0,0|2,0,0]=4 903 B9R0.45 COCCOCCCCCl Amb18798737 [2,0,0,0,0,0|2,0,0]=4 904 B9R0.45 COCCOCCCCN Amb6250163 [2,0,0,0,0,0|2,0,0]=4 905 B9R0.45 COCCSCCCCF Amb28064856 [2,0,0,0,0,0|2,0,0]=4 906 B9R0.45 COCOCCCCCBr Amb27408460 [2,0,0,0,0,0|2,0,0]=4 907 B9R0.45 COCOCCCCCN Amb28291853 [2,0,0,0,0,0|2,0,0]=4 908 B9R0.45 COCOCCCCCO Amb27839456 [2,0,0,0,0,0|2,0,0]=4 909 B9R0.45 CONCCCCCCO Amb27952629 [2,0,0,0,0,0|2,0,0]=4 910 B9R0.45 CSCCCCCCCN Amb27860341 [2,0,0,0,0,0|1,1,0]=4 911 B9R0.45 CSCCCCCCSC Amb6366244 [2,0,0,0,0,0|1,1,0]=4 912 B9R0.45 CSCCCCCNC=O Amb27165514 [2,0,0,0,0,0|2,0,0]=4 913 B9R0.45 C\C=C/CCCCCCC Amb26019969 [2,0,0,0,0,0|0,0,1]=3 914 B9R0.45 C\C=C\CCCCCCO Amb27980554 [2,0,0,0,0,0|1,0,1]=4 915 B9R0.45 C\C=C\CCCCCNC Amb26398871 [2,0,0,0,0,0|1,0,1]=4 916 B9R0.45 C\C=C\CCNCCCC Amb27789929 [2,0,0,0,0,0|1,0,1]=4 917 B9R0.45 N#CCCCCCCC=O Amb26516252 [2,0,0,0,0,0|1,0,1]=4 918 B9R0.45 NCCCCCCNC=O Amb28251393 [2,0,0,0,0,0|2,0,0]=4 919 B9R0.45 NCCCNCCCC=O Amb27489145 [2,0,0,0,0,0|2,0,0]=4 920 B9R0.45 O=CCCCCCCC=O Amb27836602 [2,0,0,0,0,0|1,0,1]=4 921 B9R0.45 O=CCCCCCCCF Amb25075653 [2,0,0,0,0,0|1,0,0]=3 922 B9R0.45 O=CCCCCCCCO Amb25765567 [2,0,0,0,0,0|1,0,0]=3 923 B11R0.2 CCCCCCC(C)CC(=O)O Amb4001745 [1,1,0,0,0,0|1,0,0]=3 924 B11R0.2 CCCCCCC(C)OC(=O)Cl Amb24061311 [1,1,0,0,0,0|1,0,0]=3 925 B11R0.2 CCCCCCC(N)CC(=O)O Amb2229636 [1,1,0,0,0,0|1,0,0]=3 926 B11R0.2 CCCCCCC(N)CC(=O)O Amb31307615 [1,1,0,0,0,0|1,0,0]=3 927 B11R0.2 CCCCCCC(N)CC(N)=O Amb32787662 [1,1,0,0,0,0|1,0,0]=3 928 B11R0.2 CCCCCCC(O)CC(=O)O Amb18803982 [1,1,0,0,0,0|1,0,0]=3 929 B11R0.2 CCCCCCN(C)CC(=O)O Amb33552686 [1,1,0,0,0,0|2,0,0]=4 930 B11R0.2 CCCCCOC(=O)CC(C)=O Amb22734938 [1,1,0,0,0,0|1,0,1]=4 931 B11R0.30 C=C(Br)CCCCCOC(C)=O Amb6299495 [1,1,0,0,0,0|0,0,2]=4 932 B11R0.30 C=C(C)CCCCCOC(C)=O Amb6299497 [1,1,0,0,0,0|0,0,1]=3 933 B11R0.30 C=C(Cl)CCCCCOC(C)=O Amb6299493 [1,1,0,0,0,0|0,0,2]=4 934 B11R0.30 CC(=O)CCCCCCC(=O)O Amb28653044 [1,1,0,0,0,0|1,0,1]=4 935 B11R0.30 CC(=O)CCCCCCC(C)=O Amb21962685 [1,1,0,0,0,0|0,0,1]=3 936 B11R0.30 CC(C)CCCCCCC(=O)[O-] Amb33513097 [1,1,0,0,0,0|1,0,0]=3 937 B11R0.30 CC(C)CCNCCCC(=O)O Amb24271192 [1,1,0,0,0,0|2,0,0]=4 938 B11R0.30 CC(C)CCNCCCC(=O)O Amb9208916 [1,1,0,0,0,0|2,0,0]=4 939 B11R0.30 CC(C)COCCCCC(=O)O Amb9207793 [1,1,0,0,0,0|2,0,0]=4 940 B11R0.40 C=CC(=O)OCCCCCCO Amb31188276 [1,1,0,0,0,0|1,0,1]=4 941 B11R0.40 C=CS(=O)CCCCCCCC Amb1032994 [1,1,0,0,0,0|1,0,1]=4 942 B11R0.40 CCCCCCC#CC(=O)OC Amb2725482 [1,1,0,0,0,0|0,0,2]=4 943 B11R0.40 CCCCCCCCC(=O)CC Amb9024774 [1,1,0,0,0,0|0,0,0]=2 944 B11R0.40 CCCCCCCCC(=O)NN Amb6544507 [1,1,0,0,0,0|1,0,0]=3 945 B11R0.40 CCCCCCCCC(=O)OC Amb8517582 [1,1,0,0,0,0|0,0,0]=2 946 B11R0.40 CCCCCCCCC(Br)CBr Amb9787331 [1,1,0,0,0,0|1,0,1]=4 947 B11R0.40 CCCCCCCCC(C)CBr Amb32688274 [1,1,0,0,0,0|1,0,1]=4 948 B11R0.40 CCCCCCCCC(C)CCl Amb32688273 [1,1,0,0,0,0|1,0,1]=4 949 B11R0.40 CCCCCCCCC(N)CO Amb22536244 [1,1,0,0,0,0|1,0,1]=4 950 B11R0.40 CCCCCCCCC(O)CO Amb8517521 [1,1,0,0,0,0|0,0,2]=4 951 B11R0.40 CCCCCCCNC(=O)CBr Amb17323631 [1,1,0,0,0,0|1,0,0]=3 952 B11R0.40 CCCCCCCNC(=O)CCl Amb17329833 [1,1,0,0,0,0|1,0,0]=3 953 B11R0.40 CCCCCCCNC(=O)CN Amb24115161 [1,1,0,0,0,0|1,0,0]=3 954 B11R0.40 CCCCCCCOC(=O)CC Amb9787227 [1,1,0,0,0,0|0,0,0]=2 955 B11R0.40 CCCCCCCOC(=O)CCl Amb9787570 [1,1,0,0,0,0|0,0,0]=2 956 B11R0.40 CCCCCCCOC(=O)CS Amb9786410 [1,1,0,0,0,0|0,0,0]=2 957 B11R0.40 CCCCCC\C=C\C(=O)OC Amb33513079 [1,1,0,0,0,0|0,0,2]=4 958 B11R0.40 CCCCOCCNC(=O)CCl Amb10609737 [1,1,0,0,0,0|2,0,0]=4 959 B11R0.40 CCCNCCCOC(=O)CC Amb18263176 [1,1,0,0,0,0|1,0,0]=3 960 B11R0.40 CCCSSCCCC(=O)OC Amb33040840 [1,1,0,0,0,0|2,0,0]=4 961 B11R0.40 CCOCCCCNC(=O)CCl Amb17330717 [1,1,0,0,0,0|2,0,0]=4 962 B11R0.40 CCOCCOCCC(=O)NC Amb32651489 [1,1,0,0,0,0|2,0,0]=4 963 B11R0.40 CNC(=O)CCNCCCOC Amb18808415 [1,1,0,0,0,0|2,0,0]=4 964 B11R0.40 CNCCOCCCC(=O)OC Amb18624289 [1,1,0,0,0,0|2,0,0]=4 965 B11R0.40 COC(=O)CCCCCCCBr Amb24063235 [1,1,0,0,0,0|1,0,0]=3 966 B11R0.40 COC(=O)CCCCCCCN Amb20669115 [1,1,0,0,0,0|1,0,0]=3 967 B11R0.40 COC(=O)CCCCCCCN Amb24331924 [1,1,0,0,0,0|1,0,0]=3 968 B11R0.40 COC(=O)CCCOCCCN Amb18111569 [1,1,0,0,0,0|2,0,0]=4 969 B11R0.40 COC(=O)CCCSCCCN Amb17500720 [1,1,0,0,0,0|2,0,0]=4 970 B11R0.40 COC(=O)CCCSCCCO Amb17502861 [1,1,0,0,0,0|2,0,0]=4 971 B11R0.40 COC(=O)NCCCCCCO Amb24095886 [1,1,0,0,0,0|2,0,0]=4 972 B11R0.40 COCCOCCOC(=O)CS Amb32666540 [1,1,0,0,0,0|2,0,0]=4 973 B11R0.42 CCCCCCCC(=O)C(=O)O Amb22904309 [1,1,0,0,0,0|1,0,1]=4 974 B11R0.42 CCCCCCCC(N)C(=O)O Amb2229635 [1,1,0,0,0,0|1,0,0]=3 975 B11R0.42 CCCCCCCC(N)C(N)=O Amb18794469 [1,1,0,0,0,0|1,0,0]=3 976 B11R0.42 CCCCCCC[C@@H](N)C(=O)O Amb22747720 [1,1,0,0,0,0|1,0,0]=3 977 B11R0.42 CCCCCCC[C@H](N)C(=O)O Amb33308889 [1,1,0,0,0,0|1,0,0]=3 978 B11R0.42 CCCCCCOC(C)C(=O)O Amb7790036 [1,1,0,0,0,0|2,0,0]=4 979 B11R0.42 CCCCOCCC(N)C(=O)O Amb18795636 [1,1,0,0,0,0|2,0,0]=4 980 B11R0.42 CCCCOCCC(N)C(N)=O Amb18178142 [1,1,0,0,0,0|2,0,0]=4 981 B11R0.42 CCCCOCC[C@@H](N)C(=O)O Amb33065700 [1,1,0,0,0,0|2,0,0]=4 982 B11R0.42 CCCCOCC[C@H](N)C(=O)O Amb32789517 [1,1,0,0,0,0|2,0,0]=4 983 B11R0.42 NC(=O)C(N)CCCCCCO Amb33036551 [1,1,0,0,0,0|2,0,0]=4 984 B11R0.42 NC(CCCCCCO)C(=O)O Amb32937041 [1,1,0,0,0,0|2,0,0]=4 985 B11R0.42 N[C@@H](CCCCCCO)C(=O)O Amb33033601 [1,1,0,0,0,0|2,0,0]=4 986 B11R0.42 N[C@H](CCCCCCO)C(=O)O Amb33069952 [1,1,0,0,0,0|2,0,0]=4 987 B11R0.46 CCCCCC(=O)CCC(=O)O Amb4330519 [1,1,0,0,0,0|1,0,1]=4 988 B11R0.46 CCCCCC(C)CCC(=O)O Amb10807482 [1,1,0,0,0,0|1,0,0]=3 989 B11R0.46 CCCCCC(C)CCC(=O)[O-] Amb33513096 [1,1,0,0,0,0|1,0,0]=3 990 B11R0.46 CCCCCN(C)CCC(=O)O Amb8392952 [1,1,0,0,0,0|2,0,0]=4 991 B11R0.46 CCCCCN(C)CCC(=O)O Amb8925855 [1,1,0,0,0,0|2,0,0]=4 992 B11R0.111 CC(=O)OCCCCC(F)CBr Amb22641499 [1,1,0,0,0,0|1,0,0]=3 993 B11R0.111 CCC(=O)CCCCCC(=O)O Amb6305228 [1,1,0,0,0,0|1,0,1]=4 994 B11R0.111 O=C(O)CCCCCC(F)CBr Amb22547633 [1,1,0,0,0,0|2,0,0]=4 995 B11R0.147 CCCCC(=O)CCCC(=O)O Amb6305231 [1,1,0,0,0,0|1,0,1]=4 996 B11R0.147 CCCCN(C)CCCC(=O)Cl Amb17143107 [1,1,0,0,0,0|2,0,0]=4 997 B11R0.159 CCCCCCCCC(C)(C)O Amb33330811 [1,1,0,0,0,0|0,0,2]=4 998 B11R0.159 CCCCCCCCP(=O)(O)O Amb19515959 [1,1,0,0,0,0|2,0,0]=4 999 B11R0.159 CCCCCCCCS(=O)(=O)Cl Amb8516201 [1,1,0,0,0,0|2,0,0]=4 1000 B11R0.159 CCCCCCCCS(=O)(=O)F Amb33352751 [1,1,0,0,0,0|2,0,0]=4 1001 B11R0.159 CCCCCCCCS(=O)(=O)O Amb22228001 [1,1,0,0,0,0|2,0,0]=4 1002 B11R0.159 CCCCCCCCS(=O)(=O)[O-] Amb2689968 [1,1,0,0,0,0|2,0,0]=4 1003 B11R0.159 CCCCCCCCS(=O)(=O)[O-] Amb6366784 [1,1,0,0,0,0|2,0,0]=4 1004 B11R0.159 CCCCCCCCS(=O)(=O)[O-] Amb9871421 [1,1,0,0,0,0|2,0,0]=4 1005 B11R0.159 CCCCCCCCS(N)(=O)=O Amb16191923 [1,1,0,0,0,0|2,0,0]=4 1006 B11R0.159 CCCCCCCC[N+](C)(C)C Amb22348496 [1,1,0,0,0,0|2,0,0]=4 1007 B11R0.159 CCCCCCCC[N+](C)(C)C Amb9787164 [1,1,0,0,0,0|2,0,0]=4 1008 B11R0.159 CCCCCCCC[Si](C)(C)Cl Amb8515435 [1,1,0,0,0,0|1,1,0]=4 1009 B11R0.159 CCCCCCCOS(C)(=O)=O Amb28286190 [1,1,0,0,0,0|1,0,0]=3 1010 B11R0.159 CS(=O)(=O)OCCCCCCF Amb27959751 [1,1,0,0,0,0|2,0,0]=4 1011 B11R0.176 CCCC(=O)CCCCC(=O)O Amb6305241 [1,1,0,0,0,0|1,0,1]=4 1012 B11R0.176 CCOC(=O)CCCOC(C)=O Amb17613918 [1,1,0,0,0,0|1,0,1]=4 1013 B11R0.176 O=C(O)CCCC[C@@H](S)CCS Amb24099064 [1,1,0,0,0,0|2,0,0]=4 1014 B11R0.3 C=CCCCCCCCCC=O Amb8513533 [1,1,0,0,0,0|1,0,1]=4 1015 B11R0.3 C=CCCCCCCCCCBr Amb2691196 [1,1,0,0,0,0|1,0,1]=4 1016 B11R0.3 C=CCCCCCCCCCC Amb3940486 [1,1,0,0,0,0|1,0,1]=4 1017 B11R0.3 C=CCCCCCCCCCCl Amb2721562 [1,1,0,0,0,0|1,0,1]=4 1018 B11R0.3 C=CCCCCCCCCCN Amb2721533 [1,1,0,0,0,0|1,0,1]=4 1019 B11R0.3 C=CCCCCCCCCCO Amb2721673 [1,1,0,0,0,0|1,0,1]=4 1020 B11R0.3 CCCCCCCCCCCBr Amb8514664 [1,1,0,0,0,0|1,0,1]=4 1021 B11R0.3 CCCCCCCCCCCC Amb8513157 [1,1,0,0,0,0|1,0,1]=4 1022 B11R0.3 CCCCCCCCCCCCl Amb9787117 [1,1,0,0,0,0|1,0,1]=4 1023 B11R0.3 CCCCCCCCCCCN Amb3941511 [1,1,0,0,0,0|1,0,1]=4 1024 B11R0.3 CCCCCCCCCCCO Amb6646062 [1,1,0,0,0,0|1,0,1]=4 1025 B11R0.3 CCCCCCCCCCNC Amb33934687 [1,1,0,0,0,0|1,0,1]=4 1026 B11R0.3 CCCCCCCCCCNC Amb9787067 [1,1,0,0,0,0|1,0,1]=4 1027 B11R0.3 CCCCCCCCCNCC Amb7761767 [1,1,0,0,0,0|1,0,1]=4 1028 B11R0.3 CCCCCCCCNCCN Amb18794624 [1,1,0,0,0,0|1,0,1]=4 1029 B11R0.3 CCCCCCCCNCCN Amb22358941 [1,1,0,0,0,0|1,0,1]=4 1030 B11R0.3 CCCCCCCCNCCO Amb7757629 [1,1,0,0,0,0|1,0,1]=4 1031 B11R0.3 CCCCCCCCOCCN Amb7790956 [1,1,0,0,0,0|0,0,1]=3 1032 B11R0.3 CCCCCCCCOCCO Amb9787110 [1,1,0,0,0,0|0,0,1]=3 1033 B11R0.3 CCCCCCCCSCCN Amb7794933 [1,1,0,0,0,0|0,1,1]=4 1034 B11R0.3 CCCCCCCCSCCO Amb33531593 [1,1,0,0,0,0|0,1,1]=4 1035 B11R0.3 CCCCCCCCSCCS Amb9787630 [1,1,0,0,0,0|0,1,1]=4 1036 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [1,1,0,0,0,0|1,0,0]=3 1037 B11R0.3 CCCCCCCC\C=C\CO Amb22052644 [1,1,0,0,0,0|1,0,0]=3 1038 B11R0.3 CCCCCCCNCCCC Amb4313708 [1,1,0,0,0,0|1,0,1]=4 1039 B11R0.3 CCCCCCNCCCCC Amb6656070 [1,1,0,0,0,0|1,0,1]=4 1040 B11R0.3 CCCCCCNCCCOC Amb7760836 [1,1,0,0,0,0|2,0,0]=4 1041 B11R0.3 CCCCCSCCOCCN Amb17501985 [1,1,0,0,0,0|1,0,1]=4 1042 B11R0.3 CCCCNCCCCCOC Amb33133268 [1,1,0,0,0,0|2,0,0]=4 1043 B11R0.3 CCNCCCCCCNCC Amb22733571 [1,1,0,0,0,0|1,0,1]=4 1044 B11R0.3 CCOCCOCCOCC=O Amb32669837 [1,1,0,0,0,0|2,0,0]=4 1045 B11R0.3 CCSCCCCCCSCC Amb9786285 [1,1,0,0,0,0|0,1,1]=4 1046 B11R0.3 C\C=C\CCCCCCCCO Amb22641580 [1,1,0,0,0,0|1,0,0]=3 1047 B11R0.3 O=CCCCCCCCCCBr Amb21963218 [1,1,0,0,0,0|1,0,0]=3 1048 B11R0.4 C=COC(=O)CCCCCCC Amb17672562 [1,1,0,0,0,0|0,0,2]=4 1049 B11R0.4 CCCCCCCC(=O)OCC Amb6608755 [1,1,0,0,0,0|0,0,2]=4 1050 B11R0.4 CCCCCCCC(O)CCC Amb18803156 [1,1,0,0,0,0|1,0,1]=4 1051 B11R0.140 CCCCCC(N)CCCCC Amb9620841 [1,1,0,0,0,0|1,0,1]=4 1052 B11R0.140 CCCCCC(S)CCCCC Amb32788302 [1,1,0,0,0,0|1,0,1]=4 1053 B13R0.62 CCCCCCCC(CC)CC(=O)O Amb32412880 [0,2,0,0,0,0|2,0,0]=4 1054 B13R0.274 CCCCCCCC(=O)CC(=O)OC Amb17617713 [0,2,0,0,0,0|1,0,1]=4 1055 B13R0.274 CCCCCCC[C@@H](O)CC(=O)OC Amb17615271 [0,2,0,0,0,0|1,0,0]=3 1056 B13R0.274 CCCCCCC\C(C)=C\C(=O)OC Amb33472149 [0,2,0,0,0,0|1,0,1]=4 1057 B13R0.274 CCCCCCNC(C)CC(=O)OC Amb20673380 [0,2,0,0,0,0|2,0,0]=4 1058 B13R0.335 CCCCCCCCC(C)CC(=O)O Amb28653289 [0,2,0,0,0,0|2,0,0]=4 1059 B13R0.335 CCCCCCCOC(=O)CC(C)=O Amb9787148 [0,2,0,0,0,0|1,0,1]=4 1060 B13R0.188 CCCCCC(=O)CCCCC(=O)O Amb6305236 [0,2,0,0,0,0|2,0,0]=4 1061 B13R0.280 CCCCCCCCCCP(C)(C)=O Amb1239581 [0,2,0,0,0,0|2,0,0]=4 1062 B13R0.1215 CCCCCCCCOC(C)(C)CBr Amb33348284 [0,2,0,0,0,0|1,0,1]=4 1063 B13R0.1215 CCCCCCCCOC(C)(C)CI Amb33348454 [0,2,0,0,0,0|1,0,1]=4 1064 B13R0.1215 CCCCCCCCOS(=O)(=O)O[Na] Amb22352581 [0,2,0,0,0,0|2,0,0]=4 1065 B13R0.1398 CC(=O)OCCC(C)CCC=C(C)C Amb4011988 [0,2,0,0,0,0|0,0,2]=4 1066 B13R0.54 C=CCCCCCCCCCC(=O)O Amb6296074 [0,2,0,0,0,0|2,0,0]=4 1067 B13R0.54 C=CCCCCCCCCOC(C)=O Amb10563791 [0,2,0,0,0,0|0,0,0]=2 1068 B13R0.54 CCCCCCCCCCCC(=O)Cl Amb3940238 [0,2,0,0,0,0|2,0,0]=4 1069 B13R0.54 CCCCCCCCCCCC(=O)O Amb2708779 [0,2,0,0,0,0|2,0,0]=4 1070 B13R0.54 CCCCCCCCCCCC(=O)[O-] Amb22729066 [0,2,0,0,0,0|2,0,0]=4 1071 B13R0.54 CCCCCCCCCCCC(=O)[O-] Amb8516675 [0,2,0,0,0,0|2,0,0]=4 1072 B13R0.54 CCCCCCCCCCCC(N)=O Amb4008368 [0,2,0,0,0,0|2,0,0]=4 1073 B13R0.54 CCCCCCCCCCOC(=O)Cl Amb22337976 [0,2,0,0,0,0|1,0,0]=3 1074 B13R0.54 CCCCCCCCC\C=C/C(=O)O Amb30666645 [0,2,0,0,0,0|2,0,0]=4 1075 B13R0.54 CCCCCCCCC\C=C\C(=O)O Amb13952752 [0,2,0,0,0,0|2,0,0]=4 1076 B13R0.54 CCCCCCCCSCCC(=O)O Amb1038994 [0,2,0,0,0,0|1,1,0]=4 1077 B13R0.54 CCCCCNCCCCCC(=O)O Amb32410634 [0,2,0,0,0,0|2,0,0]=4 1078 B13R0.54 CCCCOCCOCCCC(=O)O Amb9208474 [0,2,0,0,0,0|2,0,0]=4 1079 B13R0.54 CCCCOCCOCCOC(C)=O Amb8516522 [0,2,0,0,0,0|0,0,0]=2 1080 B13R0.54 CCCCSCCCCCCC(=O)O Amb1036584 [0,2,0,0,0,0|2,0,0]=4 1081 B13R0.54 CCCC\C=C/CCCCOC(C)=O Amb4025835 [0,2,0,0,0,0|0,0,0]=2 1082 B13R0.54 COCCOCCOCCOC(C)=O Amb9787467 [0,2,0,0,0,0|1,0,0]=3 1083 B13R0.54 N#CCCCCCCCCCC(=O)O Amb22547629 [0,2,0,0,0,0|2,0,0]=4 1084 B13R0.54 NCCCCCCCCCCC(=O)Cl Amb17143769 [0,2,0,0,0,0|2,0,0]=4 1085 B13R0.54 NCCCCCCCCCCC(=O)O Amb3940461 [0,2,0,0,0,0|2,0,0]=4 1086 B13R0.54 O=C(O)CCCCCCCCCCBr Amb639361 [0,2,0,0,0,0|2,0,0]=4 1087 B13R0.54 O=C(O)CCCCCCCCCCCl Amb534918 [0,2,0,0,0,0|2,0,0]=4 1088 B13R0.54 O=C(O)CCCCCCCCCCO Amb1814707 [0,2,0,0,0,0|2,0,0]=4 1089 B13R0.54 O=C(O)CCCCCCCCCCS Amb584507 [0,2,0,0,0,0|2,0,0]=4 1090 B13R0.119 CCCCC(=O)CCCCCC(=O)O Amb6305233 [0,2,0,0,0,0|2,0,0]=4 1091 B13R0.147 C=CC(=O)OCCCCCCCCC Amb20670989 [0,2,0,0,0,0|0,0,1]=3 1092 B13R0.147 C=CCCCCCCCCC(=O)OC Amb612439 [0,2,0,0,0,0|1,0,1]=4 1093 B13R0.147 CC#CCCCCCCCC(=O)OC Amb22641576 [0,2,0,0,0,0|1,0,1]=4 1094 B13R0.147 CCCCCCCCCCC(=O)NN Amb534278 [0,2,0,0,0,0|2,0,0]=4 1095 B13R0.147 CCCCCCCCCCC(=O)OC Amb9787313 [0,2,0,0,0,0|1,0,0]=3 1096 B13R0.147 CCCCCCCCCCC(C)C=O Amb32671323 [0,2,0,0,0,0|1,0,1]=4 1097 B13R0.147 CCCCCCCCCNC(=O)CCl Amb17797886 [0,2,0,0,0,0|1,0,0]=3 1098 B13R0.147 CCCCCCCCOCC(O)CO Amb4458899 [0,2,0,0,0,0|0,0,2]=4 1099 B13R0.147 CCCCCCCNCCC(=O)NC Amb18333360 [0,2,0,0,0,0|1,0,0]=3 1100 B13R0.147 CCCCCCCNCCC(=O)NN Amb20171959 [0,2,0,0,0,0|2,0,0]=4 1101 B13R0.147 COC(=O)CCCCCCCCC=O Amb9787740 [0,2,0,0,0,0|1,0,1]=4 1102 B13R0.147 COC(=O)CCCCCCCCCBr Amb3941556 [0,2,0,0,0,0|1,0,0]=3 1103 B13R0.147 COC(=O)CCCCCCCCCN Amb32680801 [0,2,0,0,0,0|1,0,0]=3 1104 B13R0.147 COC(=O)CCCCCCCCCN Amb33330795 [0,2,0,0,0,0|1,0,0]=3 1105 B13R0.147 C\C=C\CCCCCCCC(=O)OC Amb22641574 [0,2,0,0,0,0|1,0,1]=4 1106 B13R0.147 NCCCCCCCCNC(=O)CBr Amb19981082 [0,2,0,0,0,0|1,0,0]=3 1107 B13R0.150 CCCCCCCCCC(=O)C(F)F Amb35744328 [0,2,0,0,0,0|1,0,0]=3 1108 B13R0.150 CCCCCCCCCC(=O)N(C)C Amb2720945 [0,2,0,0,0,0|1,0,0]=3 1109 B13R0.150 CCCCCCCCCC(C)C(=O)O Amb18320092 [0,2,0,0,0,0|1,0,1]=4 1110 B13R0.150 CCCCCCCCC[C@@H](N)C(=O)O Amb34139108 [0,2,0,0,0,0|2,0,0]=4 1111 B13R0.150 CCCCCCCCC[C@H](N)C(=O)O Amb34152043 [0,2,0,0,0,0|2,0,0]=4 1112 B13R0.150 CCCCCCCCNC(=O)C(=O)O Amb28653366 [0,2,0,0,0,0|1,0,1]=4 1113 B13R0.150 CCCCCCCCNC(=O)C(C)Br Amb17327670 [0,2,0,0,0,0|1,0,0]=3 1114 B13R0.150 CCCCCCCCNC(=O)C(C)Cl Amb17329451 [0,2,0,0,0,0|1,0,0]=3 1115 B13R0.150 CCCCOCCCNC(=O)C(C)Cl Amb17331233 [0,2,0,0,0,0|2,0,0]=4 1116 B13R0.154 CCCCCCCC(O)CCC(=O)[O-] Amb19148937 [0,2,0,0,0,0|2,0,0]=4 1117 B13R0.179 CC(=O)OCCCCCCOC(C)=O Amb9787141 [0,2,0,0,0,0|0,0,1]=3 1118 B13R0.179 CC(Br)CCCCCCCCC(=O)O Amb8487858 [0,2,0,0,0,0|2,0,0]=4 1119 B13R0.202 O=C(O)CCCCCCCC(F)CBr Amb22547613 [0,2,0,0,0,0|2,0,0]=4 1120 B13R0.2 C=COC(=O)CCCCCCCCC Amb17672564 [0,2,0,0,0,0|1,0,1]=4 1121 B13R0.2 CCCCCCCCCC(=O)CCC Amb9031610 [0,2,0,0,0,0|1,0,0]=3 1122 B13R0.2 CCCCCCCCCC(=O)OCCl Amb31282507 [0,2,0,0,0,0|1,0,0]=3 1123 B13R0.2 CCCCCCCCCC(=O)OCI Amb32410583 [0,2,0,0,0,0|1,0,0]=3 1124 B13R0.2 CCCCCCCCCC(C)CC=O Amb33421993 [0,2,0,0,0,0|1,0,1]=4 1125 B13R0.2 CCCCCCCCNC(=O)CC#N Amb1103425 [0,2,0,0,0,0|1,0,0]=3 1126 B13R0.2 CCCCCCCCNC(=O)CCCl Amb17327381 [0,2,0,0,0,0|1,0,0]=3 1127 B13R0.2 CCCCCCCCNC(=O)CNC Amb24115165 [0,2,0,0,0,0|1,0,0]=3 1128 B13R0.2 CCCCCCCCOC(=O)CC#N Amb16232993 [0,2,0,0,0,0|0,0,0]=2 1129 B13R0.2 CCCCCCNCCC(=O)OCC Amb18334458 [0,2,0,0,0,0|2,0,0]=4 1130 B13R0.2 CCCCOCCCNC(=O)CCBr Amb17326501 [0,2,0,0,0,0|2,0,0]=4 1131 B13R0.2 CCCCOCCCNC(=O)CCCl Amb17329188 [0,2,0,0,0,0|2,0,0]=4 1132 B13R0.2 CCCCOCCCNC(=O)CNC Amb24115104 [0,2,0,0,0,0|2,0,0]=4 1133 B13R0.2 CCOC(=O)CCCCCCCCBr Amb21520303 [0,2,0,0,0,0|2,0,0]=4 1134 B13R0.2 CCOCCOCCOC(=O)CC#N Amb17210533 [0,2,0,0,0,0|2,0,0]=4 1135 B13R0.340 CCCCCCNCC(C)C(=O)OC Amb20673379 [0,2,0,0,0,0|2,0,0]=4 1136 B13R0.412 CCCCCCCCOC(CN)CO Amb32721465 [0,2,0,0,0,0|0,0,2]=4 1137 B13R0.1167 CCCCCCC(C)(O)CCC(=O)O Amb30987997 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.24 C=C1CCCN(CCCC)C1 Amb27176811 [1,0,0,1,0,0|2,0,0]=4 1139 B11R1.24 C=CCC[C@H]1CCCC(=O)C1 Amb27802471 [1,0,0,1,0,0|0,0,2]=4 1140 B11R1.24 CC#CCC1CCCC(=O)C1 Amb27222722 [1,0,0,1,0,0|0,0,2]=4 1141 B11R1.24 CCCCC1=CC(=O)CCC1 Amb17593800 [1,0,0,1,0,0|0,0,2]=4 1142 B11R1.24 CCCCC1CCCC(Br)C1 Amb27979044 [1,0,0,1,0,0|1,0,1]=4 1143 B11R1.24 CCCCC1CCCC(C)N1 Amb27194619 [1,0,0,1,0,0|1,0,1]=4 1144 B11R1.24 CCCCN1CCCC(=O)C1 Amb28322509 [1,0,0,1,0,0|1,0,0]=3 1145 B11R1.24 CCCC[C@@H]1CCC[C@@H](O)C1 Amb27251503 [1,0,0,1,0,0|0,0,2]=4 1146 B11R1.24 CCCC[C@@H]1CCC[C@H](C)N1 Amb27200235 [1,0,0,1,0,0|1,0,1]=4 1147 B11R1.24 CCCC[C@@H]1CCC[C@H](O)C1 Amb27970937 [1,0,0,1,0,0|0,0,2]=4 1148 B11R1.24 CCCC[C@H]1CCC[C@H](O)C1 Amb27652900 [1,0,0,1,0,0|0,0,2]=4 1149 B11R1.24 CCNCC1CCCC(=O)N1 Amb32721818 [1,0,0,1,0,0|2,0,0]=4 1150 B11R1.24 CCOCC1CCCC(=O)C1 Amb28073558 [1,0,0,1,0,0|1,0,0]=3 1151 B11R1.24 CCOCC1CCNC(=O)C1 Amb32654952 [1,0,0,1,0,0|2,0,0]=4 1152 B11R1.24 CCSCC1CCCC(=O)C1 Amb35699380 [1,0,0,1,0,0|1,0,0]=3 1153 B11R1.24 CNCCC1CCCC(=O)N1 Amb27466194 [1,0,0,1,0,0|2,0,0]=4 1154 B11R1.24 N#CCCC1CCCC(=O)C1 Amb18125303 [1,0,0,1,0,0|1,0,1]=4 1155 B11R1.24 NCCCC1CCCC(=O)C1 Amb27272657 [1,0,0,1,0,0|1,0,0]=3 1156 B11R1.24 NCCCC1CCCC(=O)N1 Amb18200144 [1,0,0,1,0,0|2,0,0]=4 1157 B11R1.24 NCCCC1CCNC(=O)C1 Amb25697471 [1,0,0,1,0,0|2,0,0]=4 1158 B11R1.24 NCCCC1CCNC(=O)C1 Amb33734215 [1,0,0,1,0,0|2,0,0]=4 1159 B11R1.24 O=C1CCCC(CCCO)N1 Amb18199970 [1,0,0,1,0,0|2,0,0]=4 1160 B11R1.24 O=C1CCCC(NCCO)C1 Amb27206993 [1,0,0,1,0,0|2,0,0]=4 1161 B11R1.24 O=C1CCCC(SCCO)C1 Amb27238717 [1,0,0,1,0,0|2,0,0]=4 1162 B11R1.24 O=C1CCCN(CCCO)C1 Amb28324812 [1,0,0,1,0,0|2,0,0]=4 1163 B11R1.27 CCCC#CC1CCC(=O)C1 Amb27261961 [1,0,0,1,0,0|0,0,2]=4 1164 B11R1.27 CCCCCC1=CC(=O)CC1 Amb27987060 [1,0,0,1,0,0|0,0,2]=4 1165 B11R1.27 CCCCCC1CCC(=O)O1 Amb569744 [1,0,0,1,0,0|1,0,0]=3 1166 B11R1.27 CCCCCC1CCC(Cl)C1 Amb27987841 [1,0,0,1,0,0|1,0,1]=4 1167 B11R1.27 CCCCCC1CCC(O)C1 Amb27272444 [1,0,0,1,0,0|0,0,2]=4 1168 B11R1.27 CCCCCC1CNC(=O)O1 Amb27987874 [1,0,0,1,0,0|2,0,0]=4 1169 B11R1.27 CCCCC[C@@H]1CCC(=O)C1 Amb27673726 [1,0,0,1,0,0|0,0,0]=2 1170 B11R1.27 CCCCC[C@H]1CCC(=O)C1 Amb28080151 [1,0,0,1,0,0|0,0,0]=2 1171 B11R1.27 CCCCC[C@H]1CCC(=O)N1 Amb28080184 [1,0,0,1,0,0|1,0,0]=3 1172 B11R1.27 CCCCC[C@H]1CCC(=O)O1 Amb22348365 [1,0,0,1,0,0|1,0,0]=3 1173 B11R1.27 CCCNCC1CCC(=O)N1 Amb25382477 [1,0,0,1,0,0|2,0,0]=4 1174 B11R1.27 CCCNCC1CNC(=O)C1 Amb28079895 [1,0,0,1,0,0|2,0,0]=4 1175 B11R1.27 CCCNCC1COC(=O)N1 Amb28352095 [1,0,0,1,0,0|2,0,0]=4 1176 B11R1.27 CCCOCC1CCC(=O)C1 Amb27987809 [1,0,0,1,0,0|1,0,0]=3 1177 B11R1.27 CCCSC[C@@H]1CCC(=O)N1 Amb27673440 [1,0,0,1,0,0|2,0,0]=4 1178 B11R1.27 CCSCCC1COC(=O)N1 Amb27266840 [1,0,0,1,0,0|2,0,0]=4 1179 B11R1.27 CCSCCN1CCC(=O)C1 Amb27267017 [1,0,0,1,0,0|2,0,0]=4 1180 B11R1.27 CSCCCC1COC(=O)N1 Amb27818857 [1,0,0,1,0,0|2,0,0]=4 1181 B11R1.27 CSCCSC1CCC(=O)C1 Amb28079898 [1,0,0,1,0,0|2,0,0]=4 1182 B11R1.27 NCCCCC1CCC(=O)O1 Amb27671667 [1,0,0,1,0,0|2,0,0]=4 1183 B11R1.27 O=C1CCC(CCCCBr)C1 Amb27673519 [1,0,0,1,0,0|1,0,0]=3 1184 B11R1.27 O=C1CCC(CCCCCl)C1 Amb27990027 [1,0,0,1,0,0|1,0,0]=3 1185 B11R1.27 O=C1CCC(CCCCO)C1 Amb28080310 [1,0,0,1,0,0|1,0,0]=3 1186 B11R1.27 O=C1CCC(SCCCO)C1 Amb27271112 [1,0,0,1,0,0|2,0,0]=4 1187 B11R1.27 O=C1CCN(CCCCF)C1 Amb27987922 [1,0,0,1,0,0|2,0,0]=4 1188 B11R1.53 C#CC1CCCCC1C(C)=O Amb25677027 [1,0,0,1,0,0|0,0,2]=4 1189 B11R1.53 C=CC1CCCCC1C(C)=O Amb26627090 [1,0,0,1,0,0|0,0,2]=4 1190 B11R1.53 C=C[C@@H]1CCCC[C@H]1C(C)=O Amb27861488 [1,0,0,1,0,0|0,0,2]=4 1191 B11R1.53 C=C[C@H]1CCCC[C@@H]1C(C)=O Amb27252281 [1,0,0,1,0,0|0,0,2]=4 1192 B11R1.53 C=C[C@H]1CCCC[C@H]1C(C)=O Amb28054461 [1,0,0,1,0,0|0,0,2]=4 1193 B11R1.53 CC(=O)C1CCCCC1C#N Amb25864043 [1,0,0,1,0,0|1,0,1]=4 1194 B11R1.53 CC(=O)C1CCCCC1CN Amb24488210 [1,0,0,1,0,0|1,0,0]=3 1195 B11R1.53 CC(=O)C1CCCCC1CO Amb28144180 [1,0,0,1,0,0|1,0,0]=3 1196 B11R1.53 CC(=O)N1CCCCC1CO Amb9277476 [1,0,0,1,0,0|2,0,0]=4 1197 B11R1.53 CC(=O)N1CCCC[C@@H]1CO Amb25829477 [1,0,0,1,0,0|2,0,0]=4 1198 B11R1.53 CC(=O)N1CCCC[C@H]1CO Amb25268937 [1,0,0,1,0,0|2,0,0]=4 1199 B11R1.53 CC(=O)[C@@H]1CCCC[C@@H]1CN Amb33132917 [1,0,0,1,0,0|1,0,0]=3 1200 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1C#N Amb28324352 [1,0,0,1,0,0|1,0,1]=4 1201 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1C=O Amb27789881 [1,0,0,1,0,0|1,0,1]=4 1202 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CBr Amb27252188 [1,0,0,1,0,0|1,0,0]=3 1203 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CCl Amb27634843 [1,0,0,1,0,0|1,0,0]=3 1204 B11R1.53 CC(=O)[C@H]1CCCC[C@H]1C#N Amb27471969 [1,0,0,1,0,0|1,0,1]=4 1205 B11R1.53 CCC1CC=CCC1C(C)=O Amb25699945 [1,0,0,1,0,0|0,0,2]=4 1206 B11R1.53 CCC1CCCCC1C(=O)O Amb27606678 [1,0,0,1,0,0|1,0,0]=3 1207 B11R1.53 CCC1CCCCC1C(C)N Amb28387851 [1,0,0,1,0,0|1,0,1]=4 1208 B11R1.53 CCC1CCCCC1C(N)=O Amb27989232 [1,0,0,1,0,0|1,0,0]=3 1209 B11R1.53 CCC1CCCCC1[N+](=O)[O-] Amb33299040 [1,0,0,1,0,0|2,0,0]=4 1210 B11R1.53 CCC1CCCCN1C(N)=O Amb8873523 [1,0,0,1,0,0|2,0,0]=4 1211 B11R1.53 CCC1CCCNC1C(=O)O Amb26014486 [1,0,0,1,0,0|2,0,0]=4 1212 B11R1.53 CCC1CCNCC1C(=O)O Amb18199964 [1,0,0,1,0,0|2,0,0]=4 1213 B11R1.53 CCC1CCNCC1C(N)=O Amb28286755 [1,0,0,1,0,0|2,0,0]=4 1214 B11R1.53 CCC1CNCCC1C(=O)O Amb33275584 [1,0,0,1,0,0|2,0,0]=4 1215 B11R1.53 CCC1CNCCC1C(C)=O Amb32676965 [1,0,0,1,0,0|1,0,0]=3 1216 B11R1.53 CCC1CNCCC1C(N)=O Amb27186164 [1,0,0,1,0,0|2,0,0]=4 1217 B11R1.53 CCC1COCCC1C(=O)O Amb27791043 [1,0,0,1,0,0|2,0,0]=4 1218 B11R1.53 CCC1NCCCC1C(=O)O Amb27858957 [1,0,0,1,0,0|2,0,0]=4 1219 B11R1.53 CCC1OCCCC1C(=O)O Amb26441727 [1,0,0,1,0,0|2,0,0]=4 1220 B11R1.53 CCC1OCCCC1C(N)=O Amb27752806 [1,0,0,1,0,0|2,0,0]=4 1221 B11R1.53 CCN1CCCCC1C(=O)O Amb10603421 [1,0,0,1,0,0|2,0,0]=4 1222 B11R1.53 CCN1CCCCC1C(=O)O Amb9299667 [1,0,0,1,0,0|2,0,0]=4 1223 B11R1.53 CCN1CCCC[C@@H]1C(=O)O Amb27400269 [1,0,0,1,0,0|2,0,0]=4 1224 B11R1.53 CCN1CCCC[C@H]1C(=O)O Amb28244690 [1,0,0,1,0,0|2,0,0]=4 1225 B11R1.53 CC[C@@H]1CCCC[C@H]1C(C)=O Amb25232533 [1,0,0,1,0,0|0,0,0]=2 1226 B11R1.53 CC[C@@H]1CCCN[C@@H]1C(=O)O Amb28200831 [1,0,0,1,0,0|2,0,0]=4 1227 B11R1.53 CC[C@@H]1NCCC[C@H]1C(=O)O Amb18199984 [1,0,0,1,0,0|2,0,0]=4 1228 B11R1.53 CC[C@@H]1OCCC[C@@H]1C(=O)O Amb27858544 [1,0,0,1,0,0|2,0,0]=4 1229 B11R1.53 CC[C@H]1CCCN[C@@H]1C(=O)O Amb27620290 [1,0,0,1,0,0|2,0,0]=4 1230 B11R1.53 CNC1CCCCC1C(=O)O Amb26595951 [1,0,0,1,0,0|2,0,0]=4 1231 B11R1.53 CNC1CCCCC1C(N)=O Amb25255322 [1,0,0,1,0,0|2,0,0]=4 1232 B11R1.53 CN[C@@H]1CCCC[C@@H]1C(N)=O Amb27631439 [1,0,0,1,0,0|2,0,0]=4 1233 B11R1.53 COC1CCCCC1C(=O)Cl Amb25124892 [1,0,0,1,0,0|2,0,0]=4 1234 B11R1.53 COC1CCCCC1C(=O)O Amb18967398 [1,0,0,1,0,0|2,0,0]=4 1235 B11R1.53 COC1CCCCC1C(C)=O Amb27762537 [1,0,0,1,0,0|1,0,0]=3 1236 B11R1.53 COC1CCCCC1C(N)=O Amb27152949 [1,0,0,1,0,0|2,0,0]=4 1237 B11R1.53 COC1CCCCN1C(C)=O Amb25793837 [1,0,0,1,0,0|2,0,0]=4 1238 B11R1.53 CO[C@H]1CCCC[C@@H]1C(=O)O Amb27845470 [1,0,0,1,0,0|2,0,0]=4 1239 B11R1.53 NC(=O)C1CCCCC1CO Amb28365379 [1,0,0,1,0,0|2,0,0]=4 1240 B11R1.53 NC(=O)[C@@H]1CCCC[C@@H]1CO Amb26884904 [1,0,0,1,0,0|2,0,0]=4 1241 B11R1.53 NC(=O)[C@@H]1CCCC[C@H]1CO Amb16233807 [1,0,0,1,0,0|2,0,0]=4 1242 B11R1.53 NC(=O)[C@H]1CCCC[C@H]1CO Amb25362020 [1,0,0,1,0,0|2,0,0]=4 1243 B11R1.53 NCC1CCCCC1C(=O)O Amb18126060 [1,0,0,1,0,0|2,0,0]=4 1244 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb22901093 [1,0,0,1,0,0|2,0,0]=4 1245 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb24602383 [1,0,0,1,0,0|2,0,0]=4 1246 B11R1.53 O=C(O)C1CCCCC1CCl Amb28121870 [1,0,0,1,0,0|2,0,0]=4 1247 B11R1.53 O=C(O)C1CCCCC1CF Amb20668097 [1,0,0,1,0,0|2,0,0]=4 1248 B11R1.53 O=C(O)C1CCCCC1CO Amb24484407 [1,0,0,1,0,0|2,0,0]=4 1249 B11R1.53 O=C(O)[C@H]1CCCC[C@H]1CO Amb24615220 [1,0,0,1,0,0|2,0,0]=4 1250 B11R1.57 CC(=O)CN1CCC[C@@H]1CO Amb29855226 [1,0,0,1,0,0|2,0,0]=4 1251 B11R1.57 CC(=O)CN1CCC[C@H]1CO Amb35687993 [1,0,0,1,0,0|2,0,0]=4 1252 B11R1.57 CC(=O)C[C@@H]1CCC[C@H]1C=O Amb24561068 [1,0,0,1,0,0|1,0,1]=4 1253 B11R1.57 CC(=O)C[C@@H]1CCC[C@H]1CCl Amb27660210 [1,0,0,1,0,0|1,0,0]=3 1254 B11R1.57 CC(=O)NC1CCCC1CCl Amb27235337 [1,0,0,1,0,0|2,0,0]=4 1255 B11R1.57 CC(=O)NC1CCCC1CO Amb28044186 [1,0,0,1,0,0|2,0,0]=4 1256 B11R1.57 CC(=O)OC1CCCC1C#N Amb27873344 [1,0,0,1,0,0|1,0,1]=4 1257 B11R1.57 CC(=O)OC1CCOC1CO Amb28065104 [1,0,0,1,0,0|2,0,0]=4 1258 B11R1.57 CC(=O)O[C@@H]1CCC[C@@H]1C#N Amb25919293 [1,0,0,1,0,0|1,0,1]=4 1259 B11R1.57 CC(=O)O[C@@H]1CCC[C@H]1C#N Amb27421937 [1,0,0,1,0,0|1,0,1]=4 1260 B11R1.57 CC(=O)O[C@H]1CCC[C@H]1C#N Amb27449499 [1,0,0,1,0,0|1,0,1]=4 1261 B11R1.57 CC(=O)O[C@H]1CCO[C@@H]1CO Amb27420410 [1,0,0,1,0,0|2,0,0]=4 1262 B11R1.57 CCC1CCCC1NC(=O)Cl Amb35633526 [1,0,0,1,0,0|2,0,0]=4 1263 B11R1.57 CCC1CNCC1CC(=O)O Amb28198977 [1,0,0,1,0,0|2,0,0]=4 1264 B11R1.57 CCC1COCC1CC(=O)O Amb35631919 [1,0,0,1,0,0|2,0,0]=4 1265 B11R1.57 CCC1COCC1NC(C)=O Amb35617073 [1,0,0,1,0,0|2,0,0]=4 1266 B11R1.57 CCN1CCCC1CC(=O)O Amb17504530 [1,0,0,1,0,0|2,0,0]=4 1267 B11R1.57 CCN1CCCC1CC(=O)O Amb33550833 [1,0,0,1,0,0|2,0,0]=4 1268 B11R1.57 CC[C@@H]1NCC[C@H]1CC(=O)O Amb18199980 [1,0,0,1,0,0|2,0,0]=4 1269 B11R1.57 CC[C@H]1NCC[C@@H]1CC(=O)O Amb28429151 [1,0,0,1,0,0|2,0,0]=4 1270 B11R1.57 CN[C@@H]1CCC[C@H]1NC(C)=O Amb28052128 [1,0,0,1,0,0|2,0,0]=4 1271 B11R1.57 COC1CCCC1CC(=O)O Amb18199909 [1,0,0,1,0,0|2,0,0]=4 1272 B11R1.57 CO[C@@H]1CCC[C@H]1NC(C)=O Amb27598363 [1,0,0,1,0,0|2,0,0]=4 1273 B11R1.57 CO[C@@H]1CCC[C@H]1OC(=O)Cl Amb33297184 [1,0,0,1,0,0|2,0,0]=4 1274 B11R1.57 CSC1CCCC1NC(C)=O Amb27469729 [1,0,0,1,0,0|2,0,0]=4 1275 B11R1.57 CS[C@@H]1CCC[C@H]1NC(C)=O Amb27783376 [1,0,0,1,0,0|2,0,0]=4 1276 B11R1.57 NC[C@@H]1CCC[C@H]1CC(=O)O Amb27967366 [1,0,0,1,0,0|2,0,0]=4 1277 B11R1.86 C=C(C)CC1CCCCC1N Amb28240598 [1,0,0,1,0,0|2,0,0]=4 1278 B11R1.86 C=C(C)CC1CCCCC1O Amb18799539 [1,0,0,1,0,0|2,0,0]=4 1279 B11R1.86 C=C(C)C[C@@H]1CCCC[C@H]1O Amb28053661 [1,0,0,1,0,0|2,0,0]=4 1280 B11R1.86 CC(=O)CC1=C(C)CCCC1 Amb17593809 [1,0,0,1,0,0|0,0,2]=4 1281 B11R1.86 CC(=O)CC1CCCCC1=O Amb17593853 [1,0,0,1,0,0|1,0,1]=4 1282 B11R1.86 CC(=O)CC1CCCCC1Cl Amb28137935 [1,0,0,1,0,0|1,0,0]=3 1283 B11R1.86 CC(=O)CC1CCCCC1F Amb27791180 [1,0,0,1,0,0|1,0,0]=3 1284 B11R1.86 CC(=O)CC1CCCCC1N Amb24582661 [1,0,0,1,0,0|1,0,0]=3 1285 B11R1.86 CC(=O)CC1CCCCN1C Amb5718445 [1,0,0,1,0,0|1,0,0]=3 1286 B11R1.86 CC(=O)CC1CCCOC1O Amb28253856 [1,0,0,1,0,0|2,0,0]=4 1287 B11R1.86 CC(=O)CN1CCCCC1C Amb8427993 [1,0,0,1,0,0|1,0,0]=3 1288 B11R1.86 CC(=O)C[C@@H]1CCCCN1C Amb26450192 [1,0,0,1,0,0|1,0,0]=3 1289 B11R1.86 CC(=O)C[C@@H]1CCCC[C@@H]1N Amb33307982 [1,0,0,1,0,0|1,0,0]=3 1290 B11R1.86 CC(=O)C[C@@H]1CCCC[C@H]1O Amb27212016 [1,0,0,1,0,0|1,0,0]=3 1291 B11R1.86 CC(=O)NC1CCCCC1Cl Amb27875116 [1,0,0,1,0,0|2,0,0]=4 1292 B11R1.86 CC(=O)NC1CCCCC1O Amb18797124 [1,0,0,1,0,0|2,0,0]=4 1293 B11R1.86 CC(=O)NC1CCCCC1S Amb28292774 [1,0,0,1,0,0|2,0,0]=4 1294 B11R1.86 CC(=O)NC1CCCC[C@@H]1Cl Amb24571625 [1,0,0,1,0,0|2,0,0]=4 1295 B11R1.86 CC(=O)NC1CCNCC1C Amb25866016 [1,0,0,1,0,0|2,0,0]=4 1296 B11R1.86 CC(=O)NC1CCNCC1C Amb33328616 [1,0,0,1,0,0|2,0,0]=4 1297 B11R1.86 CC(=O)NC1CNCCC1C Amb27591818 [1,0,0,1,0,0|2,0,0]=4 1298 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1Cl Amb26450561 [1,0,0,1,0,0|2,0,0]=4 1299 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1N Amb27822700 [1,0,0,1,0,0|2,0,0]=4 1300 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1C Amb28435840 [1,0,0,1,0,0|1,0,0]=3 1301 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1Cl Amb27797252 [1,0,0,1,0,0|2,0,0]=4 1302 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1O Amb28320855 [1,0,0,1,0,0|2,0,0]=4 1303 B11R1.86 CC(=O)OC1=C(C)CCCC1 Amb28284233 [1,0,0,1,0,0|0,0,2]=4 1304 B11R1.86 CC(=O)OC1CCCCC1=O Amb10576141 [1,0,0,1,0,0|1,0,1]=4 1305 B11R1.86 CC(=O)O[C@@H]1CCCC[C@@H]1Cl Amb27454844 [1,0,0,1,0,0|1,0,0]=3 1306 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1C Amb26958236 [1,0,0,1,0,0|0,0,0]=2 1307 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1Cl Amb27483080 [1,0,0,1,0,0|1,0,0]=3 1308 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1O Amb17844353 [1,0,0,1,0,0|1,0,0]=3 1309 B11R1.86 CC(=O)O[C@H]1CCCC[C@@H]1Cl Amb27440472 [1,0,0,1,0,0|1,0,0]=3 1310 B11R1.86 CC(=O)S[C@@H]1CCCC[C@@H]1Cl Amb27845415 [1,0,0,1,0,0|1,1,0]=4 1311 B11R1.86 CC(=O)S[C@@H]1CCCC[C@H]1N Amb30884410 [1,0,0,1,0,0|1,1,0]=4 1312 B11R1.86 CC(N)CC1CCCCC1C Amb27445569 [1,0,0,1,0,0|1,0,1]=4 1313 B11R1.86 CC1CCCCC1CC(=O)O Amb6749252 [1,0,0,1,0,0|1,0,0]=3 1314 B11R1.86 CC1CCCCC1CC(N)=O Amb27232827 [1,0,0,1,0,0|1,0,0]=3 1315 B11R1.86 CC1CCCCC1NC(=O)Cl Amb35637113 [1,0,0,1,0,0|2,0,0]=4 1316 B11R1.86 CC1CCCCC1NC(N)=O Amb1105317 [1,0,0,1,0,0|2,0,0]=4 1317 B11R1.86 CC1CCCCC1OC(=O)Cl Amb27648622 [1,0,0,1,0,0|1,0,0]=3 1318 B11R1.86 CC1CCCCN1CC(=O)O Amb6356107 [1,0,0,1,0,0|2,0,0]=4 1319 B11R1.86 CC1CCCCN1CC(N)=O Amb6528335 [1,0,0,1,0,0|2,0,0]=4 1320 B11R1.86 CC1CCNCC1CC(=O)O Amb28652859 [1,0,0,1,0,0|2,0,0]=4 1321 B11R1.86 CC1CCNCC1CC(=O)O Amb8387926 [1,0,0,1,0,0|2,0,0]=4 1322 B11R1.86 CC1CNCCC1CC(=O)O Amb8387925 [1,0,0,1,0,0|2,0,0]=4 1323 B11R1.86 CC1NCCCC1CC(=O)O Amb32662853 [1,0,0,1,0,0|2,0,0]=4 1324 B11R1.86 CC1NCCCC1CC(=O)O Amb8387928 [1,0,0,1,0,0|2,0,0]=4 1325 B11R1.86 CC1NCCCC1CC(N)=O Amb27186162 [1,0,0,1,0,0|2,0,0]=4 1326 B11R1.86 CC1SCCCC1CC(=O)O Amb27235116 [1,0,0,1,0,0|2,0,0]=4 1327 B11R1.86 CN1CCCCC1CC(=O)O Amb1076959 [1,0,0,1,0,0|2,0,0]=4 1328 B11R1.86 CN1CCCCC1CC(=O)O Amb13885783 [1,0,0,1,0,0|2,0,0]=4 1329 B11R1.86 CN1CCCCC1CC(N)=O Amb26606500 [1,0,0,1,0,0|2,0,0]=4 1330 B11R1.86 NC(=O)CC1CCCCC1O Amb25700984 [1,0,0,1,0,0|2,0,0]=4 1331 B11R1.86 NC(=O)O[C@@H]1CCCC[C@H]1Cl Amb27657603 [1,0,0,1,0,0|2,0,0]=4 1332 B11R1.86 NC1CCCCC1CC(=O)O Amb24509773 [1,0,0,1,0,0|2,0,0]=4 1333 B11R1.86 NC1CCCCC1CC(=O)O Amb28652992 [1,0,0,1,0,0|2,0,0]=4 1334 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Amb26528136 [1,0,0,1,0,0|2,0,0]=4 1335 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Amb32661117 [1,0,0,1,0,0|2,0,0]=4 1336 B11R1.86 N[C@@H]1CCCC[C@H]1CC(=O)O Amb28199039 [1,0,0,1,0,0|2,0,0]=4 1337 B11R1.86 N[C@H]1CCCC[C@H]1CC(=O)O Amb24561031 [1,0,0,1,0,0|2,0,0]=4 1338 B11R1.86 O=C(Cl)OC1CCCCC1Cl Amb27233656 [1,0,0,1,0,0|2,0,0]=4 1339 B11R1.86 O=C(O)CC1CCCCC1F Amb24697602 [1,0,0,1,0,0|2,0,0]=4 1340 B11R1.86 O=C(O)CC1CCCCC1O Amb8009303 [1,0,0,1,0,0|2,0,0]=4 1341 B11R1.86 O=C(O)CC1CCCC[C@H]1O Amb25792260 [1,0,0,1,0,0|2,0,0]=4 1342 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1F Amb25168843 [1,0,0,1,0,0|2,0,0]=4 1343 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O Amb28057566 [1,0,0,1,0,0|2,0,0]=4 1344 B11R1.86 O=C(O)C[C@H]1CCCC[C@@H]1O Amb25274080 [1,0,0,1,0,0|2,0,0]=4 1345 B11R1.86 O=C(O)C[C@H]1CCCC[C@H]1O Amb27419962 [1,0,0,1,0,0|2,0,0]=4 1346 B11R1.90 C=C(C)CCC1CCCC1O Amb24460073 [1,0,0,1,0,0|2,0,0]=4 1347 B11R1.90 C=C(C)CC[C@@H]1CCC[C@H]1O Amb32950846 [1,0,0,1,0,0|2,0,0]=4 1348 B11R1.90 CC(=N)NCC1CCCC1C Amb28072360 [1,0,0,1,0,0|2,0,0]=4 1349 B11R1.90 CC(=O)CCC1CCCN1C Amb25145698 [1,0,0,1,0,0|1,0,0]=3 1350 B11R1.90 CC(=O)CCC1CCOC1C Amb33426815 [1,0,0,1,0,0|1,0,0]=3 1351 B11R1.90 CC(=O)COC1CCCC1O Amb27599458 [1,0,0,1,0,0|2,0,0]=4 1352 B11R1.90 CC(=O)CSC1CCOC1C Amb28077033 [1,0,0,1,0,0|2,0,0]=4 1353 B11R1.90 CC(=O)NCC1CCCC1C Amb27617362 [1,0,0,1,0,0|1,0,0]=3 1354 B11R1.90 CC(=O)NCC1CCCN1C Amb27758772 [1,0,0,1,0,0|2,0,0]=4 1355 B11R1.90 CC(=O)NC[C@@H]1CCC[C@@H]1C Amb27216289 [1,0,0,1,0,0|1,0,0]=3 1356 B11R1.90 CC(=O)NC[C@@H]1CCC[C@@H]1O Amb28197193 [1,0,0,1,0,0|2,0,0]=4 1357 B11R1.90 CC(=O)NC[C@@H]1CCC[C@H]1O Amb27254214 [1,0,0,1,0,0|2,0,0]=4 1358 B11R1.90 CC(=O)NC[C@H]1CCC[C@@H]1O Amb27235919 [1,0,0,1,0,0|2,0,0]=4 1359 B11R1.90 CC(=O)OCC1CCCC1=O Amb25990779 [1,0,0,1,0,0|1,0,1]=4 1360 B11R1.90 CC(=O)OCC1CCCN1C Amb25199931 [1,0,0,1,0,0|1,0,0]=3 1361 B11R1.90 CC(=O)OCC1OCCC1Br Amb27411320 [1,0,0,1,0,0|2,0,0]=4 1362 B11R1.90 CC(=O)OCC1OCCC1C Amb25710223 [1,0,0,1,0,0|1,0,0]=3 1363 B11R1.90 CC(=O)OCC1OCCC1Cl Amb27762647 [1,0,0,1,0,0|2,0,0]=4 1364 B11R1.90 CC(=O)OC[C@@H]1CCCC1=O Amb28382804 [1,0,0,1,0,0|1,0,1]=4 1365 B11R1.90 CC(=O)OC[C@H]1CCC[C@@H]1O Amb27972537 [1,0,0,1,0,0|1,0,0]=3 1366 B11R1.90 CC(O)CC[C@H]1CCC[C@@H]1C Amb27198020 [1,0,0,1,0,0|0,0,2]=4 1367 B11R1.90 CC(O)CC[C@H]1CCC[C@H]1C Amb27472609 [1,0,0,1,0,0|0,0,2]=4 1368 B11R1.90 CC1CCCC1CNC(=O)Cl Amb35633347 [1,0,0,1,0,0|2,0,0]=4 1369 B11R1.90 CC1CCNC1CCC(N)=O Amb27638874 [1,0,0,1,0,0|2,0,0]=4 1370 B11R1.90 CC1OCCC1CCC(=O)O Amb33427953 [1,0,0,1,0,0|2,0,0]=4 1371 B11R1.90 CN1CCCC1CCC(=O)O Amb17504569 [1,0,0,1,0,0|2,0,0]=4 1372 B11R1.90 CN1CCCC1CCC(=O)O Amb28872305 [1,0,0,1,0,0|2,0,0]=4 1373 B11R1.90 CN1CCC[C@@H]1COC(=O)Cl Amb33297287 [1,0,0,1,0,0|2,0,0]=4 1374 B11R1.90 CS(=O)CCC1CCCC1Cl Amb28073494 [1,0,0,1,0,0|2,0,0]=4 1375 B11R1.90 C[C@H]1CCC[C@@H]1CCC(=O)O Amb28455731 [1,0,0,1,0,0|1,0,0]=3 1376 B11R1.90 N[C@@H]1CCC[C@H]1CCC(=O)O Amb28244799 [1,0,0,1,0,0|2,0,0]=4 1377 B11R1.90 O=C(O)CCC1CCCC1F Amb27623706 [1,0,0,1,0,0|2,0,0]=4 1378 B11R1.91 C=C(C)CCC1CCCNC1 Amb27755579 [1,0,0,1,0,0|2,0,0]=4 1379 B11R1.91 C=C(C)CCN1CCCCC1 Amb27840134 [1,0,0,1,0,0|2,0,0]=4 1380 B11R1.91 C=C(C)CNC1CCCCC1 Amb17308768 [1,0,0,1,0,0|2,0,0]=4 1381 B11R1.91 CC(=O)C#CC1CCCCC1 Amb17593738 [1,0,0,1,0,0|0,0,2]=4 1382 B11R1.91 CC(=O)CCC1CC=CCC1 Amb24456632 [1,0,0,1,0,0|0,0,2]=4 1383 B11R1.91 CC(=O)CCC1CCCCC1 Amb9031564 [1,0,0,1,0,0|0,0,0]=2 1384 B11R1.91 CC(=O)CCC1CCCCN1 Amb27881489 [1,0,0,1,0,0|1,0,0]=3 1385 B11R1.91 CC(=O)CCC1CCCCO1 Amb26040132 [1,0,0,1,0,0|1,0,0]=3 1386 B11R1.91 CC(=O)CCC1CCCNC1 Amb25041564 [1,0,0,1,0,0|1,0,0]=3 1387 B11R1.91 CC(=O)CCC1CCCOC1 Amb26058874 [1,0,0,1,0,0|1,0,0]=3 1388 B11R1.91 CC(=O)CCC1CCCSC1 Amb32726147 [1,0,0,1,0,0|1,0,0]=3 1389 B11R1.91 CC(=O)CCC1CCNCC1 Amb24377330 [1,0,0,1,0,0|1,0,0]=3 1390 B11R1.91 CC(=O)CCC1CCOCC1 Amb18182100 [1,0,0,1,0,0|1,0,0]=3 1391 B11R1.91 CC(=O)CCN1CCCCC1 Amb1130395 [1,0,0,1,0,0|1,0,0]=3 1392 B11R1.91 CC(=O)CCN1CCCCC1 Amb33548792 [1,0,0,1,0,0|1,0,0]=3 1393 B11R1.91 CC(=O)CCN1CCNCC1 Amb33715439 [1,0,0,1,0,0|2,0,0]=4 1394 B11R1.91 CC(=O)CCN1CCOCC1 Amb1152970 [1,0,0,1,0,0|2,0,0]=4 1395 B11R1.91 CC(=O)COC1CCNCC1 Amb25789702 [1,0,0,1,0,0|2,0,0]=4 1396 B11R1.91 CC(=O)NCC1CCCCN1 Amb28555668 [1,0,0,1,0,0|2,0,0]=4 1397 B11R1.91 CC(=O)NCC1CCCCN1 Amb6249084 [1,0,0,1,0,0|2,0,0]=4 1398 B11R1.91 CC(=O)NCC1CCCNC1 Amb4304393 [1,0,0,1,0,0|2,0,0]=4 1399 B11R1.91 CC(=O)NCC1CCCSC1 Amb27802138 [1,0,0,1,0,0|2,0,0]=4 1400 B11R1.91 CC(=O)NCC1CCNCC1 Amb10205333 [1,0,0,1,0,0|2,0,0]=4 1401 B11R1.91 CC(=O)NCC1CCNCC1 Amb1095014 [1,0,0,1,0,0|2,0,0]=4 1402 B11R1.91 CC(=O)NCC1CCNCC1 Amb11012597 [1,0,0,1,0,0|2,0,0]=4 1403 B11R1.91 CC(=O)NCC1CCOCC1 Amb27823275 [1,0,0,1,0,0|2,0,0]=4 1404 B11R1.91 CC(=O)NCC1CCSCC1 Amb27165594 [1,0,0,1,0,0|2,0,0]=4 1405 B11R1.91 CC(=O)NCN1CCCCC1 Amb10568234 [1,0,0,1,0,0|2,0,0]=4 1406 B11R1.91 CC(=O)OCC1CCCCC1 Amb24323616 [1,0,0,1,0,0|0,0,0]=2 1407 B11R1.91 CC(=O)OCC1CCCCN1 Amb25717263 [1,0,0,1,0,0|1,0,0]=3 1408 B11R1.91 CC(=O)OCC1CCCCN1 Amb34202134 [1,0,0,1,0,0|1,0,0]=3 1409 B11R1.91 CC(=O)OCC1CCCCO1 Amb4012775 [1,0,0,1,0,0|1,0,0]=3 1410 B11R1.91 CC(=O)OCC1CCCNC1 Amb28251060 [1,0,0,1,0,0|1,0,0]=3 1411 B11R1.91 CC(=O)OCC1CCCOC1 Amb27810025 [1,0,0,1,0,0|1,0,0]=3 1412 B11R1.91 CC(=O)OCC1CCOCC1 Amb26911055 [1,0,0,1,0,0|1,0,0]=3 1413 B11R1.91 CC(=O)OCC1CNCCN1 Amb26544181 [1,0,0,1,0,0|2,0,0]=4 1414 B11R1.91 CC(=O)OCC1CNCCO1 Amb27396923 [1,0,0,1,0,0|2,0,0]=4 1415 B11R1.91 CC(=O)OCC1COCCO1 Amb25710480 [1,0,0,1,0,0|2,0,0]=4 1416 B11R1.91 CC(=O)OC[C@H]1CCCNC1 Amb27603139 [1,0,0,1,0,0|1,0,0]=3 1417 B11R1.91 CC(=O)ON=C1CCCCC1 Amb27825886 [1,0,0,1,0,0|1,0,1]=4 1418 B11R1.91 CC(=O)SCC1CCCOC1 Amb28292895 [1,0,0,1,0,0|1,1,0]=4 1419 B11R1.91 CC(=O)\C=C/C1CCCCC1 Amb28141273 [1,0,0,1,0,0|0,0,2]=4 1420 B11R1.91 CC(=O)\C=C\C1CCCCC1 Amb24625780 [1,0,0,1,0,0|0,0,2]=4 1421 B11R1.91 CC(=O)\C=N\C1CCCCC1 Amb28052310 [1,0,0,1,0,0|1,0,1]=4 1422 B11R1.91 CC(Br)CCC1CCCCC1 Amb24657044 [1,0,0,1,0,0|1,0,1]=4 1423 B11R1.91 CC(Cl)CCC1CCCCC1 Amb27592650 [1,0,0,1,0,0|1,0,1]=4 1424 B11R1.91 CC(Cl)OCC1CCCCC1 Amb32715988 [1,0,0,1,0,0|1,0,1]=4 1425 B11R1.91 CC(N)CCC1CCCCC1 Amb9031768 [1,0,0,1,0,0|1,0,1]=4 1426 B11R1.91 CC(O)CCC1CCCCC1 Amb18799747 [1,0,0,1,0,0|0,0,2]=4 1427 B11R1.91 CN(O)CCC1CCCCC1 Amb33326187 [1,0,0,1,0,0|1,0,1]=4 1428 B11R1.91 CS(=O)CCC1CCCNC1 Amb27397729 [1,0,0,1,0,0|2,0,0]=4 1429 B11R1.91 CS(=O)CCC1CCNCC1 Amb28348942 [1,0,0,1,0,0|2,0,0]=4 1430 B11R1.91 C[C@@H](N)CCC1CCCCC1 Amb33361710 [1,0,0,1,0,0|1,0,1]=4 1431 B11R1.91 C[C@@H](O)CCC1CCCCC1 Amb33361711 [1,0,0,1,0,0|0,0,2]=4 1432 B11R1.91 C[C@H](N)CCC1CCCCC1 Amb33361709 [1,0,0,1,0,0|1,0,1]=4 1433 B11R1.91 C[C@H](O)CCC1CCCCC1 Amb33361713 [1,0,0,1,0,0|0,0,2]=4 1434 B11R1.91 N=C(N)CCC1CCCCC1 Amb24392724 [1,0,0,1,0,0|2,0,0]=4 1435 B11R1.91 NC(=O)CCC1CCCCC1 Amb6430126 [1,0,0,1,0,0|1,0,0]=3 1436 B11R1.91 NC(=O)CCC1CCCCN1 Amb18295940 [1,0,0,1,0,0|2,0,0]=4 1437 B11R1.91 NC(=O)CCC1CCCNC1 Amb10607788 [1,0,0,1,0,0|2,0,0]=4 1438 B11R1.91 NC(=O)CCC1CCCNC1 Amb13949150 [1,0,0,1,0,0|2,0,0]=4 1439 B11R1.91 NC(=O)CCC1CCCOC1 Amb28280723 [1,0,0,1,0,0|2,0,0]=4 1440 B11R1.91 NC(=O)CCC1CCNCC1 Amb8011291 [1,0,0,1,0,0|2,0,0]=4 1441 B11R1.91 NC(=O)CCC1CCNCC1 Amb8503428 [1,0,0,1,0,0|2,0,0]=4 1442 B11R1.91 NC(=O)CCC1CCOCC1 Amb28139505 [1,0,0,1,0,0|2,0,0]=4 1443 B11R1.91 NC(=O)CCN1CCCCC1 Amb9681664 [1,0,0,1,0,0|2,0,0]=4 1444 B11R1.91 NC(=O)CC[C@@H]1CCCNC1 Amb28043282 [1,0,0,1,0,0|2,0,0]=4 1445 B11R1.91 NC(=O)CNC1CCCCC1 Amb6661332 [1,0,0,1,0,0|2,0,0]=4 1446 B11R1.91 NC(=O)COC1CCCCC1 Amb18791809 [1,0,0,1,0,0|2,0,0]=4 1447 B11R1.91 NC(=O)NCC1CCCCC1 Amb4016522 [1,0,0,1,0,0|2,0,0]=4 1448 B11R1.91 NC(=O)OCC1CCCCC1 Amb28458479 [1,0,0,1,0,0|1,0,0]=3 1449 B11R1.91 NC(=O)OCC1CCCCN1 Amb27404153 [1,0,0,1,0,0|2,0,0]=4 1450 B11R1.91 NC(=O)OCC1CCCNC1 Amb27877206 [1,0,0,1,0,0|2,0,0]=4 1451 B11R1.91 NC(=S)CCC1CCCCC1 Amb18627059 [1,0,0,1,0,0|1,1,0]=4 1452 B11R1.91 NS(=O)CCC1CCCCC1 Amb32720441 [1,0,0,1,0,0|2,0,0]=4 1453 B11R1.91 O=C(Cl)CCC1CCCCC1 Amb2720380 [1,0,0,1,0,0|1,0,0]=3 1454 B11R1.91 O=C(Cl)NCC1CCCCC1 Amb35637043 [1,0,0,1,0,0|2,0,0]=4 1455 B11R1.91 O=C(Cl)OCC1CCCCC1 Amb25140788 [1,0,0,1,0,0|1,0,0]=3 1456 B11R1.91 O=C(Cl)OCC1CCCCO1 Amb27171806 [1,0,0,1,0,0|2,0,0]=4 1457 B11R1.91 O=C(Cl)OCC1CCCSC1 Amb28051652 [1,0,0,1,0,0|2,0,0]=4 1458 B11R1.91 O=C(Cl)OCC1CCOCC1 Amb22642257 [1,0,0,1,0,0|2,0,0]=4 1459 B11R1.91 O=C(Cl)OCC1CCSCC1 Amb27789054 [1,0,0,1,0,0|2,0,0]=4 1460 B11R1.91 O=C(O)CCC1CCCCC1 Amb3939828 [1,0,0,1,0,0|1,0,0]=3 1461 B11R1.91 O=C(O)CCC1CCCCN1 Amb1102729 [1,0,0,1,0,0|2,0,0]=4 1462 B11R1.91 O=C(O)CCC1CCCCN1 Amb8630249 [1,0,0,1,0,0|2,0,0]=4 1463 B11R1.91 O=C(O)CCC1CCCCO1 Amb17506864 [1,0,0,1,0,0|2,0,0]=4 1464 B11R1.91 O=C(O)CCC1CCCCS1 Amb33470228 [1,0,0,1,0,0|2,0,0]=4 1465 B11R1.91 O=C(O)CCC1CCCNC1 Amb10576190 [1,0,0,1,0,0|2,0,0]=4 1466 B11R1.91 O=C(O)CCC1CCCNC1 Amb1101056 [1,0,0,1,0,0|2,0,0]=4 1467 B11R1.91 O=C(O)CCC1CCCOC1 Amb33529911 [1,0,0,1,0,0|2,0,0]=4 1468 B11R1.91 O=C(O)CCC1CCCSC1 Amb18825218 [1,0,0,1,0,0|2,0,0]=4 1469 B11R1.91 O=C(O)CCC1CCC[NH2+]C1 Amb2694709 [1,0,0,1,0,0|2,0,0]=4 1470 B11R1.91 O=C(O)CCC1CCNCC1 Amb10609864 [1,0,0,1,0,0|2,0,0]=4 1471 B11R1.91 O=C(O)CCC1CCNCC1 Amb10609915 [1,0,0,1,0,0|2,0,0]=4 1472 B11R1.91 O=C(O)CCC1CCNCC1 Amb2696646 [1,0,0,1,0,0|2,0,0]=4 1473 B11R1.91 O=C(O)CCC1CCOCC1 Amb18990337 [1,0,0,1,0,0|2,0,0]=4 1474 B11R1.91 O=C(O)CCC1CCSCC1 Amb18197511 [1,0,0,1,0,0|2,0,0]=4 1475 B11R1.91 O=C(O)CCN1CCCCC1 Amb10609748 [1,0,0,1,0,0|2,0,0]=4 1476 B11R1.91 O=C(O)CCN1CCCCC1 Amb594197 [1,0,0,1,0,0|2,0,0]=4 1477 B11R1.91 O=C(O)CNC1CCCCC1 Amb19263851 [1,0,0,1,0,0|2,0,0]=4 1478 B11R1.91 O=C(O)CNC1CCCCC1 Amb840542 [1,0,0,1,0,0|2,0,0]=4 1479 B11R1.91 O=C(O)COC1CCCCC1 Amb2693120 [1,0,0,1,0,0|2,0,0]=4 1480 B11R1.91 O=C(O)CSC1CCCCC1 Amb6537757 [1,0,0,1,0,0|2,0,0]=4 1481 B11R1.91 O=S(Cl)CCC1CCCCC1 Amb32720440 [1,0,0,1,0,0|2,0,0]=4 1482 B11R1.91 O=S([O-])CCC1CCCCC1 Amb32755538 [1,0,0,1,0,0|2,0,0]=4 1483 B11R1.91 O=[N+]([O-])CCC1CCCCC1 Amb25911033 [1,0,0,1,0,0|2,0,0]=4 1484 B11R1.91 O=[N+]([O-])OCC1CCCCC1 Amb27751251 [1,0,0,1,0,0|2,0,0]=4 1485 B11R1.101 ClC1CCCCCCCCC1 Amb26603797 [1,0,0,1,0,0|1,0,1]=4 1486 B11R1.101 NC1CCCCCCCCC1 Amb17593887 [1,0,0,1,0,0|1,0,1]=4 1487 B11R1.101 NC1CCCCCCCCC1 Amb29837926 [1,0,0,1,0,0|1,0,1]=4 1488 B11R1.101 O=C1C=CCCCCCCC1 Amb28254479 [1,0,0,1,0,0|0,0,2]=4 1489 B11R1.101 O=C1CC=CCCCCCC1 Amb26880464 [1,0,0,1,0,0|0,0,2]=4 1490 B11R1.101 O=C1CCC=CCCCCC1 Amb4034899 [1,0,0,1,0,0|0,0,2]=4 1491 B11R1.101 O=C1CCCCCCCCC1 Amb2778532 [1,0,0,1,0,0|0,0,0]=2 1492 B11R1.101 O=C1CCCCCCCCN1 Amb4034840 [1,0,0,1,0,0|1,0,0]=3 1493 B11R1.101 O=C1CCNCCCCCN1 Amb32679586 [1,0,0,1,0,0|2,0,0]=4 1494 B11R1.101 O=C1CNCCCCCCN1 Amb28044832 [1,0,0,1,0,0|2,0,0]=4 1495 B11R1.101 OC1CCCCCCCCC1 Amb22008249 [1,0,0,1,0,0|0,0,2]=4 1496 B11R1.101 S=C1CCCCCCCCN1 Amb27636863 [1,0,0,1,0,0|1,1,0]=4 1497 B11R1.107 CC1=CCCCCCC(=O)C1 Amb28381149 [1,0,0,1,0,0|0,0,2]=4 1498 B11R1.107 CC1CCCCCCC(=O)C1 Amb28200023 [1,0,0,1,0,0|0,0,0]=2 1499 B11R1.107 O=C1CCCCCCC(=O)C1 Amb17593852 [1,0,0,1,0,0|1,0,1]=4 1500 B11R1.110 CCCC1CCCCC(=O)N1 Amb2229640 [1,0,0,1,0,0|1,0,0]=3 1501 B11R1.110 CCCC1CCCCC(Cl)C1 Amb27981131 [1,0,0,1,0,0|1,0,1]=4 1502 B11R1.110 CCCN1CCCNC(=O)C1 Amb27176452 [1,0,0,1,0,0|2,0,0]=4 1503 B11R1.110 CCC[C@@H]1CSCCC(=O)N1 Amb27169108 [1,0,0,1,0,0|2,0,0]=4 1504 B11R1.110 COCC1CCCCC(=O)C1 Amb27246950 [1,0,0,1,0,0|1,0,0]=3 1505 B11R1.110 N#CCC1CCCCC(=O)C1 Amb27174178 [1,0,0,1,0,0|1,0,1]=4 1506 B11R1.110 NCCC1CCCCC(=O)N1 Amb19515432 [1,0,0,1,0,0|2,0,0]=4 1507 B11R1.110 NCCC1CCCNC(=O)C1 Amb27468807 [1,0,0,1,0,0|2,0,0]=4 1508 B11R1.110 O=C1CCCCC(CCCl)O1 Amb27407753 [1,0,0,1,0,0|2,0,0]=4 1509 B11R1.110 O=C1CCCC[C@@H](CCO)O1 Amb27197176 [1,0,0,1,0,0|2,0,0]=4 1510 B11R1.110 O=C1CN(CCO)CCCO1 Amb27613231 [1,0,0,1,0,0|2,0,0]=4 1511 B11R1.110 O=CCC1CCCCC(=O)C1 Amb28286724 [1,0,0,1,0,0|1,0,1]=4 1512 B11R1.143 C=C(C)C1CCCCCC1O Amb25788203 [1,0,0,1,0,0|2,0,0]=4 1513 B11R1.143 C=C(C)[C@@H]1CCCCC[C@H]1O Amb32944787 [1,0,0,1,0,0|2,0,0]=4 1514 B11R1.143 CC(=O)C1CCCCC=C1C Amb27261169 [1,0,0,1,0,0|0,0,2]=4 1515 B11R1.143 CC(=O)C1CCCCCC1=O Amb18796759 [1,0,0,1,0,0|1,0,1]=4 1516 B11R1.143 CC(=O)C1CCCCCC1C Amb35725700 [1,0,0,1,0,0|0,0,0]=2 1517 B11R1.143 CC(=O)C1CCCCCC1N Amb26968176 [1,0,0,1,0,0|1,0,0]=3 1518 B11R1.143 CC(=O)C1CCCCCC1O Amb32945460 [1,0,0,1,0,0|1,0,0]=3 1519 B11R1.143 CC(=O)C1CCCCCN1C Amb27963187 [1,0,0,1,0,0|1,0,0]=3 1520 B11R1.143 CC(=O)N1CCOCCC1C Amb28349810 [1,0,0,1,0,0|2,0,0]=4 1521 B11R1.143 CC(=O)[C@@H]1CCCCC[C@@H]1N Amb33307461 [1,0,0,1,0,0|1,0,0]=3 1522 B11R1.143 CC(=O)[C@@H]1CCCCC[C@H]1O Amb32945317 [1,0,0,1,0,0|1,0,0]=3 1523 B11R1.143 CC(Br)C1CCCCCC1C Amb35721309 [1,0,0,1,0,0|1,0,1]=4 1524 B11R1.143 CC(Cl)C1CCCCCC1C Amb35721305 [1,0,0,1,0,0|1,0,1]=4 1525 B11R1.143 CC(O)C1CCCCCC1C Amb35672756 [1,0,0,1,0,0|0,0,2]=4 1526 B11R1.143 CC1CCCCCC1N(C)N Amb35681285 [1,0,0,1,0,0|2,0,0]=4 1527 B11R1.143 CC1CCNCCC1C(=O)O Amb27445777 [1,0,0,1,0,0|2,0,0]=4 1528 B11R1.143 CC1CCOCCC1C(=O)O Amb27861013 [1,0,0,1,0,0|2,0,0]=4 1529 B11R1.143 CC1NCCCCC1C(=O)O Amb27597000 [1,0,0,1,0,0|2,0,0]=4 1530 B11R1.143 CN1CCCCCC1C(=O)O Amb3941310 [1,0,0,1,0,0|2,0,0]=4 1531 B11R1.143 CN1CCCCCC1C(=O)O Amb8503498 [1,0,0,1,0,0|2,0,0]=4 1532 B11R1.143 CN1CCCCCC1C(N)=O Amb27607657 [1,0,0,1,0,0|2,0,0]=4 1533 B11R1.143 C[C@@H]1NCCCC[C@H]1C(=O)O Amb18199981 [1,0,0,1,0,0|2,0,0]=4 1534 B11R1.143 C[C@H]1NCCCC[C@@H]1C(=O)O Amb27420245 [1,0,0,1,0,0|2,0,0]=4 1535 B11R1.143 NC(=O)C1CCCCCC1N Amb20668797 [1,0,0,1,0,0|2,0,0]=4 1536 B11R1.143 NC(=O)C1CCCCCC1N Amb22059737 [1,0,0,1,0,0|2,0,0]=4 1537 B11R1.143 NC(=O)C1CCCCCC1O Amb25760752 [1,0,0,1,0,0|2,0,0]=4 1538 B11R1.143 NC(=O)[C@@H]1CCCCC[C@H]1O Amb28137536 [1,0,0,1,0,0|2,0,0]=4 1539 B11R1.143 NC1CCCCCC1C(=O)O Amb2694961 [1,0,0,1,0,0|2,0,0]=4 1540 B11R1.143 NC1CCCCCC1C(=O)O Amb8630073 [1,0,0,1,0,0|2,0,0]=4 1541 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1993851 [1,0,0,1,0,0|2,0,0]=4 1542 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1994004 [1,0,0,1,0,0|2,0,0]=4 1543 B11R1.143 N[C@@H]1CCCCC[C@H]1C(=O)O Amb27635591 [1,0,0,1,0,0|2,0,0]=4 1544 B11R1.143 N[C@H]1CCCCC[C@@H]1C(=O)O Amb28411250 [1,0,0,1,0,0|2,0,0]=4 1545 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1993850 [1,0,0,1,0,0|2,0,0]=4 1546 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1994003 [1,0,0,1,0,0|2,0,0]=4 1547 B11R1.143 O=C(O)C1CCCCCC1O Amb18280963 [1,0,0,1,0,0|2,0,0]=4 1548 B11R1.143 O=C(O)C1CCCCCC1S Amb18949212 [1,0,0,1,0,0|2,0,0]=4 1549 B11R1.143 O=C(O)[C@@H]1CCCCC[C@@H]1O Amb27848050 [1,0,0,1,0,0|2,0,0]=4 1550 B11R1.143 O=C(O)[C@H]1CCCCC[C@@H]1O Amb27848051 [1,0,0,1,0,0|2,0,0]=4 1551 B11R1.161 C=C(C)CCNC1CCC1C Amb27266945 [1,0,0,1,0,0|2,0,0]=4 1552 B11R1.161 CC1CCC1CCCC(=O)O Amb27266949 [1,0,0,1,0,0|1,0,0]=3 1553 B11R1.161 CC1CCC1NCCC(=O)O Amb27270129 [1,0,0,1,0,0|2,0,0]=4 1554 B11R1.161 CC1CCC1NCCC(N)=O Amb27270131 [1,0,0,1,0,0|2,0,0]=4 1555 B11R1.172 C=C(C)CNCC1CCCC1 Amb18796741 [1,0,0,1,0,0|2,0,0]=4 1556 B11R1.172 CC(=O)CCC=C1CCCC1 Amb28202156 [1,0,0,1,0,0|0,0,2]=4 1557 B11R1.172 CC(=O)CCCC1CCCC1 Amb26076138 [1,0,0,1,0,0|0,0,0]=2 1558 B11R1.172 CC(=O)CCCN1CCCC1 Amb9659032 [1,0,0,1,0,0|1,0,0]=3 1559 B11R1.172 CC(=O)CCOC1CCOC1 Amb27271547 [1,0,0,1,0,0|2,0,0]=4 1560 B11R1.172 CC(=O)COCC1CCCC1 Amb28386909 [1,0,0,1,0,0|1,0,0]=3 1561 B11R1.172 CC(=O)COCC1CCCO1 Amb9664734 [1,0,0,1,0,0|2,0,0]=4 1562 B11R1.172 CC(=O)CSCC1CCCC1 Amb27269541 [1,0,0,1,0,0|1,0,0]=3 1563 B11R1.172 CC(=O)NCCC1CCCC1 Amb8328911 [1,0,0,1,0,0|1,0,0]=3 1564 B11R1.172 CC(=O)NCCC1CCCN1 Amb27789209 [1,0,0,1,0,0|2,0,0]=4 1565 B11R1.172 CC(=O)NCCC1CCNC1 Amb24477543 [1,0,0,1,0,0|2,0,0]=4 1566 B11R1.172 CC(=O)NCCN1CCCC1 Amb24723020 [1,0,0,1,0,0|2,0,0]=4 1567 B11R1.172 CC(=O)NCC[C@H]1CCCN1 Amb27427200 [1,0,0,1,0,0|2,0,0]=4 1568 B11R1.172 CC(=O)OCCC1CCCC1 Amb28326525 [1,0,0,1,0,0|0,0,0]=2 1569 B11R1.172 CC(=O)OCCC1CCCO1 Amb28326526 [1,0,0,1,0,0|1,0,0]=3 1570 B11R1.172 CC(=O)\C=C\CC1CCCC1 Amb33378003 [1,0,0,1,0,0|0,0,2]=4 1571 B11R1.172 CC(Br)CCCC1CCCC1 Amb26076992 [1,0,0,1,0,0|1,0,1]=4 1572 B11R1.172 CC(C)=CCCC1CCCC1 Amb30023888 [1,0,0,1,0,0|1,0,1]=4 1573 B11R1.172 CC(N)CCCC1CCCC1 Amb26992747 [1,0,0,1,0,0|1,0,1]=4 1574 B11R1.172 CC(O)CCCC1CCCC1 Amb26992742 [1,0,0,1,0,0|0,0,2]=4 1575 B11R1.172 CN(O)CCCC1CCCC1 Amb33374912 [1,0,0,1,0,0|1,0,1]=4 1576 B11R1.172 CS(=O)CCCC1CCCN1 Amb27670386 [1,0,0,1,0,0|2,0,0]=4 1577 B11R1.172 CS(=O)CCNC1CCCC1 Amb27988444 [1,0,0,1,0,0|2,0,0]=4 1578 B11R1.172 C[C@@H](N)CCCC1CCCC1 Amb33378383 [1,0,0,1,0,0|1,0,1]=4 1579 B11R1.172 C[C@@H](O)CCCC1CCCC1 Amb33378384 [1,0,0,1,0,0|0,0,2]=4 1580 B11R1.172 C[C@H](N)CCCC1CCCC1 Amb33378382 [1,0,0,1,0,0|1,0,1]=4 1581 B11R1.172 C[C@H](O)CCCC1CCCC1 Amb33378386 [1,0,0,1,0,0|0,0,2]=4 1582 B11R1.172 N=C(N)CCCC1CCCC1 Amb33379884 [1,0,0,1,0,0|2,0,0]=4 1583 B11R1.172 NC(=O)CCCC1CCCO1 Amb27818759 [1,0,0,1,0,0|2,0,0]=4 1584 B11R1.172 NC(=O)CCCN1CCCC1 Amb17142881 [1,0,0,1,0,0|2,0,0]=4 1585 B11R1.172 NC(=O)CCNC1CCCC1 Amb8841120 [1,0,0,1,0,0|2,0,0]=4 1586 B11R1.172 NC(=O)COCC1CCCC1 Amb28386904 [1,0,0,1,0,0|2,0,0]=4 1587 B11R1.172 NC(=O)CSCC1CCCC1 Amb27269544 [1,0,0,1,0,0|2,0,0]=4 1588 B11R1.172 NC(=O)OCCC1CCNC1 Amb27671522 [1,0,0,1,0,0|2,0,0]=4 1589 B11R1.172 NC(=S)CCCC1CCCC1 Amb33379883 [1,0,0,1,0,0|1,1,0]=4 1590 B11R1.172 O=C(Cl)NCCC1CCCC1 Amb35625732 [1,0,0,1,0,0|2,0,0]=4 1591 B11R1.172 O=C(O)CCCC1CCCC1 Amb19149142 [1,0,0,1,0,0|1,0,0]=3 1592 B11R1.172 O=C(O)CCCC1CCCN1 Amb18199969 [1,0,0,1,0,0|2,0,0]=4 1593 B11R1.172 O=C(O)CCCC1CCCO1 Amb26990705 [1,0,0,1,0,0|2,0,0]=4 1594 B11R1.172 O=C(O)CCCC1CCCS1 Amb26659241 [1,0,0,1,0,0|2,0,0]=4 1595 B11R1.172 O=C(O)CCCC1CCOC1 Amb24755490 [1,0,0,1,0,0|2,0,0]=4 1596 B11R1.172 O=C(O)CCCC1CCSC1 Amb27989571 [1,0,0,1,0,0|2,0,0]=4 1597 B11R1.172 O=C(O)CCCN1CCCC1 Amb2607773 [1,0,0,1,0,0|2,0,0]=4 1598 B11R1.172 O=C(O)CCCN1CCCC1 Amb33551514 [1,0,0,1,0,0|2,0,0]=4 1599 B11R1.172 O=C(O)CCNC1CCCC1 Amb1109669 [1,0,0,1,0,0|2,0,0]=4 1600 B11R1.172 O=C(O)CCNC1CCCC1 Amb13951292 [1,0,0,1,0,0|2,0,0]=4 1601 B11R1.172 O=C(O)CCOC1CCCC1 Amb6275835 [1,0,0,1,0,0|2,0,0]=4 1602 B11R1.172 O=C(O)CCSC1CCCC1 Amb6274643 [1,0,0,1,0,0|2,0,0]=4 1603 B11R1.172 O=C(O)COCC1CCCC1 Amb21963936 [1,0,0,1,0,0|2,0,0]=4 1604 B11R1.172 O=[N+]([O-])CCCC1CCCC1 Amb33378376 [1,0,0,1,0,0|2,0,0]=4 1605 B11R1.174 CC(=O)NCCCC1CCN1 Amb27674421 [1,0,0,1,0,0|2,0,0]=4 1606 B11R1.174 CC(=O)NCCCC1CNC1 Amb27674417 [1,0,0,1,0,0|2,0,0]=4 1607 B11R1.174 CC(=O)NCCNC1CCC1 Amb18799705 [1,0,0,1,0,0|2,0,0]=4 1608 B11R1.174 CC(=O)NCCOC1CCC1 Amb28351910 [1,0,0,1,0,0|2,0,0]=4 1609 B11R1.176 CC(Cl)OCCCCC1CC1 Amb32716011 [1,0,0,1,0,0|1,0,1]=4 1610 B11R1.176 O=C(O)CCCOCC1CC1 Amb6680910 [1,0,0,1,0,0|2,0,0]=4 1611 B11R1.191 CCCC1CCCCC1(C)O Amb32945232 [1,0,0,1,0,0|0,0,2]=4 1612 B11R1.191 CCC[C@@H]1CCCC[C@@]1(C)O Amb33213723 [1,0,0,1,0,0|0,0,2]=4 1613 B11R1.193 C#CCC1CCCC1C(C)=O Amb25759595 [1,0,0,1,0,0|0,0,2]=4 1614 B11R1.193 C=CC[C@@H]1CCC[C@H]1C(C)=O Amb27227228 [1,0,0,1,0,0|0,0,2]=4 1615 B11R1.193 CC(=O)C1CCCC1CC#N Amb27951586 [1,0,0,1,0,0|1,0,1]=4 1616 B11R1.193 CC(=O)[C@@H]1CCC[C@H]1CC=O Amb27467933 [1,0,0,1,0,0|1,0,1]=4 1617 B11R1.193 CCCC1CCCC1C(=O)O Amb18644850 [1,0,0,1,0,0|1,0,0]=3 1618 B11R1.193 CCCC1CCCN1C(=O)Cl Amb27493472 [1,0,0,1,0,0|2,0,0]=4 1619 B11R1.193 CCCC1CCCN1C(C)=N Amb27252244 [1,0,0,1,0,0|2,0,0]=4 1620 B11R1.193 CCCC1CCNC1C(=O)O Amb25241187 [1,0,0,1,0,0|2,0,0]=4 1621 B11R1.193 CCCC1CCNC1C(=O)O Amb28652947 [1,0,0,1,0,0|2,0,0]=4 1622 B11R1.193 CCCC1CCN[C@@H]1C(=O)O Amb28340938 [1,0,0,1,0,0|2,0,0]=4 1623 B11R1.193 CCCC1COCC1C(=O)O Amb27864218 [1,0,0,1,0,0|2,0,0]=4 1624 B11R1.193 CCCC1COCC1C(C)=O Amb29882922 [1,0,0,1,0,0|1,0,0]=3 1625 B11R1.193 CCCC1SCCN1C(C)=O Amb28061197 [1,0,0,1,0,0|2,0,0]=4 1626 B11R1.193 CCCN1CCCC1C(=O)O Amb9704298 [1,0,0,1,0,0|2,0,0]=4 1627 B11R1.193 CCCN1CCCC1C(N)=O Amb26327231 [1,0,0,1,0,0|2,0,0]=4 1628 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27591265 [1,0,0,1,0,0|2,0,0]=4 1629 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27839891 [1,0,0,1,0,0|2,0,0]=4 1630 B11R1.193 CCCN1CCC[C@H]1C(=O)O Amb25864864 [1,0,0,1,0,0|2,0,0]=4 1631 B11R1.193 CCCN1CCC[C@H]1C(N)=O Amb26480008 [1,0,0,1,0,0|2,0,0]=4 1632 B11R1.193 CCC[C@@H]1CC=C[C@H]1C(C)=O Amb27629704 [1,0,0,1,0,0|0,0,2]=4 1633 B11R1.193 CCC[C@@H]1CCC[C@@H]1C(=O)O Amb27878683 [1,0,0,1,0,0|1,0,0]=3 1634 B11R1.193 CCC[C@@H]1CCN[C@H]1C(=O)O Amb26452406 [1,0,0,1,0,0|2,0,0]=4 1635 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992396 [1,0,0,1,0,0|2,0,0]=4 1636 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992397 [1,0,0,1,0,0|2,0,0]=4 1637 B11R1.193 CCNC1COCC1C(C)=O Amb25698028 [1,0,0,1,0,0|2,0,0]=4 1638 B11R1.193 CCOC1CNCC1C(C)=O Amb29869780 [1,0,0,1,0,0|2,0,0]=4 1639 B11R1.193 CNCC1CCCC1C(=O)O Amb27654981 [1,0,0,1,0,0|2,0,0]=4 1640 B11R1.193 CNC[C@@H]1CCCN1C(C)=O Amb22227518 [1,0,0,1,0,0|2,0,0]=4 1641 B11R1.193 CNOC1CCCC1C(C)=O Amb24484596 [1,0,0,1,0,0|2,0,0]=4 1642 B11R1.193 COCC1CCCC1C(=O)O Amb25200900 [1,0,0,1,0,0|2,0,0]=4 1643 B11R1.193 COCC1CCCN1C(C)=O Amb27872243 [1,0,0,1,0,0|2,0,0]=4 1644 B11R1.193 COC[C@@H]1CCCN1C(C)=O Amb27834362 [1,0,0,1,0,0|2,0,0]=4 1645 B11R1.193 COC[C@@H]1CCC[C@@H]1C(=O)O Amb27758197 [1,0,0,1,0,0|2,0,0]=4 1646 B11R1.193 COC[C@H]1CCC[C@H]1C(=O)O Amb25295380 [1,0,0,1,0,0|2,0,0]=4 1647 B11R1.193 O=C(O)C1CCCC1CCF Amb27635907 [1,0,0,1,0,0|2,0,0]=4 1648 B11R1.204 CC(=O)N1CCC1CCCN Amb27674411 [1,0,0,1,0,0|2,0,0]=4 1649 B11R1.204 CCCCC1=C(C(C)=O)CC1 Amb28080144 [1,0,0,1,0,0|0,0,2]=4 1650 B11R1.204 CCCCN1CC[C@H]1C(N)=O Amb27272273 [1,0,0,1,0,0|2,0,0]=4 1651 B11R1.204 CNCCC1CCN1C(C)=O Amb27674412 [1,0,0,1,0,0|2,0,0]=4 1652 B11R1.204 CSCCC1CCC1C(=O)O Amb27986354 [1,0,0,1,0,0|2,0,0]=4 1653 B11R1.245 CCC1CCCC=CC(=O)C1 Amb27954110 [1,0,0,1,0,0|0,0,2]=4 1654 B11R1.245 CCC1CCCCCC(=O)N1 Amb25313080 [1,0,0,1,0,0|1,0,0]=3 1655 B11R1.245 COC1CCCCCC(=O)C1 Amb27164648 [1,0,0,1,0,0|1,0,0]=3 1656 B11R1.271 C=C(C)CCC1CCC1CN Amb27988104 [1,0,0,1,0,0|2,0,0]=4 1657 B11R1.271 C=C(C)CCN1CCC1CC Amb27986909 [1,0,0,1,0,0|2,0,0]=4 1658 B11R1.271 C=C(C)CNC1CCC1CC Amb27272151 [1,0,0,1,0,0|2,0,0]=4 1659 B11R1.271 CC(=O)OC[C@@H]1CC[C@@H]1C=O Amb25383270 [1,0,0,1,0,0|1,0,1]=4 1660 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1C=O Amb25383269 [1,0,0,1,0,0|1,0,1]=4 1661 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1CO Amb31308520 [1,0,0,1,0,0|1,0,0]=3 1662 B11R1.271 CC(=O)OC[C@H]1CC[C@H]1C=O Amb25383267 [1,0,0,1,0,0|1,0,1]=4 1663 B11R1.271 CCC1CCC1NCC(N)=O Amb27272153 [1,0,0,1,0,0|2,0,0]=4 1664 B11R1.271 CCC1CCN1CCC(=O)O Amb27986912 [1,0,0,1,0,0|2,0,0]=4 1665 B11R1.271 CCC1CCN1CCC(C)=O Amb27986910 [1,0,0,1,0,0|1,0,0]=3 1666 B11R1.271 CCC1CCN1CCC(N)=O Amb27986696 [1,0,0,1,0,0|2,0,0]=4 1667 B11R1.543 CC1(O)CCCCCCCC1 Amb22342433 [1,0,0,1,0,0|0,0,2]=4 1668 B11R1.706 CC(=O)C1=CCCCCCC1 Amb27473365 [1,0,0,1,0,0|0,0,2]=4 1669 B11R1.706 CC(=O)C1C=CCCCCC1 Amb22011813 [1,0,0,1,0,0|0,0,2]=4 1670 B11R1.706 CC(=O)C1CCCCCCC1 Amb25327542 [1,0,0,1,0,0|0,0,0]=2 1671 B11R1.706 CC(C)=C1CCCCCCC1 Amb22356359 [1,0,0,1,0,0|1,0,1]=4 1672 B11R1.706 CC(Cl)C1CCCCCCC1 Amb27218660 [1,0,0,1,0,0|1,0,1]=4 1673 B11R1.706 CC(N)C1CCCCCCC1 Amb26478080 [1,0,0,1,0,0|1,0,1]=4 1674 B11R1.706 C[C@@H](N)C1CCCCCCC1 Amb26593788 [1,0,0,1,0,0|1,0,1]=4 1675 B11R1.706 C[C@H](N)C1CCCCCCC1 Amb26034933 [1,0,0,1,0,0|1,0,1]=4 1676 B11R1.706 O=C(Cl)C1CCCCCCC1 Amb25760237 [1,0,0,1,0,0|1,0,0]=3 1677 B11R1.706 O=C(O)C1CCCCCCC1 Amb18278612 [1,0,0,1,0,0|1,0,0]=3 1678 B11R1.706 O=C(O)C1CCCCCCN1 Amb27760420 [1,0,0,1,0,0|2,0,0]=4 1679 B11R1.706 O=C(O)C1CCCCCCN1 Amb28652940 [1,0,0,1,0,0|2,0,0]=4 1680 B11R1.706 O=C(O)C1CCCSCCC1 Amb28239756 [1,0,0,1,0,0|2,0,0]=4 1681 B11R1.706 O=[N+]([O-])C1CCCCCCC1 Amb33299000 [1,0,0,1,0,0|2,0,0]=4 1682 B11R1.742 CC(=N)NC1CCCCCC1 Amb27213610 [1,0,0,1,0,0|2,0,0]=4 1683 B11R1.742 CC(=O)C=C1CCCCCC1 Amb27948607 [1,0,0,1,0,0|0,0,2]=4 1684 B11R1.742 CC(=O)CC1=CCCCCC1 Amb28122365 [1,0,0,1,0,0|0,0,2]=4 1685 B11R1.742 CC(=O)CC1CCCCCC1 Amb25094261 [1,0,0,1,0,0|0,0,0]=2 1686 B11R1.742 CC(=O)CC1CCCCCN1 Amb23585599 [1,0,0,1,0,0|1,0,0]=3 1687 B11R1.742 CC(=O)CC1CCCOCC1 Amb27486093 [1,0,0,1,0,0|1,0,0]=3 1688 B11R1.742 CC(=O)CN1CCCCCC1 Amb8427988 [1,0,0,1,0,0|1,0,0]=3 1689 B11R1.742 CC(=O)CN1CCCCCC1 Amb9173328 [1,0,0,1,0,0|1,0,0]=3 1690 B11R1.742 CC(=O)CN1CCCNCC1 Amb18284149 [1,0,0,1,0,0|2,0,0]=4 1691 B11R1.742 CC(=O)C[C@@H]1C=CCCCC1 Amb27227101 [1,0,0,1,0,0|0,0,2]=4 1692 B11R1.742 CC(=O)NC1CCCSCC1 Amb35691520 [1,0,0,1,0,0|2,0,0]=4 1693 B11R1.742 CC(=O)OC1CCC=CCC1 Amb22364710 [1,0,0,1,0,0|0,0,2]=4 1694 B11R1.742 CC(=O)OC1CCCCCC1 Amb26487005 [1,0,0,1,0,0|0,0,0]=2 1695 B11R1.742 CC(Br)CC1CCCCCC1 Amb33432623 [1,0,0,1,0,0|1,0,1]=4 1696 B11R1.742 CC(N)CC1CCCCCC1 Amb26317267 [1,0,0,1,0,0|1,0,1]=4 1697 B11R1.742 CC(O)CC1CCCCCC1 Amb27195551 [1,0,0,1,0,0|0,0,2]=4 1698 B11R1.742 CN(O)CC1CCCCCC1 Amb33224395 [1,0,0,1,0,0|1,0,1]=4 1699 B11R1.742 CS(=O)CC1CCCCNC1 Amb35611340 [1,0,0,1,0,0|2,0,0]=4 1700 B11R1.742 C[C@@H](N)CC1CCCCCC1 Amb33267285 [1,0,0,1,0,0|1,0,1]=4 1701 B11R1.742 C[C@@H](O)CC1CCCCCC1 Amb33267867 [1,0,0,1,0,0|0,0,2]=4 1702 B11R1.742 C[C@H](N)CC1CCCCCC1 Amb33267282 [1,0,0,1,0,0|1,0,1]=4 1703 B11R1.742 C[C@H](O)CC1CCCCCC1 Amb33267868 [1,0,0,1,0,0|0,0,2]=4 1704 B11R1.742 N=C(N)CC1CCCCCC1 Amb32882353 [1,0,0,1,0,0|2,0,0]=4 1705 B11R1.742 NC(=O)CC1CCCCCC1 Amb24487974 [1,0,0,1,0,0|1,0,0]=3 1706 B11R1.742 NC(=O)CC1CCCNCC1 Amb24363656 [1,0,0,1,0,0|2,0,0]=4 1707 B11R1.742 NC(=O)CC1CCCNCC1 Amb26473933 [1,0,0,1,0,0|2,0,0]=4 1708 B11R1.742 NC(=O)CC1CCCNCC1 Amb32663654 [1,0,0,1,0,0|2,0,0]=4 1709 B11R1.742 NC(=O)CN1CCCCCC1 Amb8326954 [1,0,0,1,0,0|2,0,0]=4 1710 B11R1.742 NC(=O)NC1CCCCCC1 Amb4008281 [1,0,0,1,0,0|2,0,0]=4 1711 B11R1.742 NC(=O)OC1CCCNCC1 Amb35723380 [1,0,0,1,0,0|2,0,0]=4 1712 B11R1.742 NC(=S)CC1CCCCCC1 Amb33267826 [1,0,0,1,0,0|1,1,0]=4 1713 B11R1.742 O=C(Cl)NC1CCCCCC1 Amb35637080 [1,0,0,1,0,0|2,0,0]=4 1714 B11R1.742 O=C(Cl)OC1CCCCCC1 Amb28365356 [1,0,0,1,0,0|1,0,0]=3 1715 B11R1.742 O=C(O)CC1CCCCCC1 Amb6749261 [1,0,0,1,0,0|1,0,0]=3 1716 B11R1.742 O=C(O)CC1CCCCCN1 Amb18199972 [1,0,0,1,0,0|2,0,0]=4 1717 B11R1.742 O=C(O)CC1CCCCCO1 Amb27823132 [1,0,0,1,0,0|2,0,0]=4 1718 B11R1.742 O=C(O)CC1CCCCNC1 Amb18199974 [1,0,0,1,0,0|2,0,0]=4 1719 B11R1.742 O=C(O)CC1CCCNCC1 Amb18199994 [1,0,0,1,0,0|2,0,0]=4 1720 B11R1.742 O=C(O)CC1CCCNCC1 Amb30584770 [1,0,0,1,0,0|2,0,0]=4 1721 B11R1.742 O=C(O)CC1CCCOCC1 Amb18199912 [1,0,0,1,0,0|2,0,0]=4 1722 B11R1.742 O=C(O)CC1CCCSCC1 Amb18197457 [1,0,0,1,0,0|2,0,0]=4 1723 B11R1.742 O=C(O)CN1CCCCCC1 Amb2536986 [1,0,0,1,0,0|2,0,0]=4 1724 B11R1.742 O=C(O)CN1CCCCCC1 Amb9677404 [1,0,0,1,0,0|2,0,0]=4 1725 B11R1.742 O=[N+]([O-])CC1CCCCCC1 Amb33267271 [1,0,0,1,0,0|2,0,0]=4 1726 B11R1.753 CCCCOC1CC1C(=O)O Amb9677555 [1,0,0,1,0,0|2,0,0]=4 1727 B11R1.944 CCC1CCCCCC1(C)O Amb35721138 [1,0,0,1,0,0|0,0,2]=4 1728 B11R1.4 BrCCCCCC1CCOC1 Amb32690149 [1,0,0,1,0,0|1,0,1]=4 1729 B11R1.4 CNCCCCC1CCCC1 Amb33448409 [1,0,0,1,0,0|2,0,0]=4 1730 B11R1.4 C\C=C\CCNC1CCCC1 Amb27988121 [1,0,0,1,0,0|2,0,0]=4 1731 B11R1.4 ClCCCCCC1CCOC1 Amb32690148 [1,0,0,1,0,0|1,0,1]=4 1732 B11R1.4 O=C=NCCCC1CCCC1 Amb26083705 [1,0,0,1,0,0|1,0,1]=4 1733 B11R1.4 O=CCCCCC1CCCC1 Amb33358714 [1,0,0,1,0,0|1,0,0]=3 1734 B11R1.4 O=CCCCCN1CCCC1 Amb33225870 [1,0,0,1,0,0|2,0,0]=4 1735 B11R1.4 O=CNCCCC1CCCN1 Amb27989289 [1,0,0,1,0,0|2,0,0]=4 1736 B11R1.4 O=CNCCCC1CCNC1 Amb27989293 [1,0,0,1,0,0|2,0,0]=4 1737 B11R1.4 O=CNCCCN1CCCC1 Amb28386791 [1,0,0,1,0,0|2,0,0]=4 1738 B11R1.4 O=CNCCOC1CCCC1 Amb27818501 [1,0,0,1,0,0|2,0,0]=4 1739 B11R1.4 O=C\C=C\CCC1CCCC1 Amb33374529 [1,0,0,1,0,0|1,0,1]=4 1740 B11R1.5 CCCC1CSCCNC1=O Amb28284783 [1,0,0,1,0,0|2,0,0]=4 1741 B11R1.5 CCCC1NCCCNC1=O Amb32719912 [1,0,0,1,0,0|2,0,0]=4 1742 B11R1.5 CCC[C@H]1NCCCNC1=O Amb32719924 [1,0,0,1,0,0|2,0,0]=4 1743 B11R1.5 CCOC1CCCCCC1Br Amb24418269 [1,0,0,1,0,0|1,0,1]=4 1744 B11R1.5 CCOC1CCCCCC1I Amb27590958 [1,0,0,1,0,0|1,0,1]=4 1745 B11R1.5 CCO[C@@H]1CCCCC[C@H]1N Amb33339088 [1,0,0,1,0,0|1,0,1]=4 1746 B11R1.5 COCC1CCCCNC1=O Amb25093894 [1,0,0,1,0,0|2,0,0]=4 1747 B11R1.5 CONC1CCCCCC1C Amb35726892 [1,0,0,1,0,0|2,0,0]=4 1748 B11R1.5 C[C@@H]1CCOCC[C@H]1OC=O Amb25257191 [1,0,0,1,0,0|1,0,0]=3 1749 B11R1.5 C\C=C\C1CCCCCC1O Amb33213699 [1,0,0,1,0,0|2,0,0]=4 1750 B11R1.5 C\C=C\[C@@H]1CCCCC[C@H]1O Amb32950402 [1,0,0,1,0,0|2,0,0]=4 1751 B11R1.5 NCCC1CCCCCC1=O Amb18200342 [1,0,0,1,0,0|2,0,0]=4 1752 B11R1.5 O=C1CCCCCC1CCO Amb27395084 [1,0,0,1,0,0|2,0,0]=4 1753 B11R1.5 O=C1NCCCCC1CCO Amb26456499 [1,0,0,1,0,0|2,0,0]=4 1754 B11R1.5 O=COC1CCCCCC1Cl Amb27444181 [1,0,0,1,0,0|1,0,0]=3 1755 B11R1.17 CC1CCCCC1OCC=O Amb18183071 [1,0,0,1,0,0|2,0,0]=4 1756 B11R1.17 CC1CCCCC1\C=C\C=O Amb24513220 [1,0,0,1,0,0|1,0,1]=4 1757 B11R1.17 CCCCC1CCCCC1=O Amb3940594 [1,0,0,1,0,0|1,0,0]=3 1758 B11R1.17 CCCCC1CCCCC1C Amb24484363 [1,0,0,1,0,0|1,0,1]=4 1759 B11R1.17 CCCCC1CCCNC1C Amb25989636 [1,0,0,1,0,0|1,0,1]=4 1760 B11R1.17 CCCCC1NCCNC1=O Amb18989085 [1,0,0,1,0,0|2,0,0]=4 1761 B11R1.17 CCNCC1CCCOC1C Amb28064514 [1,0,0,1,0,0|1,0,1]=4 1762 B11R1.17 CCOCC1CCCCC1=O Amb27399156 [1,0,0,1,0,0|2,0,0]=4 1763 B11R1.17 CCOCC1CCCCC1Cl Amb28289871 [1,0,0,1,0,0|1,0,1]=4 1764 B11R1.17 CCOCC1CCCCC1O Amb26996081 [1,0,0,1,0,0|1,0,1]=4 1765 B11R1.17 CCOC[C@@H]1CCCC[C@H]1O Amb26970539 [1,0,0,1,0,0|1,0,1]=4 1766 B11R1.17 CN1CCCCC1CCC=O Amb33322456 [1,0,0,1,0,0|2,0,0]=4 1767 B11R1.17 CNCCN1CCCOC1=O Amb18994355 [1,0,0,1,0,0|2,0,0]=4 1768 B11R1.17 COCCC1CCCNC1=O Amb28313285 [1,0,0,1,0,0|2,0,0]=4 1769 B11R1.17 COCC[C@H]1CCCCC1=O Amb27974073 [1,0,0,1,0,0|2,0,0]=4 1770 B11R1.17 CONCC1CCCCC1C Amb27406145 [1,0,0,1,0,0|2,0,0]=4 1771 B11R1.17 CSCCC1CCCNC1=O Amb27949745 [1,0,0,1,0,0|2,0,0]=4 1772 B11R1.17 C\C=C\CC1CCCCC1Cl Amb28118945 [1,0,0,1,0,0|2,0,0]=4 1773 B11R1.17 NCCCC1CCCCC1=O Amb18251486 [1,0,0,1,0,0|2,0,0]=4 1774 B11R1.17 NCCCC1CCCNC1=O Amb27863499 [1,0,0,1,0,0|2,0,0]=4 1775 B11R1.17 O=C1CCCCC1CCCO Amb27481191 [1,0,0,1,0,0|2,0,0]=4 1776 B11R1.17 O=C1NCCCC1CCCO Amb25978142 [1,0,0,1,0,0|2,0,0]=4 1777 B11R1.17 O=C1OCCCC1CCCI Amb27261546 [1,0,0,1,0,0|1,0,0]=3 1778 B11R1.17 O=C1OCCCN1CCCO Amb25130885 [1,0,0,1,0,0|2,0,0]=4 1779 B11R1.17 O=CCCC1CCCCC1O Amb27166081 [1,0,0,1,0,0|2,0,0]=4 1780 B11R1.17 O=CCCC1CCCOC1=O Amb28320351 [1,0,0,1,0,0|1,0,1]=4 1781 B11R1.18 CCCCC1CCCC1CC Amb27674064 [1,0,0,1,0,0|1,0,1]=4 1782 B11R1.18 CCCC[C@H]1OCC[C@@H]1C=O Amb24765269 [1,0,0,1,0,0|2,0,0]=4 1783 B11R1.18 CCCC[C@H]1OCC[C@H]1C=O Amb24765268 [1,0,0,1,0,0|2,0,0]=4 1784 B11R1.18 CCOCC1CCCC1CN Amb27670426 [1,0,0,1,0,0|1,0,1]=4 1785 B11R1.18 CCOCC1CCCC1NC Amb27987807 [1,0,0,1,0,0|1,0,1]=4 1786 B11R1.18 COC1CCCC1CCC=O Amb28079946 [1,0,0,1,0,0|2,0,0]=4 1787 B11R1.18 C\C=C\CN1CCCC1CC Amb27757138 [1,0,0,1,0,0|2,0,0]=4 1788 B11R1.26 CCC1CCCCCCC1=O Amb28284886 [1,0,0,1,0,0|1,0,0]=3 1789 B11R1.28 BrCCCCC1CCOCC1 Amb26651654 [1,0,0,1,0,0|1,0,1]=4 1790 B11R1.28 C=CCCCC1CCCCC1 Amb24117204 [1,0,0,1,0,0|1,0,1]=4 1791 B11R1.28 C=COCCN1CCCCC1 Amb17934202 [1,0,0,1,0,0|1,0,1]=4 1792 B11R1.28 CCCCCC1CCCCC1 Amb4035883 [1,0,0,1,0,0|1,0,1]=4 1793 B11R1.28 CCCCCC1CCCNC1 Amb22642855 [1,0,0,1,0,0|2,0,0]=4 1794 B11R1.28 CCCCCC1CCCNC1 Amb35745623 [1,0,0,1,0,0|2,0,0]=4 1795 B11R1.28 CCCCCC1CCNCC1 Amb3933573 [1,0,0,1,0,0|1,0,1]=4 1796 B11R1.28 CCCCCC1CCOCO1 Amb27673274 [1,0,0,1,0,0|0,0,2]=4 1797 B11R1.28 CCCCCN1CC=CCC1 Amb28352146 [1,0,0,1,0,0|2,0,0]=4 1798 B11R1.28 CCCCCN1CCOCC1 Amb10567809 [1,0,0,1,0,0|1,0,1]=4 1799 B11R1.28 CCCCNC1CCOCC1 Amb9472358 [1,0,0,1,0,0|1,0,1]=4 1800 B11R1.28 CCCNCC1CC=CCC1 Amb6719089 [1,0,0,1,0,0|2,0,0]=4 1801 B11R1.28 CCNCCC1CC=CCC1 Amb32753680 [1,0,0,1,0,0|2,0,0]=4 1802 B11R1.28 CCNCCC1CCCCC1 Amb8853691 [1,0,0,1,0,0|1,0,1]=4 1803 B11R1.28 CCNCCC1CCOCC1 Amb19025192 [1,0,0,1,0,0|1,0,1]=4 1804 B11R1.28 CCOCCC1CCCCN1 Amb17773408 [1,0,0,1,0,0|1,0,1]=4 1805 B11R1.28 CCOCCC1CCCNC1 Amb19020994 [1,0,0,1,0,0|1,0,1]=4 1806 B11R1.28 CCOCCC1CCNCC1 Amb7807278 [1,0,0,1,0,0|1,0,1]=4 1807 B11R1.28 CCOCCN1CCCCC1 Amb28256457 [1,0,0,1,0,0|1,0,1]=4 1808 B11R1.28 CCONCC1CCCCC1 Amb33546587 [1,0,0,1,0,0|1,0,1]=4 1809 B11R1.28 CNCCCC1CCCCC1 Amb8853671 [1,0,0,1,0,0|2,0,0]=4 1810 B11R1.28 CSCCCC1CCOCC1 Amb27271832 [1,0,0,1,0,0|1,0,1]=4 1811 B11R1.28 C[NH2+]CCCC1CCCCC1 Amb20648432 [1,0,0,1,0,0|2,0,0]=4 1812 B11R1.28 ClCCCCC1CCOCC1 Amb26076983 [1,0,0,1,0,0|1,0,1]=4 1813 B11R1.28 ClCOCCC1CCCCC1 Amb27990056 [1,0,0,1,0,0|1,0,1]=4 1814 B11R1.28 NCCCCC1CC=CCC1 Amb33375582 [1,0,0,1,0,0|2,0,0]=4 1815 B11R1.28 NCCCCC1CCOCC1 Amb26653417 [1,0,0,1,0,0|1,0,1]=4 1816 B11R1.28 O=C=NCCC1CCCCC1 Amb6272842 [1,0,0,1,0,0|1,0,1]=4 1817 B11R1.28 O=CCCCC1CCCCC1 Amb26998071 [1,0,0,1,0,0|1,0,0]=3 1818 B11R1.28 O=CCCCC1CCCCO1 Amb25385814 [1,0,0,1,0,0|2,0,0]=4 1819 B11R1.28 O=CCCCC1CCCOC1 Amb33323158 [1,0,0,1,0,0|2,0,0]=4 1820 B11R1.28 O=CCCCC1CCCSC1 Amb32726172 [1,0,0,1,0,0|2,0,0]=4 1821 B11R1.28 O=CCCCC1CCOCC1 Amb26076142 [1,0,0,1,0,0|2,0,0]=4 1822 B11R1.28 O=CNCCC1CCCCC1 Amb28293397 [1,0,0,1,0,0|1,0,0]=3 1823 B11R1.28 O=C\C=C\CC1CCCCC1 Amb33172261 [1,0,0,1,0,0|1,0,1]=4 1824 B11R1.28 OCCCCC1CCOCC1 Amb24750759 [1,0,0,1,0,0|1,0,1]=4 1825 B11R1.28 SCCCCC1CCOCC1 Amb27670740 [1,0,0,1,0,0|1,0,1]=4 1826 B11R1.41 C=COC1CCCCC1CC Amb27757966 [1,0,0,1,0,0|0,0,1]=3 1827 B11R1.41 CCC1CCCCC1N=C=O Amb28347996 [1,0,0,1,0,0|1,0,1]=4 1828 B11R1.41 CCC1CCCCC1NOC Amb27464264 [1,0,0,1,0,0|2,0,0]=4 1829 B11R1.41 CCC1CCCCC1OC=N Amb26009235 [1,0,0,1,0,0|1,0,0]=3 1830 B11R1.41 CCC1CCCCC1OCCl Amb27945645 [1,0,0,1,0,0|1,0,1]=4 1831 B11R1.41 CCC1CCCCN1CC=O Amb18799608 [1,0,0,1,0,0|2,0,0]=4 1832 B11R1.41 CCCC1CCCCN1C=O Amb24523123 [1,0,0,1,0,0|1,0,0]=3 1833 B11R1.41 CCCC1OCCCC1C=O Amb28132010 [1,0,0,1,0,0|2,0,0]=4 1834 B11R1.41 CCN1CCCCC1CC=O Amb27958566 [1,0,0,1,0,0|2,0,0]=4 1835 B11R1.41 CCSC1CCCCC1C=O Amb27431708 [1,0,0,1,0,0|2,0,0]=4 1836 B11R1.41 O=CN1CCCCC1CCCl Amb26642972 [1,0,0,1,0,0|2,0,0]=4 1837 B11R1.41 O=CNC1CCCCC1CO Amb27235336 [1,0,0,1,0,0|2,0,0]=4 1838 B11R1.51 CCC1CCCCCC1C=O Amb35725693 [1,0,0,1,0,0|1,0,0]=3 1839 B11R1.51 CCN1CCCCCC1C=O Amb28135545 [1,0,0,1,0,0|2,0,0]=4 1840 B11R1.51 COC1CCCCCN1C=O Amb27488557 [1,0,0,1,0,0|2,0,0]=4 1841 B11R1.51 O=CN1CCCCCC1CO Amb26932888 [1,0,0,1,0,0|2,0,0]=4 1842 B11R1.85 NC1CCCCCCNC1=O Amb27640572 [1,0,0,1,0,0|2,0,0]=4 1843 B11R1.92 C1CCCCCCCCCC1 Amb25060085 [1,0,0,1,0,0|1,0,1]=4 1844 B11R1.92 C1CCCCCNCCCC1 Amb27462141 [1,0,0,1,0,0|1,0,1]=4 1845 B11R1.109 CCCC1COCC1NC=O Amb35617215 [1,0,0,1,0,0|2,0,0]=4 1846 B11R1.117 Br\C=C\C1CCCCCCC1 Amb33135178 [1,0,0,1,0,0|2,0,0]=4 1847 B11R1.117 CCNC1CCCCCCC1 Amb6279427 [1,0,0,1,0,0|1,0,1]=4 1848 B11R1.117 CNCC1CCCCCCC1 Amb19149347 [1,0,0,1,0,0|2,0,0]=4 1849 B11R1.117 O=C=NC1CCCCCCC1 Amb22362664 [1,0,0,1,0,0|1,0,1]=4 1850 B11R1.180 CC1CCCC1CCN=C=O Amb27964358 [1,0,0,1,0,0|1,0,1]=4 1851 B11R1.180 CC1OCCC1CCCC=O Amb33426812 [1,0,0,1,0,0|2,0,0]=4 1852 B11R1.180 CC1OCCC1CCCCN Amb33426821 [1,0,0,1,0,0|1,0,1]=4 1853 B11R1.180 CCCCCC1CC=CC1=O Amb17843926 [1,0,0,1,0,0|1,0,1]=4 1854 B11R1.180 CCCCCC1CCCC1=O Amb534714 [1,0,0,1,0,0|1,0,0]=3 1855 B11R1.180 CCCCCC1CCCN1C Amb27272323 [1,0,0,1,0,0|2,0,0]=4 1856 B11R1.180 CCCCCC1COCC1=O Amb27672690 [1,0,0,1,0,0|2,0,0]=4 1857 B11R1.180 CCCCCN1CCCC1=O Amb20621968 [1,0,0,1,0,0|2,0,0]=4 1858 B11R1.180 CCCCCN1CCNC1=O Amb28386660 [1,0,0,1,0,0|2,0,0]=4 1859 B11R1.180 CCCCNC1CCOC1C Amb26650564 [1,0,0,1,0,0|1,0,1]=4 1860 B11R1.180 CCCCN[C@@H]1CCO[C@@H]1C Amb28387895 [1,0,0,1,0,0|1,0,1]=4 1861 B11R1.180 CCCC\C=C1\CCOC1=O Amb25947841 [1,0,0,1,0,0|0,0,2]=4 1862 B11R1.180 CCCNCC1CCOC1C Amb27818693 [1,0,0,1,0,0|1,0,1]=4 1863 B11R1.180 CCCOCC1CCCC1=O Amb27987801 [1,0,0,1,0,0|2,0,0]=4 1864 B11R1.180 CCNCCC1CCNC1=O Amb27674171 [1,0,0,1,0,0|2,0,0]=4 1865 B11R1.180 CCNCCN1CCOC1=O Amb19026699 [1,0,0,1,0,0|2,0,0]=4 1866 B11R1.180 CCOCCC1CCCC1Br Amb27269149 [1,0,0,1,0,0|1,0,1]=4 1867 B11R1.180 CCOCCC1CCCC1O Amb18183285 [1,0,0,1,0,0|1,0,1]=4 1868 B11R1.180 CCSCCC1CCCC1=O Amb27269774 [1,0,0,1,0,0|2,0,0]=4 1869 B11R1.180 CN1CCCC1CCCC=O Amb33320340 [1,0,0,1,0,0|2,0,0]=4 1870 B11R1.180 CN1CCCC1CCNC=O Amb35682237 [1,0,0,1,0,0|2,0,0]=4 1871 B11R1.180 CNCCSC1CCOC1=O Amb27674014 [1,0,0,1,0,0|2,0,0]=4 1872 B11R1.180 CSCCNC1CCOC1=O Amb27271810 [1,0,0,1,0,0|2,0,0]=4 1873 B11R1.180 CSCCN[C@H]1CCOC1=O Amb27987317 [1,0,0,1,0,0|2,0,0]=4 1874 B11R1.180 NCCCSC1CCOC1=O Amb27271115 [1,0,0,1,0,0|2,0,0]=4 1875 B11R1.180 O=C1CCCC1CCCCBr Amb27672177 [1,0,0,1,0,0|2,0,0]=4 1876 B11R1.180 O=C1CCCC1CCCCF Amb27267015 [1,0,0,1,0,0|2,0,0]=4 1877 B11R1.180 O=C1CCCC1CCCCO Amb27986534 [1,0,0,1,0,0|2,0,0]=4 1878 B11R1.180 O=C1OCCC1CCCCO Amb27989920 [1,0,0,1,0,0|1,0,0]=3 1879 B11R1.180 O=C1OCCC1NCCCF Amb27271858 [1,0,0,1,0,0|2,0,0]=4 1880 B11R1.180 O=C1OCCN1CCCCBr Amb8855382 [1,0,0,1,0,0|2,0,0]=4 1881 B11R1.180 O=C1OCCN1CCCCCl Amb18804714 [1,0,0,1,0,0|2,0,0]=4 1882 B11R1.180 O=C1OCC[C@@H]1SCCCO Amb27989703 [1,0,0,1,0,0|2,0,0]=4 1883 B11R1.180 O=CCCCC1CCOC1=O Amb27673678 [1,0,0,1,0,0|1,0,1]=4 1884 B11R1.203 C=CCCC1CCCCCC1 Amb29865043 [1,0,0,1,0,0|1,0,1]=4 1885 B11R1.203 CCCCC1CCCNCC1 Amb27982191 [1,0,0,1,0,0|1,0,1]=4 1886 B11R1.203 CNCCC1CCCCCC1 Amb26457524 [1,0,0,1,0,0|2,0,0]=4 1887 B11R1.203 ClCOCC1CCCCCC1 Amb28118315 [1,0,0,1,0,0|1,0,1]=4 1888 B11R1.203 O=C=NCC1CCCCCC1 Amb27847742 [1,0,0,1,0,0|1,0,1]=4 1889 B11R1.203 O=CCCC1CCCCCC1 Amb26946978 [1,0,0,1,0,0|1,0,0]=3 1890 B11R1.203 O=CCOC1CCCCCC1 Amb18183074 [1,0,0,1,0,0|2,0,0]=4 1891 B11R1.203 O=CNCC1CCCCCC1 Amb28193191 [1,0,0,1,0,0|1,0,0]=3 1892 B11R1.203 O=CNCC1CCCSCC1 Amb35637603 [1,0,0,1,0,0|2,0,0]=4 1893 B11R1.203 O=C\C=C\C1CCCCCC1 Amb33079648 [1,0,0,1,0,0|1,0,1]=4 1894 B11R1.248 O=CC1=CCCCCCCC1 Amb25172766 [1,0,0,1,0,0|1,0,1]=4 1895 B11R1.248 O=CC1CCCCCCCC1 Amb27215402 [1,0,0,1,0,0|1,0,0]=3 1896 B11R1.248 O=NN1CCCCCCCC1 Amb27605593 [1,0,0,1,0,0|2,0,0]=4 1897 B13R1.55 CCCCCC1CC(=O)C=C(C)C1 Amb20621710 [0,1,0,1,0,0|1,0,1]=4 1898 B13R1.55 CCCCCC1CC(=O)C=C(O)C1 Amb21962886 [0,1,0,1,0,0|1,0,1]=4 1899 B13R1.88 CCC1CCCCC1(N)CC(=O)O Amb24415698 [0,1,0,1,0,0|2,0,0]=4 1900 B13R1.88 CCC1CCCCC1(N)CC(N)=O Amb32787664 [0,1,0,1,0,0|2,0,0]=4 1901 B13R1.190 CCCCCCC1CC(=O)OC1=O Amb33756887 [0,1,0,1,0,0|0,0,1]=3 1902 B13R1.190 CCCCCCC1OC(=O)CC1C Amb22001856 [0,1,0,1,0,0|2,0,0]=4 1903 B13R1.201 C=C(C)CC(N)C1CCCCC1C Amb27859270 [0,1,0,1,0,0|2,0,0]=4 1904 B13R1.201 CC(=O)CC(C)N1CCCCC1C Amb28243499 [0,1,0,1,0,0|2,0,0]=4 1905 B13R1.201 CC(=O)CC(O)C1CCCCC1C Amb27764836 [0,1,0,1,0,0|1,0,0]=3 1906 B13R1.201 CC1CCCCC1C(N)CC(=O)O Amb27983852 [0,1,0,1,0,0|2,0,0]=4 1907 B13R1.201 CC1CCCCC1C(N)CC(N)=O Amb26547592 [0,1,0,1,0,0|2,0,0]=4 1908 B13R1.201 CC1CCCCC1[C@@H](N)CC(=O)O Amb26537480 [0,1,0,1,0,0|2,0,0]=4 1909 B13R1.201 CC1CCCCC1[C@@H](N)CC(N)=O Amb28193965 [0,1,0,1,0,0|2,0,0]=4 1910 B13R1.201 CC1CCCCC1[C@H](N)CC(=O)O Amb26451779 [0,1,0,1,0,0|2,0,0]=4 1911 B13R1.201 CC1CCCCC1[C@H](N)CC(N)=O Amb26537449 [0,1,0,1,0,0|2,0,0]=4 1912 B13R1.289 CC1CCCCCCCCC(=O)N1 Amb28365005 [0,1,0,1,0,0|1,0,0]=3 1913 B13R1.348 CC(=N)NC(C)CC1CCCCC1 Amb35742560 [0,1,0,1,0,0|2,0,0]=4 1914 B13R1.348 CC(=O)CC(C)SC1CCCCC1 Amb32670934 [0,1,0,1,0,0|2,0,0]=4 1915 B13R1.348 CC(=O)NC(C)CC1CCCCC1 Amb27408553 [0,1,0,1,0,0|1,0,0]=3 1916 B13R1.348 CC(=O)NC(C)CC1CCCCN1 Amb29889185 [0,1,0,1,0,0|2,0,0]=4 1917 B13R1.348 CC(=O)\C=C(\C)CC1CCCCC1 Amb35683550 [0,1,0,1,0,0|1,0,1]=4 1918 B13R1.348 CC(C)=CC(O)CC1CCCCC1 Amb27609281 [0,1,0,1,0,0|2,0,0]=4 1919 B13R1.348 CC(CC(=O)O)CC1CCCCC1 Amb32953558 [0,1,0,1,0,0|2,0,0]=4 1920 B13R1.348 CC(CC1CCCCC1)NC(=O)Cl Amb35633523 [0,1,0,1,0,0|2,0,0]=4 1921 B13R1.348 CC(CC1CCCCC1)NC(N)=O Amb35742464 [0,1,0,1,0,0|2,0,0]=4 1922 B13R1.348 C[C@@H](CC1CCCCC1)NC(N)=O Amb28350849 [0,1,0,1,0,0|2,0,0]=4 1923 B13R1.348 NC(=O)CC(N)CC1CCCCC1 Amb33255910 [0,1,0,1,0,0|2,0,0]=4 1924 B13R1.348 NC(CC(=O)O)CC1CCCCC1 Amb18822383 [0,1,0,1,0,0|2,0,0]=4 1925 B13R1.348 N[C@@H](CC(=O)O)CC1CCCCC1 Amb32757665 [0,1,0,1,0,0|2,0,0]=4 1926 B13R1.348 N[C@@H](CC(=O)O)CC1CCCCC1 Amb33038389 [0,1,0,1,0,0|2,0,0]=4 1927 B13R1.348 N[C@H](CC(=O)O)CC1CCCCC1 Amb33456114 [0,1,0,1,0,0|2,0,0]=4 1928 B13R1.348 N[C@H](CC(=O)O)CC1CCCCC1 Amb33457558 [0,1,0,1,0,0|2,0,0]=4 1929 B13R1.348 O=C(O)CC(O)CC1CCCCC1 Amb33474067 [0,1,0,1,0,0|2,0,0]=4 1930 B13R1.348 O=C(O)C[C@@H](O)CC1CCCCC1 Amb33429766 [0,1,0,1,0,0|2,0,0]=4 1931 B13R1.348 O=C(O)C[C@H](O)CC1CCCCC1 Amb33224869 [0,1,0,1,0,0|2,0,0]=4 1932 B13R1.373 CCCN1CCCC(NC(C)=O)C1 Amb26607171 [0,1,0,1,0,0|2,0,0]=4 1933 B13R1.373 CCCN1CCCC(OC(=O)Cl)C1 Amb33297305 [0,1,0,1,0,0|2,0,0]=4 1934 B13R1.373 CCOC1CCCC(OC(=O)Cl)C1 Amb33297242 [0,1,0,1,0,0|2,0,0]=4 1935 B13R1.373 CCSC1CCCC(NC(C)=O)C1 Amb28067445 [0,1,0,1,0,0|2,0,0]=4 1936 B13R1.593 CC(CCC1CCCC1)CC(=O)O Amb33172403 [0,1,0,1,0,0|2,0,0]=4 1937 B13R1.593 NC(CCC1CCCC1)CC(=O)O Amb33481442 [0,1,0,1,0,0|2,0,0]=4 1938 B13R1.593 O=C(O)CC(O)CCC1CCCC1 Amb33374559 [0,1,0,1,0,0|2,0,0]=4 1939 B13R1.593 O=C(O)C[C@@H](O)CCC1CCCC1 Amb33374558 [0,1,0,1,0,0|2,0,0]=4 1940 B13R1.593 O=C(O)C[C@H](O)CCC1CCCC1 Amb33481206 [0,1,0,1,0,0|2,0,0]=4 1941 B13R1.775 C[C@H]1CCCCC[C@H](O)CC(=O)O1 Amb27467919 [0,1,0,1,0,0|1,0,0]=3 1942 B13R1.1107 CC(=O)CN1CCCCCCCC1 Amb27596192 [0,1,0,1,0,0|1,0,0]=3 1943 B13R1.1107 NC(=O)CN1CCCCCCCC1 Amb28254750 [0,1,0,1,0,0|2,0,0]=4 1944 B13R1.2020 C=C(C)CC1(N)CCCCCCC1 Amb30030521 [0,1,0,1,0,0|2,0,0]=4 1945 B13R1.2020 CC(=O)CC1(O)CCCCCCC1 Amb32943767 [0,1,0,1,0,0|1,0,0]=3 1946 B13R1.2020 NC(=O)CC1(N)CCCCCCC1 Amb32787700 [0,1,0,1,0,0|2,0,0]=4 1947 B13R1.2020 NC1(CC(=O)O)CCCCCCC1 Amb22641941 [0,1,0,1,0,0|2,0,0]=4 1948 B13R1.2020 NC1(CC(=O)O)CCCCCCC1 Amb31307619 [0,1,0,1,0,0|2,0,0]=4 1949 B13R1.3765 CC(C)=CC1(O)CCCCCC1C Amb35717678 [0,1,0,1,0,0|2,0,0]=4 1950 B13R1.3765 CC1CCCCCC1(N)CC(=O)O Amb33255481 [0,1,0,1,0,0|2,0,0]=4 1951 B13R1.3765 CC1CCCCCC1(N)CC(N)=O Amb33255409 [0,1,0,1,0,0|2,0,0]=4 1952 B13R1.3765 CC1CCCCCC1(O)CC(=O)O Amb35718034 [0,1,0,1,0,0|2,0,0]=4 1953 B13R1.7456 CC(=O)CC(O)C1CCCCCC1 Amb27980460 [0,1,0,1,0,0|1,0,0]=3 1954 B13R1.7456 CC(=O)N[C@@H](C)C1CCCCCC1 Amb27609226 [0,1,0,1,0,0|1,0,0]=3 1955 B13R1.7456 CC(=O)OC(C)C1CCCCCC1 Amb27833463 [0,1,0,1,0,0|0,0,0]=2 1956 B13R1.7456 CC(C)=CC(O)C1CCCCCC1 Amb27606198 [0,1,0,1,0,0|2,0,0]=4 1957 B13R1.7456 CC(CC(=O)O)C1CCCCCC1 Amb18191560 [0,1,0,1,0,0|2,0,0]=4 1958 B13R1.7456 NC(=O)CC(N)C1CCCCCC1 Amb25851902 [0,1,0,1,0,0|2,0,0]=4 1959 B13R1.7456 NC(=O)C[C@@H](N)C1CCCCCC1 Amb24629675 [0,1,0,1,0,0|2,0,0]=4 1960 B13R1.7456 NC(=O)C[C@H](N)C1CCCCCC1 Amb24377514 [0,1,0,1,0,0|2,0,0]=4 1961 B13R1.7456 NC(CC(=O)O)C1CCCCCC1 Amb28243685 [0,1,0,1,0,0|2,0,0]=4 1962 B13R1.7456 NC(CC(=O)O)C1CCCCCC1 Amb33184712 [0,1,0,1,0,0|2,0,0]=4 1963 B13R1.7456 N[C@@H](CC(=O)O)C1CCCCCC1 Amb26037948 [0,1,0,1,0,0|2,0,0]=4 1964 B13R1.7456 N[C@H](CC(=O)O)C1CCCCCC1 Amb25266526 [0,1,0,1,0,0|2,0,0]=4 1965 B13R1.7456 O=C(O)CC(O)C1CCCCCC1 Amb33171812 [0,1,0,1,0,0|2,0,0]=4 1966 B13R1.7456 O=C(O)C[C@@H](O)C1CCCCCC1 Amb33267304 [0,1,0,1,0,0|2,0,0]=4 1967 B13R1.7456 O=C(O)C[C@H](O)C1CCCCCC1 Amb33267305 [0,1,0,1,0,0|2,0,0]=4 1968 B13R1.128 CC1CCC(CCCCC(=O)O)C1 Amb33229248 [0,1,0,1,0,0|2,0,0]=4 1969 B13R1.158 CC(=O)NCCC1CCCCC1=O Amb28287293 [0,1,0,1,0,0|1,0,1]=4 1970 B13R1.158 CC(=O)NCCC1CCCCC1O Amb33229060 [0,1,0,1,0,0|1,0,0]=3 1971 B13R1.158 CC(=O)NCCC1NCCCC1C Amb35731467 [0,1,0,1,0,0|1,0,0]=3 1972 B13R1.158 CC(=O)NCCN1CCCCC1C Amb27605089 [0,1,0,1,0,0|1,0,0]=3 1973 B13R1.158 CC(C)=CCCC1CCCCC1Br Amb35618152 [0,1,0,1,0,0|2,0,0]=4 1974 B13R1.158 CC(C)=CCCC1CCCCC1Cl Amb35618151 [0,1,0,1,0,0|2,0,0]=4 1975 B13R1.158 CC(C)=CCCC1CCCCC1N Amb35744196 [0,1,0,1,0,0|2,0,0]=4 1976 B13R1.158 CC(C)=CCCC1CCCCC1O Amb32950880 [0,1,0,1,0,0|2,0,0]=4 1977 B13R1.158 CC(C)=CCC[C@@H]1CCCC[C@H]1O Amb33213211 [0,1,0,1,0,0|2,0,0]=4 1978 B13R1.158 CC1CCCCC1NCCC(=O)O Amb7755666 [0,1,0,1,0,0|2,0,0]=4 1979 B13R1.158 CC1CCCCN1CCCC(=O)O Amb5761440 [0,1,0,1,0,0|2,0,0]=4 1980 B13R1.158 CC1CCCNC1CCNC(N)=O Amb35716590 [0,1,0,1,0,0|2,0,0]=4 1981 B13R1.158 CN1CCCCC1CCCC(=O)O Amb33322459 [0,1,0,1,0,0|2,0,0]=4 1982 B13R1.158 CN1CCCCC1COCC(=O)O Amb8010336 [0,1,0,1,0,0|2,0,0]=4 1983 B13R1.337 CC(=O)CCCCN1CCOCC1 Amb9659035 [0,1,0,1,0,0|2,0,0]=4 1984 B13R1.337 CC(=O)NCCCN1CCNCC1 Amb9302151 [0,1,0,1,0,0|2,0,0]=4 1985 B13R1.337 CC(=O)NCCNC1CCSCC1 Amb32652295 [0,1,0,1,0,0|2,0,0]=4 1986 B13R1.337 CC(=O)NCCNC1CCSCC1 Amb9249001 [0,1,0,1,0,0|2,0,0]=4 1987 B13R1.337 CC(=O)N\N=C\CC1CCCCC1 Amb27256191 [0,1,0,1,0,0|1,0,1]=4 1988 B13R1.337 CC(=O)OCC#CC1CCCCC1 Amb27953899 [0,1,0,1,0,0|0,0,1]=3 1989 B13R1.337 NC(=O)CNCCC1CCCCC1 Amb13952496 [0,1,0,1,0,0|2,0,0]=4 1990 B13R1.337 O=C(O)C#CCCC1CCCCC1 Amb27947677 [0,1,0,1,0,0|2,0,0]=4 1991 B13R1.337 O=C(O)CCCCC1CCCCC1 Amb22336378 [0,1,0,1,0,0|2,0,0]=4 1992 B13R1.337 O=C(O)CCCCC1CCCCN1 Amb32430376 [0,1,0,1,0,0|2,0,0]=4 1993 B13R1.337 O=C(O)CCCCC1CCCOC1 Amb33229244 [0,1,0,1,0,0|2,0,0]=4 1994 B13R1.337 O=C(O)CCCCC1CCOCC1 Amb33229243 [0,1,0,1,0,0|2,0,0]=4 1995 B13R1.337 O=C(O)CCCCN1CCCCC1 Amb19373622 [0,1,0,1,0,0|2,0,0]=4 1996 B13R1.337 O=C(O)CCCSC1CCCCC1 Amb32411477 [0,1,0,1,0,0|2,0,0]=4 1997 B13R1.337 O=C(O)CCNCC1CCCCC1 Amb8830821 [0,1,0,1,0,0|2,0,0]=4 1998 B13R1.337 O=C(O)CCSCC1CCCCC1 Amb6260195 [0,1,0,1,0,0|2,0,0]=4 1999 B13R1.337 O=C(O)COCCC1CCCCN1 Amb18628209 [0,1,0,1,0,0|2,0,0]=4 2000 B13R1.337 O=C(O)COCCN1CCCCC1 Amb33620646 [0,1,0,1,0,0|2,0,0]=4 2001 B13R1.337 O=C(O)COCCN1CCCCC1 Amb33732301 [0,1,0,1,0,0|2,0,0]=4 2002 B13R1.337 O=C(O)\C=C\CCC1CCCCC1 Amb33470091 [0,1,0,1,0,0|2,0,0]=4 2003 B13R1.568 CCCCC1CCCC(C(=O)O)N1 Amb33500856 [0,1,0,1,0,0|2,0,0]=4 2004 B13R1.568 CCNCC1CCCN(C(C)=O)C1 Amb21860341 [0,1,0,1,0,0|2,0,0]=4 2005 B13R1.893 C=C(C)CCC1CC(N)CCC1C Amb32866201 [0,1,0,1,0,0|2,0,0]=4 2006 B13R1.893 CC(=O)CCN1CC(C)CCC1C Amb28347655 [0,1,0,1,0,0|2,0,0]=4 2007 B13R1.893 CC(=O)CC[C@@H]1C[C@H](O)OC[C@@H]1C Amb27651755 [0,1,0,1,0,0|2,0,0]=4 2008 B13R1.893 CC(=O)OCC1CC(C)CCC1C Amb25980821 [0,1,0,1,0,0|0,0,0]=2 2009 B13R1.893 CC(=O)OCC1CC(O)CCN1C Amb27255212 [0,1,0,1,0,0|1,0,0]=3 2010 B13R1.893 CC(C)OCC1CC(Br)CCC1C Amb32865999 [0,1,0,1,0,0|1,0,1]=4 2011 B13R1.893 CC(C)OCC1CC(Cl)CCC1C Amb32865776 [0,1,0,1,0,0|1,0,1]=4 2012 B13R1.893 CC(C)OCC1CC(N)CCC1C Amb32866241 [0,1,0,1,0,0|1,0,1]=4 2013 B13R1.3501 C=C(C)CCC1CCCCC(Br)C1 Amb28457143 [0,1,0,1,0,0|2,0,0]=4 2014 B13R1.3501 C=C(C)CCC1CCCCC(N)C1 Amb27754899 [0,1,0,1,0,0|2,0,0]=4 2015 B13R1.3501 C=C(C)CCC1CCCCC(O)C1 Amb28457142 [0,1,0,1,0,0|2,0,0]=4 2016 B13R1.3501 CC(=O)CCN1CCCCC(C)C1 Amb27188266 [0,1,0,1,0,0|2,0,0]=4 2017 B13R1.3501 CC(=O)OCC1CCCCC(=O)N1 Amb28319892 [0,1,0,1,0,0|1,0,1]=4 2018 B13R1.3501 CC(C)OCC1CCCCC(=O)C1 Amb27756608 [0,1,0,1,0,0|2,0,0]=4 2019 B13R1.3501 CC(C)OCC1CCCCC(Br)C1 Amb27787633 [0,1,0,1,0,0|1,0,1]=4 2020 B13R1.3501 CC(F)CCN1CCCNC(=O)C1 Amb27220031 [0,1,0,1,0,0|2,0,0]=4 2021 B13R1.3501 CC(N)CSC1CCCNC(=O)C1 Amb27771968 [0,1,0,1,0,0|2,0,0]=4 2022 B13R1.3501 CS(=O)CCC1CCCCC(Br)C1 Amb27874528 [0,1,0,1,0,0|2,0,0]=4 2023 B13R1.3710 CC(=O)OC1C=CC(Cl)CCCC1 Amb27771742 [0,1,0,1,0,0|0,0,2]=4 2024 B13R1.3710 CC(=O)OC1CCCCC(Cl)CC1 Amb27401165 [0,1,0,1,0,0|0,0,0]=2 2025 B13R1.3710 CC(=O)O[C@@H]1C=C[C@H](O)CCCC1 Amb28435711 [0,1,0,1,0,0|0,0,2]=4 2026 B13R1.3710 CC(=O)O[C@H]1C=C[C@@H](Cl)CCCC1 Amb27442992 [0,1,0,1,0,0|0,0,2]=4 2027 B13R1.3710 CC(=O)O[C@H]1C=C[C@@H](O)CCCC1 Amb28206077 [0,1,0,1,0,0|0,0,2]=4 2028 B13R1.3803 O=C1CCC=CCC(O)CCCO1 Amb27457854 [0,1,0,1,0,0|0,0,2]=4 2029 B13R1.3803 O=C1CCCCCC(O)CCCO1 Amb28205496 [0,1,0,1,0,0|0,0,0]=2 2030 B13R1.4012 CC(=O)N1CCCC(C)C1CCBr Amb29854782 [0,1,0,1,0,0|2,0,0]=4 2031 B13R1.4012 CC(=O)N1CCCC(C)C1CCCl Amb35677649 [0,1,0,1,0,0|2,0,0]=4 2032 B13R1.4012 CC(=O)N1CCCC(C)C1CCN Amb35689086 [0,1,0,1,0,0|2,0,0]=4 2033 B13R1.4012 CC(=O)N1CCCC(C)C1CCO Amb35712851 [0,1,0,1,0,0|2,0,0]=4 2034 B13R1.4012 CCCC1C(C)CCCN1C(=O)Cl Amb32864031 [0,1,0,1,0,0|2,0,0]=4 2035 B13R1.4012 CCCC1C(C)CCCN1C(N)=O Amb28078573 [0,1,0,1,0,0|2,0,0]=4 2036 B13R1.157 CC1CCCCC1CNS(C)(=N)=O Amb35680539 [0,1,0,1,0,0|2,0,0]=4 2037 B13R1.281 CC1CCCCCC1NS(C)(=N)=O Amb35710944 [0,1,0,1,0,0|2,0,0]=4 2038 B13R1.281 CC1CCCCCC1OS(C)(=O)=O Amb35725710 [0,1,0,1,0,0|1,0,0]=3 2039 B13R1.381 CCCC1CCCCN1S(C)(=N)=O Amb35695687 [0,1,0,1,0,0|2,0,0]=4 2040 B13R1.612 CCC1CCCCCN1S(C)(=N)=O Amb30012945 [0,1,0,1,0,0|2,0,0]=4 2041 B13R1.622 CCC1CCCCC1NS(C)(=N)=O Amb30019696 [0,1,0,1,0,0|2,0,0]=4 2042 B13R1.622 CCC1CCCCC1NS(C)(=O)=O Amb14015232 [0,1,0,1,0,0|2,0,0]=4 2043 B13R1.622 CCC1CCCCC1O[Si](C)(C)C Amb26444576 [0,1,0,1,0,0|1,1,0]=4 2044 B13R1.3523 CS(=O)(=O)OCCC1CCCCO1 Amb26014335 [0,1,0,1,0,0|2,0,0]=4 2045 B13R1.3523 CS(=O)(=O)OCCC1CCOCC1 Amb27391132 [0,1,0,1,0,0|2,0,0]=4 2046 B13R1.3523 CS(=O)(=O)OCCN1CCCCC1 Amb27961262 [0,1,0,1,0,0|2,0,0]=4 2047 B13R1.3523 NS(=O)(=O)OCCC1CCCCC1 Amb33054763 [0,1,0,1,0,0|2,0,0]=4 2048 B13R1.6264 CS(=N)(=O)N1CCCCCCCC1 Amb29851879 [0,1,0,1,0,0|2,0,0]=4 2049 B13R1.6268 CS(=N)(=O)NCC1CCCCCC1 Amb35715450 [0,1,0,1,0,0|2,0,0]=4 2050 B13R1.6268 CS(=O)(=O)OCC1CCCCCC1 Amb25070926 [0,1,0,1,0,0|1,0,0]=3 2051 B13R1.6268 NS(=O)(=O)OCC1CCCCCC1 Amb33484903 [0,1,0,1,0,0|2,0,0]=4 2052 B13R1.6279 CS(=N)(=O)NC1CCCCCCC1 Amb35715272 [0,1,0,1,0,0|2,0,0]=4 2053 B13R1.6279 CS(=O)(=O)NC1CCCCCCC1 Amb6564669 [0,1,0,1,0,0|2,0,0]=4 2054 B13R1.150 CC(=O)CCN1CCCC(O)C1C Amb27211602 [0,1,0,1,0,0|2,0,0]=4 2055 B13R1.150 CC(=O)NCC1CCCC(C)C1C Amb27665155 [0,1,0,1,0,0|1,0,0]=3 2056 B13R1.150 CC1CCCC(CNC(N)=O)C1C Amb27804816 [0,1,0,1,0,0|2,0,0]=4 2057 B13R1.513 CC(=O)NCCC1CCC(C)CN1 Amb35725528 [0,1,0,1,0,0|2,0,0]=4 2058 B13R1.513 CC(=O)NCCC1CCN(C)CC1 Amb26853502 [0,1,0,1,0,0|2,0,0]=4 2059 B13R1.513 CC(=O)NCCN1CCC(Br)CC1 Amb27956142 [0,1,0,1,0,0|2,0,0]=4 2060 B13R1.513 CC(=O)NCCN1CCC(Cl)CC1 Amb27875421 [0,1,0,1,0,0|2,0,0]=4 2061 B13R1.513 CC(=O)NCCN1CCC(N)CC1 Amb9419292 [0,1,0,1,0,0|2,0,0]=4 2062 B13R1.513 CC(=O)NCCN1CCC(O)CC1 Amb19075789 [0,1,0,1,0,0|2,0,0]=4 2063 B13R1.513 CC(=O)NOCC1CCC(C)CC1 Amb27652393 [0,1,0,1,0,0|2,0,0]=4 2064 B13R1.513 CC(C)=CCCC1CCC(C)CC1 Amb35587690 [0,1,0,1,0,0|2,0,0]=4 2065 B13R1.513 CC1CCC(CCCC(=O)O)CC1 Amb33449764 [0,1,0,1,0,0|2,0,0]=4 2066 B13R1.513 CC1CCC(CCNC(=O)Cl)CC1 Amb35633386 [0,1,0,1,0,0|2,0,0]=4 2067 B13R1.513 CC1CCC(CCNC(N)=O)CC1 Amb27970374 [0,1,0,1,0,0|2,0,0]=4 2068 B13R1.547 CC(=O)N1CCCCC1C(C)CBr Amb29854448 [0,1,0,1,0,0|2,0,0]=4 2069 B13R1.547 CC(=O)N1CCCCC1C(C)CCl Amb35610878 [0,1,0,1,0,0|2,0,0]=4 2070 B13R1.547 CC(=O)N1CCCCC1C(C)CN Amb35610846 [0,1,0,1,0,0|2,0,0]=4 2071 B13R1.547 CC(=O)N1CCCCC1C(C)CO Amb29854550 [0,1,0,1,0,0|2,0,0]=4 2072 B13R1.547 CC(=O)N1CCCCC1C(O)CN Amb25743487 [0,1,0,1,0,0|2,0,0]=4 2073 B13R1.547 CCC(=O)C1CCCCN1C(C)=O Amb24576797 [0,1,0,1,0,0|1,0,1]=4 2074 B13R1.547 CCC(C)C1CCCCN1C(=O)Cl Amb32863978 [0,1,0,1,0,0|2,0,0]=4 2075 B13R1.643 CC(=O)NCC1CCCC(CN)C1 Amb28397115 [0,1,0,1,0,0|2,0,0]=4 2076 B13R1.643 CC(=O)NC[C@H]1CCC[C@@H](CO)C1 Amb27980230 [0,1,0,1,0,0|2,0,0]=4 2077 B13R1.643 CCN1CCCC(CNC(C)=O)C1 Amb27752705 [0,1,0,1,0,0|2,0,0]=4 2078 B13R1.1868 C=C(CC)CC1CCCCC(=O)C1 Amb27852319 [0,1,0,1,0,0|1,0,1]=4 2079 B13R1.1868 CCC(F)CN1CCCNC(=O)C1 Amb27775374 [0,1,0,1,0,0|2,0,0]=4 2080 B13R1.3118 CS[C@]1(C)CCCC[C@H]1NC(C)=O Amb28052663 [0,1,0,1,0,0|2,0,0]=4 2081 B13R1.7544 CC(=O)NCCN1CCC(C)C1C Amb27651503 [0,1,0,1,0,0|2,0,0]=4 2082 B13R1.7544 CC(=O)NCCN1CCC(N)C1C Amb27835213 [0,1,0,1,0,0|2,0,0]=4 2083 B13R1.7544 CC(C)=CCCC1CCC(Br)C1C Amb35744299 [0,1,0,1,0,0|2,0,0]=4 2084 B13R1.7544 CC(C)=CCCC1CCC(Cl)C1C Amb35744304 [0,1,0,1,0,0|2,0,0]=4 2085 B13R1.7544 CC(C)=CCCC1CCC(N)C1C Amb35738219 [0,1,0,1,0,0|2,0,0]=4 2086 B13R1.7544 CC(C)=CCCC1CCC(O)C1C Amb35738242 [0,1,0,1,0,0|2,0,0]=4 2087 B13R1.149 CC(=N)NCCC1CCCC(C)C1 Amb28410701 [0,1,0,1,0,0|2,0,0]=4 2088 B13R1.149 CC(=O)NCCC1CCOC(C)C1 Amb27660684 [0,1,0,1,0,0|2,0,0]=4 2089 B13R1.149 CC(=O)NCCN1CCCC(C)C1 Amb28078608 [0,1,0,1,0,0|2,0,0]=4 2090 B13R1.149 CC(C)=CCCC1CCCC(Br)C1 Amb35743977 [0,1,0,1,0,0|2,0,0]=4 2091 B13R1.149 CC(C)=CCCC1CCCC(C)C1 Amb35587669 [0,1,0,1,0,0|2,0,0]=4 2092 B13R1.149 CC(C)=CCCC1CCCC(Cl)C1 Amb35744291 [0,1,0,1,0,0|2,0,0]=4 2093 B13R1.149 CC(C)=CCCC1CCCC(N)C1 Amb35738220 [0,1,0,1,0,0|2,0,0]=4 2094 B13R1.149 CC(C)=CCCC1CCCC(O)C1 Amb35738237 [0,1,0,1,0,0|2,0,0]=4 2095 B13R1.149 CC(C)COCC1CCNC(=O)C1 Amb32654954 [0,1,0,1,0,0|2,0,0]=4 2096 B13R1.149 CC1CCCC(CCNC(=O)Cl)C1 Amb35633231 [0,1,0,1,0,0|2,0,0]=4 2097 B13R1.280 C=C(C)CCC1CCCCCC1N Amb27865273 [0,1,0,1,0,0|2,0,0]=4 2098 B13R1.280 C=C(C)CCC1CCCCCC1O Amb26330320 [0,1,0,1,0,0|2,0,0]=4 2099 B13R1.280 C=C(C)CC[C@@H]1CCCCC[C@H]1O Amb33213344 [0,1,0,1,0,0|2,0,0]=4 2100 B13R1.280 C=C(C)CNC1CCCCCC1C Amb27181020 [0,1,0,1,0,0|2,0,0]=4 2101 B13R1.280 CC(=O)CCN1CCCOCC1C Amb27804744 [0,1,0,1,0,0|2,0,0]=4 2102 B13R1.280 CC(C)=CCC1CCCCCC1O Amb19074198 [0,1,0,1,0,0|2,0,0]=4 2103 B13R1.280 CC(C)=CCN1CCCCCC1C Amb27806018 [0,1,0,1,0,0|2,0,0]=4 2104 B13R1.280 CC(C)OCC1CCCCCC1Br Amb27415843 [0,1,0,1,0,0|1,0,1]=4 2105 B13R1.280 CC(C)OCC1CCCCCC1O Amb26995520 [0,1,0,1,0,0|1,0,1]=4 2106 B13R1.280 CC(C)OC[C@@H]1CCCCC[C@H]1O Amb32945773 [0,1,0,1,0,0|1,0,1]=4 2107 B13R1.280 CC(C)ONC1CCCCCC1C Amb35725811 [0,1,0,1,0,0|1,0,1]=4 2108 B13R1.280 CN1CCCCCC1CCC(=O)O Amb18191306 [0,1,0,1,0,0|2,0,0]=4 2109 B13R1.280 CS(=O)CCC1CCCCCC1Cl Amb27879969 [0,1,0,1,0,0|2,0,0]=4 2110 B13R1.280 NC(=O)COC1CCCCCC1N Amb27596830 [0,1,0,1,0,0|2,0,0]=4 2111 B13R1.1988 CC(=O)NCCN1CCCCCC1 Amb25897411 [0,1,0,1,0,0|1,0,0]=3 2112 B13R1.1988 CC(=O)NOCC1CCCCCC1 Amb27806373 [0,1,0,1,0,0|0,0,0]=2 2113 B13R1.1988 CC(C)=CCCC1CCCCCC1 Amb35588025 [0,1,0,1,0,0|2,0,0]=4 2114 B13R1.1988 CC(C)=CCCC1CCCCCN1 Amb35744180 [0,1,0,1,0,0|2,0,0]=4 2115 B13R1.1988 CC(C)=CCCC1CCCCNC1 Amb35624126 [0,1,0,1,0,0|2,0,0]=4 2116 B13R1.1988 CC(C)=CCCN1CCCCCC1 Amb30023693 [0,1,0,1,0,0|2,0,0]=4 2117 B13R1.1988 CS(=O)\N=C\CC1CCCCCC1 Amb35722117 [0,1,0,1,0,0|2,0,0]=4 2118 B13R1.1988 NC(=O)CCNC1CCCCCC1 Amb8858451 [0,1,0,1,0,0|2,0,0]=4 2119 B13R1.1988 NC(=O)NOCC1CCCCCC1 Amb27467105 [0,1,0,1,0,0|1,0,0]=3 2120 B13R1.1988 O=C(O)C#CCC1CCCCCC1 Amb27238099 [0,1,0,1,0,0|2,0,0]=4 2121 B13R1.1988 O=C(O)CCCC1CCCCCC1 Amb33470260 [0,1,0,1,0,0|2,0,0]=4 2122 B13R1.1988 O=C(O)CCCN1CCCCCC1 Amb10072744 [0,1,0,1,0,0|2,0,0]=4 2123 B13R1.1988 O=C(O)CCCN1CCCCCC1 Amb5501646 [0,1,0,1,0,0|2,0,0]=4 2124 B13R1.1988 O=C(O)\C=C\CC1CCCCCC1 Amb26047869 [0,1,0,1,0,0|2,0,0]=4 2125 B13R1.3089 C=C(C)CC1CC(N)CCC1CC Amb32866398 [0,1,0,1,0,0|2,0,0]=4 2126 B13R1.3089 COC1OCC(O)CC1OC(C)=O Amb27415076 [0,1,0,1,0,0|2,0,0]=4 2127 B13R1.3566 CC(C)=CCCC1(N)CCCC1C Amb35618312 [0,1,0,1,0,0|2,0,0]=4 2128 B13R1.3566 CC(C)=CCCC1(O)CCCC1C Amb35663955 [0,1,0,1,0,0|2,0,0]=4 2129 B13R1.3787 CC(=O)CCN1[C@H](C)CCC[C@H]1C Amb27434722 [0,1,0,1,0,0|2,0,0]=4 2130 B13R1.5134 CC(C)=CCCC1(N)CCCCC1 Amb35738442 [0,1,0,1,0,0|2,0,0]=4 2131 B13R1.5134 CC(C)=CCCC1(O)CCCCC1 Amb35663957 [0,1,0,1,0,0|2,0,0]=4 2132 B13R1.5134 CC1(CCCC(=O)O)CCCCC1 Amb33449448 [0,1,0,1,0,0|2,0,0]=4 2133 B13R1.5134 NC(=O)NCCC1(O)CCCCC1 Amb35704646 [0,1,0,1,0,0|2,0,0]=4 2134 B13R1.6 CCCCCCC1CCCC(=O)O1 Amb9825889 [0,1,0,1,0,0|2,0,0]=4 2135 B13R1.6 CCCCNCC1CCCC(=O)N1 Amb32721277 [0,1,0,1,0,0|2,0,0]=4 2136 B13R1.6 CCCCOCC1CCNC(=O)C1 Amb32654950 [0,1,0,1,0,0|1,0,0]=3 2137 B13R1.6 N#CCCCCC1CCCC(=O)C1 Amb6302009 [0,1,0,1,0,0|1,0,1]=4 2138 B13R1.90 CCC1CCCCC1OCC(=O)O Amb6281025 [0,1,0,1,0,0|1,0,0]=3 2139 B13R1.90 CCC1CCCCC1\C=C\C(=O)O Amb27626367 [0,1,0,1,0,0|2,0,0]=4 2140 B13R1.90 CCC1CCCCC1\C=N\S(C)=O Amb35722105 [0,1,0,1,0,0|2,0,0]=4 2141 B13R1.90 CCC1CCCCN1CC=C(C)C Amb27651473 [0,1,0,1,0,0|2,0,0]=4 2142 B13R1.90 CCC1CCCCN1CCC(=O)Cl Amb17143287 [0,1,0,1,0,0|2,0,0]=4 2143 B13R1.90 CCC1CCCCN1CCC(=O)O Amb21955365 [0,1,0,1,0,0|2,0,0]=4 2144 B13R1.90 CCC1CCCCN1CCC(=O)O Amb5760925 [0,1,0,1,0,0|2,0,0]=4 2145 B13R1.90 CCC1CCCCN1CCC(C)=O Amb8872862 [0,1,0,1,0,0|1,0,0]=3 2146 B13R1.90 CCC1CCCC\C1=N/NC(C)=O Amb28398717 [0,1,0,1,0,0|1,0,1]=4 2147 B13R1.90 CCN1CCCCC1CNC(N)=O Amb27823872 [0,1,0,1,0,0|2,0,0]=4 2148 B13R1.90 CCN1CCCCC1COC(=O)Cl Amb33297367 [0,1,0,1,0,0|1,0,0]=3 2149 B13R1.90 COC1CCCCC1CNC(N)=O Amb27769616 [0,1,0,1,0,0|2,0,0]=4 2150 B13R1.167 CN1CCCC1CCCCC(=O)O Amb33320357 [0,1,0,1,0,0|2,0,0]=4 2151 B13R1.224 CCNC1CCCCCC1C(N)=O Amb27804671 [0,1,0,1,0,0|2,0,0]=4 2152 B13R1.224 CCNC1CCCCCC1S(C)=O Amb27873686 [0,1,0,1,0,0|2,0,0]=4 2153 B13R1.279 O=C1CCCCCCCCCCC1 Amb1935123 [0,1,0,1,0,0|1,0,0]=3 2154 B13R1.279 O=C1CCCCCCCCCCN1 Amb22011853 [0,1,0,1,0,0|1,0,0]=3 2155 B13R1.279 O=C1CNCCCCCCCCN1 Amb27240963 [0,1,0,1,0,0|1,0,0]=3 2156 B13R1.283 CC(=O)OC1CCC=CCCC1O Amb27617677 [0,1,0,1,0,0|0,0,2]=4 2157 B13R1.283 CC(=O)OC1CCCCCCC1O Amb28146133 [0,1,0,1,0,0|0,0,0]=2 2158 B13R1.283 CC(=O)O[C@@H]1CCCCCC[C@H]1O Amb27447910 [0,1,0,1,0,0|0,0,0]=2 2159 B13R1.283 CC(=O)O[C@H]1CCC=CCC[C@@H]1Cl Amb27872163 [0,1,0,1,0,0|0,0,2]=4 2160 B13R1.283 CC(=O)O[C@H]1CCCCC=C[C@H]1Cl Amb27841699 [0,1,0,1,0,0|0,0,2]=4 2161 B13R1.283 CC(=O)O[C@H]1CCCCCC[C@@H]1Cl Amb28344689 [0,1,0,1,0,0|0,0,0]=2 2162 B13R1.283 CC(C)OC1CCCCCCC1Br Amb25161211 [0,1,0,1,0,0|1,0,1]=4 2163 B13R1.283 CC(C)OC1CCCCCCC1I Amb27835349 [0,1,0,1,0,0|1,0,1]=4 2164 B13R1.283 NC1CCCCCCC1CC(=O)O Amb32863475 [0,1,0,1,0,0|2,0,0]=4 2165 B13R1.343 CC(=O)NCCCCN1CCCC1 Amb13848931 [0,1,0,1,0,0|1,0,0]=3 2166 B13R1.343 O=C(O)CCCCCC1CCCC1 Amb33172440 [0,1,0,1,0,0|2,0,0]=4 2167 B13R1.343 O=C(O)CCCCCN1CCCC1 Amb32953909 [0,1,0,1,0,0|2,0,0]=4 2168 B13R1.343 O=C(O)CCCCOC1CCCC1 Amb9207783 [0,1,0,1,0,0|2,0,0]=4 2169 B13R1.380 C=CCC1CCCCC1NC(C)=O Amb27782431 [0,1,0,1,0,0|1,0,1]=4 2170 B13R1.380 CC(=O)C[C@@H]1CCCC[C@H]1CC#N Amb28194621 [0,1,0,1,0,0|1,0,1]=4 2171 B13R1.380 CC(=O)NC1CCCCC1CC=O Amb28197195 [0,1,0,1,0,0|1,0,1]=4 2172 B13R1.380 CC(=O)OC1CCCCC1N=[N+]=[N-] Amb27638045 [0,1,0,1,0,0|2,0,0]=4 2173 B13R1.380 CC(=O)O[C@@H]1CCCC[C@H]1N=[N+]=[N-] Amb28290469 [0,1,0,1,0,0|2,0,0]=4 2174 B13R1.380 CC(=O)O[C@H]1CCCC[C@@H]1CC#N Amb27973830 [0,1,0,1,0,0|0,0,1]=3 2175 B13R1.380 CCCC1CCCCC1NC(N)=O Amb28051036 [0,1,0,1,0,0|2,0,0]=4 2176 B13R1.380 CCNC1CCCCC1OC(C)C Amb17606038 [0,1,0,1,0,0|1,0,1]=4 2177 B13R1.380 CCSC1CCCCC1NC(C)=O Amb28342862 [0,1,0,1,0,0|1,0,0]=3 2178 B13R1.380 CCSC1CCCCC1NC(N)=O Amb28352300 [0,1,0,1,0,0|2,0,0]=4 2179 B13R1.392 CC(=O)NCC1CCCN1CCN Amb21860951 [0,1,0,1,0,0|2,0,0]=4 2180 B13R1.392 CC(=O)NCC1CCCN1CCO Amb21860941 [0,1,0,1,0,0|2,0,0]=4 2181 B13R1.486 O=C1CCCCCC(CCCO)N1 Amb18191307 [0,1,0,1,0,0|2,0,0]=4 2182 B13R1.572 CC(=O)N1CCCCC1CCON Amb17139135 [0,1,0,1,0,0|2,0,0]=4 2183 B13R1.572 CCCCC1CCCNC1C(=O)O Amb33500830 [0,1,0,1,0,0|2,0,0]=4 2184 B13R1.572 CCCCC1CCNCC1C(=O)O Amb33500858 [0,1,0,1,0,0|2,0,0]=4 2185 B13R1.572 CCCCC1CNCCC1C(=O)O Amb33500839 [0,1,0,1,0,0|2,0,0]=4 2186 B13R1.572 CCCCC1NCCCC1C(=O)O Amb33500838 [0,1,0,1,0,0|2,0,0]=4 2187 B13R1.572 CCCCN1CCCCC1C(=O)O Amb13886354 [0,1,0,1,0,0|2,0,0]=4 2188 B13R1.572 CCCCN1CCCCC1C(=O)O Amb2382770 [0,1,0,1,0,0|2,0,0]=4 2189 B13R1.572 CCNCC1CCCCN1C(C)=O Amb21860340 [0,1,0,1,0,0|1,0,0]=3 2190 B13R1.610 CC(=O)OC1CCCCOC1CO Amb27188543 [0,1,0,1,0,0|1,0,0]=3 2191 B13R1.610 CC(=O)O[C@H]1CCCCO[C@@H]1C=O Amb27253600 [0,1,0,1,0,0|1,0,1]=4 2192 B13R1.610 CC(=O)O[C@H]1CCCCO[C@@H]1CO Amb27218874 [0,1,0,1,0,0|1,0,0]=3 2193 B13R1.610 CCC1CCCCCC1CC(=O)O Amb35721706 [0,1,0,1,0,0|2,0,0]=4 2194 B13R1.610 CCC1CCCCCC1NC(C)=O Amb2227899 [0,1,0,1,0,0|1,0,0]=3 2195 B13R1.610 CCC1CCCCCN1CC(C)=O Amb28250568 [0,1,0,1,0,0|1,0,0]=3 2196 B13R1.610 CCC1CCCCC\C1=C/C(=O)O Amb35721261 [0,1,0,1,0,0|2,0,0]=4 2197 B13R1.610 CCC1CCCCC\C1=C/C(C)=O Amb35734056 [0,1,0,1,0,0|1,0,0]=3 2198 B13R1.610 CCC1CCCCC\C1=N/S(C)=O Amb35722115 [0,1,0,1,0,0|2,0,0]=4 2199 B13R1.610 CC[C@@H]1NCCCC[C@H]1CC(=O)O Amb18191310 [0,1,0,1,0,0|2,0,0]=4 2200 B13R1.610 CC[C@H]1CCCCC[C@@H]1NC(C)=O Amb27969225 [0,1,0,1,0,0|1,0,0]=3 2201 B13R1.610 COC1CCCCCC1CC(=O)O Amb18822015 [0,1,0,1,0,0|2,0,0]=4 2202 B13R1.610 COC1CCCCCC1NC(C)=O Amb28283624 [0,1,0,1,0,0|1,0,0]=3 2203 B13R1.610 NC(=O)NC1CCCCCC1CO Amb28182914 [0,1,0,1,0,0|2,0,0]=4 2204 B13R1.614 CCN1CCCCCCC1C(=O)O Amb28249659 [0,1,0,1,0,0|2,0,0]=4 2205 B13R1.668 CCCCCC1NCCOC1(C)C Amb33216262 [0,1,0,1,0,0|1,0,1]=4 2206 B13R1.670 CC(=O)N1CCCC1CNCCO Amb21860622 [0,1,0,1,0,0|2,0,0]=4 2207 B13R1.670 CC(=O)N1CCCC1COCCN Amb21860633 [0,1,0,1,0,0|2,0,0]=4 2208 B13R1.670 CC(=O)N1CCCC1COCCO Amb21860552 [0,1,0,1,0,0|2,0,0]=4 2209 B13R1.1009 CC(=O)N1CCCNCCOCC1 Amb33039951 [0,1,0,1,0,0|2,0,0]=4 2210 B13R1.1009 O=C(O)C1CCCCCCCCN1 Amb27392275 [0,1,0,1,0,0|2,0,0]=4 2211 B13R1.1022 C=C(C)CNC1CCCCCCC1 Amb17308786 [0,1,0,1,0,0|2,0,0]=4 2212 B13R1.1022 CC(=O)NN=C1CCCCCCC1 Amb982254 [0,1,0,1,0,0|1,0,1]=4 2213 B13R1.1022 CC(=O)\N=C\C1CCCCCCC1 Amb26953639 [0,1,0,1,0,0|1,0,0]=3 2214 B13R1.1022 CC(C)=NCC1CCCCCCN1 Amb27415706 [0,1,0,1,0,0|2,0,0]=4 2215 B13R1.1022 CS(=O)\N=C\C1CCCCCCC1 Amb35693132 [0,1,0,1,0,0|2,0,0]=4 2216 B13R1.1022 NC(=O)NNC1CCCCCCC1 Amb27848563 [0,1,0,1,0,0|2,0,0]=4 2217 B13R1.1022 NC(=O)\C=C\C1CCCCCCC1 Amb25791108 [0,1,0,1,0,0|2,0,0]=4 2218 B13R1.1022 O=C(O)CCC1CCCCCCC1 Amb27605503 [0,1,0,1,0,0|2,0,0]=4 2219 B13R1.1022 O=C(O)CCN1CCCCCCC1 Amb21955684 [0,1,0,1,0,0|2,0,0]=4 2220 B13R1.1022 O=C(O)CCN1CCCCCCC1 Amb6646779 [0,1,0,1,0,0|2,0,0]=4 2221 B13R1.1022 O=C(O)COC1CCCCCCC1 Amb28385714 [0,1,0,1,0,0|1,0,0]=3 2222 B13R1.1022 O=C(O)\C=C\C1CCCCCCC1 Amb24397482 [0,1,0,1,0,0|2,0,0]=4 2223 B13R1.1052 O=C(O)CCCCCCCC1CC1 Amb33167110 [0,1,0,1,0,0|2,0,0]=4 2224 B13R1.9 CCCCCCC1CCC(=O)CC1 Amb33718611 [0,1,0,1,0,0|1,0,0]=3 2225 B13R1.9 CCCCCCN1CCC(=O)CC1 Amb6384594 [0,1,0,1,0,0|2,0,0]=4 2226 B13R1.91 C#CC(=O)NC1CCCCC1CC Amb27594523 [0,1,0,1,0,0|1,0,1]=4 2227 B13R1.91 CCC(=O)NC1CCCCC1CO Amb27247164 [0,1,0,1,0,0|2,0,0]=4 2228 B13R1.91 CCC(=O)NC1CNCCC1CC Amb32677483 [0,1,0,1,0,0|2,0,0]=4 2229 B13R1.91 CCC(=O)N[C@@H]1CCCC[C@H]1CO Amb27588671 [0,1,0,1,0,0|2,0,0]=4 2230 B13R1.91 CCC(=O)OC1CCCCC1C#N Amb27769237 [0,1,0,1,0,0|1,0,1]=4 2231 B13R1.91 CCC1CCCCC1NC(=O)CBr Amb27179056 [0,1,0,1,0,0|1,0,0]=3 2232 B13R1.91 CCC1CCCCC1NC(=O)CS Amb27858203 [0,1,0,1,0,0|1,0,0]=3 2233 B13R1.91 CCC1CCCCC1NC(=O)NC Amb27225632 [0,1,0,1,0,0|1,0,0]=3 2234 B13R1.91 CCC1CCCCC1\C=C(\C)CBr Amb27960108 [0,1,0,1,0,0|2,0,0]=4 2235 B13R1.91 CCC1CCCCC1\C=C(\C)CN Amb27627201 [0,1,0,1,0,0|2,0,0]=4 2236 B13R1.91 CCC1CCCCC1\C=C(\C)CO Amb27222932 [0,1,0,1,0,0|1,0,1]=4 2237 B13R1.91 CCC1CCCC\C1=C/C(=O)OC Amb27803102 [0,1,0,1,0,0|1,0,1]=4 2238 B13R1.91 CCC1CCCC\C1=C\C(=O)OC Amb33468675 [0,1,0,1,0,0|1,0,1]=4 2239 B13R1.91 CCC1CCNCC1NC(=O)CBr Amb32677523 [0,1,0,1,0,0|2,0,0]=4 2240 B13R1.91 CCC1CCNCC1NC(=O)CCl Amb32677521 [0,1,0,1,0,0|2,0,0]=4 2241 B13R1.91 CNC(=O)NC1CCCCC1SC Amb27220361 [0,1,0,1,0,0|2,0,0]=4 2242 B13R1.91 CNC(=O)N[C@@H]1CCCC[C@H]1OC Amb27944983 [0,1,0,1,0,0|2,0,0]=4 2243 B13R1.91 CNC(=O)N[C@H]1CCCC[C@@H]1OC Amb27944987 [0,1,0,1,0,0|2,0,0]=4 2244 B13R1.91 CNC(=O)N[C@H]1CCCC[C@@H]1SC Amb27944988 [0,1,0,1,0,0|2,0,0]=4 2245 B13R1.91 COC1CCCCC1NC(=O)SC Amb4014376 [0,1,0,1,0,0|2,0,0]=4 2246 B13R1.91 CO[C@@H]1CCCC[C@H]1NC(=O)CO Amb27661677 [0,1,0,1,0,0|2,0,0]=4 2247 B13R1.91 CSC1CCCCC1NC(=O)CN Amb27208855 [0,1,0,1,0,0|2,0,0]=4 2248 B13R1.91 CSC1CCCCC1NC(=O)CS Amb27233245 [0,1,0,1,0,0|2,0,0]=4 2249 B13R1.91 N#CC1CCCCC1OC(=O)CO Amb27946550 [0,1,0,1,0,0|1,0,1]=4 2250 B13R1.91 NCC(=O)NC1CCCCC1CO Amb27783965 [0,1,0,1,0,0|2,0,0]=4 2251 B13R1.91 O=C(CCl)NC1CCCCC1CO Amb27790633 [0,1,0,1,0,0|2,0,0]=4 2252 B13R1.91 O=C(CO)N[C@@H]1CCCC[C@H]1CO Amb28254894 [0,1,0,1,0,0|2,0,0]=4 2253 B13R1.189 CCCCCCC1COC(OC)O1 Amb32652969 [0,1,0,1,0,0|0,0,2]=4 2254 B13R1.203 O=C1CCCCCCCCCC1O Amb28282020 [0,1,0,1,0,0|1,0,0]=3 2255 B13R1.382 CCC(=O)N1CCCCC1CCBr Amb17103918 [0,1,0,1,0,0|2,0,0]=4 2256 B13R1.382 CCC(=O)N1CCCCC1CCCl Amb17103645 [0,1,0,1,0,0|2,0,0]=4 2257 B13R1.382 CCC(=O)N1CCCCC1CCN Amb17046293 [0,1,0,1,0,0|2,0,0]=4 2258 B13R1.382 CCC(=O)N1CCCCC1CCO Amb5797481 [0,1,0,1,0,0|2,0,0]=4 2259 B13R1.382 CCCC1CCCCN1C(=O)NC Amb27415066 [0,1,0,1,0,0|1,0,0]=3 2260 B13R1.382 CCCC1CCCCN1C(=O)NN Amb27410952 [0,1,0,1,0,0|2,0,0]=4 2261 B13R1.382 CCCC1CCCCN1C(=S)NC Amb27588749 [0,1,0,1,0,0|1,1,0]=4 2262 B13R1.382 CNC(=O)N1CCCCC1CCN Amb32661630 [0,1,0,1,0,0|2,0,0]=4 2263 B13R1.382 COCC1CCCCN1C(=O)CCl Amb21860277 [0,1,0,1,0,0|2,0,0]=4 2264 B13R1.382 COCC1CCCCN1C(=O)CN Amb21860302 [0,1,0,1,0,0|2,0,0]=4 2265 B13R1.382 O=C(CBr)N1CCCCC1CCO Amb20573406 [0,1,0,1,0,0|2,0,0]=4 2266 B13R1.382 O=C(CCl)N1CCCCC1CCO Amb9707141 [0,1,0,1,0,0|2,0,0]=4 2267 B13R1.382 O=C(CO)N1CCCCC1CCO Amb5798105 [0,1,0,1,0,0|2,0,0]=4 2268 B13R1.393 CCCC1COCC1NC(=O)NC Amb35613746 [0,1,0,1,0,0|2,0,0]=4 2269 B13R1.527 CC1CCCCCC1NC(=O)CCl Amb27181116 [0,1,0,1,0,0|1,0,0]=3 2270 B13R1.527 CC1CCCCCC1NC(=O)CN Amb28397086 [0,1,0,1,0,0|1,0,0]=3 2271 B13R1.527 CNC(=O)CN1CCCCCC1C Amb27823783 [0,1,0,1,0,0|2,0,0]=4 2272 B13R1.527 CNC(=O)NC1CCCCCC1N Amb27163442 [0,1,0,1,0,0|2,0,0]=4 2273 B13R1.527 CNC(=O)NC1CCCCCC1O Amb27597338 [0,1,0,1,0,0|2,0,0]=4 2274 B13R1.527 CNC(=O)OC1CCCCCC1N Amb27813785 [0,1,0,1,0,0|1,0,0]=3 2275 B13R1.527 CNC(=S)NC1CCCCCC1C Amb27969745 [0,1,0,1,0,0|1,1,0]=4 2276 B13R1.527 COC(=O)CC1CCCCCC1N Amb32861898 [0,1,0,1,0,0|2,0,0]=4 2277 B13R1.527 COC(=O)NC1CCCCCC1O Amb27810523 [0,1,0,1,0,0|2,0,0]=4 2278 B13R1.527 COC(=O)\C=C1\CCCCCC1C Amb35721700 [0,1,0,1,0,0|1,0,1]=4 2279 B13R1.527 NCC(=O)N[C@@H]1CCCCC[C@H]1N Amb27196679 [0,1,0,1,0,0|2,0,0]=4 2280 B13R1.527 O=C(CCl)OC1CCCCCC1F Amb27408530 [0,1,0,1,0,0|1,0,0]=3 2281 B13R1.528 CC1CCCCC1CNC(=O)NN Amb19058079 [0,1,0,1,0,0|2,0,0]=4 2282 B13R1.528 CCC(=O)NCC1CCCCC1O Amb28321161 [0,1,0,1,0,0|2,0,0]=4 2283 B13R1.528 CCC(=O)NCC1CCNCC1C Amb26353363 [0,1,0,1,0,0|2,0,0]=4 2284 B13R1.528 CN1CCCCC1CNC(=O)CBr Amb27753274 [0,1,0,1,0,0|2,0,0]=4 2285 B13R1.528 CNC(=O)CCC1CCCCC1N Amb27859013 [0,1,0,1,0,0|2,0,0]=4 2286 B13R1.528 CNC(=O)COC1CCCCC1C Amb25883056 [0,1,0,1,0,0|2,0,0]=4 2287 B13R1.528 CNC(=O)NCC1CCCCC1N Amb27763232 [0,1,0,1,0,0|2,0,0]=4 2288 B13R1.528 CNC(=O)NCC1CNCCC1C Amb27600617 [0,1,0,1,0,0|2,0,0]=4 2289 B13R1.528 CNC(=O)NCC1NCCCC1C Amb27877300 [0,1,0,1,0,0|2,0,0]=4 2290 B13R1.528 COC(=O)CCC1CCCCC1N Amb33726906 [0,1,0,1,0,0|2,0,0]=4 2291 B13R1.528 COC(=O)CCC1CCNCC1C Amb33747347 [0,1,0,1,0,0|2,0,0]=4 2292 B13R1.528 COC(=O)CCN1CCCCC1C Amb7755661 [0,1,0,1,0,0|2,0,0]=4 2293 B13R1.528 COC(=O)COC1CCCCC1C Amb9206376 [0,1,0,1,0,0|2,0,0]=4 2294 B13R1.528 COC(=O)NCC1CCCCC1C Amb28351017 [0,1,0,1,0,0|1,0,0]=3 2295 B13R1.528 COC(=O)NCC1CCCCN1C Amb27415034 [0,1,0,1,0,0|2,0,0]=4 2296 B13R1.528 COC(=O)NCC1CCOCC1C Amb27599129 [0,1,0,1,0,0|2,0,0]=4 2297 B13R1.528 COC(=O)NCC1NCCCC1C Amb27394523 [0,1,0,1,0,0|2,0,0]=4 2298 B13R1.528 O=C(CCl)NCC1CCCCC1O Amb27180456 [0,1,0,1,0,0|2,0,0]=4 2299 B13R1.528 O=C(CS)NCC1CCCCC1O Amb28129721 [0,1,0,1,0,0|2,0,0]=4 2300 B13R1.536 O=C(CBr)NCCCN1CCCC1 Amb20414368 [0,1,0,1,0,0|2,0,0]=4 2301 B13R1.536 O=C(CCl)NCCCN1CCCC1 Amb8999820 [0,1,0,1,0,0|2,0,0]=4 2302 B13R1.546 COC(=O)C1CCCCCCC1N Amb20668749 [0,1,0,1,0,0|2,0,0]=4 2303 B13R1.546 COC(=O)C1CCCCCCC1N Amb25114777 [0,1,0,1,0,0|2,0,0]=4 2304 B13R1.546 COC(=O)C1CCCCCC[C@@H]1O Amb27593953 [0,1,0,1,0,0|2,0,0]=4 2305 B13R1.546 COC(=O)[C@@H]1CCCCCC[C@@H]1N Amb25932755 [0,1,0,1,0,0|2,0,0]=4 2306 B13R1.546 COC(=O)[C@@H]1CCCCCC[C@@H]1N Amb32651799 [0,1,0,1,0,0|2,0,0]=4 2307 B13R1.560 CCCCCCCCOC1CNC1 Amb18327049 [0,1,0,1,0,0|1,0,1]=4 2308 B13R1.599 CCC(=O)NCC[C@@H]1CNC[C@H]1C Amb32696186 [0,1,0,1,0,0|2,0,0]=4 2309 B13R1.599 CNC(=O)NCCC1CCCN1C Amb24181773 [0,1,0,1,0,0|2,0,0]=4 2310 B13R1.611 C=CC(=O)N1CCCCCC1CC Amb27759697 [0,1,0,1,0,0|1,0,1]=4 2311 B13R1.611 CCC(=O)C1CCCCCC1CC Amb35725694 [0,1,0,1,0,0|1,0,0]=3 2312 B13R1.611 CCC(=O)N1CCCCCC1CN Amb27483627 [0,1,0,1,0,0|2,0,0]=4 2313 B13R1.611 CCC1CCCCCN1C(=S)NC Amb27405483 [0,1,0,1,0,0|1,1,0]=4 2314 B13R1.611 CCC1CCCCCN1C(C)C=O Amb35647307 [0,1,0,1,0,0|1,0,1]=4 2315 B13R1.611 CCN1CCCCCC1C(=O)OC Amb27823899 [0,1,0,1,0,0|2,0,0]=4 2316 B13R1.611 CNC(=O)N1CCCCCC1CO Amb28367944 [0,1,0,1,0,0|2,0,0]=4 2317 B13R1.611 CNC1CCCCCC1C(=O)OC Amb28282320 [0,1,0,1,0,0|2,0,0]=4 2318 B13R1.611 COC(=O)N1CCCCCC1CO Amb27415029 [0,1,0,1,0,0|2,0,0]=4 2319 B13R1.611 NCC(=O)N1CCCCCC1CO Amb27415062 [0,1,0,1,0,0|2,0,0]=4 2320 B13R1.611 O=C(CCl)N1CCCCCC1CO Amb27165036 [0,1,0,1,0,0|2,0,0]=4 2321 B13R1.613 CCN1CCCC1CNC(=O)NC Amb24181772 [0,1,0,1,0,0|2,0,0]=4 2322 B13R1.623 COC1=NCCCCCCCCC1 Amb33621275 [0,1,0,1,0,0|1,0,1]=4 2323 B13R1.718 C#CC(=O)NCCC1CCCCC1 Amb28249420 [0,1,0,1,0,0|1,0,1]=4 2324 B13R1.718 CNC(=N)NCCC1CCCCC1 Amb19068492 [0,1,0,1,0,0|2,0,0]=4 2325 B13R1.718 CNC(=O)NCCC1CCCNC1 Amb27454379 [0,1,0,1,0,0|2,0,0]=4 2326 B13R1.718 CNC(=O)NCCC1CCOCC1 Amb27179873 [0,1,0,1,0,0|2,0,0]=4 2327 B13R1.718 CNC(=O)NCCN1CCCCC1 Amb22584246 [0,1,0,1,0,0|2,0,0]=4 2328 B13R1.718 COC(=O)C#CCC1CCCCC1 Amb27798236 [0,1,0,1,0,0|1,0,1]=4 2329 B13R1.718 COC(=O)CCCC1CCCCN1 Amb33746927 [0,1,0,1,0,0|2,0,0]=4 2330 B13R1.718 COC(=O)CCCN1CCCCC1 Amb22235542 [0,1,0,1,0,0|2,0,0]=4 2331 B13R1.718 COC(=O)CCCN1CCCCC1 Amb8455430 [0,1,0,1,0,0|2,0,0]=4 2332 B13R1.718 COC(=O)CCNC1CCCCC1 Amb9203454 [0,1,0,1,0,0|2,0,0]=4 2333 B13R1.718 COC(=O)CCOC1CCCCC1 Amb9206350 [0,1,0,1,0,0|2,0,0]=4 2334 B13R1.718 COC(=O)NCCC1CCCCN1 Amb6668912 [0,1,0,1,0,0|2,0,0]=4 2335 B13R1.718 NCC(=O)NCCN1CCCCC1 Amb19017775 [0,1,0,1,0,0|2,0,0]=4 2336 B13R1.718 NCC(=O)NCCN1CCCCC1 Amb32663109 [0,1,0,1,0,0|2,0,0]=4 2337 B13R1.718 O=C(CBr)NCCC1CCCCC1 Amb17330356 [0,1,0,1,0,0|1,0,0]=3 2338 B13R1.718 O=C(CBr)NCCN1CCCCC1 Amb20573619 [0,1,0,1,0,0|2,0,0]=4 2339 B13R1.718 O=C(CCl)NCCC1CCCCC1 Amb17325960 [0,1,0,1,0,0|1,0,0]=3 2340 B13R1.718 O=C(CCl)NCCN1CCCCC1 Amb20573547 [0,1,0,1,0,0|2,0,0]=4 2341 B13R1.718 O=C(CCl)OCCN1CCOCC1 Amb9174158 [0,1,0,1,0,0|2,0,0]=4 2342 B13R1.1689 C#CC(=O)N1CCCCCCCC1 Amb29888608 [0,1,0,1,0,0|1,0,1]=4 2343 B13R1.1689 C=CC(=O)N1CCCCCCCC1 Amb25878803 [0,1,0,1,0,0|1,0,1]=4 2344 B13R1.1689 CC(C=O)N1CCCCCCCC1 Amb30036785 [0,1,0,1,0,0|1,0,1]=4 2345 B13R1.1689 CNC(=S)N1CCCCCCCC1 Amb27483496 [0,1,0,1,0,0|1,1,0]=4 2346 B13R1.1689 COC(=O)C1CCCCCNCC1 Amb28141756 [0,1,0,1,0,0|2,0,0]=4 2347 B13R1.1711 C#CC(=O)NCC1CCCCCC1 Amb35614242 [0,1,0,1,0,0|1,0,1]=4 2348 B13R1.1711 CCC(=O)NCC1CCCCCC1 Amb28193192 [0,1,0,1,0,0|1,0,0]=3 2349 B13R1.1711 CCC(=O)NCC1CCCCCN1 Amb33038742 [0,1,0,1,0,0|2,0,0]=4 2350 B13R1.1711 CCC(=O)NCC1CCCCNC1 Amb25926481 [0,1,0,1,0,0|2,0,0]=4 2351 B13R1.1711 CCC(=O)NCC1CCCSCC1 Amb29884315 [0,1,0,1,0,0|2,0,0]=4 2352 B13R1.1711 CNC(=O)NCC1CCCSCC1 Amb30030694 [0,1,0,1,0,0|2,0,0]=4 2353 B13R1.1711 CNC(=O)OCC1CCCCNC1 Amb35647545 [0,1,0,1,0,0|1,0,0]=3 2354 B13R1.1711 COC(=O)C#CC1CCCCCC1 Amb25278204 [0,1,0,1,0,0|1,0,1]=4 2355 B13R1.1711 COC(=O)CCN1CCCCCC1 Amb843107 [0,1,0,1,0,0|2,0,0]=4 2356 B13R1.1711 COC(=O)NCC1CCCCNC1 Amb27828396 [0,1,0,1,0,0|2,0,0]=4 2357 B13R1.1711 COC(=O)NCC1CCCSCC1 Amb30030719 [0,1,0,1,0,0|2,0,0]=4 2358 B13R1.1711 NCC(=O)NCC1CCCSCC1 Amb29884186 [0,1,0,1,0,0|2,0,0]=4 2359 B13R1.1711 NNC(=O)NCC1CCCCCC1 Amb27964801 [0,1,0,1,0,0|2,0,0]=4 2360 B13R1.1711 O=C(CBr)NCC1CCCCCC1 Amb28286509 [0,1,0,1,0,0|1,0,0]=3 2361 B13R1.1711 O=C(CBr)NCC1CCCSCC1 Amb29884381 [0,1,0,1,0,0|2,0,0]=4 2362 B13R1.1711 O=C(CCl)NCC1CCCSCC1 Amb29884380 [0,1,0,1,0,0|2,0,0]=4 2363 B13R1.1711 O=C(CS)NCC1CCCCCC1 Amb28067183 [0,1,0,1,0,0|1,0,0]=3 2364 B13R1.1711 O=C(CS)NCC1CCCSCC1 Amb35627024 [0,1,0,1,0,0|2,0,0]=4 2365 B13R1.1870 C#CC(=O)NC1CCCCCCC1 Amb27765680 [0,1,0,1,0,0|1,0,1]=4 2366 B13R1.1870 C=CC(=O)NC1CCCCCCC1 Amb9480537 [0,1,0,1,0,0|1,0,1]=4 2367 B13R1.1870 CCC(=N)NC1CCCCCCC1 Amb28054013 [0,1,0,1,0,0|2,0,0]=4 2368 B13R1.1870 CCC(=O)CN1CCCCCCC1 Amb19074506 [0,1,0,1,0,0|2,0,0]=4 2369 B13R1.1870 CCC(=O)NC1CCCCCCC1 Amb5797475 [0,1,0,1,0,0|1,0,0]=3 2370 B13R1.1870 CCC(=O)NC1CCCCCNC1 Amb32659971 [0,1,0,1,0,0|2,0,0]=4 2371 B13R1.1870 CCC(=O)OC1CCC=CCCC1 Amb26046949 [0,1,0,1,0,0|0,0,2]=4 2372 B13R1.1870 CCC(=O)OC1CCCCCCC1 Amb27605036 [0,1,0,1,0,0|0,0,0]=2 2373 B13R1.1870 CNC(=O)NC1CCCCCCC1 Amb27793309 [0,1,0,1,0,0|1,0,0]=3 2374 B13R1.1870 CNC(=S)NC1CCCCCCC1 Amb5951355 [0,1,0,1,0,0|1,1,0]=4 2375 B13R1.1870 COC(=O)C=C1CCCCCCC1 Amb25180453 [0,1,0,1,0,0|1,0,1]=4 2376 B13R1.1870 COC(=O)CC1CCCCCCN1 Amb33356231 [0,1,0,1,0,0|2,0,0]=4 2377 B13R1.1870 COC(=O)CN1CCCCCCC1 Amb7761444 [0,1,0,1,0,0|2,0,0]=4 2378 B13R1.1870 COC(=O)NC1CCCCCCC1 Amb17739564 [0,1,0,1,0,0|1,0,0]=3 2379 B13R1.1870 COC(=O)OC1CCCCCCC1 Amb25782061 [0,1,0,1,0,0|0,0,0]=2 2380 B13R1.1870 C\C(=C/C1CCCCCCC1)CBr Amb27586949 [0,1,0,1,0,0|2,0,0]=4 2381 B13R1.1870 C\C(=C/C1CCCCCCC1)CCl Amb28293553 [0,1,0,1,0,0|2,0,0]=4 2382 B13R1.1870 C\C(C=O)=C/C1CCCCCCC1 Amb27586948 [0,1,0,1,0,0|1,0,0]=3 2383 B13R1.1870 O=C(CBr)NC1CCCCCCC1 Amb27480675 [0,1,0,1,0,0|1,0,0]=3 2384 B13R1.1870 O=C(CCl)NC1CCCCCCC1 Amb1150245 [0,1,0,1,0,0|1,0,0]=3 2385 B13R1.1870 O=C(CO)NC1CCCCCCC1 Amb5798096 [0,1,0,1,0,0|1,0,0]=3 2386 B13R1.1870 O=C(CO)OC1CCCCCCC1 Amb28249413 [0,1,0,1,0,0|0,0,0]=2 2387 B13R1.1917 CCCCN1CCCNC(=O)C1C Amb28138332 [0,1,0,1,0,0|2,0,0]=4 2388 B13R1.3819 CC1C(=O)OCCCCCCC1O Amb27661174 [0,1,0,1,0,0|1,0,0]=3 2389 B13R1.89 C=C(C)C(O)C1CCCCC1CC Amb28344240 [0,1,0,1,0,0|2,0,0]=4 2390 B13R1.89 CCC1CCCCC1C(=O)C(=O)O Amb27786999 [0,1,0,1,0,0|2,0,0]=4 2391 B13R1.89 CCC1CCCCC1C(F)C(=O)O Amb28282175 [0,1,0,1,0,0|2,0,0]=4 2392 B13R1.89 CCC1CCCCC1C(N)C(N)=O Amb25900285 [0,1,0,1,0,0|2,0,0]=4 2393 B13R1.89 CCC1CCCCC1N(C)C(N)=O Amb28190181 [0,1,0,1,0,0|2,0,0]=4 2394 B13R1.89 CCC1CCCCC1[C@@H](N)C(=O)O Amb26350175 [0,1,0,1,0,0|2,0,0]=4 2395 B13R1.89 CCC1CCCCC1[C@H](N)C(=O)O Amb28136297 [0,1,0,1,0,0|2,0,0]=4 2396 B13R1.202 CC(=O)N(C)CC1CCCCC1O Amb28064914 [0,1,0,1,0,0|2,0,0]=4 2397 B13R1.202 CC1CCCCC1CC(=O)C(=O)O Amb27645540 [0,1,0,1,0,0|2,0,0]=4 2398 B13R1.202 CC1CCCCC1CC(O)C(=O)O Amb33353338 [0,1,0,1,0,0|2,0,0]=4 2399 B13R1.202 CC1CCCCC1C[C@H](N)C(=O)O Amb27964783 [0,1,0,1,0,0|2,0,0]=4 2400 B13R1.351 CC(=O)N(O)CCN1CCCCC1 Amb24096666 [0,1,0,1,0,0|2,0,0]=4 2401 B13R1.351 CC(CCC1CCCCC1)C(=O)O Amb33449274 [0,1,0,1,0,0|2,0,0]=4 2402 B13R1.351 C[C@@H](CCC1CCCCC1)C(=O)O Amb33729748 [0,1,0,1,0,0|2,0,0]=4 2403 B13R1.351 C[C@H](CCC1CCCCC1)C(=O)O Amb33727422 [0,1,0,1,0,0|2,0,0]=4 2404 B13R1.351 NC(=O)C(N)CCC1CCCCC1 Amb33069939 [0,1,0,1,0,0|2,0,0]=4 2405 B13R1.351 NC(CCC1CCCCC1)C(=O)O Amb32867914 [0,1,0,1,0,0|2,0,0]=4 2406 B13R1.351 N[C@@H](CCC1CCCCC1)C(=O)O Amb30594707 [0,1,0,1,0,0|2,0,0]=4 2407 B13R1.351 N[C@H](CCC1CCCCC1)C(=O)O Amb33308683 [0,1,0,1,0,0|2,0,0]=4 2408 B13R1.351 O=C(O)C(=O)CCC1CCCCC1 Amb33079594 [0,1,0,1,0,0|2,0,0]=4 2409 B13R1.351 O=C(O)C(O)CCC1CCCCC1 Amb18649400 [0,1,0,1,0,0|2,0,0]=4 2410 B13R1.1097 CC1(C(=O)O)CCCCCCCC1 Amb28193430 [0,1,0,1,0,0|2,0,0]=4 2411 B13R1.1097 NC1(C(=O)O)CCCCCCCC1 Amb27256620 [0,1,0,1,0,0|2,0,0]=4 2412 B13R1.1110 CC(CCCC1CCCC1)C(=O)O Amb33481728 [0,1,0,1,0,0|2,0,0]=4 2413 B13R1.1110 NC(CCCC1CCCC1)C(=O)O Amb33374920 [0,1,0,1,0,0|2,0,0]=4 2414 B13R1.1110 O=C(O)C(=O)CCCC1CCCC1 Amb33481441 [0,1,0,1,0,0|2,0,0]=4 2415 B13R1.1110 O=C(O)C(O)CCCC1CCCC1 Amb33374586 [0,1,0,1,0,0|2,0,0]=4 2416 B13R1.1220 CCSC1CCCCN(C(C)=O)C1 Amb27658647 [0,1,0,1,0,0|2,0,0]=4 2417 B13R1.1232 CCCCCC[C@@H]1C[C@@]1(C)C(=O)O Amb33098437 [0,1,0,1,0,0|2,0,0]=4 2418 B13R1.1232 CCCCCC[C@H]1C[C@@]1(C)C(=O)O Amb33098411 [0,1,0,1,0,0|2,0,0]=4 2419 B13R1.1267 CCCC1CCCCC1(N)C(=O)O Amb28385663 [0,1,0,1,0,0|2,0,0]=4 2420 B13R1.2191 C=C(C)C1(O)CCCCCC1CC Amb35721147 [0,1,0,1,0,0|2,0,0]=4 2421 B13R1.2191 CCC1CCCCCC1(N)C(=O)O Amb35681356 [0,1,0,1,0,0|2,0,0]=4 2422 B13R1.2191 CCC1CCCCCC1(N)C(N)=O Amb35733874 [0,1,0,1,0,0|2,0,0]=4 2423 B13R1.2191 CCC1CCCCCC1(O)C(=O)O Amb29865302 [0,1,0,1,0,0|2,0,0]=4 2424 B13R1.2191 CCC1CCCCCC1(O)C(N)=O Amb35706799 [0,1,0,1,0,0|2,0,0]=4 2425 B13R1.2840 NC(=O)C(N)CCCCCC1CC1 Amb33037078 [0,1,0,1,0,0|2,0,0]=4 2426 B13R1.2840 NC(CCCCCC1CC1)C(=O)O Amb33308704 [0,1,0,1,0,0|2,0,0]=4 2427 B13R1.2840 N[C@@H](CCCCCC1CC1)C(=O)O Amb33308674 [0,1,0,1,0,0|2,0,0]=4 2428 B13R1.2840 N[C@H](CCCCCC1CC1)C(=O)O Amb33036900 [0,1,0,1,0,0|2,0,0]=4 2429 B13R1.3766 CC(=N)N(C)C1CCCCCC1C Amb35733880 [0,1,0,1,0,0|2,0,0]=4 2430 B13R1.3766 CC(=O)N(C)C1CCCCCC1C Amb35681362 [0,1,0,1,0,0|1,0,0]=3 2431 B13R1.3766 CC1CCCCCC1C(C)C(=O)O Amb29865074 [0,1,0,1,0,0|2,0,0]=4 2432 B13R1.3766 CC1CCCCCC1C(F)C(=O)O Amb29865075 [0,1,0,1,0,0|2,0,0]=4 2433 B13R1.3766 CC1CCCCCC1C(N)C(=O)O Amb35663283 [0,1,0,1,0,0|2,0,0]=4 2434 B13R1.3766 CC1CCCCCC1C(O)C(=O)O Amb35725681 [0,1,0,1,0,0|2,0,0]=4 2435 B13R1.3766 CC1CCCCCC1N(C)C(=O)Cl Amb35681231 [0,1,0,1,0,0|2,0,0]=4 2436 B13R1.3766 CC1CCCCCC1N(C)C(N)=O Amb35681201 [0,1,0,1,0,0|2,0,0]=4 2437 B13R1.3807 CC(=O)C1=CC(O)CCCCCC1 Amb27833639 [0,1,0,1,0,0|1,0,1]=4 2438 B13R1.6161 CC(C(=O)O)C1CCCCCCC1 Amb24652377 [0,1,0,1,0,0|2,0,0]=4 2439 B13R1.6161 NC(=O)C(Cl)C1CCCCCCC1 Amb27598729 [0,1,0,1,0,0|2,0,0]=4 2440 B13R1.6161 NC(=O)C(N)C1CCCCCCC1 Amb27853339 [0,1,0,1,0,0|2,0,0]=4 2441 B13R1.6161 NC(=O)C(O)C1CCCCCCC1 Amb27219980 [0,1,0,1,0,0|2,0,0]=4 2442 B13R1.6161 NC(C(=O)O)C1CCCCCCC1 Amb27814084 [0,1,0,1,0,0|2,0,0]=4 2443 B13R1.6161 N[C@@H](C(=O)O)C1CCCCCCC1 Amb27168101 [0,1,0,1,0,0|2,0,0]=4 2444 B13R1.6161 O=C(O)C(O)C1CCCCCCC1 Amb27205442 [0,1,0,1,0,0|2,0,0]=4 2445 B13R1.6192 C=C(C)C(N)CC1CCCCCC1 Amb27948417 [0,1,0,1,0,0|2,0,0]=4 2446 B13R1.6192 CC(=O)C(=O)CC1CCCCCN1 Amb24361324 [0,1,0,1,0,0|2,0,0]=4 2447 B13R1.6192 CC(=O)C(=O)NC1CCCCCC1 Amb17400987 [0,1,0,1,0,0|2,0,0]=4 2448 B13R1.6192 CC(CC1CCCCCC1)C(=O)O Amb28320084 [0,1,0,1,0,0|2,0,0]=4 2449 B13R1.6192 C[C@@H](CC1CCCCCC1)C(=O)O Amb33749534 [0,1,0,1,0,0|2,0,0]=4 2450 B13R1.6192 C[C@H](CC1CCCCCC1)C(=O)O Amb33727763 [0,1,0,1,0,0|2,0,0]=4 2451 B13R1.6192 NC(CC1CCCCCC1)C(=O)O Amb26519677 [0,1,0,1,0,0|2,0,0]=4 2452 B13R1.6192 NC(CC1CCCCCC1)C(=O)O Amb32666066 [0,1,0,1,0,0|2,0,0]=4 2453 B13R1.6192 N[C@@H](CC1CCCCCC1)C(=O)O Amb26634280 [0,1,0,1,0,0|2,0,0]=4 2454 B13R1.6192 N[C@@H](CC1CCCCCC1)C(=O)O Amb28600370 [0,1,0,1,0,0|2,0,0]=4 2455 B13R1.6192 O=C(O)C(=O)CC1CCCCCC1 Amb24751418 [0,1,0,1,0,0|2,0,0]=4 2456 B13R1.6192 O=C(O)C(O)CC1CCCCCC1 Amb28434371 [0,1,0,1,0,0|2,0,0]=4 2457 B13R1.6192 O=C(O)C(S)CC1CCCCCC1 Amb27801746 [0,1,0,1,0,0|2,0,0]=4 2458 B13R1.45 CC(=O)NCC(C)C1CCCCN1 Amb30010428 [0,1,0,1,0,0|2,0,0]=4 2459 B13R1.45 CC(=O)NCC(C)N1CCCCC1 Amb26542679 [0,1,0,1,0,0|2,0,0]=4 2460 B13R1.45 CC(=O)NCC(O)C1CCCCC1 Amb28251033 [0,1,0,1,0,0|1,0,0]=3 2461 B13R1.45 CC(=O)NCC(O)C1CCOCC1 Amb27802176 [0,1,0,1,0,0|2,0,0]=4 2462 B13R1.45 CC(C)=CCC(N)C1CCCCC1 Amb30029414 [0,1,0,1,0,0|2,0,0]=4 2463 B13R1.45 CC(C)=CCC(O)C1CCCCC1 Amb27479067 [0,1,0,1,0,0|2,0,0]=4 2464 B13R1.45 NC(CCC(=O)O)C1CCCCC1 Amb23440686 [0,1,0,1,0,0|2,0,0]=4 2465 B13R1.141 CCCC1CCC(N)CC1C(=O)O Amb32866496 [0,1,0,1,0,0|2,0,0]=4 2466 B13R1.141 CCCC1CCC(O)CC1C(=O)O Amb32867810 [0,1,0,1,0,0|2,0,0]=4 2467 B13R1.159 C=C(C)CCC1(N)CCCCC1C Amb35657814 [0,1,0,1,0,0|2,0,0]=4 2468 B13R1.159 CC(C)=CCC1(N)CCCCC1C Amb35642679 [0,1,0,1,0,0|2,0,0]=4 2469 B13R1.159 CC(C)OCC1(O)CCCCC1C Amb28070732 [0,1,0,1,0,0|1,0,1]=4 2470 B13R1.159 CC1CCCCC1(O)CCC(N)=O Amb27758683 [0,1,0,1,0,0|2,0,0]=4 2471 B13R1.344 NC(CCC(=O)O)CC1CCCC1 Amb19045804 [0,1,0,1,0,0|2,0,0]=4 2472 B13R1.2135 CO[C@@H]1CCC[C@@H](O)[C@H]1CC(C)=O Amb27427704 [0,1,0,1,0,0|2,0,0]=4 2473 B13R1.8682 C=C(C)CCC1(N)CCCCCC1 Amb35649480 [0,1,0,1,0,0|2,0,0]=4 2474 B13R1.8682 CC(=O)NCC1(N)CCCCCC1 Amb27802154 [0,1,0,1,0,0|1,0,0]=3 2475 B13R1.8682 CC(C)=CCC1(N)CCCCCC1 Amb30029642 [0,1,0,1,0,0|2,0,0]=4 2476 B13R1.8682 CS(=O)CCC1(N)CCCCCC1 Amb28430271 [0,1,0,1,0,0|2,0,0]=4 2477 B13R1.8682 CS(=O)NCC1(O)CCCCCC1 Amb28399216 [0,1,0,1,0,0|2,0,0]=4 2478 B13R1.8682 NC1(CCC(=O)O)CCCCCC1 Amb18822376 [0,1,0,1,0,0|2,0,0]=4 2479 B13R1.589 CC(=O)C1CCCCN1CC(C)C Amb27187202 [0,1,0,1,0,0|2,0,0]=4 2480 B13R1.589 CC(=O)N1CCNCC1CC(C)C Amb17578367 [0,1,0,1,0,0|2,0,0]=4 2481 B13R1.589 CC(=O)N1CCOCC1CC(C)C Amb27802152 [0,1,0,1,0,0|2,0,0]=4 2482 B13R1.589 CC(=O)N1CCOCC1CC(C)O Amb28249470 [0,1,0,1,0,0|2,0,0]=4 2483 B13R1.589 CC(=O)NC1CCCCC1N(C)C Amb26375210 [0,1,0,1,0,0|2,0,0]=4 2484 B13R1.589 CC(=O)N[C@@H]1CCCC[C@@H]1N(C)C Amb27213883 [0,1,0,1,0,0|2,0,0]=4 2485 B13R1.589 CC(=O)OC1CCCCC1C(=O)Cl Amb25222643 [0,1,0,1,0,0|1,0,1]=4 2486 B13R1.589 CC(=O)O[C@@H]1CCCC[C@H]1C(=O)Cl Amb27409374 [0,1,0,1,0,0|1,0,1]=4 2487 B13R1.589 CC(C)C1CCCCC1CC(=O)O Amb28044620 [0,1,0,1,0,0|2,0,0]=4 2488 B13R1.589 CC(C)C1CCCCC1NC(=O)Cl Amb35625911 [0,1,0,1,0,0|2,0,0]=4 2489 B13R1.589 CC(C)C1CCCCC1OC(=O)Cl Amb33297334 [0,1,0,1,0,0|1,0,0]=3 2490 B13R1.589 CC(C)CC1CCCCN1C(=O)Cl Amb33296873 [0,1,0,1,0,0|2,0,0]=4 2491 B13R1.1082 CC(=O)C1CCCCCC1C(C)C Amb35725697 [0,1,0,1,0,0|1,0,0]=3 2492 B13R1.1082 CC(=O)N1CCCCCC1C(C)C Amb27753551 [0,1,0,1,0,0|1,0,0]=3 2493 B13R1.1082 CC(C)C1CCCCCC1C(=O)Cl Amb24399876 [0,1,0,1,0,0|2,0,0]=4 2494 B13R1.3575 C=C(C)CCC1CCCCC1(C)O Amb32944678 [0,1,0,1,0,0|2,0,0]=4 2495 B13R1.3575 C=C(C)CC[C@@H]1CCCC[C@@]1(C)O Amb32944275 [0,1,0,1,0,0|2,0,0]=4 2496 B13R1.3575 CC(=O)CCC1CCCCC1(F)F Amb27427314 [0,1,0,1,0,0|2,0,0]=4 2497 B13R1.3575 CC(=O)NCC1NCCCC1(C)C Amb27869957 [0,1,0,1,0,0|2,0,0]=4 2498 B13R1.3575 CC(C)OCC1CCCCC1(C)O Amb32944573 [0,1,0,1,0,0|1,0,1]=4 2499 B13R1.3575 CC(C)OC[C@@H]1CCCC[C@@]1(C)O Amb32945255 [0,1,0,1,0,0|1,0,1]=4 2500 B13R1.3575 CC1(C)CCCCC1CCC(=O)O Amb33470261 [0,1,0,1,0,0|2,0,0]=4 2501 B13R1.3576 CC(=O)N1CCCC1CNC(C)C Amb21861194 [0,1,0,1,0,0|2,0,0]=4 2502 B13R1.3576 CC(=O)NCC1CCOC1C(C)C Amb28454733 [0,1,0,1,0,0|2,0,0]=4 2503 B13R1.3576 CC(=O)NC[C@H]1CCO[C@@H]1C(C)C Amb27254715 [0,1,0,1,0,0|2,0,0]=4 2504 B13R1.1462 CCCC(C)N1CCCNC(=O)C1 Amb27823898 [0,1,0,1,0,0|2,0,0]=4 2505 B13R1.3485 CC(=O)NCCN1CC(C)CC1C Amb27431214 [0,1,0,1,0,0|2,0,0]=4 2506 B13R1.3485 CC(=O)NCCN1CC(O)CC1C Amb27456156 [0,1,0,1,0,0|2,0,0]=4 2507 B13R1.3780 NC(=O)OC1CCCC(=O)CCC1 Amb27955268 [0,1,0,1,0,0|1,0,1]=4 2508 B13R2.7 CCC1CCCC12CC(=O)CO2 Amb35734224 [0,0,0,2,0,0|2,0,0]=4 2509 B13R2.7 CCC1CCCC12CC(=O)NN2 Amb35701168 [0,0,0,2,0,0|2,0,0]=4 2510 B13R2.7 CCC1CCCC12COC(N)=N2 Amb27645779 [0,0,0,2,0,0|2,0,0]=4 2511 B13R2.7 CCC1COCC12CNC(=O)C2 Amb35635815 [0,0,0,2,0,0|2,0,0]=4 2512 B13R2.7 CCC1COCC12COC(=O)N2 Amb35616378 [0,0,0,2,0,0|2,0,0]=4 2513 B13R2.7 CO[C@@H]1CCC[C@]12COC(=O)N2 Amb28207277 [0,0,0,2,0,0|2,0,0]=4 2514 B13R2.10 CC1=NC(C2CCCCC2)CN1 Amb30021254 [0,0,0,2,0,0|2,0,0]=4 2515 B13R2.10 O=C1CC(C2CCCCC2)CN1 Amb22411524 [0,0,0,2,0,0|1,0,0]=3 2516 B13R2.10 O=C1CC(C2CCCCC2)NN1 Amb29862141 [0,0,0,2,0,0|2,0,0]=4 2517 B13R2.10 O=C1CC(C2CCCCN2)CN1 Amb24465692 [0,0,0,2,0,0|2,0,0]=4 2518 B13R2.10 O=C1CC(C2CCCCO2)CN1 Amb33225553 [0,0,0,2,0,0|2,0,0]=4 2519 B13R2.10 O=C1CC(C2CCCNC2)CN1 Amb25222027 [0,0,0,2,0,0|2,0,0]=4 2520 B13R2.10 O=C1CC(C2CCCOC2)CN1 Amb27836310 [0,0,0,2,0,0|2,0,0]=4 2521 B13R2.10 O=C1CC(C2CCCSC2)CN1 Amb32726154 [0,0,0,2,0,0|2,0,0]=4 2522 B13R2.10 O=C1CC(C2CCNCC2)CN1 Amb25763191 [0,0,0,2,0,0|2,0,0]=4 2523 B13R2.10 O=C1CC(C2CCNCC2)CN1 Amb32667183 [0,0,0,2,0,0|2,0,0]=4 2524 B13R2.10 O=C1CC(C2CCOCC2)CN1 Amb26957451 [0,0,0,2,0,0|2,0,0]=4 2525 B13R2.10 O=C1CCC(C2CCCCC2)N1 Amb27973556 [0,0,0,2,0,0|2,0,0]=4 2526 B13R2.10 O=C1COC(C2CCCCC2)C1 Amb28324356 [0,0,0,2,0,0|2,0,0]=4 2527 B13R2.10 O=C1C[C@@H](C2CCCCC2)CN1 Amb27174216 [0,0,0,2,0,0|1,0,0]=3 2528 B13R2.10 O=C1NC(C2CCCCC2)CO1 Amb24422007 [0,0,0,2,0,0|1,0,0]=3 2529 B13R2.10 O=C1NC(C2CCCCO2)CO1 Amb33377390 [0,0,0,2,0,0|2,0,0]=4 2530 B13R2.10 O=C1NC(C2CCCOC2)CO1 Amb27782296 [0,0,0,2,0,0|2,0,0]=4 2531 B13R2.10 O=C1NC(C2CCCSC2)CO1 Amb27465345 [0,0,0,2,0,0|2,0,0]=4 2532 B13R2.10 O=C1NC(C2CCNCC2)CO1 Amb23538726 [0,0,0,2,0,0|2,0,0]=4 2533 B13R2.10 O=C1NC(C2CCNCC2)CO1 Amb30585047 [0,0,0,2,0,0|2,0,0]=4 2534 B13R2.10 O=C1NC(C2CCOCC2)CO1 Amb27614589 [0,0,0,2,0,0|2,0,0]=4 2535 B13R2.10 O=C1NCC(C2CCCCC2)O1 Amb27595140 [0,0,0,2,0,0|2,0,0]=4 2536 B13R2.10 O=C1NCC(C2CCCCC2)S1 Amb28367673 [0,0,0,2,0,0|2,0,0]=4 2537 B13R2.10 O=C1N[C@H](C2CCCCC2)CO1 Amb28130263 [0,0,0,2,0,0|1,0,0]=3 2538 B13R2.51 CC[C@@H]1C[C@H]1CN2CCC(=O)C2 Amb27266213 [0,0,0,2,0,0|2,0,0]=4 2539 B13R2.142 O=C1CC(CC2CCCC2)CN1 Amb25064533 [0,0,0,2,0,0|1,0,0]=3 2540 B13R2.142 O=C1CC(CC2CCCC2)NN1 Amb35694141 [0,0,0,2,0,0|2,0,0]=4 2541 B13R2.142 O=C1CC(NC2CCCC2)CN1 Amb27780632 [0,0,0,2,0,0|2,0,0]=4 2542 B13R2.142 O=C1CCC(SC2CCCC2)C1 Amb27235443 [0,0,0,2,0,0|2,0,0]=4 2543 B13R2.142 O=C1COC(CC2CCCC2)C1 Amb35734234 [0,0,0,2,0,0|2,0,0]=4 2544 B13R2.142 O=C1NC(CC2CCCC2)CO1 Amb24600592 [0,0,0,2,0,0|1,0,0]=3 2545 B13R2.142 O=C1NCC(CC2CCCC2)O1 Amb26980342 [0,0,0,2,0,0|2,0,0]=4 2546 B13R2.144 CC1OCCC1C2CNC(=O)C2 Amb33426791 [0,0,0,2,0,0|2,0,0]=4 2547 B13R2.144 CC1OCCC1C2COC(=O)N2 Amb33426785 [0,0,0,2,0,0|2,0,0]=4 2548 B13R2.145 CC1CCC1NC2CNC(=O)C2 Amb27829106 [0,0,0,2,0,0|2,0,0]=4 2549 B13R2.259 O=C1C[C@H]2OC[C@@H](CCO)[C@H]2O1 Amb27184233 [0,0,0,2,0,0|2,0,0]=4 2550 B13R2.389 O=C1CC2CCCCC(O)C2O1 Amb27757311 [0,0,0,2,0,0|1,0,0]=3 2551 B13R2.389 O=C1C[C@@H]2CCCCC(=O)[C@H]2O1 Amb27427756 [0,0,0,2,0,0|1,0,1]=4 2552 B13R2.389 O=C1C[C@H]2CCCCC(=O)[C@H]2O1 Amb27802452 [0,0,0,2,0,0|1,0,1]=4 2553 B13R2.389 O=C1C[C@H]2CCCC[C@H](O)[C@H]2O1 Amb27197200 [0,0,0,2,0,0|1,0,0]=3 2554 B13R2.390 O=C1CCCC[C@H]2CC[C@@H](O)[C@@H]12 Amb27802450 [0,0,0,2,0,0|2,0,0]=4 2555 B13R2.390 O=C1CC[C@@H]2CCCC[C@H](O)[C@H]12 Amb27428029 [0,0,0,2,0,0|2,0,0]=4 2556 B13R2.390 O=C1CC[C@H]2CCCC[C@@H](O)[C@H]12 Amb27199061 [0,0,0,2,0,0|2,0,0]=4 2557 B13R2.513 O=C1CCC2CC(CCCO)C12 Amb27177903 [0,0,0,2,0,0|2,0,0]=4 2558 B13R2.581 CCC1CCCC2CC(=O)CN12 Amb27599401 [0,0,0,2,0,0|2,0,0]=4 2559 B13R2.582 COC1CCCC2COC(=O)N21 Amb27490759 [0,0,0,2,0,0|2,0,0]=4 2560 B13R2.2974 O=C1CC(CNC2CCC2)CN1 Amb27959549 [0,0,0,2,0,0|2,0,0]=4 2561 B13R2.3672 O=C1CCC2CCCCCCC12 Amb28202072 [0,0,0,2,0,0|1,0,0]=3 2562 B13R2.3672 O=C1OCC2=C1CCCCCC2 Amb28255592 [0,0,0,2,0,0|0,0,2]=4 2563 B13R2.4688 NC1=NC2CCCCCCC2O1 Amb27214155 [0,0,0,2,0,0|2,0,0]=4 2564 B13R2.4688 O=C1C=C2CCCCCCC2C1 Amb27175871 [0,0,0,2,0,0|1,0,1]=4 2565 B13R2.4688 O=C1CC2CCCCCCC2C1 Amb28351616 [0,0,0,2,0,0|1,0,0]=3 2566 B13R2.4688 O=C1CC2CCCCCCC2N1 Amb28340979 [0,0,0,2,0,0|1,0,0]=3 2567 B13R2.4688 O=C1N[C@H]2CCCCCC[C@H]2O1 Amb27201637 [0,0,0,2,0,0|1,0,0]=3 2568 B13R2.4688 OC1C[C@H]2CCCCCC[C@@H]2O1 Amb27423114 [0,0,0,2,0,0|0,0,2]=4 2569 B13R2.5023 CC1CCCCC12CC(=O)NN2 Amb32667477 [0,0,0,2,0,0|2,0,0]=4 2570 B13R2.5023 CC1CCCCC12COC(=O)N2 Amb28141676 [0,0,0,2,0,0|1,0,0]=3 2571 B13R2.5023 CC1CCCCC12COC(N)=N2 Amb27488033 [0,0,0,2,0,0|2,0,0]=4 2572 B13R2.5023 CC1CCCC[C@]12CCC(=O)C2 Amb28126666 [0,0,0,2,0,0|1,0,0]=3 2573 B13R2.5023 CC1SCCCC12CNC(=O)C2 Amb28043515 [0,0,0,2,0,0|2,0,0]=4 2574 B13R2.5023 C[C@@H]1CCCC[C@]12C=CC(=O)C2 Amb27626907 [0,0,0,2,0,0|1,0,1]=4 2575 B13R2.5023 C[C@@H]1CCCC[C@]12CCC(=O)C2 Amb28248005 [0,0,0,2,0,0|1,0,0]=3 2576 B13R2.5023 C[C@H]1CCCC[C@@]12C=CC(=O)C2 Amb27489093 [0,0,0,2,0,0|1,0,1]=4 2577 B13R2.5023 C[C@H]1CCCC[C@@]12CCC(=O)C2 Amb28054352 [0,0,0,2,0,0|1,0,0]=3 2578 B13R2.5023 C[C@H]1CCCC[C@]12CNC(=O)O2 Amb28251125 [0,0,0,2,0,0|2,0,0]=4 2579 B13R2.5023 O=C1CC[C@]2(CCCC[C@@H]2O)C1 Amb28324294 [0,0,0,2,0,0|2,0,0]=4 2580 B13R2.13132 O=C1C=CC2(CCCCCC2)C1 Amb26399380 [0,0,0,2,0,0|1,0,1]=4 2581 B13R2.13132 O=C1CC2(CCCCCC2)CN1 Amb10608002 [0,0,0,2,0,0|1,0,0]=3 2582 B13R2.13132 O=C1CC2(CCCCCC2)NN1 Amb30019352 [0,0,0,2,0,0|2,0,0]=4 2583 B13R2.13132 O=C1CC2(CCCNCC2)CN1 Amb25978859 [0,0,0,2,0,0|2,0,0]=4 2584 B13R2.13132 O=C1CC2(CCCNCC2)CN1 Amb33484209 [0,0,0,2,0,0|2,0,0]=4 2585 B13R2.13132 O=C1CC2(CCCOCC2)CN1 Amb26398528 [0,0,0,2,0,0|2,0,0]=4 2586 B13R2.13132 O=C1CC2(CCCSCC2)CN1 Amb35610982 [0,0,0,2,0,0|2,0,0]=4 2587 B13R2.13132 O=C1NC2(CCCSCC2)CO1 Amb35610979 [0,0,0,2,0,0|2,0,0]=4 2588 B13R2.13132 S=C1CC2(CCCCCC2)CN1 Amb24465059 [0,0,0,2,0,0|1,1,0]=4 2589 B13R2.13132 S=C1NC2(CCCCCC2)CO1 Amb27864027 [0,0,0,2,0,0|1,1,0]=4 2590 B13R2.13 O=C1CC(C2CCCC2)CCN1 Amb27618311 [0,0,0,2,0,0|1,0,0]=3 2591 B13R2.13 O=C1CC(C2CCCC2)CCO1 Amb27438645 [0,0,0,2,0,0|0,0,0]=2 2592 B13R2.13 O=C1CCCC(C2CCCC2)C1 Amb27494299 [0,0,0,2,0,0|1,0,0]=3 2593 B13R2.13 O=C1CCCC(C2CCOC2)C1 Amb25152573 [0,0,0,2,0,0|2,0,0]=4 2594 B13R2.13 O=C1CCCN(C2CCCC2)C1 Amb10603078 [0,0,0,2,0,0|2,0,0]=4 2595 B13R2.13 O=C1CCOC(C2CCCC2)C1 Amb28146616 [0,0,0,2,0,0|2,0,0]=4 2596 B13R2.136 CO[C@@H]1C[C@@H]1C2CCCC(=O)C2 Amb27781993 [0,0,0,2,0,0|2,0,0]=4 2597 B13R2.153 CC1CC1CN2CCNC(=O)C2 Amb27834815 [0,0,0,2,0,0|2,0,0]=4 2598 B13R2.486 CCCCC1C2CCC1C(=O)C2 Amb27861493 [0,0,0,2,0,0|1,0,0]=3 2599 B13R2.486 CCCC[C@@H]1[C@@H]2CC[C@H]1C(=O)C2 Amb28052421 [0,0,0,2,0,0|1,0,0]=3 2600 B13R2.486 CCCC[C@H]1[C@@H]2CC[C@H]1C(=O)C2 Amb27785530 [0,0,0,2,0,0|1,0,0]=3 2601 B13R2.596 CCC1CNC2CC(=O)CC1C2 Amb27967263 [0,0,0,2,0,0|2,0,0]=4 2602 B13R2.3021 O=C1CCCC(CN2CCC2)C1 Amb30013872 [0,0,0,2,0,0|2,0,0]=4 2603 B13R2.3021 O=C1CN(CC2CCC2)CCN1 Amb27977214 [0,0,0,2,0,0|2,0,0]=4 2604 B13R2.3473 CC1CCCC12CCCC(=O)C2 Amb27854953 [0,0,0,2,0,0|1,0,0]=3 2605 B13R2.3473 C[C@H]1CCC[C@@]12CCCC(=O)C2 Amb27211892 [0,0,0,2,0,0|1,0,0]=3 2606 B13R2.3473 O=C1CCC[C@@]2(CCC[C@@H]2Cl)C1 Amb28052053 [0,0,0,2,0,0|2,0,0]=4 2607 B13R2.3473 O=C1CCC[C@@]2(CCC[C@@H]2O)C1 Amb27267055 [0,0,0,2,0,0|2,0,0]=4 2608 B13R2.3477 O=C1CC2CCC[C@@H](Cl)C1CC2 Amb27477815 [0,0,0,2,0,0|2,0,0]=4 2609 B13R2.3729 O=C1CCC2CCCNCC2N1 Amb28397430 [0,0,0,2,0,0|2,0,0]=4 2610 B13R2.3729 O=C1CCC2CCNCCC2N1 Amb27593578 [0,0,0,2,0,0|2,0,0]=4 2611 B13R2.3729 O=C1CCC2CNCCCC2N1 Amb27614658 [0,0,0,2,0,0|2,0,0]=4 2612 B13R2.3729 O=C1CC[C@@H]2CCCNC[C@H]2N1 Amb18826475 [0,0,0,2,0,0|2,0,0]=4 2613 B13R2.3729 O=C1CC[C@@H]2CCNCC[C@H]2N1 Amb18826473 [0,0,0,2,0,0|2,0,0]=4 2614 B13R2.3729 O=C1CC[C@@H]2CNCCC[C@H]2N1 Amb18826479 [0,0,0,2,0,0|2,0,0]=4 2615 B13R2.3729 O=C1CC[C@H]2CCCCC[C@@H]2N1 Amb27663610 [0,0,0,2,0,0|1,0,0]=3 2616 B13R2.3729 O=C1NC2CCCCCC2CO1 Amb27832446 [0,0,0,2,0,0|1,0,0]=3 2617 B13R2.4668 O=C1CC2CCCCCC1CC2 Amb27177666 [0,0,0,2,0,0|1,0,0]=3 2618 B13R2.4668 O=C1C[C@H]2CCCCC[C@@H]1CC2 Amb27629639 [0,0,0,2,0,0|1,0,0]=3 2619 B13R2.4719 O=C1CC2CCCCCC(C1)C2 Amb24400472 [0,0,0,2,0,0|1,0,0]=3 2620 B13R2.4719 O=C1C[C@H]2CCCCC[C@@H](C1)C2 Amb27177986 [0,0,0,2,0,0|1,0,0]=3 2621 B13R2.4818 CC1CCCC2CC=CC(=O)C12 Amb27177883 [0,0,0,2,0,0|1,0,1]=4 2622 B13R2.4818 CC1CCCC2CCCC(=O)C12 Amb27256357 [0,0,0,2,0,0|1,0,0]=3 2623 B13R2.4818 C[C@@H]1CCC[C@@H]2CCO[C@@H](O)[C@@H]12 Amb28064042 [0,0,0,2,0,0|0,0,2]=4 2624 B13R2.4818 C[C@@H]1CCC[C@H]2CCCC(=O)[C@@H]21 Amb28429551 [0,0,0,2,0,0|1,0,0]=3 2625 B13R2.4818 C[C@H]1CCC[C@@H]2CCCC(=O)[C@H]12 Amb27427740 [0,0,0,2,0,0|1,0,0]=3 2626 B13R2.4818 C[C@H]1CCC[C@H]2CC=CC(=O)[C@H]12 Amb28202084 [0,0,0,2,0,0|1,0,1]=4 2627 B13R2.4818 O=C1CCC[C@H]2CCC[C@H](O)[C@@H]12 Amb28194567 [0,0,0,2,0,0|2,0,0]=4 2628 B13R2.4820 O=C1CCCC2=C1CCCCC2 Amb28202323 [0,0,0,2,0,0|1,0,1]=4 2629 B13R2.4820 O=C1CCCC2CCCCC=C12 Amb28461159 [0,0,0,2,0,0|1,0,1]=4 2630 B13R2.4820 O=C1CCC[C@H]2CCCCC[C@H]12 Amb27212437 [0,0,0,2,0,0|1,0,0]=3 2631 B13R2.4820 O=C1CCNC2CCCCCN12 Amb33295208 [0,0,0,2,0,0|2,0,0]=4 2632 B13R2.4820 O=C1CCOC2CCCCCC12 Amb18826487 [0,0,0,2,0,0|2,0,0]=4 2633 B13R2.4820 O=C1NCCN2CCCCCC12 Amb2692468 [0,0,0,2,0,0|2,0,0]=4 2634 B13R2.4828 O=C1CCCC2CCCC(C1)C2 Amb28351584 [0,0,0,2,0,0|1,0,0]=3 2635 B13R2.4828 O=C1CCC[C@@H]2CCC[C@H](C1)C2 Amb27854596 [0,0,0,2,0,0|1,0,0]=3 2636 B13R2.5179 CC1CCCC2NC(=O)CCC12 Amb27815132 [0,0,0,2,0,0|2,0,0]=4 2637 B13R2.5179 CC1NCCC2CC(=O)CCC21 Amb27259415 [0,0,0,2,0,0|2,0,0]=4 2638 B13R2.5179 CN1CCCC2CC(=O)CCC21 Amb27876196 [0,0,0,2,0,0|2,0,0]=4 2639 B13R2.5179 C[C@@H]1CCC[C@@H]2CC(=O)CCN12 Amb27428327 [0,0,0,2,0,0|2,0,0]=4 2640 B13R2.5179 C[C@H]1CCC[C@@H]2NC(=O)CC[C@H]12 Amb27790359 [0,0,0,2,0,0|2,0,0]=4 2641 B13R2.5179 C[C@H]1NCC[C@@H]2CC(=O)CC[C@@H]21 Amb27876628 [0,0,0,2,0,0|2,0,0]=4 2642 B13R2.5179 O=C1CC2CCCC(=O)C2CO1 Amb28322045 [0,0,0,2,0,0|1,0,1]=4 2643 B13R2.5179 O=C1C[C@@H]2CCCC(=O)[C@H]2CO1 Amb27261987 [0,0,0,2,0,0|1,0,1]=4 2644 B13R2.5331 O=C1CCOC(CCC2CC2)C1 Amb27231985 [0,0,0,2,0,0|2,0,0]=4 2645 B13R2.11128 CC1NC2(CCCCC2)CCO1 Amb33193841 [0,0,0,2,0,0|1,0,1]=4 2646 B13R2.11128 O=C1CC2(CCCCC2)CCN1 Amb28288238 [0,0,0,2,0,0|1,0,0]=3 2647 B13R2.11128 O=C1CC2(CCCCC2)CCO1 Amb24737335 [0,0,0,2,0,0|0,0,0]=2 2648 B13R2.11128 O=C1CC2(CCNCC2)CCN1 Amb18559404 [0,0,0,2,0,0|2,0,0]=4 2649 B13R2.11128 O=C1CC2(CCNCC2)CCN1 Amb24179151 [0,0,0,2,0,0|2,0,0]=4 2650 B13R2.11128 O=C1CC2(CCNCC2)CCN1 Amb33714472 [0,0,0,2,0,0|2,0,0]=4 2651 B13R2.11128 O=C1CCCC2(CCCCC2)C1 Amb4009192 [0,0,0,2,0,0|1,0,0]=3 2652 B13R2.11128 O=C1CCCC2(CCCCC2)N1 Amb25150848 [0,0,0,2,0,0|2,0,0]=4 2653 B13R2.11128 O=C1CCNC2(CCCCC2)C1 Amb18826926 [0,0,0,2,0,0|2,0,0]=4 2654 B13R2.11128 O=C1CCOC2(CCCCC2)C1 Amb18826491 [0,0,0,2,0,0|2,0,0]=4 2655 B13R2.11128 O=C1CCSC2(CCCCC2)C1 Amb18822698 [0,0,0,2,0,0|2,0,0]=4 2656 B13R2.11128 O=C1NC2(CCCNC2)CCO1 Amb25756619 [0,0,0,2,0,0|2,0,0]=4 2657 B13R2.11128 O=C1NC2(CCNCC2)CCO1 Amb23440221 [0,0,0,2,0,0|2,0,0]=4 2658 B13R2.11128 O=C1NCCC2(CCCCC2)N1 Amb27186676 [0,0,0,2,0,0|2,0,0]=4 2659 B13R2.11128 O=C1NCCC2(CCCCC2)O1 Amb26587318 [0,0,0,2,0,0|2,0,0]=4 2660 B13R2.31 O=C1CC(CC2CCCCC2)N1 Amb27874554 [0,0,0,2,0,0|1,0,0]=3 2661 B13R2.31 O=C1CC(CN2CCCCC2)N1 Amb27389344 [0,0,0,2,0,0|2,0,0]=4 2662 B13R2.31 O=C1C[C@@H](CN2CCCCC2)N1 Amb27600063 [0,0,0,2,0,0|2,0,0]=4 2663 B13R2.90 COC1CCCCC12CC(=O)N2 Amb27179822 [0,0,0,2,0,0|2,0,0]=4 2664 B13R2.216 O=C1CC(C2CCCCC2O)N1 Amb27948675 [0,0,0,2,0,0|2,0,0]=4 2665 B13R2.216 O=C1C[C@H]([C@@H]2CCCC[C@@H]2O)N1 Amb28287306 [0,0,0,2,0,0|2,0,0]=4 2666 B13R2.458 CCCC1COCC12CC(=O)N2 Amb35616389 [0,0,0,2,0,0|2,0,0]=4 2667 B13R2.3475 CC1CCCCCC12CC(=O)N2 Amb35734084 [0,0,0,2,0,0|1,0,0]=3 2668 B13R2.4776 O=C1CC2(CCCCCCC2)N1 Amb27761969 [0,0,0,2,0,0|1,0,0]=3 2669 B13R2.4787 O=C1C[C@H]2CCCCCCC[C@H]12 Amb27433087 [0,0,0,2,0,0|1,0,0]=3 2670 B13R2.4787 O=C1NC2CCCCCCCC12 Amb27646369 [0,0,0,2,0,0|1,0,0]=3 2671 B13R2.4787 O=C1N[C@H]2CCCCCCC[C@@H]12 Amb27983514 [0,0,0,2,0,0|1,0,0]=3 2672 B13R2.4787 O=C1N[C@H]2CCCCCCC[C@H]12 Amb27841212 [0,0,0,2,0,0|1,0,0]=3 2673 B13R2.5283 O=C1CC(C2CCCCCC2)N1 Amb27475547 [0,0,0,2,0,0|1,0,0]=3 2674 B13R2.72 CC(=N)N1CCC2CCCCC21 Amb27661782 [0,0,0,2,0,0|2,0,0]=4 2675 B13R2.72 CC(=O)C1CC[C@H]2CCCC[C@@H]12 Amb27212467 [0,0,0,2,0,0|1,0,0]=3 2676 B13R2.72 CC(=O)C1COC2CCCCC21 Amb27660788 [0,0,0,2,0,0|2,0,0]=4 2677 B13R2.72 CC(=O)N1CCC2CCCCC21 Amb27178271 [0,0,0,2,0,0|1,0,0]=3 2678 B13R2.72 CC(=O)N1CCC2NCCCC21 Amb32678625 [0,0,0,2,0,0|2,0,0]=4 2679 B13R2.72 CC(=O)N1CC[C@@H]2CCCC[C@@H]21 Amb28208619 [0,0,0,2,0,0|1,0,0]=3 2680 B13R2.72 CC(=O)N1CC[C@@H]2CCNC[C@@H]21 Amb33100504 [0,0,0,2,0,0|2,0,0]=4 2681 B13R2.72 NC(=O)C1CC[C@H]2CCCC[C@@H]12 Amb27252173 [0,0,0,2,0,0|2,0,0]=4 2682 B13R2.72 NC(=O)N1CCC2CCCCC21 Amb27965961 [0,0,0,2,0,0|2,0,0]=4 2683 B13R2.72 NC(=O)N1CC[C@@H]2CCCC[C@@H]21 Amb27247492 [0,0,0,2,0,0|2,0,0]=4 2684 B13R2.72 O=C(Cl)N1CCC2CCCCC21 Amb27444086 [0,0,0,2,0,0|2,0,0]=4 2685 B13R2.72 O=C(Cl)N1CC[C@@H]2CCCC[C@@H]21 Amb27856323 [0,0,0,2,0,0|2,0,0]=4 2686 B13R2.72 O=C(O)C1CCC2CCCCC21 Amb27805919 [0,0,0,2,0,0|2,0,0]=4 2687 B13R2.72 O=C(O)C1CC[C@@H]2CCCC[C@H]12 Amb27858685 [0,0,0,2,0,0|2,0,0]=4 2688 B13R2.72 O=C(O)C1CC[C@H]2CCCCC12 Amb28290328 [0,0,0,2,0,0|2,0,0]=4 2689 B13R2.72 O=C(O)[C@@H]1CC[C@@H]2CCCC[C@H]21 Amb27201330 [0,0,0,2,0,0|2,0,0]=4 2690 B13R2.72 O=C(O)[C@@H]1CC[C@H]2CCCC[C@H]21 Amb27204924 [0,0,0,2,0,0|2,0,0]=4 2691 B13R2.72 O=C(O)[C@H]1CC[C@@H]2CCCC[C@H]21 Amb27232967 [0,0,0,2,0,0|2,0,0]=4 2692 B13R2.72 O=C(O)[C@H]1CC[C@H]2CCCC[C@@H]12 Amb28457533 [0,0,0,2,0,0|2,0,0]=4 2693 B13R2.163 NC1=NCCC2CCCCC2C1 Amb27657800 [0,0,0,2,0,0|2,0,0]=4 2694 B13R2.163 O=C1C=C2CCCCC2CCC1 Amb27177506 [0,0,0,2,0,0|1,0,1]=4 2695 B13R2.163 O=C1CC2CCCCN2CCN1 Amb26316859 [0,0,0,2,0,0|2,0,0]=4 2696 B13R2.163 O=C1CCC[C@@H]2CCCC[C@@H]2C1 Amb28457521 [0,0,0,2,0,0|1,0,0]=3 2697 B13R2.163 O=C1CCC[C@@H]2CCCC[C@H]2N1 Amb27220587 [0,0,0,2,0,0|1,0,0]=3 2698 B13R2.163 O=C1CCC[C@@H]2CCNC[C@H]2N1 Amb18826477 [0,0,0,2,0,0|2,0,0]=4 2699 B13R2.163 O=C1CCC[C@@H]2CNCC[C@H]2N1 Amb18826481 [0,0,0,2,0,0|2,0,0]=4 2700 B13R2.163 O=C1CCSC2CCCCC2N1 Amb28364400 [0,0,0,2,0,0|2,0,0]=4 2701 B13R2.163 O=C1COC[C@@H]2CCCC[C@@H]2N1 Amb27662094 [0,0,0,2,0,0|2,0,0]=4 2702 B13R2.163 O=C1COC[C@H]2CCCC[C@@H]2N1 Amb27790258 [0,0,0,2,0,0|2,0,0]=4 2703 B13R2.163 O=C1NCC[C@@H]2CCCC[C@H]2O1 Amb32992735 [0,0,0,2,0,0|1,0,0]=3 2704 B13R2.163 S=C1CCCC2CCCCC2N1 Amb28240524 [0,0,0,2,0,0|1,1,0]=4 2705 B13R2.328 CC1CC(=N)NC2CCCCC12 Amb27770309 [0,0,0,2,0,0|2,0,0]=4 2706 B13R2.328 CC1CC(=O)C2CCCCC2N1 Amb9782239 [0,0,0,2,0,0|2,0,0]=4 2707 B13R2.328 CC1CC(=O)C2CCCCC2O1 Amb18199232 [0,0,0,2,0,0|2,0,0]=4 2708 B13R2.328 CC1CC(=O)CC2CCCCC12 Amb27954151 [0,0,0,2,0,0|1,0,0]=3 2709 B13R2.328 CC1CC(=O)NC2CCCCC12 Amb27752074 [0,0,0,2,0,0|1,0,0]=3 2710 B13R2.328 CC1CC(=O)[C@H]2CCCC[C@@H]2N1 Amb27440499 [0,0,0,2,0,0|2,0,0]=4 2711 B13R2.328 CC1CC(O)OC2CCCCC12 Amb27416939 [0,0,0,2,0,0|0,0,2]=4 2712 B13R2.328 CC1NC(=O)NC2CCCCC12 Amb27484875 [0,0,0,2,0,0|2,0,0]=4 2713 B13R2.328 CC1OC(=O)CC2CCCCC21 Amb28251218 [0,0,0,2,0,0|2,0,0]=4 2714 B13R2.328 CN1CC(=O)C[C@H]2CCCC[C@@H]21 Amb28253788 [0,0,0,2,0,0|2,0,0]=4 2715 B13R2.328 CN1CC(=O)N2CCCCC2C1 Amb24708117 [0,0,0,2,0,0|2,0,0]=4 2716 B13R2.328 CN1CC(=O)[C@H]2CCCC[C@H]2C1 Amb27785509 [0,0,0,2,0,0|2,0,0]=4 2717 B13R2.328 C[C@@H]1CC(=O)[C@@H]2CCCC[C@H]2N1 Amb10608385 [0,0,0,2,0,0|2,0,0]=4 2718 B13R2.328 C[C@@H]1CC(=O)[C@H]2CCCC[C@@H]2N1 Amb22757987 [0,0,0,2,0,0|2,0,0]=4 2719 B13R2.328 C[C@@H]1OC(=O)N[C@H]2CCCC[C@@H]21 Amb27818042 [0,0,0,2,0,0|2,0,0]=4 2720 B13R2.328 C[C@H]1CC(=O)C[C@@H]2CCCCN12 Amb27789899 [0,0,0,2,0,0|2,0,0]=4 2721 B13R2.328 C[C@H]1CC(=O)[C@@H]2CCCC[C@@H]2N1 Amb27794463 [0,0,0,2,0,0|2,0,0]=4 2722 B13R2.328 C[C@H]1CC(=O)[C@@H]2CCCC[C@H]2N1 Amb10608650 [0,0,0,2,0,0|2,0,0]=4 2723 B13R2.328 O=C1CC(O)C2CCCCC2C1 Amb27176018 [0,0,0,2,0,0|2,0,0]=4 2724 B13R2.328 O=C1CC(O)C2CCCCC2O1 Amb27665502 [0,0,0,2,0,0|1,0,0]=3 2725 B13R2.545 O=C(O)CC1CCCCC12CC2 Amb18826489 [0,0,0,2,0,0|2,0,0]=4 2726 B13R2.689 CC(=O)CN1C2CCCC1CC2 Amb27784422 [0,0,0,2,0,0|2,0,0]=4 2727 B13R2.1282 CC(=O)CN1CCC2CCC1C2 Amb27164560 [0,0,0,2,0,0|2,0,0]=4 2728 B13R2.1282 CC(=O)NC1CCC2CCC1C2 Amb27390099 [0,0,0,2,0,0|1,0,0]=3 2729 B13R2.1282 CC(=O)NC1CCC2CCC1O2 Amb28060409 [0,0,0,2,0,0|2,0,0]=4 2730 B13R2.1282 CC(=O)N[C@H]1CC[C@H]2CC[C@@H]1C2 Amb28197166 [0,0,0,2,0,0|1,0,0]=3 2731 B13R2.1282 CC(=O)OC1C=CC2CCC1C2 Amb28428394 [0,0,0,2,0,0|0,0,2]=4 2732 B13R2.1282 CC(=O)O[C@H]1CC[C@H]2CC[C@@H]1N2 Amb27633215 [0,0,0,2,0,0|1,0,0]=3 2733 B13R2.1287 CC(=O)CC1CC2CCC1CC2 Amb35721834 [0,0,0,2,0,0|1,0,0]=3 2734 B13R2.1287 CC(=O)CN1CC2CCC1CC2 Amb28122397 [0,0,0,2,0,0|2,0,0]=4 2735 B13R2.1287 CC(=O)N[C@@H]1CN2CCC1CC2 Amb28325052 [0,0,0,2,0,0|2,0,0]=4 2736 B13R2.1287 CC(=O)N[C@H]1CN2CCC1CC2 Amb27402990 [0,0,0,2,0,0|2,0,0]=4 2737 B13R2.1287 CC(=O)OC1CN2CCC1CC2 Amb17607217 [0,0,0,2,0,0|1,0,0]=3 2738 B13R2.1287 CC(=O)OC1CN2CCC1CC2 Amb2224447 [0,0,0,2,0,0|1,0,0]=3 2739 B13R2.1287 CC(=O)OC1CN2CCC1CC2 Amb24076277 [0,0,0,2,0,0|1,0,0]=3 2740 B13R2.1287 CC(=O)OC1CN2CCC1CC2 Amb33716678 [0,0,0,2,0,0|1,0,0]=3 2741 B13R2.1287 CC(=O)O[C@@H]1CN2CCC1CC2 Amb24484246 [0,0,0,2,0,0|1,0,0]=3 2742 B13R2.1287 NC(=O)NC1CC2CCC1CC2 Amb28239816 [0,0,0,2,0,0|2,0,0]=4 2743 B13R2.1287 O=C(Cl)NC1CC2CCC1CC2 Amb35633312 [0,0,0,2,0,0|2,0,0]=4 2744 B13R2.1287 O=C(Cl)O[C@H]1CN2CCC1CC2 Amb24733531 [0,0,0,2,0,0|2,0,0]=4 2745 B13R2.1711 CC(=O)N1C2CCC1C(CN)C2 Amb32723464 [0,0,0,2,0,0|2,0,0]=4 2746 B13R2.1711 CC(=O)N1C2CCC1C(CO)C2 Amb27652716 [0,0,0,2,0,0|2,0,0]=4 2747 B13R2.2363 CC[C@@]12CCCCC1=CC(=O)C2 Amb27802739 [0,0,0,2,0,0|1,0,1]=4 2748 B13R2.2363 O=C1CC2(CO)CCCCC2N1 Amb27445872 [0,0,0,2,0,0|2,0,0]=4 2749 B13R2.2377 CCN1C2CCCC1CC(=O)C2 Amb18798931 [0,0,0,2,0,0|2,0,0]=4 2750 B13R2.3936 CC(=O)O[C@H]1CC[C@@H]2C[C@H]1C2=O Amb28351432 [0,0,0,2,0,0|1,0,1]=4 2751 B13R2.7011 CC(=O)N[C@@H]1C[C@@H]2CC[C@@H]1[C@@H]2F Amb28198017 [0,0,0,2,0,0|2,0,0]=4 2752 B13R2.7011 CC(=O)N[C@@H]1C[C@@H]2CC[C@@H]1[C@H]2F Amb28130419 [0,0,0,2,0,0|2,0,0]=4 2753 B13R2.7011 CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1[C@@H]2Cl Amb28319235 [0,0,0,2,0,0|2,0,0]=4 2754 B13R2.7011 CC(=O)OC1CC2CCC1C2Cl Amb27863808 [0,0,0,2,0,0|1,0,0]=3 2755 B13R2.7011 CC(=O)OC1CC2CCC1C2O Amb28139704 [0,0,0,2,0,0|1,0,0]=3 2756 B13R2.7011 CC(=O)O[C@@H]1C[C@H]2CC[C@@H]1[C@@H]2Cl Amb28051825 [0,0,0,2,0,0|1,0,0]=3 2757 B13R2.7011 CC(=O)O[C@@H]1C[C@H]2CC[C@@H]1[C@H]2O Amb27218927 [0,0,0,2,0,0|1,0,0]=3 2758 B13R2.7011 CC(=O)O[C@H]1C[C@@H]2CC[C@H]1[C@@H]2O Amb27652954 [0,0,0,2,0,0|1,0,0]=3 2759 B13R2.7011 CC(=O)O[C@H]1C[C@H]2CC[C@H]1C2=O Amb28349288 [0,0,0,2,0,0|1,0,1]=4 2760 B13R2.157 CC1CC(=O)N2CCCC2CN1 Amb27229237 [0,0,0,2,0,0|2,0,0]=4 2761 B13R2.210 O=C1CCC[C@@H]2CCC[C@@H]2CC1 Amb27854965 [0,0,0,2,0,0|1,0,0]=3 2762 B13R2.430 CC(=O)N1CCC2CNCC2C1 Amb27409758 [0,0,0,2,0,0|2,0,0]=4 2763 B13R2.430 CC(=O)N1CCC2COCC2C1 Amb30029152 [0,0,0,2,0,0|2,0,0]=4 2764 B13R2.430 CC(=O)N1CCN2CCCC2C1 Amb25880991 [0,0,0,2,0,0|2,0,0]=4 2765 B13R2.430 CC(=O)N1CCN2CCC[C@H]2C1 Amb27858227 [0,0,0,2,0,0|2,0,0]=4 2766 B13R2.430 CC(=O)N1CC[C@H]2CCN[C@H]2C1 Amb33100521 [0,0,0,2,0,0|2,0,0]=4 2767 B13R2.430 NC(=O)C1CCC2CCCC2C1 Amb27794843 [0,0,0,2,0,0|2,0,0]=4 2768 B13R2.430 O=C(O)[C@@H]1CC[C@H]2CCC[C@H]2C1 Amb27231830 [0,0,0,2,0,0|2,0,0]=4 2769 B13R2.430 O=C(O)[C@H]1CC[C@H]2CCC[C@@H]2C1 Amb27444600 [0,0,0,2,0,0|2,0,0]=4 2770 B13R2.687 CC(=O)CC1NCC2CCCC21 Amb26613800 [0,0,0,2,0,0|2,0,0]=4 2771 B13R2.687 CC(=O)C[C@@H]1CC[C@H]2CCC[C@@H]12 Amb27427773 [0,0,0,2,0,0|1,0,0]=3 2772 B13R2.687 CC(=O)NC1CC[C@H]2CNC[C@@H]12 Amb28320547 [0,0,0,2,0,0|2,0,0]=4 2773 B13R2.687 CC(=O)N[C@H]1CC[C@H]2CCC[C@@H]12 Amb27202556 [0,0,0,2,0,0|1,0,0]=3 2774 B13R2.687 CC(=O)OC1COC2OCCC12 Amb27178275 [0,0,0,2,0,0|2,0,0]=4 2775 B13R2.687 CC(=O)O[C@@H]1CO[C@@H]2OCC[C@H]12 Amb17614927 [0,0,0,2,0,0|2,0,0]=4 2776 B13R2.687 O=C(O)CC1CCC2CCCC21 Amb27607708 [0,0,0,2,0,0|2,0,0]=4 2777 B13R2.687 O=C(O)C[C@@H]1CC[C@H]2CCC[C@@H]12 Amb28052117 [0,0,0,2,0,0|2,0,0]=4 2778 B13R2.5537 CC(=O)NCC12CCC1CCN2 Amb33228518 [0,0,0,2,0,0|2,0,0]=4 2779 B13R2.5551 CC(=O)CCC1CC2CCC1C2 Amb27447988 [0,0,0,2,0,0|1,0,0]=3 2780 B13R2.5551 CC(=O)CCC1CC2CCC1O2 Amb32874099 [0,0,0,2,0,0|2,0,0]=4 2781 B13R2.5551 CC(=O)CCN1CC2CCC1C2 Amb18792964 [0,0,0,2,0,0|2,0,0]=4 2782 B13R2.5551 CC(=O)CC[C@@H]1C[C@@H]2CC[C@@H]1C2 Amb27974644 [0,0,0,2,0,0|1,0,0]=3 2783 B13R2.5551 CC(=O)CSC1CC2CCC1C2 Amb27835671 [0,0,0,2,0,0|2,0,0]=4 2784 B13R2.5551 CC(=O)NCC1CC2CCC1C2 Amb27982421 [0,0,0,2,0,0|1,0,0]=3 2785 B13R2.5551 CC(=O)NCC1CC2CCC1N2 Amb32723448 [0,0,0,2,0,0|2,0,0]=4 2786 B13R2.5551 CC(=O)NC[C@@H]1C[C@@H]2CC[C@H]1O2 Amb27188080 [0,0,0,2,0,0|2,0,0]=4 2787 B13R2.5551 CC(=O)OCC1CC2CCC1C2 Amb534702 [0,0,0,2,0,0|0,0,0]=2 2788 B13R2.5551 CC(=O)\C=C/[C@@H]1C[C@H]2CC[C@@H]1C2 Amb28053976 [0,0,0,2,0,0|1,0,1]=4 2789 B13R2.5551 CC(=O)\C=C\C1CC2CCC1C2 Amb33449025 [0,0,0,2,0,0|1,0,1]=4 2790 B13R2.5551 CC(=O)\C=C\[C@@H]1C[C@H]2CC[C@@H]1C2 Amb27432611 [0,0,0,2,0,0|1,0,1]=4 2791 B13R2.5551 NC(=O)CCC1CC2CCC1C2 Amb27646412 [0,0,0,2,0,0|2,0,0]=4 2792 B13R2.5551 O=C(Cl)NCC1CC2CCC1C2 Amb35625877 [0,0,0,2,0,0|2,0,0]=4 2793 B13R2.5551 O=C(O)CCC1CC2CCC1C2 Amb24692916 [0,0,0,2,0,0|2,0,0]=4 2794 B13R2.7243 CCC12CCCC1CCC(=O)C2 Amb27176087 [0,0,0,2,0,0|1,0,0]=3 2795 B13R2.33 O=C1CC[C@H]2CCCC[C@@H]2OC1 Amb28052365 [0,0,0,2,0,0|2,0,0]=4 2796 B13R2.34 CC12CCCCC1C=CC(=O)C2 Amb27854946 [0,0,0,2,0,0|1,0,1]=4 2797 B13R2.34 CC12CCCCC1CCC(=O)C2 Amb17594140 [0,0,0,2,0,0|1,0,0]=3 2798 B13R2.34 C[C@]12CCCC[C@H]1C=CC(=O)C2 Amb27493465 [0,0,0,2,0,0|1,0,1]=4 2799 B13R2.34 C[C@]12CCCC[C@H]1CCC(=O)C2 Amb28054012 [0,0,0,2,0,0|1,0,0]=3 2800 B13R2.34 C[N+]12CCCCC1CNC(=O)C2 Amb22364527 [0,0,0,2,0,0|2,0,0]=4 2801 B13R2.34 O=C1CC[C@@H]2CCCC[C@@]2(O)C1 Amb27433117 [0,0,0,2,0,0|2,0,0]=4 2802 B13R2.34 O=C1CC[C@H]2CCCC[C@]2(O)C1 Amb28144047 [0,0,0,2,0,0|2,0,0]=4 2803 B13R2.435 CC(=O)C1=C[C@@H]2CCCC[C@@H]2C1 Amb28053992 [0,0,0,2,0,0|1,0,1]=4 2804 B13R2.435 CC(=O)C1CC2CCCCN2C1 Amb27201768 [0,0,0,2,0,0|2,0,0]=4 2805 B13R2.435 CC(=O)C1C[C@H]2CCCC[C@@H]2C1 Amb28202216 [0,0,0,2,0,0|1,0,0]=3 2806 B13R2.435 CC(=O)N1C[C@@H]2CCCN[C@@H]2C1 Amb22843844 [0,0,0,2,0,0|2,0,0]=4 2807 B13R2.435 CC(=O)N1C[C@H]2CCCN[C@H]2C1 Amb28250119 [0,0,0,2,0,0|2,0,0]=4 2808 B13R2.435 NC(=O)C1CC2CCCCC2C1 Amb28428417 [0,0,0,2,0,0|2,0,0]=4 2809 B13R2.435 NC(=O)N1CC2CCCCC2C1 Amb28281463 [0,0,0,2,0,0|2,0,0]=4 2810 B13R2.435 NC(=O)N1C[C@H]2CCCC[C@H]2C1 Amb28143307 [0,0,0,2,0,0|2,0,0]=4 2811 B13R2.435 O=C(Cl)N1C[C@H]2CCCC[C@H]2C1 Amb25953869 [0,0,0,2,0,0|2,0,0]=4 2812 B13R2.435 O=C(O)C1CC2CCCCC2C1 Amb18647052 [0,0,0,2,0,0|2,0,0]=4 2813 B13R2.435 O=C(O)C1C[C@H]2CCCC[C@@H]2C1 Amb28458485 [0,0,0,2,0,0|2,0,0]=4 2814 B13R2.435 O=C(O)[C@H]1C[C@@H]2CCCC[C@@H]2C1 Amb27425241 [0,0,0,2,0,0|2,0,0]=4 2815 B13R2.3754 CC(=O)NCC12CC1CNC2C Amb27876290 [0,0,0,2,0,0|2,0,0]=4 2816 B13R2.3771 CC(=O)N1CC2CC1CCC2O Amb23596880 [0,0,0,2,0,0|2,0,0]=4 2817 B13R2.4958 CC(=O)OC1C2CCC1C(Cl)C2 Amb22365117 [0,0,0,2,0,0|1,0,0]=3 2818 B13R2.4958 CC(=O)O[C@@H]1[C@H]2CC[C@@H]1[C@@H](O)C2 Amb27790300 [0,0,0,2,0,0|1,0,0]=3 2819 B13R2.5531 CC(=N)NCC12CCCCC1C2 Amb35692037 [0,0,0,2,0,0|2,0,0]=4 2820 B13R2.5531 CC(=O)NCC12CC1CCCN2 Amb32722276 [0,0,0,2,0,0|2,0,0]=4 2821 B13R2.5531 CC(=O)NCC12CCCCC1C2 Amb35682216 [0,0,0,2,0,0|1,0,0]=3 2822 B13R2.5531 NC(=O)NCC12CCCCC1C2 Amb30010184 [0,0,0,2,0,0|2,0,0]=4 2823 B13R2.5531 O=C(Cl)NCC12CCCCC1C2 Amb35636897 [0,0,0,2,0,0|2,0,0]=4 2824 B13R2.10201 CN1C2CCCC1CC(=O)NC2 Amb25793596 [0,0,0,2,0,0|2,0,0]=4 2825 B13R2.10201 CN1C2CCC[C@@H]1CNC(=O)C2 Amb28384777 [0,0,0,2,0,0|2,0,0]=4 2826 B13R2.10201 CN1[C@H]2CCC[C@@H]1CC(=O)NC2 Amb28197191 [0,0,0,2,0,0|2,0,0]=4 2827 B13R2.11306 CC(=O)OC[C@H]1C[C@@H]2O[C@@H]2[C@H]1O Amb27427710 [0,0,0,2,0,0|2,0,0]=4 2828 B13R2.13856 CC(=N)NCC1CCCC2CC12 Amb35742599 [0,0,0,2,0,0|2,0,0]=4 2829 B13R2.13856 CC(=O)CCN1CCCC2CC21 Amb27485509 [0,0,0,2,0,0|2,0,0]=4 2830 B13R2.13856 CC(=O)CCN1CCC[C@@H]2C[C@@H]21 Amb27979251 [0,0,0,2,0,0|2,0,0]=4 2831 B13R2.13856 CC(=O)NCC1CCCC2CC12 Amb35742527 [0,0,0,2,0,0|1,0,0]=3 2832 B13R2.13856 NC(=O)NCC1CCCC2CC12 Amb35655671 [0,0,0,2,0,0|2,0,0]=4 2833 B13R2.13856 O=C(Cl)NCC1CCCC2CC12 Amb35636899 [0,0,0,2,0,0|2,0,0]=4 2834 B13R2.543 CC(=O)CN1CC2CCCC2C1 Amb27616711 [0,0,0,2,0,0|2,0,0]=4 2835 B13R2.543 CC(=O)NC1CC2CNCC2C1 Amb27956012 [0,0,0,2,0,0|2,0,0]=4 2836 B13R2.543 CC(=O)N[C@@H]1C[C@@H]2CCC[C@@H]2C1 Amb28243878 [0,0,0,2,0,0|1,0,0]=3 2837 B13R2.543 CC(=O)N[C@H]1C[C@@H]2CCC[C@@H]2C1 Amb27254220 [0,0,0,2,0,0|1,0,0]=3 2838 B13R2.543 O=C(O)CC1CC2CCCC2C1 Amb27792902 [0,0,0,2,0,0|2,0,0]=4 2839 B13R2.3732 CC(=O)C1CC[C@@H]2C(F)CC[C@H]12 Amb27256457 [0,0,0,2,0,0|2,0,0]=4 2840 B13R2.4701 CC(=O)OC1CC2CC1CC2Cl Amb27178096 [0,0,0,2,0,0|1,0,0]=3 2841 B13R2.4701 CC(=O)OC1CC2CC1CC2O Amb27651681 [0,0,0,2,0,0|1,0,0]=3 2842 B13R2.4701 CC(=O)O[C@@H]1C[C@@H]2C[C@H]1CC2=O Amb27428394 [0,0,0,2,0,0|1,0,1]=4 2843 B13R2.4701 CC(=O)O[C@@H]1C[C@@H]2C[C@H]1C[C@@H]2O Amb28196672 [0,0,0,2,0,0|1,0,0]=3 2844 B13R2.4701 CC(=O)O[C@@H]1C[C@@H]2C[C@H]1C[C@H]2Cl Amb27848043 [0,0,0,2,0,0|1,0,0]=3 2845 B13R2.4701 CC(=O)O[C@@H]1C[C@H]2C[C@@H]1CC2=O Amb27640558 [0,0,0,2,0,0|1,0,1]=4 2846 B13R2.4701 CC(=O)O[C@@H]1C[C@H]2C[C@@H]1CC2O Amb27981761 [0,0,0,2,0,0|1,0,0]=3 2847 B13R2.4701 CC(=O)O[C@H]1C[C@H]2C[C@@H]1C[C@H]2O Amb27970976 [0,0,0,2,0,0|1,0,0]=3 2848 B13R2.4701 CC(=O)O[C@H]1C[C@H]2C[C@H]1CC2=O Amb28324321 [0,0,0,2,0,0|1,0,1]=4 2849 B13R2.11877 CC(=O)C1CCC2CCC1N2C Amb27153175 [0,0,0,2,0,0|2,0,0]=4 2850 B13R2.11877 CC(=O)[C@@H]1CC[C@@H]2CC[C@H]1N2C Amb28052358 [0,0,0,2,0,0|2,0,0]=4 2851 B13R2.4746 C[C@@]12CCCCCC1=CC(=O)C2 Amb27599501 [0,0,0,2,0,0|1,0,1]=4 2852 B13R2.4746 C[C@]12CCCCC[C@@H]1CC(=O)C2 Amb28052368 [0,0,0,2,0,0|1,0,0]=3 2853 B13R2.4746 C[C@]12CCCCC[C@H]1CC(=O)C2 Amb28457464 [0,0,0,2,0,0|1,0,0]=3 2854 B13R2.5226 O=C1CCCCCCC[C@H]2C[C@@H]12 Amb27640532 [0,0,0,2,0,0|1,0,0]=3 2855 B13R2.191 CC1CC12CCCC2CC(=O)O Amb33494118 [0,0,0,2,0,0|2,0,0]=4 2856 B13R2.2326 CC(=O)N1CCCC1C2CC2N Amb27485891 [0,0,0,2,0,0|2,0,0]=4 2857 B13R2.5542 CC(=N)NCC1CCC2CC2C1 Amb35699373 [0,0,0,2,0,0|2,0,0]=4 2858 B13R2.5542 CC(=O)CCC1CCC2CC2C1 Amb35704797 [0,0,0,2,0,0|1,0,0]=3 2859 B13R2.5542 CC(=O)CCN1CCC2CC2C1 Amb35631234 [0,0,0,2,0,0|2,0,0]=4 2860 B13R2.5542 CC(=O)NCC1CCC2CC2C1 Amb35715087 [0,0,0,2,0,0|1,0,0]=3 2861 B13R2.5542 CC(=O)\C=C\C1CCC2CC2C1 Amb35598474 [0,0,0,2,0,0|1,0,1]=4 2862 B13R2.5542 NC(=O)NCC1CCC2CC2C1 Amb35714809 [0,0,0,2,0,0|2,0,0]=4 2863 B13R2.5542 O=C(Cl)NCC1CCC2CC2C1 Amb35636891 [0,0,0,2,0,0|2,0,0]=4 2864 B13R2.5542 O=C(O)CCC1CCC2CC2C1 Amb30019267 [0,0,0,2,0,0|2,0,0]=4 2865 B13R2.4761 CC(=O)OC1C(=O)CC2CCC21 Amb27256372 [0,0,0,2,0,0|1,0,1]=4 2866 B13R2.4761 CC(=O)O[C@H]1C(=O)C[C@H]2CC[C@H]21 Amb28052400 [0,0,0,2,0,0|1,0,1]=4 2867 B13R2.5549 CC(=O)NCC1CCN1C2CC2 Amb29879669 [0,0,0,2,0,0|2,0,0]=4 2868 B13R2.218 O=C1CCCCC2CCCC2C1 Amb28351378 [0,0,0,2,0,0|1,0,0]=3 2869 B13R2.218 O=C1CCCC[C@@H]2CCC[C@@H]2C1 Amb28285836 [0,0,0,2,0,0|1,0,0]=3 2870 B13R2.218 O=C1CCCC[C@@H]2CCC[C@H]2C1 Amb28199945 [0,0,0,2,0,0|1,0,0]=3 2871 B13R2.218 O=C1CCCC[C@@H]2NCC[C@H]2N1 Amb30527616 [0,0,0,2,0,0|2,0,0]=4 2872 B13R2.278 NCCC1CC(=O)N2CCCC12 Amb28197691 [0,0,0,2,0,0|2,0,0]=4 2873 B13R2.3047 O=C1NCCCNC2CCCC12 Amb27841423 [0,0,0,2,0,0|2,0,0]=4 2874 B13R2.5011 O=C1CC2CCCC(CCC2)N1 Amb27494164 [0,0,0,2,0,0|1,0,0]=3 2875 B13R2.393 O=C1CCCCC2OC2CCC1 Amb32620332 [0,0,0,2,0,0|2,0,0]=4 2876 B13R2.2744 CO[C@H]1[C@H](C(C)=O)CC[C@H]2C[C@H]21 Amb28457496 [0,0,0,2,0,0|2,0,0]=4 2877 B13R2.4946 CC(=O)O[C@@H]1C[C@@H]2O[C@@H]2C[C@@H]1O Amb27202841 [0,0,0,2,0,0|2,0,0]=4 2878 B13R2.5572 O=C(O)C1CCCC2CC2CC1 Amb32656316 [0,0,0,2,0,0|2,0,0]=4 2879 B13R2.1286 CC(=O)O[C@@H]1C[C@H]2CCC[C@@H]1N2 Amb26421734 [0,0,0,2,0,0|1,0,0]=3 2880 B13R2.3760 CC(=O)OC12CCC1CCC2O Amb27829861 [0,0,0,2,0,0|1,0,0]=3 2881 B13R2.10744 CC(=O)O[C@@H]1CC[C@@H]2C[C@@H]2C1=O Amb27437375 [0,0,0,2,0,0|1,0,1]=4 2882 B13R2.10744 CC(=O)O[C@H]1CC[C@H]2C[C@H]2C1=O Amb27467869 [0,0,0,2,0,0|1,0,1]=4 2883 B13R2.12987 CC(=O)O[C@@]12CCC[C@@H]1C[C@@H]2O Amb27420578 [0,0,0,2,0,0|1,0,0]=3 2884 B13R2.12987 CC(=O)O[C@@]12CCC[C@@H]1C[C@H]2O Amb27197222 [0,0,0,2,0,0|1,0,0]=3 2885 B13R2.13972 CC(=O)C1CC2CCCCCC21 Amb27175956 [0,0,0,2,0,0|1,0,0]=3 2886 B13R2.13972 CC(=O)[C@@H]1C[C@@H]2CCCCC[C@@H]21 Amb28052539 [0,0,0,2,0,0|1,0,0]=3 2887 B13R2.13972 NC(=O)C1CC2CCCCCC21 Amb28200896 [0,0,0,2,0,0|2,0,0]=4 2888 B13R2.13972 O=C(O)[C@@H]1C[C@@H]2CCCCC[C@@H]21 Amb33804300 [0,0,0,2,0,0|2,0,0]=4 2889 B13R2.355 CC(=O)N1C(C)CC2CNCC21 Amb9459055 [0,0,0,2,0,0|2,0,0]=4 2890 B13R2.5513 CC(=O)C12CCCCCCC1C2 Amb28321909 [0,0,0,2,0,0|1,0,0]=3 2891 B13R2.5558 CC(=O)C1CCC2CCCC1C2 Amb27802568 [0,0,0,2,0,0|1,0,0]=3 2892 B13R2.5558 CC(=O)C1CCN2CCCC1C2 Amb27670014 [0,0,0,2,0,0|2,0,0]=4 2893 B13R2.5558 CC(=O)N1CCN2CCCC1C2 Amb26929588 [0,0,0,2,0,0|2,0,0]=4 2894 B13R2.5558 O=C(O)C1CCC2CCCC1C2 Amb28365636 [0,0,0,2,0,0|2,0,0]=4 2895 B13R2.10832 CC(=O)C12CCCCC1CC2C Amb27802806 [0,0,0,2,0,0|1,0,0]=3 2896 B13R2.13710 CC(=O)C1CCC[C@@H]2CC[C@H]1N2 Amb27631454 [0,0,0,2,0,0|2,0,0]=4 2897 B13R2.13710 CC(=O)N1CCNC2CCC1C2 Amb25212509 [0,0,0,2,0,0|2,0,0]=4 2898 B13R2.13710 CC(=O)[C@@H]1CCC[C@H]2CC[C@@H]1N2 Amb26974390 [0,0,0,2,0,0|2,0,0]=4 2899 B13R2.13710 CC(=O)[C@H]1CCC[C@H]2CC[C@@H]1N2 Amb27638718 [0,0,0,2,0,0|2,0,0]=4 2900 B13R2.5252 O=C1C=CCCC2CCCCC12 Amb28253747 [0,0,0,2,0,0|1,0,1]=4 2901 B13R2.5252 O=C1CCCC[C@H]2CCCC[C@@H]12 Amb28202238 [0,0,0,2,0,0|1,0,0]=3 2902 B13R2.5252 O=C1NCCCC2CCCCC12 Amb27413893 [0,0,0,2,0,0|1,0,0]=3 2903 B13R2.3283 CC(=O)O[C@@H]1CC[C@@H]2C(=O)C[C@@H]21 Amb27881829 [0,0,0,2,0,0|1,0,1]=4 2904 B13R2.5548 CC(=O)CCN1CC2CCC2C1 Amb35626497 [0,0,0,2,0,0|2,0,0]=4 2905 B13R2.423 CC(=O)C1CC1C2CCCCO2 Amb35621227 [0,0,0,2,0,0|2,0,0]=4 2906 B13R2.423 CC(=O)C1CC1C2CCOCC2 Amb18799106 [0,0,0,2,0,0|2,0,0]=4 2907 B13R2.423 CC(=O)C1OC1C2CCCCC2 Amb26344549 [0,0,0,2,0,0|2,0,0]=4 2908 B13R2.423 O=C(Cl)C1CC1C2CCCCC2 Amb25045510 [0,0,0,2,0,0|2,0,0]=4 2909 B13R2.423 O=C(O)C1CC1C2CCCCC2 Amb18960083 [0,0,0,2,0,0|2,0,0]=4 2910 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2CCCCC2 Amb33098458 [0,0,0,2,0,0|2,0,0]=4 2911 B13R2.437 CC(=O)C1CCC12CCCCC2 Amb29874095 [0,0,0,2,0,0|1,0,0]=3 2912 B13R2.437 CC(=O)N1CCC12CCCCC2 Amb28319865 [0,0,0,2,0,0|1,0,0]=3 2913 B13R2.437 NC(=O)N1CCC12CCCCC2 Amb27829225 [0,0,0,2,0,0|2,0,0]=4 2914 B13R2.437 O=C(O)C1CCC12CCCCC2 Amb27983816 [0,0,0,2,0,0|2,0,0]=4 2915 B13R2.442 CC(=O)CC1CC12CCNCC2 Amb28132928 [0,0,0,2,0,0|2,0,0]=4 2916 B13R2.442 CC(=O)NC1CC12CCOCC2 Amb28145050 [0,0,0,2,0,0|2,0,0]=4 2917 B13R2.442 O=C(Cl)NC1CC12CCCCC2 Amb35633477 [0,0,0,2,0,0|2,0,0]=4 2918 B13R2.5559 CC(=O)N1CCN2CCC1CC2 Amb26340606 [0,0,0,2,0,0|2,0,0]=4 2919 B13R2.5849 O=C(O)CCC1C2CCCCC21 Amb25339591 [0,0,0,2,0,0|2,0,0]=4 2920 B13R2.5849 O=C(O)CCC1[C@H]2CCCC[C@@H]12 Amb27958973 [0,0,0,2,0,0|2,0,0]=4 2921 B13R2.35 CC(=O)N1CCCC12CCNC2 Amb27187742 [0,0,0,2,0,0|2,0,0]=4 2922 B13R2.35 NC(=O)N1CCCC12CCCC2 Amb27632233 [0,0,0,2,0,0|2,0,0]=4 2923 B13R2.35 O=C(O)C1CCCC12CCCC2 Amb27606964 [0,0,0,2,0,0|2,0,0]=4 2924 B13R2.424 O=C(O)C1CC1CC2CCCC2 Amb26530691 [0,0,0,2,0,0|2,0,0]=4 2925 B13R2.424 O=C(O)[C@@H]1C[C@H]1CC2CCCC2 Amb33378876 [0,0,0,2,0,0|2,0,0]=4 2926 B13R2.426 CC(=N)NC1CCC12CCCC2 Amb35619226 [0,0,0,2,0,0|2,0,0]=4 2927 B13R2.426 CC(=O)\C=C1\CCC12CCCC2 Amb35619531 [0,0,0,2,0,0|1,0,1]=4 2928 B13R2.426 O=C(Cl)NC1CCC12CCCC2 Amb35619469 [0,0,0,2,0,0|2,0,0]=4 2929 B13R2.426 O=C(O)CC1CCC12CCCC2 Amb35619425 [0,0,0,2,0,0|2,0,0]=4 2930 B13R2.427 CC(=O)CCC1CC12CCNC2 Amb27967415 [0,0,0,2,0,0|2,0,0]=4 2931 B13R2.5569 CC(=O)C1=C2CCCC2CCC1 Amb24630727 [0,0,0,2,0,0|1,0,1]=4 2932 B13R2.5569 CC(=O)C1=CCCC2CCCC12 Amb24422925 [0,0,0,2,0,0|1,0,1]=4 2933 B13R2.5569 CC(=O)N1CCCC2COCC21 Amb29872465 [0,0,0,2,0,0|2,0,0]=4 2934 B13R2.5569 CC(=O)N1CCCC2NCCC21 Amb32678624 [0,0,0,2,0,0|2,0,0]=4 2935 B13R2.5569 CC(=O)N1CCC[C@@H]2CNC[C@@H]21 Amb24519301 [0,0,0,2,0,0|2,0,0]=4 2936 B13R2.5569 CC(=O)N1CCO[C@H]2CCC[C@H]21 Amb27661998 [0,0,0,2,0,0|2,0,0]=4 2937 B13R2.5569 NC(=O)N1CCCC2CCCC21 Amb28429141 [0,0,0,2,0,0|2,0,0]=4 2938 B13R2.5569 O=C(Cl)N1CCCC2CCCC21 Amb26938177 [0,0,0,2,0,0|2,0,0]=4 2939 B13R2.5569 O=C(O)C1CCCC2CCCC21 Amb27444701 [0,0,0,2,0,0|2,0,0]=4 2940 B13R2.5569 O=C(O)[C@H]1CCC[C@@H]2CCC[C@@H]21 Amb28247986 [0,0,0,2,0,0|2,0,0]=4 2941 B13R2.11149 O=C1CC2(CCCC2)NCCN1 Amb32678014 [0,0,0,2,0,0|2,0,0]=4 2942 B13R2.11149 O=C1CCCCC2(CCCC2)N1 Amb24625849 [0,0,0,2,0,0|2,0,0]=4 2943 B13R2.1300 CC(=O)\C=C1\CCCC12CCC2 Amb27444306 [0,0,0,2,0,0|1,0,1]=4 2944 B13R2.1300 O=C(O)CC1CCCC12CCC2 Amb27799971 [0,0,0,2,0,0|2,0,0]=4 2945 B13R2.5584 O=C(O)C1CCCCC12CCC2 Amb26557269 [0,0,0,2,0,0|2,0,0]=4 2946 B13R2.5602 CC(=O)N1CCCC1C2CCC2 Amb27749020 [0,0,0,2,0,0|1,0,0]=3 2947 B13R2.5602 C\C(N)=[N+]1\CCCC1C2CCC2 Amb28183090 [0,0,0,2,0,0|2,0,0]=4 2948 B13R2.11169 O=C1CCCCC(C2CCC2)C1 Amb27416489 [0,0,0,2,0,0|1,0,0]=3 2949 B13R2.2931 O=C1C[C@H](CO)[C@@H]2CCCCN12 Amb27198008 [0,0,0,2,0,0|2,0,0]=4 2950 B13R2.5514 O=C(O)C1CCCCC1C2CC2 Amb26878459 [0,0,0,2,0,0|2,0,0]=4 2951 B13R2.13663 CC(=O)C12CCCCC1CCC2 Amb28194601 [0,0,0,2,0,0|1,0,0]=3 2952 B13R2.13663 CC(=O)C12CCCCN1CCC2 Amb26872133 [0,0,0,2,0,0|2,0,0]=4 2953 B13R2.13663 CC(=O)[C@]12CCCC[C@@H]1CCO2 Amb27785508 [0,0,0,2,0,0|2,0,0]=4 2954 B13R2.13663 CC(=O)[C@]12CCCC[C@H]1CCC2 Amb28246530 [0,0,0,2,0,0|1,0,0]=3 2955 B13R2.13663 NC(=O)[C@]12CCCC[C@@H]1CCC2 Amb27202529 [0,0,0,2,0,0|2,0,0]=4 2956 B13R2.13663 NC(=O)[C@]12CCCC[C@H]1CCC2 Amb28076692 [0,0,0,2,0,0|2,0,0]=4 2957 B13R2.13663 O=C(O)C12CCCCC1CCC2 Amb18646993 [0,0,0,2,0,0|2,0,0]=4 2958 B13R2.13663 O=C(O)[C@]12CCCC[C@@H]1CCC2 Amb27436178 [0,0,0,2,0,0|2,0,0]=4 2959 B13R2.13779 CC(=O)N1C2CCCC1COC2 Amb27649257 [0,0,0,2,0,0|2,0,0]=4 2960 B13R2.13779 O=C(Cl)C1C2CCCC1CCC2 Amb25342732 [0,0,0,2,0,0|2,0,0]=4 2961 B13R2.13779 O=C(O)C1C2CCCC1CCC2 Amb28140078 [0,0,0,2,0,0|2,0,0]=4 2962 B13R2.249 CCCN1C2CCC1CC(=O)C2 Amb10610694 [0,0,0,2,0,0|2,0,0]=4 2963 B13R2.623 CC[C@@H]1NC(=O)O[C@H]2CCCC12 Amb28367705 [0,0,0,2,0,0|1,0,0]=3 2964 B13R2.623 CC[C@H]1NC(=O)O[C@H]2CCCC21 Amb27236909 [0,0,0,2,0,0|1,0,0]=3 2965 B13R2.5604 CC(=O)NC1CCOC1C2CC2 Amb27244672 [0,0,0,2,0,0|2,0,0]=4 2966 B13R2.14125 CC(=O)CC12CCC[C@H]1OCC2 Amb33446221 [0,0,0,2,0,0|2,0,0]=4 2967 B13R2.14125 CC(=O)NC12CCCC1CCC2 Amb28365022 [0,0,0,2,0,0|1,0,0]=3 2968 B13R2.654 CCN1CC(=O)N2CCCC2C1 Amb27791125 [0,0,0,2,0,0|2,0,0]=4 2969 B13R2.6374 CCC1CC2CCCC12C(C)=O Amb27614656 [0,0,0,2,0,0|1,0,0]=3 2970 B13R2.13649 CC(=O)N1C2CCNCC1CC2 Amb27873264 [0,0,0,2,0,0|2,0,0]=4 2971 B13R2.13708 CC(=O)N1CCCNCC12CC2 Amb32645328 [0,0,0,2,0,0|2,0,0]=4 2972 B13R2.13708 NC(=O)C1CCCCCC12CC2 Amb32658627 [0,0,0,2,0,0|2,0,0]=4 2973 B13R2.13708 O=C(O)C1CCCCCC12CC2 Amb18826495 [0,0,0,2,0,0|2,0,0]=4 2974 B13R2.1280 O=C(O)CC1CCC2CC2CC1 Amb33068666 [0,0,0,2,0,0|2,0,0]=4 2975 B13R2.7235 CC(=O)N1CCCC2CC21CN Amb32722289 [0,0,0,2,0,0|2,0,0]=4 2976 B13R2.7498 CC(=O)N1CCC2CCC21CN Amb33228524 [0,0,0,2,0,0|2,0,0]=4 2977 B13R2.13776 CC(=O)[C@@H]1[C@H]2CCCCCC[C@H]21 Amb27954188 [0,0,0,2,0,0|1,0,0]=3 2978 B13R2.13776 CC(=O)[C@H]1[C@H]2CCCCCC[C@H]21 Amb27178029 [0,0,0,2,0,0|1,0,0]=3 2979 B13R2.13776 O=C(O)C1C2CCCCCCC21 Amb10071664 [0,0,0,2,0,0|2,0,0]=4 2980 B13R2.13776 O=C(O)C1[C@H]2CCCCCC[C@H]12 Amb27657631 [0,0,0,2,0,0|2,0,0]=4 2981 B13R2.13687 NC(=O)C1CC12CCCCCC2 Amb27645198 [0,0,0,2,0,0|2,0,0]=4 2982 B13R2.13815 CC(=O)C=C1C2CCCCCC12 Amb27616708 [0,0,0,2,0,0|1,0,1]=4 2983 B13R2.13815 NC(=O)N[C@H]1[C@H]2CCCCC[C@H]21 Amb27803763 [0,0,0,2,0,0|2,0,0]=4 2984 B13R2.13815 O=C(O)CC1C2CCCCCC21 Amb28132343 [0,0,0,2,0,0|2,0,0]=4