0 B10R0.4 C#CCOCCOCC(=O)O Amb34913198 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.4 C#CCSCCCCC(=O)O Amb17503766 [0,0,0,0,0,0|1,0,2]=3 2 B10R0.4 C=C(Br)CCCCCCCC Amb6298935 [0,0,0,0,0,0|2,0,0]=2 3 B10R0.4 C=C(Br)CCCCCCCCl Amb6298886 [0,0,0,0,0,0|3,0,0]=3 4 B10R0.4 C=C(C)CCCCCCC#N Amb6298908 [0,0,0,0,0,0|3,0,1]=4 5 B10R0.4 C=C(C)CCCCCCCC Amb6298941 [0,0,0,0,0,0|2,0,0]=2 6 B10R0.4 C=C(C)CNCCCCCC Amb17308745 [0,0,0,0,0,0|3,0,0]=3 7 B10R0.4 C=C(C)\C=C\CCCCCC Amb22546604 [0,0,0,0,0,0|2,0,2]=4 8 B10R0.4 C=C(Cl)CCCCCCCC Amb6298929 [0,0,0,0,0,0|2,0,0]=2 9 B10R0.4 C=CCCCCCCB(O)O Amb19892802 [0,0,0,0,0,0|1,0,3]=4 10 B10R0.4 C=CCCCCCC[C@@H](C)O Amb30594444 [0,0,0,0,0,0|1,0,3]=4 11 B10R0.4 C=CCOCCCCC(=O)O Amb9208690 [0,0,0,0,0,0|1,0,2]=3 12 B10R0.4 C=CCOCCOCC(=O)O Amb32413546 [0,0,0,0,0,0|2,0,2]=4 13 B10R0.4 CC(=O)CCCCC#CCBr Amb27673518 [0,0,0,0,0,0|2,0,2]=4 14 B10R0.4 CC(=O)CCCCC#CCO Amb28080242 [0,0,0,0,0,0|2,0,2]=4 15 B10R0.4 CC(=O)NCCCCCC=O Amb24113371 [0,0,0,0,0,0|3,0,1]=4 16 B10R0.4 CC(=O)NCCCCCCN Amb5786933 [0,0,0,0,0,0|3,0,0]=3 17 B10R0.4 CC(=O)NCCCCCCO Amb24113372 [0,0,0,0,0,0|3,0,0]=3 18 B10R0.4 CC(=O)OCCCCCCBr Amb24063174 [0,0,0,0,0,0|3,0,0]=3 19 B10R0.4 CC(=O)OCCCCC[Zn]Br Amb22000479 [0,0,0,0,0,0|4,0,0]=4 20 B10R0.4 CC(=O)SCCCCCCN Amb31031026 [0,0,0,0,0,0|3,0,0]=3 21 B10R0.4 CC(=O)SCCCCCCN Amb33276211 [0,0,0,0,0,0|3,0,0]=3 22 B10R0.4 CC(C)CCCCCCCBr Amb32689357 [0,0,0,0,0,0|3,0,1]=4 23 B10R0.4 CC(C)CCCCCCCCl Amb32689356 [0,0,0,0,0,0|3,0,1]=4 24 B10R0.4 CCC#CCCCCC(=O)O Amb27269519 [0,0,0,0,0,0|0,0,2]=2 25 B10R0.4 CCC#CCCCCC(N)=O Amb28079386 [0,0,0,0,0,0|1,0,2]=3 26 B10R0.4 CCC#C\C=C\CCC(=O)O Amb26527941 [0,0,0,0,0,0|0,0,4]=4 27 B10R0.4 CCCC#CCCCC(=O)O Amb27269520 [0,0,0,0,0,0|0,0,2]=2 28 B10R0.4 CCCC#CCCCC(N)=O Amb28079638 [0,0,0,0,0,0|1,0,2]=3 29 B10R0.4 CCCC#CC\C=C\C(=O)O Amb25991326 [0,0,0,0,0,0|0,0,4]=4 30 B10R0.4 CCCCC#CC#CC(=O)O Amb27401973 [0,0,0,0,0,0|0,0,4]=4 31 B10R0.4 CCCCC#CCCC(C)=O Amb27269937 [0,0,0,0,0,0|1,0,2]=3 32 B10R0.4 CCCCC#CCCC(C)O Amb27989638 [0,0,0,0,0,0|1,0,3]=4 33 B10R0.4 CCCCC#CCCC(N)=O Amb28079736 [0,0,0,0,0,0|1,0,2]=3 34 B10R0.4 CCCCCC#CCC(=O)Cl Amb27672073 [0,0,0,0,0,0|1,0,2]=3 35 B10R0.4 CCCCCCC#CC(=O)O Amb2780028 [0,0,0,0,0,0|0,0,2]=2 36 B10R0.4 CCCCCCC#CC(C)=O Amb27672631 [0,0,0,0,0,0|1,0,2]=3 37 B10R0.4 CCCCCCC#C[C@H](C)O Amb27989910 [0,0,0,0,0,0|1,0,3]=4 38 B10R0.4 CCCCCCCCB(O)O Amb2456044 [0,0,0,0,0,0|1,0,1]=2 39 B10R0.4 CCCCCCCCC(=O)Cl Amb3941485 [0,0,0,0,0,0|1,0,0]=1 40 B10R0.4 CCCCCCCCC(=O)O Amb3940373 [0,0,0,0,0,0|0,0,0]=0 41 B10R0.4 CCCCCCCCC(=O)[O-] Amb22729912 [0,0,0,0,0,0|0,0,1]=1 42 B10R0.4 CCCCCCCCC(C)=O Amb8513861 [0,0,0,0,0,0|1,0,0]=1 43 B10R0.4 CCCCCCCCC(C)Br Amb22731670 [0,0,0,0,0,0|2,0,1]=3 44 B10R0.4 CCCCCCCCC(C)C Amb20241015 [0,0,0,0,0,0|2,0,1]=3 45 B10R0.4 CCCCCCCCC(N)=O Amb8999041 [0,0,0,0,0,0|1,0,0]=1 46 B10R0.4 CCCCCCCCN(C)C Amb2778778 [0,0,0,0,0,0|3,0,0]=3 47 B10R0.4 CCCCCCCC[C@@H](C)O Amb19929333 [0,0,0,0,0,0|1,0,1]=2 48 B10R0.4 CCCCCCCC[S@@+](C)[O-] Amb17779184 [0,0,0,0,0,0|2,0,1]=3 49 B10R0.4 CCCCCCCNC(N)=S Amb2688655 [0,0,0,0,0,0|2,1,0]=3 50 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [0,0,0,0,0,0|2,0,0]=2 51 B10R0.4 CCCCCCCOC(C)=O Amb6366320 [0,0,0,0,0,0|2,0,0]=2 52 B10R0.4 CCCCCCCOC(C)Cl Amb32715989 [0,0,0,0,0,0|3,0,1]=4 53 B10R0.4 CCCCCCCOC(N)=O Amb32668733 [0,0,0,0,0,0|2,0,0]=2 54 B10R0.4 CCCCCCCSC(=N)N Amb22487432 [0,0,0,0,0,0|3,0,0]=3 55 B10R0.4 CCCCCCNCC(=O)O Amb8827565 [0,0,0,0,0,0|1,0,0]=1 56 B10R0.4 CCCCCCNCC(C)C Amb6730526 [0,0,0,0,0,0|3,0,1]=4 57 B10R0.4 CCCCCCNCC(C)O Amb9247474 [0,0,0,0,0,0|2,0,1]=3 58 B10R0.4 CCCCCCOCC(=O)O Amb7790032 [0,0,0,0,0,0|1,0,0]=1 59 B10R0.4 CCCCCC\C=C\B(O)O Amb2456043 [0,0,0,0,0,0|1,0,3]=4 60 B10R0.4 CCCCCC\C=C\C(=O)O Amb3940553 [0,0,0,0,0,0|0,0,2]=2 61 B10R0.4 CCCCCC\C=C\C(C)=O Amb22052629 [0,0,0,0,0,0|1,0,2]=3 62 B10R0.4 CCCCCC\C=C\C(C)O Amb22641689 [0,0,0,0,0,0|1,0,3]=4 63 B10R0.4 CCCCCNCCC(=O)O Amb7755694 [0,0,0,0,0,0|1,0,0]=1 64 B10R0.4 CCCCC\C=C\NC(C)=O Amb28080162 [0,0,0,0,0,0|2,0,2]=4 65 B10R0.4 CCCCNCCCN(C)C Amb6699375 [0,0,0,0,0,0|4,0,0]=4 66 B10R0.4 CCCCSCCCC(=O)O Amb9280591 [0,0,0,0,0,0|1,0,0]=1 67 B10R0.4 CCCCSCCSC(=N)N Amb1085961 [0,0,0,0,0,0|4,0,0]=4 68 B10R0.4 CCCC\C=C\C#CC(=O)O Amb27433905 [0,0,0,0,0,0|0,0,4]=4 69 B10R0.4 CCCNCCCOC(C)=O Amb18924647 [0,0,0,0,0,0|3,0,0]=3 70 B10R0.4 CCC\C=C\CCCC(=O)O Amb33079428 [0,0,0,0,0,0|0,0,2]=2 71 B10R0.4 CCNCCOCCC(C)=O Amb18630736 [0,0,0,0,0,0|3,0,0]=3 72 B10R0.4 CCOCCCCCC(=O)O Amb22234334 [0,0,0,0,0,0|1,0,0]=1 73 B10R0.4 CCOCCOCCC(=O)O Amb6273854 [0,0,0,0,0,0|2,0,0]=2 74 B10R0.4 CCOCCOCCC(N)=O Amb18797953 [0,0,0,0,0,0|3,0,0]=3 75 B10R0.4 CN(C)CCCCCCCN Amb6715652 [0,0,0,0,0,0|4,0,0]=4 76 B10R0.4 CNCCOCCCC(=O)O Amb18106300 [0,0,0,0,0,0|2,0,0]=2 77 B10R0.4 COCCCNCCC(=O)O Amb8841109 [0,0,0,0,0,0|2,0,0]=2 78 B10R0.4 COCCCNCCC(C)=O Amb32675820 [0,0,0,0,0,0|3,0,0]=3 79 B10R0.4 COCCCOCCC(=O)O Amb18180046 [0,0,0,0,0,0|2,0,0]=2 80 B10R0.4 COCCNCCNC(C)=O Amb9256125 [0,0,0,0,0,0|4,0,0]=4 81 B10R0.4 COCCOCCCC(=O)O Amb6271198 [0,0,0,0,0,0|2,0,0]=2 82 B10R0.4 COCCOCCCC(N)=S Amb6268127 [0,0,0,0,0,0|3,1,0]=4 83 B10R0.4 COCCOC\C=C\C(=O)O Amb18182499 [0,0,0,0,0,0|2,0,2]=4 84 B10R0.4 CSCCCCCCC(=O)O Amb28652939 [0,0,0,0,0,0|1,0,0]=1 85 B10R0.4 N#CCCNCCCC(=O)O Amb17315317 [0,0,0,0,0,0|2,0,1]=3 86 B10R0.4 N#CCCSCCCC(=O)O Amb17502410 [0,0,0,0,0,0|2,0,1]=3 87 B10R0.4 N=C(N)NCCCCCCN Amb28652951 [0,0,0,0,0,0|4,0,0]=4 88 B10R0.4 NCCCCCCCC(=O)O Amb19929586 [0,0,0,0,0,0|1,0,0]=1 89 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [0,0,0,0,0,0|1,0,0]=1 90 B10R0.4 NCCCCCCNC(=O)O Amb22494605 [0,0,0,0,0,0|2,0,0]=2 91 B10R0.4 NCCCNCCCC(=O)O Amb18183427 [0,0,0,0,0,0|2,0,0]=2 92 B10R0.4 NCCCNCCCC(=O)O Amb33172775 [0,0,0,0,0,0|2,0,0]=2 93 B10R0.4 NCCCOCCCC(=O)O Amb18111568 [0,0,0,0,0,0|2,0,0]=2 94 B10R0.4 NCCCSCCCC(=O)O Amb17500719 [0,0,0,0,0,0|2,0,0]=2 95 B10R0.4 NCCOCCOCC(=O)O Amb10602483 [0,0,0,0,0,0|3,0,0]=3 96 B10R0.4 NCCOCCOCC(=O)O Amb16232535 [0,0,0,0,0,0|3,0,0]=3 97 B10R0.4 O=C(O)CCCCC#CCBr Amb27673513 [0,0,0,0,0,0|1,0,2]=3 98 B10R0.4 O=C(O)CCCCCCCBr Amb3940372 [0,0,0,0,0,0|1,0,0]=1 99 B10R0.4 O=C(O)CCCCCCCO Amb2688777 [0,0,0,0,0,0|1,0,0]=1 100 B10R0.4 O=C(O)CCCCCN=C=S Amb33194376 [0,0,0,0,0,0|2,0,1]=3 101 B10R0.4 O=C(O)CCCCOCCO Amb7782972 [0,0,0,0,0,0|2,0,0]=2 102 B10R0.4 O=C(O)CCCSCCCO Amb17502860 [0,0,0,0,0,0|2,0,0]=2 103 B10R0.4 O=C(O)COCCOCCCl Amb33719367 [0,0,0,0,0,0|3,0,0]=3 104 B10R0.4 O=C(O)COCCOCCO Amb24057830 [0,0,0,0,0,0|3,0,0]=3 105 B10R0.4 O=C([O-])CCCCCCCO Amb33513015 [0,0,0,0,0,0|1,0,1]=2 106 B10R0.4 O=C=NCCCCCC(=O)O Amb32667106 [0,0,0,0,0,0|2,0,1]=3 107 B10R0.4 [N-]=[N+]=NCCCCCC(=O)O Amb19516608 [0,0,0,0,0,0|3,0,0]=3 108 B9R0.2 C#CCCCCCC(=O)O Amb22232010 [1,0,0,0,0,0|0,0,2]=3 109 B9R0.2 C#CCCCCCC(C)=O Amb28053988 [1,0,0,0,0,0|1,0,2]=4 110 B9R0.2 C#CCCCCCC(N)=O Amb27596626 [1,0,0,0,0,0|1,0,2]=4 111 B9R0.2 C#CCCCSCC(=O)O Amb27984745 [1,0,0,0,0,0|1,0,2]=4 112 B9R0.2 C#CCCNCCC(=O)O Amb9326411 [1,0,0,0,0,0|1,0,2]=4 113 B9R0.2 C#CCCOCCC(=O)O Amb27406242 [1,0,0,0,0,0|1,0,2]=4 114 B9R0.2 C#CCOCCCC(=O)O Amb9208659 [1,0,0,0,0,0|1,0,2]=4 115 B9R0.2 C#CCSCCCC(=O)O Amb17503626 [1,0,0,0,0,0|1,0,2]=4 116 B9R0.2 C=C(Br)CNCCCCC Amb27641587 [1,0,0,0,0,0|3,0,0]=4 117 B9R0.2 C=C(Br)CSCCCCC Amb27810009 [1,0,0,0,0,0|3,0,0]=4 118 B9R0.2 C=C(C)CCCCCCC Amb6298940 [1,0,0,0,0,0|2,0,0]=3 119 B9R0.2 C=C(C)CCCCCCCl Amb6298888 [1,0,0,0,0,0|3,0,0]=4 120 B9R0.2 C=C(C)CCCCCNC Amb27489967 [1,0,0,0,0,0|3,0,0]=4 121 B9R0.2 C=C(C)CCSCCCC Amb27199306 [1,0,0,0,0,0|3,0,0]=4 122 B9R0.2 C=C(C)CNCCCCC Amb17308711 [1,0,0,0,0,0|3,0,0]=4 123 B9R0.2 C=C(C)COCCCCC Amb27862423 [1,0,0,0,0,0|3,0,0]=4 124 B9R0.2 C=C(C)CSCCCCC Amb27977453 [1,0,0,0,0,0|3,0,0]=4 125 B9R0.2 C=C(Cl)CCCCCCCl Amb6298882 [1,0,0,0,0,0|3,0,0]=4 126 B9R0.2 C=CCCCCCC(=O)O Amb6299579 [1,0,0,0,0,0|0,0,2]=3 127 B9R0.2 C=CCCCCCC(C)=O Amb33544200 [1,0,0,0,0,0|1,0,2]=4 128 B9R0.2 C=CCCCNCC(=O)O Amb28119977 [1,0,0,0,0,0|1,0,2]=4 129 B9R0.2 C=CCCCOCC(=O)O Amb27217276 [1,0,0,0,0,0|1,0,2]=4 130 B9R0.2 C=CCCCSCC(=O)O Amb27838988 [1,0,0,0,0,0|1,0,2]=4 131 B9R0.2 C=CCCNCCC(=O)O Amb27839020 [1,0,0,0,0,0|1,0,2]=4 132 B9R0.2 C=CCCSCCC(=O)O Amb28201215 [1,0,0,0,0,0|1,0,2]=4 133 B9R0.2 C=CCOCCCC(=O)O Amb33531507 [1,0,0,0,0,0|1,0,2]=4 134 B9R0.2 C=CCSCCCC(=O)O Amb27392354 [1,0,0,0,0,0|1,0,2]=4 135 B9R0.2 CC#CCCCCC(N)=O Amb27258980 [1,0,0,0,0,0|1,0,2]=4 136 B9R0.2 CC#CCNCCC(=O)O Amb27594145 [1,0,0,0,0,0|1,0,2]=4 137 B9R0.2 CC(=O)CCCCCCN Amb25147578 [1,0,0,0,0,0|2,0,0]=3 138 B9R0.2 CC(=O)CCCCCCN Amb32663700 [1,0,0,0,0,0|2,0,0]=3 139 B9R0.2 CC(=O)CCCSCCO Amb9660259 [1,0,0,0,0,0|3,0,0]=4 140 B9R0.2 CC(=O)CNCCCCN Amb33483477 [1,0,0,0,0,0|3,0,0]=4 141 B9R0.2 CC(=O)CNCCCCN Amb33483478 [1,0,0,0,0,0|3,0,0]=4 142 B9R0.2 CC(=O)CSCCCCF Amb27952719 [1,0,0,0,0,0|3,0,0]=4 143 B9R0.2 CC(=O)CSCCCCN Amb17500952 [1,0,0,0,0,0|3,0,0]=4 144 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [1,0,0,0,0,0|3,0,0]=4 145 B9R0.2 CC(=O)NCCCCCN Amb18102716 [1,0,0,0,0,0|3,0,0]=4 146 B9R0.2 CC(=O)OCCCCCBr Amb8516155 [1,0,0,0,0,0|3,0,0]=4 147 B9R0.2 CC(=O)OCCCCCCl Amb2778974 [1,0,0,0,0,0|3,0,0]=4 148 B9R0.2 CC(O)CCCCCCO Amb27272851 [1,0,0,0,0,0|2,0,1]=4 149 B9R0.2 CCC#CCCCC(=O)O Amb27628844 [1,0,0,0,0,0|0,0,2]=3 150 B9R0.2 CCC#CCCCC(C)=O Amb27836855 [1,0,0,0,0,0|1,0,2]=4 151 B9R0.2 CCC#CCOCC(=O)O Amb27425006 [1,0,0,0,0,0|1,0,2]=4 152 B9R0.2 CCCC#CCCC(=O)O Amb27663886 [1,0,0,0,0,0|0,0,2]=3 153 B9R0.2 CCCC#CCCC(N)=O Amb28054810 [1,0,0,0,0,0|1,0,2]=4 154 B9R0.2 CCCC=C=CCC(=O)O Amb27814505 [1,0,0,0,0,0|0,0,3]=4 155 B9R0.2 CCCCC#CCC(=O)O Amb26327934 [1,0,0,0,0,0|0,0,2]=3 156 B9R0.2 CCCCC=C=CC(=O)O Amb17593544 [1,0,0,0,0,0|0,0,3]=4 157 B9R0.2 CCCCCC#CC(=O)Cl Amb27950037 [1,0,0,0,0,0|1,0,2]=4 158 B9R0.2 CCCCCC#CC(=O)O Amb2778506 [1,0,0,0,0,0|0,0,2]=3 159 B9R0.2 CCCCCCCB(O)O Amb13890611 [1,0,0,0,0,0|1,0,1]=3 160 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [1,0,0,0,0,0|1,0,0]=2 161 B9R0.2 CCCCCCCC(=O)O Amb3940371 [1,0,0,0,0,0|0,0,0]=1 162 B9R0.2 CCCCCCCC(=O)S Amb10561702 [1,0,0,0,0,0|0,1,0]=2 163 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [1,0,0,0,0,0|0,0,1]=2 164 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [1,0,0,0,0,0|0,0,1]=2 165 B9R0.2 CCCCCCCC(C)=O Amb6891951 [1,0,0,0,0,0|1,0,0]=2 166 B9R0.2 CCCCCCCC(C)Br Amb3940567 [1,0,0,0,0,0|2,0,1]=4 167 B9R0.2 CCCCCCCC(C)C Amb6366303 [1,0,0,0,0,0|2,0,1]=4 168 B9R0.2 CCCCCCCC(C)S Amb7795228 [1,0,0,0,0,0|1,1,1]=4 169 B9R0.2 CCCCCCCC(N)=O Amb8999028 [1,0,0,0,0,0|1,0,0]=2 170 B9R0.2 CCCCCCCP(O)O Amb28042243 [1,0,0,0,0,0|1,0,1]=3 171 B9R0.2 CCCCCCCS(=O)Cl Amb32720351 [1,0,0,0,0,0|2,0,0]=3 172 B9R0.2 CCCCCCCS(=O)[O-] Amb32754186 [1,0,0,0,0,0|1,0,1]=3 173 B9R0.2 CCCCCCCS(N)=O Amb32720352 [1,0,0,0,0,0|2,0,0]=3 174 B9R0.2 CCCCCCC[C@@H](C)Br Amb28252396 [1,0,0,0,0,0|2,0,1]=4 175 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [1,0,0,0,0,0|2,0,1]=4 176 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [1,0,0,0,0,0|1,0,1]=3 177 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [1,0,0,0,0,0|2,0,1]=4 178 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [1,0,0,0,0,0|1,0,1]=3 179 B9R0.2 CCCCCCC[N+](=O)[O-] Amb17672611 [1,0,0,0,0,0|1,0,1]=3 180 B9R0.2 CCCCCCNC(C)=O Amb3368460 [1,0,0,0,0,0|2,0,0]=3 181 B9R0.2 CCCCCCNC(N)=O Amb23569596 [1,0,0,0,0,0|2,0,0]=3 182 B9R0.2 CCCCCCNC(N)=S Amb1152526 [1,0,0,0,0,0|2,1,0]=4 183 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [1,0,0,0,0,0|2,0,0]=3 184 B9R0.2 CCCCCCOC(=S)[S-] Amb594881 [1,0,0,0,0,0|1,2,0]=4 185 B9R0.2 CCCCCCOC(C)=O Amb8513414 [1,0,0,0,0,0|2,0,0]=3 186 B9R0.2 CCCCCCOC(C)O Amb28347016 [1,0,0,0,0,0|2,0,1]=4 187 B9R0.2 CCCCCCOC(N)=O Amb22495526 [1,0,0,0,0,0|2,0,0]=3 188 B9R0.2 CCCCCCO[N+](=O)[O-] Amb27233862 [1,0,0,0,0,0|2,0,1]=4 189 B9R0.2 CCCCCCSC(=N)N Amb20676030 [1,0,0,0,0,0|3,0,0]=4 190 B9R0.2 CCCCCCSC(=N)N Amb22487386 [1,0,0,0,0,0|3,0,0]=4 191 B9R0.2 CCCCCCSC(=N)N Amb27811857 [1,0,0,0,0,0|3,0,0]=4 192 B9R0.2 CCCCCCSC(=O)Cl Amb28421765 [1,0,0,0,0,0|2,0,0]=3 193 B9R0.2 CCCCCCSC(C)=O Amb27837874 [1,0,0,0,0,0|2,0,0]=3 194 B9R0.2 CCCCCCSC(N)=S Amb28342219 [1,0,0,0,0,0|2,1,0]=4 195 B9R0.2 CCCCCC\C=C(\C)I Amb28464058 [1,0,0,0,0,0|2,0,1]=4 196 B9R0.2 CCCCCNCC(N)=O Amb6708061 [1,0,0,0,0,0|2,0,0]=3 197 B9R0.2 CCCCCOCC(=O)O Amb8902706 [1,0,0,0,0,0|1,0,0]=2 198 B9R0.2 CCCCCOC[C@H](C)O Amb27620605 [1,0,0,0,0,0|2,0,1]=4 199 B9R0.2 CCCCCONC(N)=O Amb2899790 [1,0,0,0,0,0|3,0,0]=4 200 B9R0.2 CCCCCSCC(=O)O Amb6249571 [1,0,0,0,0,0|1,0,0]=2 201 B9R0.2 CCCCNCCC(=O)O Amb7755713 [1,0,0,0,0,0|1,0,0]=2 202 B9R0.2 CCCCNCCC(C)=O Amb26381876 [1,0,0,0,0,0|2,0,0]=3 203 B9R0.2 CCCCNCCC(C)O Amb27986026 [1,0,0,0,0,0|2,0,1]=4 204 B9R0.2 CCCCNCCC(N)=O Amb8841106 [1,0,0,0,0,0|2,0,0]=3 205 B9R0.2 CCCCOCCC(N)=O Amb27480748 [1,0,0,0,0,0|2,0,0]=3 206 B9R0.2 CCCCOCCC(N)=S Amb8895295 [1,0,0,0,0,0|2,1,0]=4 207 B9R0.2 CCCCSCCC(=O)O Amb1032992 [1,0,0,0,0,0|1,0,0]=2 208 B9R0.2 CCCCSCCC(N)=S Amb17503251 [1,0,0,0,0,0|2,1,0]=4 209 B9R0.2 CCCC\C=C/CC(C)=O Amb26493143 [1,0,0,0,0,0|1,0,2]=4 210 B9R0.2 CCCC\C=C\CC(=O)O Amb6297257 [1,0,0,0,0,0|0,0,2]=3 211 B9R0.2 CCCC\C=C\CC(N)=O Amb1815461 [1,0,0,0,0,0|1,0,2]=4 212 B9R0.2 CCCNCCCC(=O)O Amb1109953 [1,0,0,0,0,0|1,0,0]=2 213 B9R0.2 CCCNCCOC(N)=O Amb27828395 [1,0,0,0,0,0|3,0,0]=4 214 B9R0.2 CCCOCCCC(=N)N Amb8874875 [1,0,0,0,0,0|3,0,0]=4 215 B9R0.2 CCCOCCCC(=O)O Amb8874517 [1,0,0,0,0,0|1,0,0]=2 216 B9R0.2 CCCOCCCC(N)=S Amb8874843 [1,0,0,0,0,0|2,1,0]=4 217 B9R0.2 CCCOCCOC(=O)Cl Amb26963668 [1,0,0,0,0,0|3,0,0]=4 218 B9R0.2 CCCOCCOC(C)=O Amb25354004 [1,0,0,0,0,0|3,0,0]=4 219 B9R0.2 CCCOCCOC(N)=O Amb27265626 [1,0,0,0,0,0|3,0,0]=4 220 B9R0.2 CCCONCCC(=O)O Amb27233908 [1,0,0,0,0,0|2,0,0]=3 221 B9R0.2 CCCSCCCC(=O)O Amb6680215 [1,0,0,0,0,0|1,0,0]=2 222 B9R0.2 CCCSCCCC(C)=O Amb9660304 [1,0,0,0,0,0|2,0,0]=3 223 B9R0.2 CCCSCCNC(N)=O Amb28345909 [1,0,0,0,0,0|3,0,0]=4 224 B9R0.2 CCC\C=C/CCC(=O)O Amb26566880 [1,0,0,0,0,0|0,0,2]=3 225 B9R0.2 CCC\C=C\CCC(=O)O Amb25378821 [1,0,0,0,0,0|0,0,2]=3 226 B9R0.2 CCC\C=C\CCC(C)=O Amb33359154 [1,0,0,0,0,0|1,0,2]=4 227 B9R0.2 CCC\C=C\CCC(N)=O Amb27493443 [1,0,0,0,0,0|1,0,2]=4 228 B9R0.2 CCC\C=N\NCC(=O)O Amb27432508 [1,0,0,0,0,0|2,0,1]=4 229 B9R0.2 CCNCCCCC(=O)O Amb24385094 [1,0,0,0,0,0|1,0,0]=2 230 B9R0.2 CCNCCCCC(=O)O Amb32686610 [1,0,0,0,0,0|1,0,0]=2 231 B9R0.2 CCNCCCCC(C)=O Amb27951143 [1,0,0,0,0,0|2,0,0]=3 232 B9R0.2 CCNCCCCC(N)=O Amb27964384 [1,0,0,0,0,0|2,0,0]=3 233 B9R0.2 CCNCCCNC(N)=O Amb9466113 [1,0,0,0,0,0|3,0,0]=4 234 B9R0.2 CCOCCC#CC(=O)O Amb33168968 [1,0,0,0,0,0|1,0,2]=4 235 B9R0.2 CCOCCCCC(=N)N Amb28352192 [1,0,0,0,0,0|3,0,0]=4 236 B9R0.2 CCOCCCCC(=O)O Amb9207786 [1,0,0,0,0,0|1,0,0]=2 237 B9R0.2 CCOCCCCC(C)=O Amb9659807 [1,0,0,0,0,0|2,0,0]=3 238 B9R0.2 CCOCCCCC(N)=S Amb18180039 [1,0,0,0,0,0|2,1,0]=4 239 B9R0.2 CCOCCCNC(C)=O Amb3886591 [1,0,0,0,0,0|3,0,0]=4 240 B9R0.2 CCOCCCNC(N)=O Amb404787 [1,0,0,0,0,0|3,0,0]=4 241 B9R0.2 CCOCCCOC(C)=O Amb22733319 [1,0,0,0,0,0|3,0,0]=4 242 B9R0.2 CCOCCOCC(=O)O Amb6258165 [1,0,0,0,0,0|2,0,0]=3 243 B9R0.2 CCOCCOCC(N)=O Amb28203011 [1,0,0,0,0,0|3,0,0]=4 244 B9R0.2 CCOCSCCC(=O)O Amb27447358 [1,0,0,0,0,0|2,0,0]=3 245 B9R0.2 CCONCCCC(=O)O Amb27839067 [1,0,0,0,0,0|2,0,0]=3 246 B9R0.2 CCSCCCCC(=O)O Amb7782874 [1,0,0,0,0,0|1,0,0]=2 247 B9R0.2 CCSCCCOC(C)=O Amb27605064 [1,0,0,0,0,0|3,0,0]=4 248 B9R0.2 CCSCCSCC(=O)O Amb28126747 [1,0,0,0,0,0|2,0,0]=3 249 B9R0.2 CCSCCSCC(N)=O Amb28293850 [1,0,0,0,0,0|3,0,0]=4 250 B9R0.2 CC\C=C\CNCC(=O)O Amb27422845 [1,0,0,0,0,0|1,0,2]=4 251 B9R0.2 CNCCCCCC(C)=O Amb25728176 [1,0,0,0,0,0|2,0,0]=3 252 B9R0.2 CNCCCCCC(N)=O Amb27625362 [1,0,0,0,0,0|2,0,0]=3 253 B9R0.2 CNCCOCCC(=O)O Amb18111840 [1,0,0,0,0,0|2,0,0]=3 254 B9R0.2 CNCCOCCC(C)=O Amb18630756 [1,0,0,0,0,0|3,0,0]=4 255 B9R0.2 CNCCOCCC(N)=O Amb28122222 [1,0,0,0,0,0|3,0,0]=4 256 B9R0.2 CNCCSCCC(=O)O Amb27442544 [1,0,0,0,0,0|2,0,0]=3 257 B9R0.2 COCCCCCC(=O)O Amb10607872 [1,0,0,0,0,0|1,0,0]=2 258 B9R0.2 COCCCCCC(C)=O Amb27227265 [1,0,0,0,0,0|2,0,0]=3 259 B9R0.2 COCCCCCC(N)=S Amb27226780 [1,0,0,0,0,0|2,1,0]=4 260 B9R0.2 COCCCCNC(C)=O Amb27170819 [1,0,0,0,0,0|3,0,0]=4 261 B9R0.2 COCCCCOC(C)=O Amb24325176 [1,0,0,0,0,0|3,0,0]=4 262 B9R0.2 COCCCOCC(=O)O Amb25304314 [1,0,0,0,0,0|2,0,0]=3 263 B9R0.2 COCCNCCC(=O)O Amb33527038 [1,0,0,0,0,0|2,0,0]=3 264 B9R0.2 COCCNCCC(=O)O Amb7755691 [1,0,0,0,0,0|2,0,0]=3 265 B9R0.2 COCCNCCC(C)=O Amb24473587 [1,0,0,0,0,0|3,0,0]=4 266 B9R0.2 COCCNCCC(N)=O Amb19960056 [1,0,0,0,0,0|3,0,0]=4 267 B9R0.2 COCCNCCC(N)=O Amb8841099 [1,0,0,0,0,0|3,0,0]=4 268 B9R0.2 COCCOCCC(=O)O Amb6268336 [1,0,0,0,0,0|2,0,0]=3 269 B9R0.2 COCCOCCC(N)=O Amb28428996 [1,0,0,0,0,0|3,0,0]=4 270 B9R0.2 CS(=O)CCCCCCO Amb27771220 [1,0,0,0,0,0|3,0,0]=4 271 B9R0.2 CSCCCCCC(=O)O Amb27444761 [1,0,0,0,0,0|1,0,0]=2 272 B9R0.2 CSCCCCNC(C)=O Amb28325257 [1,0,0,0,0,0|3,0,0]=4 273 B9R0.2 CSCCCCOC(C)=O Amb28041805 [1,0,0,0,0,0|3,0,0]=4 274 B9R0.2 CSCCCNCC(=O)O Amb8827601 [1,0,0,0,0,0|2,0,0]=3 275 B9R0.2 CSCCCOCC(=O)O Amb28042679 [1,0,0,0,0,0|2,0,0]=3 276 B9R0.2 CSCCCSCC(C)=O Amb28059012 [1,0,0,0,0,0|3,0,0]=4 277 B9R0.2 CSCCNCCC(=O)O Amb25055507 [1,0,0,0,0,0|2,0,0]=3 278 B9R0.2 C[C@@H](O)CCCCCCO Amb27406493 [1,0,0,0,0,0|2,0,1]=4 279 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [1,0,0,0,0,0|1,0,0]=2 280 B9R0.2 C\C=C\CCCCC(=O)O Amb18643887 [1,0,0,0,0,0|0,0,2]=3 281 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [1,0,0,0,0,0|1,0,2]=4 282 B9R0.2 C\C=C\CCOCC(=O)O Amb28340908 [1,0,0,0,0,0|1,0,2]=4 283 B9R0.2 N#CCCCCCC(=O)O Amb18643705 [1,0,0,0,0,0|1,0,1]=3 284 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [1,0,0,0,0,0|2,0,1]=4 285 B9R0.2 N#CCCNCCC(=O)O Amb17315318 [1,0,0,0,0,0|2,0,1]=4 286 B9R0.2 N#CCCSCCC(=O)O Amb18927741 [1,0,0,0,0,0|2,0,1]=4 287 B9R0.2 N#CCSCCCC(=O)O Amb17501766 [1,0,0,0,0,0|2,0,1]=4 288 B9R0.2 NC(=O)CCCCCCBr Amb27654995 [1,0,0,0,0,0|2,0,0]=3 289 B9R0.2 NC(=O)CCCCCCCl Amb27254212 [1,0,0,0,0,0|2,0,0]=3 290 B9R0.2 NC(=O)CCNCCCO Amb19959936 [1,0,0,0,0,0|3,0,0]=4 291 B9R0.2 NC(=O)CCNCCCO Amb9243308 [1,0,0,0,0,0|3,0,0]=4 292 B9R0.2 NC(=O)CCSCCCCl Amb27217057 [1,0,0,0,0,0|3,0,0]=4 293 B9R0.2 NC(=O)CCSCCCF Amb27756832 [1,0,0,0,0,0|3,0,0]=4 294 B9R0.2 NC(=O)CCSCCCO Amb27615089 [1,0,0,0,0,0|3,0,0]=4 295 B9R0.2 NC(=O)CCSCCCS Amb27779781 [1,0,0,0,0,0|3,0,0]=4 296 B9R0.2 NC(=O)COCCCCO Amb27195620 [1,0,0,0,0,0|3,0,0]=4 297 B9R0.2 NC(=O)CSCCCCCl Amb27806823 [1,0,0,0,0,0|3,0,0]=4 298 B9R0.2 NC(=O)CSCCCCS Amb27776386 [1,0,0,0,0,0|3,0,0]=4 299 B9R0.2 NCCCCCCB(O)O Amb28401029 [1,0,0,0,0,0|2,0,1]=4 300 B9R0.2 NCCCCCCC(=O)O Amb1151254 [1,0,0,0,0,0|1,0,0]=2 301 B9R0.2 NCCCCCCC(=O)O Amb16232099 [1,0,0,0,0,0|1,0,0]=2 302 B9R0.2 NCCCCCCC(=O)[O-] Amb32663972 [1,0,0,0,0,0|1,0,1]=3 303 B9R0.2 NCCCCCNC(N)=O Amb28120485 [1,0,0,0,0,0|3,0,0]=4 304 B9R0.2 NCCCCNCC(=O)O Amb27800960 [1,0,0,0,0,0|2,0,0]=3 305 B9R0.2 NCCCCSCC(=O)O Amb17500919 [1,0,0,0,0,0|2,0,0]=3 306 B9R0.2 NCCCCSCC(N)=O Amb17500917 [1,0,0,0,0,0|3,0,0]=4 307 B9R0.2 NCCCNCCC(=O)O Amb27959846 [1,0,0,0,0,0|2,0,0]=3 308 B9R0.2 NCCCOCCC(=O)O Amb18111494 [1,0,0,0,0,0|2,0,0]=3 309 B9R0.2 NCCCOCCC(N)=O Amb27412120 [1,0,0,0,0,0|3,0,0]=4 310 B9R0.2 NCCCSCCC(=O)O Amb24496605 [1,0,0,0,0,0|2,0,0]=3 311 B9R0.2 NCCCSCCC(N)=O Amb28077685 [1,0,0,0,0,0|3,0,0]=4 312 B9R0.2 NCCNCCNC(=O)O Amb24069145 [1,0,0,0,0,0|3,0,0]=4 313 B9R0.2 NCCOCCCC(=O)O Amb18111467 [1,0,0,0,0,0|2,0,0]=3 314 B9R0.2 NCCSCCCC(=O)O Amb17500468 [1,0,0,0,0,0|2,0,0]=3 315 B9R0.2 NCCSSCCC(=O)O Amb17608062 [1,0,0,0,0,0|3,0,0]=4 316 B9R0.2 NOCCCCCC(=O)O Amb32708458 [1,0,0,0,0,0|2,0,0]=3 317 B9R0.2 O=C(Cl)CCCSCCCl Amb27644536 [1,0,0,0,0,0|3,0,0]=4 318 B9R0.2 O=C(F)OCCCCCCl Amb27391688 [1,0,0,0,0,0|3,0,0]=4 319 B9R0.2 O=C(O)C#CCCCCO Amb28050129 [1,0,0,0,0,0|1,0,2]=4 320 B9R0.2 O=C(O)CCCC#CCO Amb27391720 [1,0,0,0,0,0|1,0,2]=4 321 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [1,0,0,0,0,0|1,0,0]=2 322 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [1,0,0,0,0,0|1,0,0]=2 323 B9R0.2 O=C(O)CCCCCCF Amb25132501 [1,0,0,0,0,0|1,0,0]=2 324 B9R0.2 O=C(O)CCCCCCO Amb9787028 [1,0,0,0,0,0|1,0,0]=2 325 B9R0.2 O=C(O)CCCCCCS Amb24710334 [1,0,0,0,0,0|1,0,0]=2 326 B9R0.2 O=C(O)CCCCCNBr Amb28054088 [1,0,0,0,0,0|2,0,0]=3 327 B9R0.2 O=C(O)CCCCN=C=S Amb25685363 [1,0,0,0,0,0|2,0,1]=4 328 B9R0.2 O=C(O)CCCC\C=C\Br Amb26542054 [1,0,0,0,0,0|1,0,2]=4 329 B9R0.2 O=C(O)CCCNCCO Amb9333522 [1,0,0,0,0,0|2,0,0]=3 330 B9R0.2 O=C(O)CCCOCCO Amb6680919 [1,0,0,0,0,0|2,0,0]=3 331 B9R0.2 O=C(O)CCCSCCF Amb27614997 [1,0,0,0,0,0|2,0,0]=3 332 B9R0.2 O=C(O)CCCSCCO Amb9481728 [1,0,0,0,0,0|2,0,0]=3 333 B9R0.2 O=C(O)CCC\C=C/CO Amb27425001 [1,0,0,0,0,0|1,0,2]=4 334 B9R0.2 O=C(O)CCNCCCF Amb28049536 [1,0,0,0,0,0|2,0,0]=3 335 B9R0.2 O=C(O)CCNCCCO Amb9239888 [1,0,0,0,0,0|2,0,0]=3 336 B9R0.2 O=C(O)CCOCCCO Amb24476864 [1,0,0,0,0,0|2,0,0]=3 337 B9R0.2 O=C(O)CCSCCCCl Amb26421708 [1,0,0,0,0,0|2,0,0]=3 338 B9R0.2 O=C(O)CCSCCCF Amb27251653 [1,0,0,0,0,0|2,0,0]=3 339 B9R0.2 O=C(O)CCSSCCO Amb17615366 [1,0,0,0,0,0|3,0,0]=4 340 B9R0.2 O=C(O)CNCCCCO Amb28063278 [1,0,0,0,0,0|2,0,0]=3 341 B9R0.2 O=C(O)COCCCCF Amb27770553 [1,0,0,0,0,0|2,0,0]=3 342 B9R0.2 O=C(O)COCCCCO Amb27465121 [1,0,0,0,0,0|2,0,0]=3 343 B9R0.2 O=C(O)CSCCCCCl Amb27165750 [1,0,0,0,0,0|2,0,0]=3 344 B9R0.2 O=C(O)CSCCCCF Amb28062594 [1,0,0,0,0,0|2,0,0]=3 345 B9R0.2 O=C(O)\C=C\CCCCCl Amb18645743 [1,0,0,0,0,0|1,0,2]=4 346 B9R0.2 O=C=NCCCCC(=O)O Amb24505309 [1,0,0,0,0,0|2,0,1]=4 347 B9R0.2 O=CCCCCCC(=O)O Amb26548890 [1,0,0,0,0,0|1,0,1]=3 348 B9R0.2 O=S([O-])CCCCCCO Amb27485557 [1,0,0,0,0,0|2,0,1]=4 349 B9R0.2 O=[N+]([O-])CCCCCCBr Amb27870042 [1,0,0,0,0,0|2,0,1]=4 350 B9R0.2 O=[N+]([O-])CCCCCCF Amb27882997 [1,0,0,0,0,0|2,0,1]=4 351 B9R0.2 OB(O)CCCCCCCl Amb27614247 [1,0,0,0,0,0|2,0,1]=4 352 B9R0.2 [N-]=[N+]=NCCCCC(=O)O Amb19516609 [1,0,0,0,0,0|3,0,0]=4 353 B9R0.45 BrCCCCCCCCBr Amb2725461 [1,0,0,0,0,0|2,0,1]=4 354 B9R0.45 C#CCCCCCCC=C Amb27268975 [1,0,0,0,0,0|1,0,2]=4 355 B9R0.45 C#CCCCCCCCC Amb2721541 [1,0,0,0,0,0|1,0,1]=3 356 B9R0.45 C#CCCCCCCCF Amb27845935 [1,0,0,0,0,0|2,0,1]=4 357 B9R0.45 C#CCCCCCCCN Amb24117276 [1,0,0,0,0,0|2,0,1]=4 358 B9R0.45 C#CCCCCCCCO Amb10563785 [1,0,0,0,0,0|0,0,3]=4 359 B9R0.45 C#CCCCCCCNC Amb28204575 [1,0,0,0,0,0|2,0,1]=4 360 B9R0.45 C#CCCCCCNC=O Amb27214635 [1,0,0,0,0,0|1,0,2]=4 361 B9R0.45 C#CCCCNCCCC Amb27413122 [1,0,0,0,0,0|2,0,1]=4 362 B9R0.45 C#CCCNCCCCC Amb27770336 [1,0,0,0,0,0|2,0,1]=4 363 B9R0.45 C#CCNCCCCCC Amb5262804 [1,0,0,0,0,0|2,0,1]=4 364 B9R0.45 C#CCSCCCCCC Amb28349721 [1,0,0,0,0,0|2,0,1]=4 365 B9R0.45 C=CCCCCCCC#N Amb6298893 [1,0,0,0,0,0|2,0,1]=4 366 B9R0.45 C=CCCCCCCC=C Amb2721547 [1,0,0,0,0,0|1,0,2]=4 367 B9R0.45 C=CCCCCCCC=O Amb28193259 [1,0,0,0,0,0|0,0,2]=3 368 B9R0.45 C=CCCCCCCCBr Amb19895211 [1,0,0,0,0,0|2,0,0]=3 369 B9R0.45 C=CCCCCCCCC Amb3940503 [1,0,0,0,0,0|1,0,0]=2 370 B9R0.45 C=CCCCCCCCCl Amb6298880 [1,0,0,0,0,0|2,0,0]=3 371 B9R0.45 C=CCCCCCCCN Amb24763980 [1,0,0,0,0,0|2,0,0]=3 372 B9R0.45 C=CCCCCCCCN Amb32653343 [1,0,0,0,0,0|2,0,0]=3 373 B9R0.45 C=CCCCCCCCO Amb22733549 [1,0,0,0,0,0|2,0,0]=3 374 B9R0.45 C=CCCCCCCNC Amb28120535 [1,0,0,0,0,0|2,0,0]=3 375 B9R0.45 C=CCCCCCSCC Amb27396740 [1,0,0,0,0,0|2,0,0]=3 376 B9R0.45 C=CCCCCNCCC Amb26576689 [1,0,0,0,0,0|2,0,0]=3 377 B9R0.45 C=CCCCNCCCC Amb27799206 [1,0,0,0,0,0|2,0,0]=3 378 B9R0.45 C=CCCCNCCNC Amb27466769 [1,0,0,0,0,0|3,0,0]=4 379 B9R0.45 C=CCCCSCCOC Amb27424920 [1,0,0,0,0,0|3,0,0]=4 380 B9R0.45 C=CCCNCCCCC Amb27838999 [1,0,0,0,0,0|2,0,0]=3 381 B9R0.45 C=CCCNCCCCO Amb28141464 [1,0,0,0,0,0|3,0,0]=4 382 B9R0.45 C=CCCNCCCOC Amb28126721 [1,0,0,0,0,0|3,0,0]=4 383 B9R0.45 C=CCCNCCCSC Amb27838985 [1,0,0,0,0,0|3,0,0]=4 384 B9R0.45 C=CCCNCCOCC Amb28126723 [1,0,0,0,0,0|3,0,0]=4 385 B9R0.45 C=CCCOCCCNC Amb27768715 [1,0,0,0,0,0|3,0,0]=4 386 B9R0.45 C=CCCSCCCOC Amb28280277 [1,0,0,0,0,0|3,0,0]=4 387 B9R0.45 C=CCCSCCSCC Amb27197363 [1,0,0,0,0,0|3,0,0]=4 388 B9R0.45 C=CCNCCCCCC Amb7756950 [1,0,0,0,0,0|2,0,0]=3 389 B9R0.45 C=CCNCCCCCF Amb27219940 [1,0,0,0,0,0|3,0,0]=4 390 B9R0.45 C=CCNCCCCNC Amb27251520 [1,0,0,0,0,0|3,0,0]=4 391 B9R0.45 C=CCOCCCCCC Amb17933923 [1,0,0,0,0,0|2,0,0]=3 392 B9R0.45 C=CCOCCCSCC Amb28187852 [1,0,0,0,0,0|3,0,0]=4 393 B9R0.45 C=CCOCCNCCC Amb27866133 [1,0,0,0,0,0|3,0,0]=4 394 B9R0.45 C=CCSCCCCCBr Amb27985767 [1,0,0,0,0,0|3,0,0]=4 395 B9R0.45 C=CCSCCCCCC Amb22733767 [1,0,0,0,0,0|2,0,0]=3 396 B9R0.45 C=CCSCCCCCF Amb28315981 [1,0,0,0,0,0|3,0,0]=4 397 B9R0.45 C=CCSCCCCCN Amb28435037 [1,0,0,0,0,0|3,0,0]=4 398 B9R0.45 C=CCSCCCCCS Amb27828255 [1,0,0,0,0,0|3,0,0]=4 399 B9R0.45 C=CCSCCCCNC Amb28397579 [1,0,0,0,0,0|3,0,0]=4 400 B9R0.45 C=CCSCCCCOC Amb27599202 [1,0,0,0,0,0|3,0,0]=4 401 B9R0.45 C=CC\C=C/CCCCC Amb27423727 [1,0,0,0,0,0|1,0,2]=4 402 B9R0.45 C=CC\C=C\CCCCC Amb27629643 [1,0,0,0,0,0|1,0,2]=4 403 B9R0.45 C=COCCCCCCO Amb26931083 [1,0,0,0,0,0|3,0,0]=4 404 B9R0.45 C=COCCNCCCC Amb28364273 [1,0,0,0,0,0|3,0,0]=4 405 B9R0.45 C=C\C=C/CCCCCC Amb22641680 [1,0,0,0,0,0|1,0,2]=4 406 B9R0.45 CC#CCCCCCC=O Amb28198592 [1,0,0,0,0,0|0,0,2]=3 407 B9R0.45 CC#CCCCCCCC Amb2721539 [1,0,0,0,0,0|1,0,2]=4 408 B9R0.45 CC#CCCCCCCO Amb27478697 [1,0,0,0,0,0|0,0,3]=4 409 B9R0.45 CCC#CCCCCCO Amb28050678 [1,0,0,0,0,0|0,0,3]=4 410 B9R0.45 CCCCC#CCCC=O Amb27790685 [1,0,0,0,0,0|0,0,2]=3 411 B9R0.45 CCCCCC#CCCO Amb2721746 [1,0,0,0,0,0|0,0,3]=4 412 B9R0.45 CCCCCCC#CCO Amb2721748 [1,0,0,0,0,0|0,0,3]=4 413 B9R0.45 CCCCCCCCC#N Amb7764626 [1,0,0,0,0,0|1,0,1]=3 414 B9R0.45 CCCCCCCCCBr Amb3940224 [1,0,0,0,0,0|1,0,1]=3 415 B9R0.45 CCCCCCCCCC Amb7757835 [1,0,0,0,0,0|1,0,1]=3 416 B9R0.45 CCCCCCCCCCl Amb6652537 [1,0,0,0,0,0|1,0,1]=3 417 B9R0.45 CCCCCCCCCF Amb8515361 [1,0,0,0,0,0|1,0,1]=3 418 B9R0.45 CCCCCCCCCI Amb3940284 [1,0,0,0,0,0|1,0,1]=3 419 B9R0.45 CCCCCCCCCN Amb3987584 [1,0,0,0,0,0|1,0,1]=3 420 B9R0.45 CCCCCCCCCO Amb3940342 [1,0,0,0,0,0|0,0,1]=2 421 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [1,0,0,0,0,0|1,0,1]=3 422 B9R0.45 CCCCCCCCNC Amb7757640 [1,0,0,0,0,0|2,0,0]=3 423 B9R0.45 CCCCCCCCNN Amb7786451 [1,0,0,0,0,0|2,0,0]=3 424 B9R0.45 CCCCCCCCNO Amb28069968 [1,0,0,0,0,0|1,0,0]=2 425 B9R0.45 CCCCCCCCON Amb2818885 [1,0,0,0,0,0|2,0,0]=3 426 B9R0.45 CCCCCCCCSC Amb10553780 [1,0,0,0,0,0|2,0,0]=3 427 B9R0.45 CCCCCCCN=C=O Amb3940866 [1,0,0,0,0,0|1,0,1]=3 428 B9R0.45 CCCCCCCN=C=S Amb6860842 [1,0,0,0,0,0|1,1,1]=4 429 B9R0.45 CCCCCCCN=[N+]=[N-] Amb17939437 [1,0,0,0,0,0|3,0,0]=4 430 B9R0.45 CCCCCCCNC=O Amb27170738 [1,0,0,0,0,0|1,0,0]=2 431 B9R0.45 CCCCCCCOC=O Amb9787223 [1,0,0,0,0,0|1,0,0]=2 432 B9R0.45 CCCCCCCOCC Amb26332517 [1,0,0,0,0,0|2,0,1]=4 433 B9R0.45 CCCCCCCSC#N Amb17939431 [1,0,0,0,0,0|2,0,1]=4 434 B9R0.45 CCCCCCC\C=N\N Amb28193253 [1,0,0,0,0,0|2,0,1]=4 435 B9R0.45 CCCCCCNCCC Amb6730565 [1,0,0,0,0,0|2,0,1]=4 436 B9R0.45 CCCCCCNCCCl Amb27175028 [1,0,0,0,0,0|2,0,1]=4 437 B9R0.45 CCCCCCNCCN Amb33611669 [1,0,0,0,0,0|2,0,1]=4 438 B9R0.45 CCCCCCNCCN Amb9786764 [1,0,0,0,0,0|2,0,1]=4 439 B9R0.45 CCCCCCNCCO Amb2720857 [1,0,0,0,0,0|1,0,1]=3 440 B9R0.45 CCCCCCOCC#N Amb7792031 [1,0,0,0,0,0|2,0,1]=4 441 B9R0.45 CCCCCCOCC=O Amb26624223 [1,0,0,0,0,0|1,0,0]=2 442 B9R0.45 CCCCCCOCCC Amb27838831 [1,0,0,0,0,0|2,0,1]=4 443 B9R0.45 CCCCCCOCCCl Amb8828502 [1,0,0,0,0,0|2,0,1]=4 444 B9R0.45 CCCCCCOCCO Amb9787183 [1,0,0,0,0,0|1,0,1]=3 445 B9R0.45 CCCCCCO\C=C/Cl Amb27984890 [1,0,0,0,0,0|2,0,1]=4 446 B9R0.45 CCCCCCPCCN Amb28121064 [1,0,0,0,0,0|2,0,1]=4 447 B9R0.45 CCCCCCSCCCl Amb22228746 [1,0,0,0,0,0|2,0,1]=4 448 B9R0.45 CCCCCCSCCN Amb7794935 [1,0,0,0,0,0|2,0,1]=4 449 B9R0.45 CCCCCC\C=C/CO Amb10807383 [1,0,0,0,0,0|0,0,3]=4 450 B9R0.45 CCCCCC\C=C\C=O Amb24061310 [1,0,0,0,0,0|0,0,2]=3 451 B9R0.45 CCCCCC\C=C\CO Amb22168300 [1,0,0,0,0,0|0,0,3]=4 452 B9R0.45 CCCCCNCCC#N Amb2690074 [1,0,0,0,0,0|2,0,1]=4 453 B9R0.45 CCCCCNCCCBr Amb27171159 [1,0,0,0,0,0|2,0,1]=4 454 B9R0.45 CCCCCNCCCC Amb6688183 [1,0,0,0,0,0|2,0,1]=4 455 B9R0.45 CCCCCNCCCF Amb27757655 [1,0,0,0,0,0|2,0,1]=4 456 B9R0.45 CCCCCNCCCN Amb17315271 [1,0,0,0,0,0|2,0,1]=4 457 B9R0.45 CCCCCNCCCO Amb6733807 [1,0,0,0,0,0|1,0,1]=3 458 B9R0.45 CCCCCNCCNC Amb2691992 [1,0,0,0,0,0|3,0,0]=4 459 B9R0.45 CCCCCNCCOC Amb6708081 [1,0,0,0,0,0|3,0,0]=4 460 B9R0.45 CCCCCOCCC=O Amb27628424 [1,0,0,0,0,0|1,0,0]=2 461 B9R0.45 CCCCCSCCCF Amb28204722 [1,0,0,0,0,0|2,0,1]=4 462 B9R0.45 CCCCCSCCCN Amb17500694 [1,0,0,0,0,0|2,0,1]=4 463 B9R0.45 CCCCCSCCCO Amb17502837 [1,0,0,0,0,0|1,0,1]=3 464 B9R0.45 CCCCCSCCSC Amb28282346 [1,0,0,0,0,0|3,0,0]=4 465 B9R0.45 CCCCC\C=C/CCO Amb9825885 [1,0,0,0,0,0|0,0,3]=4 466 B9R0.45 CCCCC\C=C\CCO Amb27953070 [1,0,0,0,0,0|0,0,3]=4 467 B9R0.45 CCCCNCCCC#N Amb6709574 [1,0,0,0,0,0|2,0,1]=4 468 B9R0.45 CCCCNCCCCBr Amb27403712 [1,0,0,0,0,0|2,0,1]=4 469 B9R0.45 CCCCNCCCNC Amb24502382 [1,0,0,0,0,0|3,0,0]=4 470 B9R0.45 CCCCNCCCOC Amb6730310 [1,0,0,0,0,0|3,0,0]=4 471 B9R0.45 CCCCOCCCC#N Amb8895274 [1,0,0,0,0,0|2,0,1]=4 472 B9R0.45 CCCCOCCCCBr Amb8895240 [1,0,0,0,0,0|2,0,1]=4 473 B9R0.45 CCCCOCCCCCl Amb18798377 [1,0,0,0,0,0|2,0,1]=4 474 B9R0.45 CCCCOCCCCO Amb19375051 [1,0,0,0,0,0|1,0,1]=3 475 B9R0.45 CCCCOCCCON Amb27212384 [1,0,0,0,0,0|3,0,0]=4 476 B9R0.45 CCCCSCCCCN Amb9480126 [1,0,0,0,0,0|2,0,1]=4 477 B9R0.45 CCCCSCCCCS Amb28206440 [1,0,0,0,0,0|1,1,1]=4 478 B9R0.45 CCCCSCCCOC Amb27651352 [1,0,0,0,0,0|3,0,0]=4 479 B9R0.45 CCCC\C=C\CCC=O Amb27966384 [1,0,0,0,0,0|0,0,2]=3 480 B9R0.45 CCCNCCCCCBr Amb27614955 [1,0,0,0,0,0|2,0,1]=4 481 B9R0.45 CCCNCCCCCO Amb17334254 [1,0,0,0,0,0|1,0,1]=3 482 B9R0.45 CCCNCCCCSC Amb18798068 [1,0,0,0,0,0|3,0,0]=4 483 B9R0.45 CCCNCCNCCO Amb24644910 [1,0,0,0,0,0|2,0,1]=4 484 B9R0.45 CCCNCCOCCO Amb6736235 [1,0,0,0,0,0|2,0,1]=4 485 B9R0.45 CCCOCCCCCBr Amb27494337 [1,0,0,0,0,0|2,0,1]=4 486 B9R0.45 CCCOCCCCCN Amb27869443 [1,0,0,0,0,0|2,0,1]=4 487 B9R0.45 CCCOCCCNC=O Amb27453700 [1,0,0,0,0,0|2,0,0]=3 488 B9R0.45 CCCOCCOCCO Amb22351569 [1,0,0,0,0,0|2,0,1]=4 489 B9R0.45 CCCSCCCCC#N Amb18178253 [1,0,0,0,0,0|2,0,1]=4 490 B9R0.45 CCCSCCCCCBr Amb27603024 [1,0,0,0,0,0|2,0,1]=4 491 B9R0.45 CCCSCCCCCCl Amb9304986 [1,0,0,0,0,0|2,0,1]=4 492 B9R0.45 CCCSCCCCCS Amb27431515 [1,0,0,0,0,0|1,1,1]=4 493 B9R0.45 CCCSCCNCCO Amb27618844 [1,0,0,0,0,0|2,0,1]=4 494 B9R0.45 CCCSCCSCCO Amb27433297 [1,0,0,0,0,0|2,0,1]=4 495 B9R0.45 CCC\C=C\CCCC=O Amb33361614 [1,0,0,0,0,0|0,0,2]=3 496 B9R0.45 CCNCCCCCCN Amb25855319 [1,0,0,0,0,0|2,0,1]=4 497 B9R0.45 CCNCCCCCOC Amb28186272 [1,0,0,0,0,0|3,0,0]=4 498 B9R0.45 CCNCCCCCSC Amb27167121 [1,0,0,0,0,0|3,0,0]=4 499 B9R0.45 CCNCCCNCCO Amb27770477 [1,0,0,0,0,0|2,0,1]=4 500 B9R0.45 CCOCCCCCCS Amb27834959 [1,0,0,0,0,0|1,1,1]=4 501 B9R0.45 CCOCCCCNC=O Amb27634560 [1,0,0,0,0,0|2,0,0]=3 502 B9R0.45 CCOCCOCCC=O Amb27167183 [1,0,0,0,0,0|2,0,0]=3 503 B9R0.45 CCOCCSCCCO Amb27830336 [1,0,0,0,0,0|2,0,1]=4 504 B9R0.45 CCONCCCCCO Amb28245082 [1,0,0,0,0,0|2,0,1]=4 505 B9R0.45 CCSCCCCCCCl Amb18186755 [1,0,0,0,0,0|2,0,1]=4 506 B9R0.45 CCSCCNCCCO Amb27797112 [1,0,0,0,0,0|2,0,1]=4 507 B9R0.45 CCSCCSCCCO Amb27489348 [1,0,0,0,0,0|2,0,1]=4 508 B9R0.45 CC\C=C/CCOCC=O Amb25127965 [1,0,0,0,0,0|1,0,2]=4 509 B9R0.45 CC\N=N\CCCCCO Amb27631929 [1,0,0,0,0,0|2,0,1]=4 510 B9R0.45 CNCCCCCCC#N Amb27192989 [1,0,0,0,0,0|2,0,1]=4 511 B9R0.45 CNCCCCCCNC Amb9826092 [1,0,0,0,0,0|3,0,0]=4 512 B9R0.45 CNCCCCNCCO Amb27630866 [1,0,0,0,0,0|2,0,1]=4 513 B9R0.45 CNCCSCCCCO Amb28193864 [1,0,0,0,0,0|2,0,1]=4 514 B9R0.45 COCCCCCCCCl Amb28066514 [1,0,0,0,0,0|2,0,1]=4 515 B9R0.45 COCCCCCCOC Amb10807404 [1,0,0,0,0,0|3,0,0]=4 516 B9R0.45 COCCCCNCCO Amb28368980 [1,0,0,0,0,0|2,0,1]=4 517 B9R0.45 COCCCNCCCO Amb17308606 [1,0,0,0,0,0|2,0,1]=4 518 B9R0.45 COCCCOCCCO Amb20242414 [1,0,0,0,0,0|2,0,1]=4 519 B9R0.45 COCOCCCCCO Amb27839456 [1,0,0,0,0,0|2,0,1]=4 520 B9R0.45 CONCCCCCCO Amb27952629 [1,0,0,0,0,0|2,0,1]=4 521 B9R0.45 CO\N=C\CCCCC=O Amb27422978 [1,0,0,0,0,0|2,0,1]=4 522 B9R0.45 CSCCCCCCCN Amb27860341 [1,0,0,0,0,0|2,0,1]=4 523 B9R0.45 CSCCCCCCSC Amb6366244 [1,0,0,0,0,0|3,0,0]=4 524 B9R0.45 CSCCCCCN=C=O Amb27658593 [1,0,0,0,0,0|2,0,1]=4 525 B9R0.45 CSCCCCCNC=O Amb27165514 [1,0,0,0,0,0|2,0,0]=3 526 B9R0.45 CSCCCSCCCO Amb28132547 [1,0,0,0,0,0|2,0,1]=4 527 B9R0.45 C\C=C/CCCCCCC Amb26019969 [1,0,0,0,0,0|1,0,1]=3 528 B9R0.45 C\C=C\CCCCCCO Amb27980554 [1,0,0,0,0,0|0,0,3]=4 529 B9R0.45 C\C=C\CCCCCNC Amb26398871 [1,0,0,0,0,0|2,0,1]=4 530 B9R0.45 C\C=C\CCNCCCC Amb27789929 [1,0,0,0,0,0|2,0,1]=4 531 B9R0.45 ClCCCCCCCCCl Amb2721447 [1,0,0,0,0,0|2,0,1]=4 532 B9R0.45 FCCCCCCCCBr Amb27265588 [1,0,0,0,0,0|2,0,1]=4 533 B9R0.45 FCCCCCCCCCl Amb28067739 [1,0,0,0,0,0|2,0,1]=4 534 B9R0.45 FCCCCCCCCF Amb22641491 [1,0,0,0,0,0|2,0,1]=4 535 B9R0.45 N#CCCCCCCC=O Amb26516252 [1,0,0,0,0,0|1,0,1]=3 536 B9R0.45 N#CCCCCCCCN Amb27867353 [1,0,0,0,0,0|2,0,1]=4 537 B9R0.45 NCCCCCCCCN Amb8387247 [1,0,0,0,0,0|2,0,1]=4 538 B9R0.45 NCCCCCCCCO Amb24116967 [1,0,0,0,0,0|1,0,1]=3 539 B9R0.45 NCCCCCCNC=O Amb28251393 [1,0,0,0,0,0|2,0,0]=3 540 B9R0.45 NCCCCCNCCO Amb8394909 [1,0,0,0,0,0|2,0,1]=4 541 B9R0.45 NCCCCNCCCO Amb27473423 [1,0,0,0,0,0|2,0,1]=4 542 B9R0.45 NCCCCSCCCO Amb17500966 [1,0,0,0,0,0|2,0,1]=4 543 B9R0.45 NCCCNCCCC=O Amb27489145 [1,0,0,0,0,0|2,0,0]=3 544 B9R0.45 NCCCOCCCCO Amb28454517 [1,0,0,0,0,0|2,0,1]=4 545 B9R0.45 O=C=NCCCCCCO Amb27873254 [1,0,0,0,0,0|2,0,1]=4 546 B9R0.45 O=CCCCCCCC=O Amb27836602 [1,0,0,0,0,0|1,0,1]=3 547 B9R0.45 O=CCCCCCCCF Amb25075653 [1,0,0,0,0,0|1,0,0]=2 548 B9R0.45 O=CCCCCCCCO Amb25765567 [1,0,0,0,0,0|1,0,0]=2 549 B9R0.45 O=CCCCC\C=C\CF Amb27435440 [1,0,0,0,0,0|1,0,2]=4 550 B9R0.45 O=CCOCCOCCO Amb26024891 [1,0,0,0,0,0|3,0,0]=4 551 B9R0.45 OCCCCCCCCBr Amb4296902 [1,0,0,0,0,0|1,0,1]=3 552 B9R0.45 OCCCCCCCCCl Amb6366711 [1,0,0,0,0,0|1,0,1]=3 553 B9R0.45 OCCCCCCCCF Amb25330666 [1,0,0,0,0,0|1,0,1]=3 554 B9R0.45 OCCCCCCCCI Amb32411246 [1,0,0,0,0,0|1,0,1]=3 555 B9R0.45 OCCCCCCCCO Amb8383419 [1,0,0,0,0,0|1,0,1]=3 556 B9R0.45 OCCCCCCCCS Amb28046913 [1,0,0,0,0,0|1,0,1]=3 557 B9R0.45 OCCCCCOCCCl Amb28321747 [1,0,0,0,0,0|2,0,1]=4 558 B9R0.45 OCCCCCOCCO Amb27847385 [1,0,0,0,0,0|2,0,1]=4 559 B9R0.45 OCCCCCSCCO Amb18800854 [1,0,0,0,0,0|2,0,1]=4 560 B9R0.45 OCCCCOCCCO Amb27218138 [1,0,0,0,0,0|2,0,1]=4 561 B9R0.45 OCCCNCCCCF Amb27752581 [1,0,0,0,0,0|2,0,1]=4 562 B9R0.45 OCCCSCCCCF Amb28204584 [1,0,0,0,0,0|2,0,1]=4 563 B9R0.45 OCCCSCCCCS Amb27452872 [1,0,0,0,0,0|2,0,1]=4 564 B9R0.45 OCCNCCCCCF Amb27805496 [1,0,0,0,0,0|2,0,1]=4 565 B9R0.45 [C-]#[N+]CCCOCCCC Amb3973111 [1,0,0,0,0,0|3,0,0]=4 566 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [1,0,0,0,0,0|2,0,1]=4 567 B11R0.2 CCCCCCC(C)CC(=O)O Amb4001745 [0,1,0,0,0,0|0,0,0]=1 568 B11R0.2 CCCCCCC(C)OC(=O)Cl Amb24061311 [0,1,0,0,0,0|2,0,0]=3 569 B11R0.2 CCCCCCC(N)CC(=O)O Amb2229636 [0,1,0,0,0,0|0,0,0]=1 570 B11R0.2 CCCCCCC(N)CC(=O)O Amb31307615 [0,1,0,0,0,0|0,0,0]=1 571 B11R0.2 CCCCCCC(N)CC(N)=O Amb32787662 [0,1,0,0,0,0|1,0,0]=2 572 B11R0.2 CCCCCCC(O)CC(=O)O Amb18803982 [0,1,0,0,0,0|0,0,0]=1 573 B11R0.2 CCCCCCN(C)CC(=O)O Amb33552686 [0,1,0,0,0,0|1,0,0]=2 574 B11R0.2 CCCCCOC(=O)CC(C)=O Amb22734938 [0,1,0,0,0,0|2,0,1]=4 575 B11R0.2 COCCOCC(N)CC(=O)O Amb33255511 [0,1,0,0,0,0|2,0,0]=3 576 B11R0.2 COCCOCC(N)CC(N)=O Amb32787610 [0,1,0,0,0,0|3,0,0]=4 577 B11R0.30 C=C(C)CCCCCOC(C)=O Amb6299497 [0,1,0,0,0,0|2,0,1]=4 578 B11R0.30 C=C(Cl)CCCCCCC(=O)O Amb6299583 [0,1,0,0,0,0|0,0,2]=3 579 B11R0.30 CC(=O)CCCCCCC(=O)O Amb28653044 [0,1,0,0,0,0|0,0,1]=2 580 B11R0.30 CC(=O)CCCCCCC(C)=O Amb21962685 [0,1,0,0,0,0|1,0,1]=3 581 B11R0.30 CC(=O)NCCCCCC(=O)O Amb1208026 [0,1,0,0,0,0|1,0,1]=3 582 B11R0.30 CC(=O)NCCCCCC(=O)O Amb33513104 [0,1,0,0,0,0|1,0,1]=3 583 B11R0.30 CC(=O)NCCCCCC(N)=O Amb8998167 [0,1,0,0,0,0|2,0,1]=4 584 B11R0.30 CC(C)CCCCCCC(=O)[O-] Amb33513097 [0,1,0,0,0,0|0,0,1]=2 585 B11R0.30 CC(C)CCNCCCC(=O)O Amb24271192 [0,1,0,0,0,0|1,0,0]=2 586 B11R0.30 CC(C)CCNCCCC(=O)O Amb9208916 [0,1,0,0,0,0|1,0,0]=2 587 B11R0.30 CC(C)COCCCCC(=O)O Amb9207793 [0,1,0,0,0,0|1,0,0]=2 588 B11R0.30 CC(C)\C=C/CCCCC(=O)O Amb2724658 [0,1,0,0,0,0|0,0,2]=3 589 B11R0.30 CC(C)\C=C\CCCCC(=O)O Amb4477197 [0,1,0,0,0,0|0,0,2]=3 590 B11R0.30 CN(C)CCCNCCC(N)=O Amb8841112 [0,1,0,0,0,0|3,0,0]=4 591 B11R0.30 N=C(N)NCCCCCC(=O)O Amb20621391 [0,1,0,0,0,0|2,0,1]=4 592 B11R0.30 N=C(N)NCCCCCC(=O)O Amb31291051 [0,1,0,0,0,0|2,0,1]=4 593 B11R0.30 NC(=O)NCCCCCC(=O)O Amb440324 [0,1,0,0,0,0|2,0,1]=4 594 B11R0.30 O=C(Cl)CCCCCCC(=O)Cl Amb8514533 [0,1,0,0,0,0|2,0,1]=4 595 B11R0.30 O=C(O)CCCCCCC(=O)O Amb533225 [0,1,0,0,0,0|1,0,1]=3 596 B11R0.30 O=C(O)CCCSCCC(=O)O Amb17501237 [0,1,0,0,0,0|2,0,1]=4 597 B11R0.40 C=CC(=O)OCCCCCCO Amb31188276 [0,1,0,0,0,0|3,0,0]=4 598 B11R0.40 C=CS(=O)CCCCCCCC Amb1032994 [0,1,0,0,0,0|2,0,0]=3 599 B11R0.40 CCCCCCC#CC(=O)OC Amb2725482 [0,1,0,0,0,0|0,0,2]=3 600 B11R0.40 CCCCCCCCC(=O)CC Amb9024774 [0,1,0,0,0,0|1,0,0]=2 601 B11R0.40 CCCCCCCCC(=O)NN Amb6544507 [0,1,0,0,0,0|1,0,0]=2 602 B11R0.40 CCCCCCCCC(=O)OC Amb8517582 [0,1,0,0,0,0|0,0,0]=1 603 B11R0.40 CCCCCCCCC(Br)CBr Amb9787331 [0,1,0,0,0,0|2,0,1]=4 604 B11R0.40 CCCCCCCCC(C)CBr Amb32688274 [0,1,0,0,0,0|2,0,1]=4 605 B11R0.40 CCCCCCCCC(C)CCl Amb32688273 [0,1,0,0,0,0|2,0,1]=4 606 B11R0.40 CCCCCCCCC(N)CO Amb22536244 [0,1,0,0,0,0|1,0,1]=3 607 B11R0.40 CCCCCCCCC(O)CO Amb8517521 [0,1,0,0,0,0|0,0,2]=3 608 B11R0.40 CCCCCCCNC(=O)CBr Amb17323631 [0,1,0,0,0,0|2,0,0]=3 609 B11R0.40 CCCCCCCNC(=O)CCl Amb17329833 [0,1,0,0,0,0|2,0,0]=3 610 B11R0.40 CCCCCCCNC(=O)CN Amb24115161 [0,1,0,0,0,0|2,0,0]=3 611 B11R0.40 CCCCCCCOC(=O)CC Amb9787227 [0,1,0,0,0,0|2,0,0]=3 612 B11R0.40 CCCCCCCOC(=O)CCl Amb9787570 [0,1,0,0,0,0|2,0,0]=3 613 B11R0.40 CCCCCCCOC(=O)CS Amb9786410 [0,1,0,0,0,0|1,1,0]=3 614 B11R0.40 CCCCCCOCC(O)CCl Amb9787121 [0,1,0,0,0,0|2,0,1]=4 615 B11R0.40 CCCCCC\C=C\C(=O)OC Amb33513079 [0,1,0,0,0,0|0,0,2]=3 616 B11R0.40 CCCCNCCCC(C)OC Amb33133286 [0,1,0,0,0,0|2,0,1]=4 617 B11R0.40 CCCCOCCNC(=O)CCl Amb10609737 [0,1,0,0,0,0|3,0,0]=4 618 B11R0.40 CCCNCCCOC(=O)CC Amb18263176 [0,1,0,0,0,0|3,0,0]=4 619 B11R0.40 CCCSSCCCC(=O)OC Amb33040840 [0,1,0,0,0,0|2,0,0]=3 620 B11R0.40 CCOCCCCNC(=O)CCl Amb17330717 [0,1,0,0,0,0|3,0,0]=4 621 B11R0.40 CCOCCOCCC(=O)NC Amb32651489 [0,1,0,0,0,0|3,0,0]=4 622 B11R0.40 CNC(=O)CCNCCCOC Amb18808415 [0,1,0,0,0,0|3,0,0]=4 623 B11R0.40 CNCCOCCCC(=O)OC Amb18624289 [0,1,0,0,0,0|2,0,0]=3 624 B11R0.40 COC(=O)CCCCCCCBr Amb24063235 [0,1,0,0,0,0|1,0,0]=2 625 B11R0.40 COC(=O)CCCCCCCN Amb20669115 [0,1,0,0,0,0|1,0,0]=2 626 B11R0.40 COC(=O)CCCCCCCN Amb24331924 [0,1,0,0,0,0|1,0,0]=2 627 B11R0.40 COC(=O)CCCCCN=C=O Amb2688918 [0,1,0,0,0,0|2,0,1]=4 628 B11R0.40 COC(=O)CCCCCN=C=S Amb1148287 [0,1,0,0,0,0|2,0,1]=4 629 B11R0.40 COC(=O)CCCCCN=[N+]=[N-] Amb34912713 [0,1,0,0,0,0|3,0,0]=4 630 B11R0.40 COC(=O)CCCOCCCN Amb18111569 [0,1,0,0,0,0|2,0,0]=3 631 B11R0.40 COC(=O)CCCSCCCN Amb17500720 [0,1,0,0,0,0|2,0,0]=3 632 B11R0.40 COC(=O)CCCSCCCO Amb17502861 [0,1,0,0,0,0|2,0,0]=3 633 B11R0.40 COC(=O)NCCCCCCO Amb24095886 [0,1,0,0,0,0|2,0,0]=3 634 B11R0.40 COCCCNCCC(=O)NN Amb20171677 [0,1,0,0,0,0|3,0,0]=4 635 B11R0.42 C#CCCCCCC(N)C(=O)O Amb33065497 [0,1,0,0,0,0|0,0,2]=3 636 B11R0.42 C#CCCCCCC(N)C(N)=O Amb33308952 [0,1,0,0,0,0|1,0,2]=4 637 B11R0.42 C#CCCCCC[C@@H](N)C(=O)O Amb33069966 [0,1,0,0,0,0|0,0,2]=3 638 B11R0.42 C#CCCCCC[C@H](N)C(=O)O Amb33034711 [0,1,0,0,0,0|0,0,2]=3 639 B11R0.42 C=CCCCCCC(N)C(=O)O Amb21936740 [0,1,0,0,0,0|0,0,2]=3 640 B11R0.42 C=CCCCCCC(N)C(N)=O Amb32867920 [0,1,0,0,0,0|1,0,2]=4 641 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O Amb22745701 [0,1,0,0,0,0|0,0,2]=3 642 B11R0.42 C=CCCCCC[C@H](N)C(=O)O Amb33037010 [0,1,0,0,0,0|0,0,2]=3 643 B11R0.42 C=CCCCCO[C@H](C)C(=O)O Amb22225166 [0,1,0,0,0,0|1,0,2]=4 644 B11R0.42 CCCCCCCC(=O)C(=O)O Amb22904309 [0,1,0,0,0,0|0,0,1]=2 645 B11R0.42 CCCCCCCC(N)C(=O)O Amb2229635 [0,1,0,0,0,0|0,0,0]=1 646 B11R0.42 CCCCCCCC(N)C(N)=O Amb18794469 [0,1,0,0,0,0|1,0,0]=2 647 B11R0.42 CCCCCCC[C@@H](N)C(=O)O Amb22747720 [0,1,0,0,0,0|0,0,0]=1 648 B11R0.42 CCCCCCC[C@H](N)C(=O)O Amb33308889 [0,1,0,0,0,0|0,0,0]=1 649 B11R0.42 CCCCCCOC(C)C(=O)O Amb7790036 [0,1,0,0,0,0|1,0,0]=2 650 B11R0.42 CCCCOCCC(N)C(=O)O Amb18795636 [0,1,0,0,0,0|1,0,0]=2 651 B11R0.42 CCCCOCCC(N)C(N)=O Amb18178142 [0,1,0,0,0,0|2,0,0]=3 652 B11R0.42 CCCCOCC[C@@H](N)C(=O)O Amb33065700 [0,1,0,0,0,0|1,0,0]=2 653 B11R0.42 CCCCOCC[C@H](N)C(=O)O Amb32789517 [0,1,0,0,0,0|1,0,0]=2 654 B11R0.42 CCC\C=C\CCC(C)C(=O)O Amb33373744 [0,1,0,0,0,0|0,0,2]=3 655 B11R0.42 CCNCCSCC(=O)C(=O)O Amb33069823 [0,1,0,0,0,0|2,0,1]=4 656 B11R0.42 CCOCCNCC(C)C(=O)O Amb13952381 [0,1,0,0,0,0|2,0,0]=3 657 B11R0.42 CCOCCNCC(C)C(=O)O Amb9454345 [0,1,0,0,0,0|2,0,0]=3 658 B11R0.42 CNCCCSCC(=O)C(=O)O Amb33069830 [0,1,0,0,0,0|2,0,1]=4 659 B11R0.42 COCCOCCC(N)C(=O)O Amb18790828 [0,1,0,0,0,0|2,0,0]=3 660 B11R0.42 COCCOCCC(N)C(N)=O Amb18790751 [0,1,0,0,0,0|3,0,0]=4 661 B11R0.42 COCCOCC[C@@H](N)C(=O)O Amb33065896 [0,1,0,0,0,0|2,0,0]=3 662 B11R0.42 COCCOCC[C@H](N)C(=O)O Amb32864933 [0,1,0,0,0,0|2,0,0]=3 663 B11R0.42 N#CCCCCCC(N)C(=O)O Amb33309071 [0,1,0,0,0,0|1,0,1]=3 664 B11R0.42 N#CCCCCCC(N)C(N)=O Amb32789448 [0,1,0,0,0,0|2,0,1]=4 665 B11R0.42 N#CCCCCC[C@@H](N)C(=O)O Amb33308705 [0,1,0,0,0,0|1,0,1]=3 666 B11R0.42 N#CCCCCC[C@H](N)C(=O)O Amb32789469 [0,1,0,0,0,0|1,0,1]=3 667 B11R0.42 N#CCCOCCC(N)C(=O)O Amb33036696 [0,1,0,0,0,0|2,0,1]=4 668 B11R0.42 N#CCCOCC[C@@H](N)C(=O)O Amb33065553 [0,1,0,0,0,0|2,0,1]=4 669 B11R0.42 N#CCCOCC[C@H](N)C(=O)O Amb33308660 [0,1,0,0,0,0|2,0,1]=4 670 B11R0.42 NC(=O)C(N)CCCCCCO Amb33036551 [0,1,0,0,0,0|2,0,0]=3 671 B11R0.42 NC(CCCCCCO)C(=O)O Amb32937041 [0,1,0,0,0,0|1,0,0]=2 672 B11R0.42 NC(CCCCNC=O)C(=O)O Amb22362874 [0,1,0,0,0,0|2,0,1]=4 673 B11R0.42 NCCCCSCC(=O)C(=O)O Amb33069798 [0,1,0,0,0,0|2,0,1]=4 674 B11R0.42 N[C@@H](CCCCCCO)C(=O)O Amb33033601 [0,1,0,0,0,0|1,0,0]=2 675 B11R0.42 N[C@H](CCCCCCO)C(=O)O Amb33069952 [0,1,0,0,0,0|1,0,0]=2 676 B11R0.42 O=C(O)C(=O)CSCCCCBr Amb33069755 [0,1,0,0,0,0|2,0,1]=4 677 B11R0.42 O=C(O)C(=O)CSCCCCCl Amb33069747 [0,1,0,0,0,0|2,0,1]=4 678 B11R0.42 O=C(O)C(=O)CSCCCCO Amb33069725 [0,1,0,0,0,0|2,0,1]=4 679 B11R0.42 O=C(O)C(=O)CSCCCCS Amb33069995 [0,1,0,0,0,0|2,0,1]=4 680 B11R0.42 [N-]=[N+]=NCCCC[C@H](N)C(=O)O Amb30586486 [0,1,0,0,0,0|3,0,0]=4 681 B11R0.42 [N-]=[N+]=NCCCC[C@H](N)C(=O)O Amb31031221 [0,1,0,0,0,0|3,0,0]=4 682 B11R0.46 C=CCCCN(C)CCC(=O)O Amb33033542 [0,1,0,0,0,0|1,0,2]=4 683 B11R0.46 CCCCCC(=O)CCC(=O)O Amb4330519 [0,1,0,0,0,0|0,0,1]=2 684 B11R0.46 CCCCCC(=O)NCC(=O)O Amb4306505 [0,1,0,0,0,0|1,0,1]=3 685 B11R0.46 CCCCCC(C)CCC(=O)O Amb10807482 [0,1,0,0,0,0|0,0,0]=1 686 B11R0.46 CCCCCC(C)CCC(=O)[O-] Amb33513096 [0,1,0,0,0,0|0,0,1]=2 687 B11R0.46 CCCCCC(C)NCC(C)O Amb9359383 [0,1,0,0,0,0|2,0,1]=4 688 B11R0.46 CCCCCN(C)CCC(=O)O Amb8392952 [0,1,0,0,0,0|1,0,0]=2 689 B11R0.46 CCCCCN(C)CCC(=O)O Amb8925855 [0,1,0,0,0,0|1,0,0]=2 690 B11R0.46 CCCCNC(=O)CCC(=O)Cl Amb17143098 [0,1,0,0,0,0|2,0,1]=4 691 B11R0.46 CCCCNC(=O)CCC(=O)O Amb1785994 [0,1,0,0,0,0|1,0,1]=3 692 B11R0.46 CCCCOC(=O)CCC(=O)O Amb19888684 [0,1,0,0,0,0|1,0,1]=3 693 B11R0.46 CCC\C=C\C(N)CCC(=O)O Amb33327182 [0,1,0,0,0,0|0,0,2]=3 694 B11R0.46 COCCNC(=O)CCC(=O)O Amb1840186 [0,1,0,0,0,0|2,0,1]=4 695 B11R0.46 COCCOC(=O)CCC(=O)O Amb2189153 [0,1,0,0,0,0|2,0,1]=4 696 B11R0.46 NCCCNC(=O)CCC(=O)O Amb18795210 [0,1,0,0,0,0|2,0,1]=4 697 B11R0.46 O=C(O)CCC(=O)NCCCO Amb4402301 [0,1,0,0,0,0|2,0,1]=4 698 B11R0.111 CC(=O)OCCCCC(F)CBr Amb22641499 [0,1,0,0,0,0|3,0,0]=4 699 B11R0.111 CCC(=O)CCCCCC(=O)O Amb6305228 [0,1,0,0,0,0|0,0,1]=2 700 B11R0.111 COC(=O)CCCCCC(=O)O Amb13887311 [0,1,0,0,0,0|1,0,1]=3 701 B11R0.111 COC(=O)CCCCCC(=O)[O-] Amb34915140 [0,1,0,0,0,0|1,0,2]=4 702 B11R0.111 O=C(O)CCCCCC(F)CBr Amb22547633 [0,1,0,0,0,0|1,0,0]=2 703 B11R0.147 CCCCC(=O)CCCC(=O)O Amb6305231 [0,1,0,0,0,0|0,0,1]=2 704 B11R0.147 CCCCC(=O)NCCC(=O)O Amb5741939 [0,1,0,0,0,0|1,0,1]=3 705 B11R0.147 CCCCN(C)CCCC(=O)Cl Amb17143107 [0,1,0,0,0,0|2,0,0]=3 706 B11R0.147 CCCNC(=O)CCCC(=O)O Amb1841483 [0,1,0,0,0,0|1,0,1]=3 707 B11R0.148 C#CC#CCCCCCC(=O)O Amb32789676 [0,1,0,0,0,0|0,0,3]=4 708 B11R0.148 C#CCCCCCCCC(=O)O Amb22388895 [0,1,0,0,0,0|0,0,1]=2 709 B11R0.148 C#CCCCCC\C=C\C(=O)O Amb2609438 [0,1,0,0,0,0|0,0,3]=4 710 B11R0.148 C#CCOCCOCCC(=O)O Amb33961679 [0,1,0,0,0,0|1,0,2]=4 711 B11R0.148 C=C(Br)CCCCCCCCC Amb6298936 [0,1,0,0,0,0|2,0,0]=3 712 B11R0.148 C=C(C)CCCCCCCC#N Amb6298909 [0,1,0,0,0,0|2,0,1]=4 713 B11R0.148 C=C(C)CCCCCCCCC Amb6298942 [0,1,0,0,0,0|2,0,0]=3 714 B11R0.148 C=C(Cl)CCCCCCCCC Amb6298930 [0,1,0,0,0,0|2,0,0]=3 715 B11R0.148 C=CCCCCCCCC(=O)O Amb2686677 [0,1,0,0,0,0|0,0,1]=2 716 B11R0.148 C=CCCOCCCCC(=O)O Amb33531508 [0,1,0,0,0,0|0,0,2]=3 717 B11R0.148 CC(=O)OCCCCCCC=O Amb22364796 [0,1,0,0,0,0|2,0,1]=4 718 B11R0.148 CC(O)CCCCCCCCO Amb33331053 [0,1,0,0,0,0|1,0,1]=3 719 B11R0.148 CCCC#CCCC#CC(=O)O Amb28127282 [0,1,0,0,0,0|0,0,3]=4 720 B11R0.148 CCCCCCCCCC(=O)Cl Amb8513576 [0,1,0,0,0,0|1,0,0]=2 721 B11R0.148 CCCCCCCCCC(=O)O Amb5718031 [0,1,0,0,0,0|0,0,0]=1 722 B11R0.148 CCCCCCCCCC(C)=O Amb6307417 [0,1,0,0,0,0|1,0,0]=2 723 B11R0.148 CCCCCCCCCC(C)C Amb22043228 [0,1,0,0,0,0|2,0,1]=4 724 B11R0.148 CCCCCCCCCC(C)N Amb6366423 [0,1,0,0,0,0|2,0,1]=4 725 B11R0.148 CCCCCCCCCC(N)=O Amb6366435 [0,1,0,0,0,0|1,0,0]=2 726 B11R0.148 CCCCCCCCCC(N)=S Amb7794719 [0,1,0,0,0,0|1,1,0]=3 727 B11R0.148 CCCCCCCCCS(=O)Cl Amb32720537 [0,1,0,0,0,0|2,0,0]=3 728 B11R0.148 CCCCCCCCCS(=O)[O-] Amb32755589 [0,1,0,0,0,0|1,0,1]=3 729 B11R0.148 CCCCCCCCCS(N)=O Amb32720538 [0,1,0,0,0,0|2,0,0]=3 730 B11R0.148 CCCCCCCCNC(C)=O Amb33551736 [0,1,0,0,0,0|1,0,0]=2 731 B11R0.148 CCCCCCCCNC(N)=S Amb1152183 [0,1,0,0,0,0|1,1,0]=3 732 B11R0.148 CCCCCCCCOC(=O)Cl Amb8515453 [0,1,0,0,0,0|1,0,0]=2 733 B11R0.148 CCCCCCCCOC(C)=O Amb8515405 [0,1,0,0,0,0|1,0,0]=2 734 B11R0.148 CCCCCCCNCC(=O)O Amb19373457 [0,1,0,0,0,0|0,0,0]=1 735 B11R0.148 CCCCCCCNCC(=O)O Amb8827566 [0,1,0,0,0,0|0,0,0]=1 736 B11R0.148 CCCCCCCNCC(C)C Amb7757190 [0,1,0,0,0,0|2,0,1]=4 737 B11R0.148 CCCCCCC\C=C\B(O)O Amb33513070 [0,1,0,0,0,0|1,0,2]=4 738 B11R0.148 CCCCCCC\C=C\C(=O)O Amb6336657 [0,1,0,0,0,0|0,0,1]=2 739 B11R0.148 CCCCCCNCCC(=O)O Amb8830823 [0,1,0,0,0,0|0,0,0]=1 740 B11R0.148 CCCCCCNCCC(C)C Amb6620655 [0,1,0,0,0,0|2,0,1]=4 741 B11R0.148 CCCCC\C=C\CCC(=O)O Amb24079160 [0,1,0,0,0,0|0,0,1]=2 742 B11R0.148 CCCCC\C=C\COC(C)=O Amb30988128 [0,1,0,0,0,0|1,0,2]=4 743 B11R0.148 CCCCOCCOCC(=O)O Amb9204477 [0,1,0,0,0,0|1,0,0]=2 744 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [0,1,0,0,0,0|0,0,0]=1 745 B11R0.148 CCC\C=C\CCCCC(=O)O Amb24063196 [0,1,0,0,0,0|0,0,1]=2 746 B11R0.148 CCNCCOCCCC(=O)O Amb18110845 [0,1,0,0,0,0|1,0,0]=2 747 B11R0.148 CCOCCCNCCC(N)=S Amb17315344 [0,1,0,0,0,0|2,1,0]=4 748 B11R0.148 CCOCCOCCCC(=O)O Amb6262117 [0,1,0,0,0,0|1,0,0]=2 749 B11R0.148 CCOCCOCCOC(C)=O Amb8514868 [0,1,0,0,0,0|3,0,0]=4 750 B11R0.148 CCOCCOCCOC(N)=O Amb29674648 [0,1,0,0,0,0|3,0,0]=4 751 B11R0.148 CN(C)CCCCCCCCN Amb24117500 [0,1,0,0,0,0|3,0,0]=4 752 B11R0.148 CNCCCNCCCC(=O)O Amb28963363 [0,1,0,0,0,0|1,0,0]=2 753 B11R0.148 CNCCCNCCCC(=O)O Amb33470189 [0,1,0,0,0,0|1,0,0]=2 754 B11R0.148 COCCOCCC#CC(=O)O Amb33168990 [0,1,0,0,0,0|1,0,2]=4 755 B11R0.148 COCCOCCCCC(=O)O Amb9207792 [0,1,0,0,0,0|1,0,0]=2 756 B11R0.148 COCCOCCOCC(=O)Cl Amb2689123 [0,1,0,0,0,0|3,0,0]=4 757 B11R0.148 COCCOCCOCC(=O)O Amb3940728 [0,1,0,0,0,0|2,0,0]=3 758 B11R0.148 N#CCCCSCCCC(=O)O Amb17504253 [0,1,0,0,0,0|1,0,1]=3 759 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [0,1,0,0,0,0|1,0,0]=2 760 B11R0.148 NCCOCCOCCC(=O)O Amb18111401 [0,1,0,0,0,0|2,0,0]=3 761 B11R0.148 O=C(O)CCCCCCCCBr Amb8631538 [0,1,0,0,0,0|0,0,0]=1 762 B11R0.148 O=C(O)CCCCCCCCO Amb3372037 [0,1,0,0,0,0|0,0,0]=1 763 B11R0.148 O=C(O)CCCCCCN=C=S Amb33471526 [0,1,0,0,0,0|1,0,1]=3 764 B11R0.148 O=C(O)CCOCCOCCBr Amb24057758 [0,1,0,0,0,0|2,0,0]=3 765 B11R0.148 O=C(O)CCOCCOCCO Amb24057823 [0,1,0,0,0,0|2,0,0]=3 766 B11R0.148 O=C=NCCCCCCC(=O)O Amb33471297 [0,1,0,0,0,0|1,0,1]=3 767 B11R0.148 [N-]=[N+]=NCCCCCCC(=O)O Amb22407009 [0,1,0,0,0,0|2,0,0]=3 768 B11R0.159 CCCCCCCCC(C)(C)O Amb33330811 [0,1,0,0,0,0|1,0,1]=3 769 B11R0.159 CCCCCCCCP(=O)(O)O Amb19515959 [0,1,0,0,0,0|1,0,0]=2 770 B11R0.159 CCCCCCCCS(=O)(=O)Cl Amb8516201 [0,1,0,0,0,0|1,0,1]=3 771 B11R0.159 CCCCCCCCS(=O)(=O)F Amb33352751 [0,1,0,0,0,0|1,0,1]=3 772 B11R0.159 CCCCCCCCS(=O)(=O)O Amb22228001 [0,1,0,0,0,0|1,0,0]=2 773 B11R0.159 CCCCCCCCS(=O)(=O)[O-] Amb2689968 [0,1,0,0,0,0|1,0,1]=3 774 B11R0.159 CCCCCCCCS(=O)(=O)[O-] Amb6366784 [0,1,0,0,0,0|1,0,1]=3 775 B11R0.159 CCCCCCCCS(=O)(=O)[O-] Amb9871421 [0,1,0,0,0,0|1,0,1]=3 776 B11R0.159 CCCCCCCCS(N)(=O)=O Amb16191923 [0,1,0,0,0,0|1,0,1]=3 777 B11R0.159 CCCCCCCC[N+](C)(C)C Amb22348496 [0,1,0,0,0,0|3,0,0]=4 778 B11R0.159 CCCCCCCC[N+](C)(C)C Amb9787164 [0,1,0,0,0,0|3,0,0]=4 779 B11R0.159 CCCCCCCC[Si](C)(C)Cl Amb8515435 [0,1,0,0,0,0|2,1,0]=4 780 B11R0.159 CCCCCCCOS(C)(=O)=O Amb28286190 [0,1,0,0,0,0|2,0,1]=4 781 B11R0.159 CCCCCNCCS(=O)(=O)F Amb33463772 [0,1,0,0,0,0|2,0,1]=4 782 B11R0.159 CCCCCOCCS(=O)(=O)Cl Amb32939997 [0,1,0,0,0,0|2,0,1]=4 783 B11R0.159 CCCCNCCCS(=O)(=O)F Amb33463953 [0,1,0,0,0,0|2,0,1]=4 784 B11R0.159 CCCCOCCCS(=O)(=O)Cl Amb32939804 [0,1,0,0,0,0|2,0,1]=4 785 B11R0.159 CCCOCCCCS(=O)(=O)Cl Amb32940382 [0,1,0,0,0,0|2,0,1]=4 786 B11R0.159 CCOCCCCCS(=O)(=O)Cl Amb32939824 [0,1,0,0,0,0|2,0,1]=4 787 B11R0.159 COCCCCCCS(=O)(=O)Cl Amb32939863 [0,1,0,0,0,0|2,0,1]=4 788 B11R0.159 NCCCCCCOP(=O)(O)O Amb35825329 [0,1,0,0,0,0|3,0,0]=4 789 B11R0.176 CCCC(=O)CCCCC(=O)O Amb6305241 [0,1,0,0,0,0|0,0,1]=2 790 B11R0.176 CCCC(=O)NCCCC(=O)O Amb5741969 [0,1,0,0,0,0|1,0,1]=3 791 B11R0.176 CCOC(=O)CCCCC(=O)O Amb3939942 [0,1,0,0,0,0|1,0,1]=3 792 B11R0.176 CCOC(=O)CCCCC(N)=O Amb33623115 [0,1,0,0,0,0|2,0,1]=4 793 B11R0.176 CCOC(=O)NCCCC(=O)O Amb6249852 [0,1,0,0,0,0|2,0,1]=4 794 B11R0.176 O=C(O)CCCC[C@@H](S)CCS Amb24099064 [0,1,0,0,0,0|1,0,0]=2 795 B11R1.24 C=C1CCCN(CCCC)C1 Amb27176811 [0,0,0,1,0,0|3,0,0]=4 796 B11R1.24 C=CCC[C@H]1CCCC(=O)C1 Amb27802471 [0,0,0,1,0,0|1,0,2]=4 797 B11R1.24 CC#CCC1CCCC(=O)C1 Amb27222722 [0,0,0,1,0,0|1,0,2]=4 798 B11R1.24 CCCCC1=CC(=O)CCC1 Amb17593800 [0,0,0,1,0,0|1,0,1]=3 799 B11R1.24 CCCCC1=CC(=O)CCS1 Amb27750255 [0,0,0,1,0,0|2,0,1]=4 800 B11R1.24 CCCCC1=CC(=O)NCC1 Amb27166484 [0,0,0,1,0,0|2,0,1]=4 801 B11R1.24 CCCCC1=C[C@H](O)CCC1 Amb27484691 [0,0,0,1,0,0|1,0,2]=4 802 B11R1.24 CCCCC1CC=CC(=O)N1 Amb27483840 [0,0,0,1,0,0|1,0,2]=4 803 B11R1.24 CCCCC1CCCC(Br)C1 Amb27979044 [0,0,0,1,0,0|2,0,1]=4 804 B11R1.24 CCCCC1CCCC(C)N1 Amb27194619 [0,0,0,1,0,0|2,0,1]=4 805 B11R1.24 CCCCC1CCSC(N)=N1 Amb27164252 [0,0,0,1,0,0|3,0,0]=4 806 B11R1.24 CCCCC1CNCC(C)O1 Amb27870532 [0,0,0,1,0,0|2,0,1]=4 807 B11R1.24 CCCCN1CCCC(=O)C1 Amb28322509 [0,0,0,1,0,0|2,0,0]=3 808 B11R1.24 CCCCN1CCCC(O)C1 Amb18183194 [0,0,0,1,0,0|2,0,1]=4 809 B11R1.24 CCCC[C@@H]1CCCC(O)O1 Amb27456731 [0,0,0,1,0,0|0,0,2]=3 810 B11R1.24 CCCC[C@@H]1CCC[C@@H](O)C1 Amb27251503 [0,0,0,1,0,0|1,0,1]=3 811 B11R1.24 CCCC[C@@H]1CCC[C@H](C)N1 Amb27200235 [0,0,0,1,0,0|2,0,1]=4 812 B11R1.24 CCCC[C@@H]1CCC[C@H](O)C1 Amb27970937 [0,0,0,1,0,0|1,0,1]=3 813 B11R1.24 CCCC[C@H]1C=CCC(=O)N1 Amb27176608 [0,0,0,1,0,0|1,0,2]=4 814 B11R1.24 CCCC[C@H]1CCC[C@H](O)C1 Amb27652900 [0,0,0,1,0,0|1,0,1]=3 815 B11R1.24 CCCC[C@H]1CCSC(N)=N1 Amb27642554 [0,0,0,1,0,0|3,0,0]=4 816 B11R1.24 CCCNC1=CC(=O)CCC1 Amb4453933 [0,0,0,1,0,0|2,0,1]=4 817 B11R1.24 CCCOC1CCCC(O)C1 Amb25344088 [0,0,0,1,0,0|2,0,1]=4 818 B11R1.24 CCNCC1CCCC(=O)N1 Amb32721818 [0,0,0,1,0,0|2,0,0]=3 819 B11R1.24 CCOCC1CCCC(=O)C1 Amb28073558 [0,0,0,1,0,0|2,0,0]=3 820 B11R1.24 CCOCC1CCNC(=O)C1 Amb32654952 [0,0,0,1,0,0|3,0,0]=4 821 B11R1.24 CCSCC1CCCC(=O)C1 Amb35699380 [0,0,0,1,0,0|2,0,0]=3 822 B11R1.24 CCSCC1CCCC(O)C1 Amb28411465 [0,0,0,1,0,0|2,0,1]=4 823 B11R1.24 CNCCC1CCCC(=O)N1 Amb27466194 [0,0,0,1,0,0|2,0,0]=3 824 B11R1.24 CNCCC1CCCC(O)C1 Amb27234087 [0,0,0,1,0,0|2,0,1]=4 825 B11R1.24 CSCCC1CNCC(=O)N1 Amb27975683 [0,0,0,1,0,0|3,0,0]=4 826 B11R1.24 N#CCCC1CCCC(=O)C1 Amb18125303 [0,0,0,1,0,0|2,0,1]=4 827 B11R1.24 NCCCC1CCCC(=O)C1 Amb27272657 [0,0,0,1,0,0|2,0,0]=3 828 B11R1.24 NCCCC1CCCC(=O)N1 Amb18200144 [0,0,0,1,0,0|2,0,0]=3 829 B11R1.24 NCCCC1CCNC(=O)C1 Amb25697471 [0,0,0,1,0,0|3,0,0]=4 830 B11R1.24 NCCCC1CCNC(=O)C1 Amb33734215 [0,0,0,1,0,0|3,0,0]=4 831 B11R1.24 O=C1C=C(CCCBr)CCC1 Amb27839726 [0,0,0,1,0,0|2,0,1]=4 832 B11R1.24 O=C1C=CC[C@H](CCCO)O1 Amb27775902 [0,0,0,1,0,0|1,0,2]=4 833 B11R1.24 O=C1CCCC(CCCO)N1 Amb18199970 [0,0,0,1,0,0|2,0,0]=3 834 B11R1.24 O=C1CCCC(NCCO)C1 Amb27206993 [0,0,0,1,0,0|3,0,0]=4 835 B11R1.24 O=C1CCCC(SCCO)C1 Amb27238717 [0,0,0,1,0,0|3,0,0]=4 836 B11R1.24 O=C1CCCN(CCCO)C1 Amb28324812 [0,0,0,1,0,0|3,0,0]=4 837 B11R1.24 [N-]=[N+]=NCC1CCCC(=O)O1 Amb27839711 [0,0,0,1,0,0|3,0,0]=4 838 B11R1.27 CCCC#CC1CCC(=O)C1 Amb27261961 [0,0,0,1,0,0|1,0,2]=4 839 B11R1.27 CCCC#CC1CCC(=O)N1 Amb28120024 [0,0,0,1,0,0|1,0,2]=4 840 B11R1.27 CCCCCC1=CC(=O)CC1 Amb27987060 [0,0,0,1,0,0|1,0,1]=3 841 B11R1.27 CCCCCC1=CC(=O)CO1 Amb27672377 [0,0,0,1,0,0|2,0,1]=4 842 B11R1.27 CCCCCC1=CC(O)CC1 Amb27987048 [0,0,0,1,0,0|1,0,2]=4 843 B11R1.27 CCCCCC1=CCC(=O)N1 Amb25384805 [0,0,0,1,0,0|1,0,2]=4 844 B11R1.27 CCCCCC1=CCC(=O)O1 Amb26998895 [0,0,0,1,0,0|0,0,2]=3 845 B11R1.27 CCCCCC1=NNC(=O)O1 Amb24755475 [0,0,0,1,0,0|2,0,1]=4 846 B11R1.27 CCCCCC1C=CC(=O)O1 Amb24766300 [0,0,0,1,0,0|0,0,2]=3 847 B11R1.27 CCCCCC1CCC(=O)O1 Amb569744 [0,0,0,1,0,0|0,0,0]=1 848 B11R1.27 CCCCCC1CCC(Cl)C1 Amb27987841 [0,0,0,1,0,0|2,0,1]=4 849 B11R1.27 CCCCCC1CCC(O)C1 Amb27272444 [0,0,0,1,0,0|1,0,1]=3 850 B11R1.27 CCCCCC1CN=C(N)N1 Amb27671383 [0,0,0,1,0,0|3,0,0]=4 851 B11R1.27 CCCCCC1CN=C(N)O1 Amb27987869 [0,0,0,1,0,0|2,0,0]=3 852 B11R1.27 CCCCCC1CNC(=O)O1 Amb27987874 [0,0,0,1,0,0|1,0,0]=2 853 B11R1.27 CCCCCC1OCC(C)O1 Amb22229843 [0,0,0,1,0,0|2,0,1]=4 854 B11R1.27 CCCCCN1CC[C@@H](O)C1 Amb27492016 [0,0,0,1,0,0|2,0,1]=4 855 B11R1.27 CCCCCN1CC[C@H](O)C1 Amb27670908 [0,0,0,1,0,0|2,0,1]=4 856 B11R1.27 CCCCC[C@@H]1CCC(=O)C1 Amb27673726 [0,0,0,1,0,0|1,0,0]=2 857 B11R1.27 CCCCC[C@H]1CCC(=O)C1 Amb28080151 [0,0,0,1,0,0|1,0,0]=2 858 B11R1.27 CCCCC[C@H]1CCC(=O)N1 Amb28080184 [0,0,0,1,0,0|1,0,0]=2 859 B11R1.27 CCCCC[C@H]1CCC(=O)O1 Amb22348365 [0,0,0,1,0,0|0,0,0]=1 860 B11R1.27 CCCCSC1=CC(=O)CC1 Amb27272290 [0,0,0,1,0,0|2,0,1]=4 861 B11R1.27 CCCNCC1CCC(=O)N1 Amb25382477 [0,0,0,1,0,0|2,0,0]=3 862 B11R1.27 CCCNCC1CCC(C)O1 Amb27269412 [0,0,0,1,0,0|2,0,1]=4 863 B11R1.27 CCCNCC1CNC(=O)C1 Amb28079895 [0,0,0,1,0,0|3,0,0]=4 864 B11R1.27 CCCNCC1CNC(=O)O1 Amb28352094 [0,0,0,1,0,0|2,0,0]=3 865 B11R1.27 CCCNCC1COC(=O)N1 Amb28352095 [0,0,0,1,0,0|3,0,0]=4 866 B11R1.27 CCCOCC1=CC(=O)CC1 Amb27987814 [0,0,0,1,0,0|2,0,1]=4 867 B11R1.27 CCCOCC1CCC(=O)C1 Amb27987809 [0,0,0,1,0,0|2,0,0]=3 868 B11R1.27 CCCOCC1CCC(O)C1 Amb27269762 [0,0,0,1,0,0|2,0,1]=4 869 B11R1.27 CCCSC[C@@H]1CCC(=O)N1 Amb27673440 [0,0,0,1,0,0|2,0,0]=3 870 B11R1.27 CCCSC[C@@H]1CCC(O)N1 Amb27673441 [0,0,0,1,0,0|2,0,1]=4 871 B11R1.27 CCC\C=C\C1CNC(=O)O1 Amb33373721 [0,0,0,1,0,0|1,0,2]=4 872 B11R1.27 CCSCCC1=CC(=O)CC1 Amb27492308 [0,0,0,1,0,0|2,0,1]=4 873 B11R1.27 CCSCCC1COC(=O)N1 Amb27266840 [0,0,0,1,0,0|3,0,0]=4 874 B11R1.27 CCSCCN1CCC(=O)C1 Amb27267017 [0,0,0,1,0,0|3,0,0]=4 875 B11R1.27 CNCCCC1CCC(C)O1 Amb28387037 [0,0,0,1,0,0|2,0,1]=4 876 B11R1.27 COCCCC1=CC(=O)CC1 Amb27987926 [0,0,0,1,0,0|2,0,1]=4 877 B11R1.27 COCOC[C@H]1CCC(=O)N1 Amb27673455 [0,0,0,1,0,0|3,0,0]=4 878 B11R1.27 CSCCCC1=CC(=O)CC1 Amb27492307 [0,0,0,1,0,0|2,0,1]=4 879 B11R1.27 CSCCCC1COC(=O)N1 Amb27818857 [0,0,0,1,0,0|3,0,0]=4 880 B11R1.27 CSCCSC1CCC(=O)C1 Amb28079898 [0,0,0,1,0,0|3,0,0]=4 881 B11R1.27 C[C@@H]1CCC(CCCCN)O1 Amb32730449 [0,0,0,1,0,0|2,0,1]=4 882 B11R1.27 C\C=C\CCC1CCC(=O)N1 Amb26622093 [0,0,0,1,0,0|1,0,2]=4 883 B11R1.27 NCCCCC1CCC(=O)O1 Amb27671667 [0,0,0,1,0,0|1,0,0]=2 884 B11R1.27 NCCSCC1CNC(=O)O1 Amb6746145 [0,0,0,1,0,0|3,0,0]=4 885 B11R1.27 O=C1C=C(CCCCBr)CC1 Amb27673335 [0,0,0,1,0,0|2,0,1]=4 886 B11R1.27 O=C1C=C[C@@H](CCCCO)O1 Amb27989710 [0,0,0,1,0,0|1,0,2]=4 887 B11R1.27 O=C1CCC(CCCCBr)C1 Amb27673519 [0,0,0,1,0,0|2,0,0]=3 888 B11R1.27 O=C1CCC(CCCCCl)C1 Amb27990027 [0,0,0,1,0,0|2,0,0]=3 889 B11R1.27 O=C1CCC(CCCCO)C1 Amb28080310 [0,0,0,1,0,0|2,0,0]=3 890 B11R1.27 O=C1CCC(SCCCO)C1 Amb27271112 [0,0,0,1,0,0|3,0,0]=4 891 B11R1.27 O=C1CCN(CCCCF)C1 Amb27987922 [0,0,0,1,0,0|3,0,0]=4 892 B11R1.27 O=CCCC[C@@H]1CCC(=O)N1 Amb28080117 [0,0,0,1,0,0|2,0,1]=4 893 B11R1.53 C#CC1CCCCC1C(=O)O Amb27478096 [0,0,0,1,0,0|0,0,2]=3 894 B11R1.53 C#CC1CCCCC1C(C)=O Amb25677027 [0,0,0,1,0,0|1,0,2]=4 895 B11R1.53 C=CC1CCCCC1C(=O)Cl Amb24419890 [0,0,0,1,0,0|1,0,2]=4 896 B11R1.53 C=CC1CCCCC1C(=O)O Amb18644639 [0,0,0,1,0,0|0,0,2]=3 897 B11R1.53 C=CC1CCCCC1C(C)=O Amb26627090 [0,0,0,1,0,0|1,0,2]=4 898 B11R1.53 C=CC1OCCCC1C(=O)O Amb25175776 [0,0,0,1,0,0|1,0,2]=4 899 B11R1.53 C=C[C@@H]1CCCC[C@@H]1C(=O)O Amb27865534 [0,0,0,1,0,0|0,0,2]=3 900 B11R1.53 C=C[C@@H]1CCCC[C@H]1C(=O)Cl Amb26937727 [0,0,0,1,0,0|1,0,2]=4 901 B11R1.53 C=C[C@@H]1CCCC[C@H]1C(=O)O Amb26552392 [0,0,0,1,0,0|0,0,2]=3 902 B11R1.53 C=C[C@@H]1CCCC[C@H]1C(C)=O Amb27861488 [0,0,0,1,0,0|1,0,2]=4 903 B11R1.53 C=C[C@@H]1OCCC[C@H]1C(=O)O Amb25228867 [0,0,0,1,0,0|1,0,2]=4 904 B11R1.53 C=C[C@H]1CCCC[C@@H]1C(C)=O Amb27252281 [0,0,0,1,0,0|1,0,2]=4 905 B11R1.53 C=C[C@H]1CCCC[C@H]1C(=O)Cl Amb27798752 [0,0,0,1,0,0|1,0,2]=4 906 B11R1.53 C=C[C@H]1CCCC[C@H]1C(C)=O Amb28054461 [0,0,0,1,0,0|1,0,2]=4 907 B11R1.53 CC(=O)C1CCCCC1C#N Amb25864043 [0,0,0,1,0,0|2,0,1]=4 908 B11R1.53 CC(=O)C1CCCCC1CN Amb24488210 [0,0,0,1,0,0|2,0,0]=3 909 B11R1.53 CC(=O)C1CCCCC1CO Amb28144180 [0,0,0,1,0,0|2,0,0]=3 910 B11R1.53 CC(=O)N1CCCCC1CO Amb9277476 [0,0,0,1,0,0|3,0,0]=4 911 B11R1.53 CC(=O)N1CCCC[C@@H]1CO Amb25829477 [0,0,0,1,0,0|3,0,0]=4 912 B11R1.53 CC(=O)N1CCCC[C@H]1CO Amb25268937 [0,0,0,1,0,0|3,0,0]=4 913 B11R1.53 CC(=O)[C@@H]1CCCC[C@@H]1CN Amb33132917 [0,0,0,1,0,0|2,0,0]=3 914 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1C#N Amb28324352 [0,0,0,1,0,0|2,0,1]=4 915 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1C=O Amb27789881 [0,0,0,1,0,0|2,0,1]=4 916 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CBr Amb27252188 [0,0,0,1,0,0|2,0,0]=3 917 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CCl Amb27634843 [0,0,0,1,0,0|2,0,0]=3 918 B11R1.53 CC(=O)[C@H]1CCCC[C@H]1C#N Amb27471969 [0,0,0,1,0,0|2,0,1]=4 919 B11R1.53 CCC1=C(C(=O)Cl)CCCC1 Amb28324256 [0,0,0,1,0,0|1,0,2]=4 920 B11R1.53 CCC1=C(C(=O)O)CCCO1 Amb24528967 [0,0,0,1,0,0|1,0,2]=4 921 B11R1.53 CCC1C=CCCC1C(=O)O Amb28384133 [0,0,0,1,0,0|0,0,2]=3 922 B11R1.53 CCC1CC=CCC1C(C)=O Amb25699945 [0,0,0,1,0,0|1,0,2]=4 923 B11R1.53 CCC1CCCCC1B(O)O Amb21927861 [0,0,0,1,0,0|1,0,1]=3 924 B11R1.53 CCC1CCCCC1C(=O)O Amb27606678 [0,0,0,1,0,0|0,0,0]=1 925 B11R1.53 CCC1CCCCC1C(C)N Amb28387851 [0,0,0,1,0,0|2,0,1]=4 926 B11R1.53 CCC1CCCCC1C(N)=O Amb27989232 [0,0,0,1,0,0|1,0,0]=2 927 B11R1.53 CCC1CCCCC1[N+](=O)[O-] Amb33299040 [0,0,0,1,0,0|1,0,1]=3 928 B11R1.53 CCC1CCCCN1C(N)=O Amb8873523 [0,0,0,1,0,0|2,0,0]=3 929 B11R1.53 CCC1CCCNC1C(=O)O Amb26014486 [0,0,0,1,0,0|1,0,0]=2 930 B11R1.53 CCC1CCNCC1C(=O)O Amb18199964 [0,0,0,1,0,0|1,0,0]=2 931 B11R1.53 CCC1CCNCC1C(N)=O Amb28286755 [0,0,0,1,0,0|2,0,0]=3 932 B11R1.53 CCC1CNCCC1C(=O)O Amb33275584 [0,0,0,1,0,0|1,0,0]=2 933 B11R1.53 CCC1CNCCC1C(C)=O Amb32676965 [0,0,0,1,0,0|2,0,0]=3 934 B11R1.53 CCC1CNCCC1C(N)=O Amb27186164 [0,0,0,1,0,0|2,0,0]=3 935 B11R1.53 CCC1COCCC1C(=O)O Amb27791043 [0,0,0,1,0,0|1,0,0]=2 936 B11R1.53 CCC1COCCN1C(=O)Cl Amb25063966 [0,0,0,1,0,0|3,0,0]=4 937 B11R1.53 CCC1NCCCC1C(=O)O Amb27858957 [0,0,0,1,0,0|1,0,0]=2 938 B11R1.53 CCC1OCCCC1C(=O)O Amb26441727 [0,0,0,1,0,0|1,0,0]=2 939 B11R1.53 CCC1OCCCC1C(N)=O Amb27752806 [0,0,0,1,0,0|2,0,0]=3 940 B11R1.53 CCN1CCCCC1C(=N)N Amb35666159 [0,0,0,1,0,0|3,0,0]=4 941 B11R1.53 CCN1CCCCC1C(=O)O Amb10603421 [0,0,0,1,0,0|1,0,0]=2 942 B11R1.53 CCN1CCCCC1C(=O)O Amb9299667 [0,0,0,1,0,0|1,0,0]=2 943 B11R1.53 CCN1CCCC[C@@H]1C(=O)O Amb27400269 [0,0,0,1,0,0|1,0,0]=2 944 B11R1.53 CCN1CCCC[C@H]1C(=O)O Amb28244690 [0,0,0,1,0,0|1,0,0]=2 945 B11R1.53 CCN1CCNCC1C(=O)O Amb18199893 [0,0,0,1,0,0|2,0,0]=3 946 B11R1.53 CCN1CCOCC1C(=O)O Amb28652958 [0,0,0,1,0,0|2,0,0]=3 947 B11R1.53 CCN1CCOCC1C(N)=O Amb23585603 [0,0,0,1,0,0|3,0,0]=4 948 B11R1.53 CCN1CCSCC1C(N)=O Amb27766367 [0,0,0,1,0,0|3,0,0]=4 949 B11R1.53 CC[C@@H]1CCCC[C@H]1C(C)=O Amb25232533 [0,0,0,1,0,0|1,0,0]=2 950 B11R1.53 CC[C@@H]1CCCN[C@@H]1C(=O)O Amb28200831 [0,0,0,1,0,0|1,0,0]=2 951 B11R1.53 CC[C@@H]1NCCC[C@H]1C(=O)O Amb18199984 [0,0,0,1,0,0|1,0,0]=2 952 B11R1.53 CC[C@@H]1OCCC[C@@H]1C(=O)O Amb27858544 [0,0,0,1,0,0|1,0,0]=2 953 B11R1.53 CC[C@H]1CC=CC[C@@H]1C(=O)O Amb27252233 [0,0,0,1,0,0|0,0,2]=3 954 B11R1.53 CC[C@H]1CCCN[C@@H]1C(=O)O Amb27620290 [0,0,0,1,0,0|1,0,0]=2 955 B11R1.53 CNC1CCCC=C1C(=O)O Amb27411507 [0,0,0,1,0,0|1,0,2]=4 956 B11R1.53 CNC1CCCCC1C(=N)N Amb32672058 [0,0,0,1,0,0|3,0,0]=4 957 B11R1.53 CNC1CCCCC1C(=O)O Amb26595951 [0,0,0,1,0,0|1,0,0]=2 958 B11R1.53 CNC1CCCCC1C(N)=O Amb25255322 [0,0,0,1,0,0|2,0,0]=3 959 B11R1.53 CNC1CCCCC1C(N)=S Amb32672059 [0,0,0,1,0,0|2,1,0]=4 960 B11R1.53 CNC1CCOCC1C(N)=O Amb27637346 [0,0,0,1,0,0|3,0,0]=4 961 B11R1.53 CN[C@@H]1CCCC[C@@H]1C(N)=O Amb27631439 [0,0,0,1,0,0|2,0,0]=3 962 B11R1.53 COC1CCCCC1C(=O)Cl Amb25124892 [0,0,0,1,0,0|2,0,0]=3 963 B11R1.53 COC1CCCCC1C(=O)O Amb18967398 [0,0,0,1,0,0|1,0,0]=2 964 B11R1.53 COC1CCCCC1C(C)=O Amb27762537 [0,0,0,1,0,0|2,0,0]=3 965 B11R1.53 COC1CCCCC1C(N)=O Amb27152949 [0,0,0,1,0,0|2,0,0]=3 966 B11R1.53 COC1CCCCC1C(N)=S Amb27817239 [0,0,0,1,0,0|2,1,0]=4 967 B11R1.53 COC1CCCCN1C(C)=O Amb25793837 [0,0,0,1,0,0|3,0,0]=4 968 B11R1.53 COC1CCNCC1C(=O)O Amb27427525 [0,0,0,1,0,0|2,0,0]=3 969 B11R1.53 COC1CCOCC1C(=O)O Amb27813521 [0,0,0,1,0,0|2,0,0]=3 970 B11R1.53 COC1CNCCC1C(=O)O Amb26427777 [0,0,0,1,0,0|2,0,0]=3 971 B11R1.53 COC1COCCC1C(=O)O Amb27399112 [0,0,0,1,0,0|2,0,0]=3 972 B11R1.53 COC1OCCCC1C(=O)O Amb28245261 [0,0,0,1,0,0|2,0,0]=3 973 B11R1.53 CO[C@@H]1C=CCC[C@@H]1C(=O)O Amb27983665 [0,0,0,1,0,0|1,0,2]=4 974 B11R1.53 CO[C@H]1CCCC[C@@H]1C(=O)O Amb27845470 [0,0,0,1,0,0|1,0,0]=2 975 B11R1.53 CO[C@H]1CCCC[C@H]1S(=O)Cl Amb32720773 [0,0,0,1,0,0|3,0,0]=4 976 B11R1.53 CO[C@H]1CCCC[C@H]1S(=O)[O-] Amb32755060 [0,0,0,1,0,0|2,0,1]=4 977 B11R1.53 CO[C@H]1CCCC[C@H]1S(N)=O Amb32720774 [0,0,0,1,0,0|3,0,0]=4 978 B11R1.53 C[C@@H](O)[C@H]1CCCC[C@H]1CO Amb27420658 [0,0,0,1,0,0|2,0,1]=4 979 B11R1.53 N#CC1CCCCC1C(=O)O Amb18125545 [0,0,0,1,0,0|1,0,1]=3 980 B11R1.53 N#CC1OCCCC1C(=O)O Amb26422773 [0,0,0,1,0,0|2,0,1]=4 981 B11R1.53 N#CN1CCCCC1C(=O)O Amb30031705 [0,0,0,1,0,0|2,0,1]=4 982 B11R1.53 N#CN1CCCC[C@@H]1C(=O)O Amb30031695 [0,0,0,1,0,0|2,0,1]=4 983 B11R1.53 N#CN1CCCC[C@H]1C(=O)O Amb30031710 [0,0,0,1,0,0|2,0,1]=4 984 B11R1.53 N=C(N)C1CCCCC1CO Amb27843634 [0,0,0,1,0,0|3,0,0]=4 985 B11R1.53 NC(=O)C1CCCCC1CO Amb28365379 [0,0,0,1,0,0|2,0,0]=3 986 B11R1.53 NC(=O)[C@@H]1CCCC[C@@H]1CO Amb26884904 [0,0,0,1,0,0|2,0,0]=3 987 B11R1.53 NC(=O)[C@@H]1CCCC[C@H]1CO Amb16233807 [0,0,0,1,0,0|2,0,0]=3 988 B11R1.53 NC(=O)[C@H]1CCCC[C@H]1CO Amb25362020 [0,0,0,1,0,0|2,0,0]=3 989 B11R1.53 NCC1CCCCC1C(=O)O Amb18126060 [0,0,0,1,0,0|1,0,0]=2 990 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb22901093 [0,0,0,1,0,0|1,0,0]=2 991 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb24602383 [0,0,0,1,0,0|1,0,0]=2 992 B11R1.53 O=C(O)C1=CCCCC1CO Amb27401800 [0,0,0,1,0,0|1,0,2]=4 993 B11R1.53 O=C(O)C1CC=CCC1CO Amb28397357 [0,0,0,1,0,0|1,0,2]=4 994 B11R1.53 O=C(O)C1CCCCC1CCl Amb28121870 [0,0,0,1,0,0|1,0,0]=2 995 B11R1.53 O=C(O)C1CCCCC1CF Amb20668097 [0,0,0,1,0,0|1,0,0]=2 996 B11R1.53 O=C(O)C1CCCCC1CO Amb24484407 [0,0,0,1,0,0|1,0,0]=2 997 B11R1.53 O=C(O)C1CCNCC1CO Amb28053243 [0,0,0,1,0,0|2,0,0]=3 998 B11R1.53 O=C(O)C1CNCCC1CO Amb27215492 [0,0,0,1,0,0|2,0,0]=3 999 B11R1.53 O=C(O)C1NCCOC1CO Amb27423296 [0,0,0,1,0,0|3,0,0]=4 1000 B11R1.53 O=C(O)[C@@H]1CCCN[C@H]1CO Amb18199870 [0,0,0,1,0,0|2,0,0]=3 1001 B11R1.53 O=C(O)[C@H]1CCCC[C@H]1CO Amb24615220 [0,0,0,1,0,0|1,0,0]=2 1002 B11R1.53 O=C(O)[C@H]1CCCN[C@@H]1CO Amb27420244 [0,0,0,1,0,0|2,0,0]=3 1003 B11R1.53 O=CN1CCCCC1C(=O)O Amb18278518 [0,0,0,1,0,0|2,0,1]=4 1004 B11R1.53 O=CN1CCCC[C@@H]1C(=O)O Amb28455481 [0,0,0,1,0,0|2,0,1]=4 1005 B11R1.53 O=CN1CCCC[C@H]1C(=O)O Amb27657717 [0,0,0,1,0,0|2,0,1]=4 1006 B11R1.53 O=NN1CCCCC1C(=O)O Amb17618613 [0,0,0,1,0,0|3,0,0]=4 1007 B11R1.53 O=NN1CCCC[C@@H]1C(=O)O Amb27247099 [0,0,0,1,0,0|3,0,0]=4 1008 B11R1.57 C=C(Cl)CN1CCCC1CC Amb28125609 [0,0,0,1,0,0|3,0,0]=4 1009 B11R1.57 C=C[C@@H]1CCC[C@@H]1CC(=O)O Amb27788425 [0,0,0,1,0,0|0,0,2]=3 1010 B11R1.57 CC(=O)CN1CCC[C@@H]1CO Amb29855226 [0,0,0,1,0,0|3,0,0]=4 1011 B11R1.57 CC(=O)CN1CCC[C@H]1CO Amb35687993 [0,0,0,1,0,0|3,0,0]=4 1012 B11R1.57 CC(=O)C[C@@H]1CCC[C@H]1C=O Amb24561068 [0,0,0,1,0,0|2,0,1]=4 1013 B11R1.57 CC(=O)C[C@@H]1CCC[C@H]1CCl Amb27660210 [0,0,0,1,0,0|2,0,0]=3 1014 B11R1.57 CC(=O)NC1CCCC1CCl Amb27235337 [0,0,0,1,0,0|3,0,0]=4 1015 B11R1.57 CC(=O)NC1CCCC1CO Amb28044186 [0,0,0,1,0,0|3,0,0]=4 1016 B11R1.57 CCC1CCCC1NC(=O)Cl Amb35633526 [0,0,0,1,0,0|2,0,0]=3 1017 B11R1.57 CCC1CCCN1CC(N)=S Amb18180374 [0,0,0,1,0,0|2,1,0]=4 1018 B11R1.57 CCC1CCCN1C[C@H](C)O Amb27477393 [0,0,0,1,0,0|2,0,1]=4 1019 B11R1.57 CCC1CNCC1CC(=O)O Amb28198977 [0,0,0,1,0,0|1,0,0]=2 1020 B11R1.57 CCC1COCC1CC(=O)O Amb35631919 [0,0,0,1,0,0|1,0,0]=2 1021 B11R1.57 CCC1COCC1NC(=O)Cl Amb35636914 [0,0,0,1,0,0|3,0,0]=4 1022 B11R1.57 CCC1COCC1NC(C)=O Amb35617073 [0,0,0,1,0,0|3,0,0]=4 1023 B11R1.57 CCC1COCC1NC(N)=O Amb35617112 [0,0,0,1,0,0|3,0,0]=4 1024 B11R1.57 CCC1COC\C1=C/C(=O)O Amb35631904 [0,0,0,1,0,0|1,0,2]=4 1025 B11R1.57 CCN1CCCC1CC(=O)O Amb17504530 [0,0,0,1,0,0|1,0,0]=2 1026 B11R1.57 CCN1CCCC1CC(=O)O Amb33550833 [0,0,0,1,0,0|1,0,0]=2 1027 B11R1.57 CC[C@@H]1NCC[C@H]1CC(=O)O Amb18199980 [0,0,0,1,0,0|1,0,0]=2 1028 B11R1.57 CC[C@H]1NCC[C@@H]1CC(=O)O Amb28429151 [0,0,0,1,0,0|1,0,0]=2 1029 B11R1.57 CN[C@@H]1CCC[C@H]1NC(C)=O Amb28052128 [0,0,0,1,0,0|3,0,0]=4 1030 B11R1.57 COC1CCCC1CC(=O)O Amb18199909 [0,0,0,1,0,0|1,0,0]=2 1031 B11R1.57 COC1CCCC1CC(C)O Amb27405471 [0,0,0,1,0,0|2,0,1]=4 1032 B11R1.57 COC1CCCC1NC(=O)Cl Amb35625873 [0,0,0,1,0,0|3,0,0]=4 1033 B11R1.57 COC1CCCC1NC(N)=O Amb18799940 [0,0,0,1,0,0|3,0,0]=4 1034 B11R1.57 CO[C@@H]1CCC[C@H]1NC(C)=O Amb27598363 [0,0,0,1,0,0|3,0,0]=4 1035 B11R1.57 CO[C@@H]1CCC[C@H]1NC(N)=O Amb28182684 [0,0,0,1,0,0|3,0,0]=4 1036 B11R1.57 CO[C@@H]1CCC[C@H]1OC(=O)Cl Amb33297184 [0,0,0,1,0,0|3,0,0]=4 1037 B11R1.57 CO[C@@H]1CNC[C@H]1CC(N)=O Amb30530042 [0,0,0,1,0,0|3,0,0]=4 1038 B11R1.57 CO[C@H]1CCC[C@@H]1NC(N)=O Amb28461097 [0,0,0,1,0,0|3,0,0]=4 1039 B11R1.57 CSC1CCCC1NC(=O)Cl Amb35633373 [0,0,0,1,0,0|3,0,0]=4 1040 B11R1.57 CSC1CCCC1NC(C)=O Amb27469729 [0,0,0,1,0,0|3,0,0]=4 1041 B11R1.57 CS[C@@H]1CCC[C@H]1NC(C)=O Amb27783376 [0,0,0,1,0,0|3,0,0]=4 1042 B11R1.57 N#CC1CCCC1CC(=O)O Amb18201141 [0,0,0,1,0,0|1,0,1]=3 1043 B11R1.57 N#CN1CCCC1CC(=O)O Amb30031708 [0,0,0,1,0,0|2,0,1]=4 1044 B11R1.57 NCC1CCCC1NC(N)=O Amb18287965 [0,0,0,1,0,0|3,0,0]=4 1045 B11R1.57 NCC1CCCN1CC(=O)O Amb26998361 [0,0,0,1,0,0|2,0,0]=3 1046 B11R1.57 NCC1CCCN1CC(N)=O Amb18251523 [0,0,0,1,0,0|3,0,0]=4 1047 B11R1.57 NC[C@@H]1CCCN1CC(=O)O Amb24737565 [0,0,0,1,0,0|2,0,0]=3 1048 B11R1.57 NC[C@@H]1CCCN1CC(N)=O Amb27210174 [0,0,0,1,0,0|3,0,0]=4 1049 B11R1.57 NC[C@@H]1CCC[C@H]1CC(=O)O Amb27967366 [0,0,0,1,0,0|1,0,0]=2 1050 B11R1.57 NC[C@H]1CCCN1CC(=O)O Amb25314232 [0,0,0,1,0,0|2,0,0]=3 1051 B11R1.57 O=C(O)CN1CCCC1CO Amb18984550 [0,0,0,1,0,0|2,0,0]=3 1052 B11R1.57 O=C(O)CN1CCC[C@H]1CO Amb10067045 [0,0,0,1,0,0|2,0,0]=3 1053 B11R1.86 C=C(C)CC1CCCCC1N Amb28240598 [0,0,0,1,0,0|3,0,0]=4 1054 B11R1.86 C=C(C)CC1CCCCC1O Amb18799539 [0,0,0,1,0,0|3,0,0]=4 1055 B11R1.86 C=C(C)C[C@@H]1CCCC[C@H]1O Amb28053661 [0,0,0,1,0,0|3,0,0]=4 1056 B11R1.86 C=C(Cl)CC1CCCCC1O Amb24575552 [0,0,0,1,0,0|3,0,0]=4 1057 B11R1.86 C=C(Cl)C[C@@H]1CCCC[C@H]1O Amb33213298 [0,0,0,1,0,0|3,0,0]=4 1058 B11R1.86 C=C1CCCCC1CC(=O)O Amb18125767 [0,0,0,1,0,0|0,0,2]=3 1059 B11R1.86 C=C1CCCC[C@@H]1CC(=O)O Amb27407705 [0,0,0,1,0,0|0,0,2]=3 1060 B11R1.86 CC(=O)CC1=C(C)CCCC1 Amb17593809 [0,0,0,1,0,0|1,0,2]=4 1061 B11R1.86 CC(=O)CC1CCCCC1=O Amb17593853 [0,0,0,1,0,0|2,0,1]=4 1062 B11R1.86 CC(=O)CC1CCCCC1Cl Amb28137935 [0,0,0,1,0,0|2,0,0]=3 1063 B11R1.86 CC(=O)CC1CCCCC1F Amb27791180 [0,0,0,1,0,0|2,0,0]=3 1064 B11R1.86 CC(=O)CC1CCCCC1N Amb24582661 [0,0,0,1,0,0|2,0,0]=3 1065 B11R1.86 CC(=O)CC1CCCCN1C Amb5718445 [0,0,0,1,0,0|2,0,0]=3 1066 B11R1.86 CC(=O)CC1CCCOC1O Amb28253856 [0,0,0,1,0,0|3,0,0]=4 1067 B11R1.86 CC(=O)CN1CCCCC1C Amb8427993 [0,0,0,1,0,0|2,0,0]=3 1068 B11R1.86 CC(=O)C[C@@H]1CCCCN1C Amb26450192 [0,0,0,1,0,0|2,0,0]=3 1069 B11R1.86 CC(=O)C[C@@H]1CCCC[C@@H]1N Amb33307982 [0,0,0,1,0,0|2,0,0]=3 1070 B11R1.86 CC(=O)C[C@@H]1CCCC[C@H]1O Amb27212016 [0,0,0,1,0,0|2,0,0]=3 1071 B11R1.86 CC(=O)NC1CCCCC1Cl Amb27875116 [0,0,0,1,0,0|3,0,0]=4 1072 B11R1.86 CC(=O)NC1CCCCC1O Amb18797124 [0,0,0,1,0,0|3,0,0]=4 1073 B11R1.86 CC(=O)NC1CCCCC1S Amb28292774 [0,0,0,1,0,0|3,0,0]=4 1074 B11R1.86 CC(=O)NC1CCCC[C@@H]1Cl Amb24571625 [0,0,0,1,0,0|3,0,0]=4 1075 B11R1.86 CC(=O)NC1CCNCC1C Amb25866016 [0,0,0,1,0,0|3,0,0]=4 1076 B11R1.86 CC(=O)NC1CCNCC1C Amb33328616 [0,0,0,1,0,0|3,0,0]=4 1077 B11R1.86 CC(=O)NC1CNCCC1C Amb27591818 [0,0,0,1,0,0|3,0,0]=4 1078 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1Cl Amb26450561 [0,0,0,1,0,0|3,0,0]=4 1079 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1N Amb27822700 [0,0,0,1,0,0|3,0,0]=4 1080 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1C Amb28435840 [0,0,0,1,0,0|2,0,0]=3 1081 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1Cl Amb27797252 [0,0,0,1,0,0|3,0,0]=4 1082 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1O Amb28320855 [0,0,0,1,0,0|3,0,0]=4 1083 B11R1.86 CC(=O)O[C@@H]1CCCC[C@@H]1Cl Amb27454844 [0,0,0,1,0,0|3,0,0]=4 1084 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1C Amb26958236 [0,0,0,1,0,0|2,0,0]=3 1085 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1Cl Amb27483080 [0,0,0,1,0,0|3,0,0]=4 1086 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1O Amb17844353 [0,0,0,1,0,0|3,0,0]=4 1087 B11R1.86 CC(=O)O[C@H]1CCCC[C@@H]1Cl Amb27440472 [0,0,0,1,0,0|3,0,0]=4 1088 B11R1.86 CC(=O)S[C@@H]1CCCC[C@@H]1Cl Amb27845415 [0,0,0,1,0,0|3,0,0]=4 1089 B11R1.86 CC(=O)S[C@@H]1CCCC[C@H]1N Amb30884410 [0,0,0,1,0,0|3,0,0]=4 1090 B11R1.86 CC(N)CC1CCCCC1C Amb27445569 [0,0,0,1,0,0|2,0,1]=4 1091 B11R1.86 CC(O)CC1CCCCC1N Amb35584289 [0,0,0,1,0,0|2,0,1]=4 1092 B11R1.86 CC(O)CC1CCCCN1C Amb27780420 [0,0,0,1,0,0|2,0,1]=4 1093 B11R1.86 CC(O)C[C@@H]1CCCCN1C Amb27472720 [0,0,0,1,0,0|2,0,1]=4 1094 B11R1.86 CC1CCCCC1C=C(Br)Br Amb27490358 [0,0,0,1,0,0|2,0,1]=4 1095 B11R1.86 CC1CCCCC1CB(O)O Amb28063935 [0,0,0,1,0,0|1,0,1]=3 1096 B11R1.86 CC1CCCCC1CC(=O)O Amb6749252 [0,0,0,1,0,0|0,0,0]=1 1097 B11R1.86 CC1CCCCC1CC(Cl)Cl Amb27444959 [0,0,0,1,0,0|2,0,1]=4 1098 B11R1.86 CC1CCCCC1CC(N)=O Amb27232827 [0,0,0,1,0,0|1,0,0]=2 1099 B11R1.86 CC1CCCCC1NC(=O)Cl Amb35637113 [0,0,0,1,0,0|2,0,0]=3 1100 B11R1.86 CC1CCCCC1NC(N)=O Amb1105317 [0,0,0,1,0,0|2,0,0]=3 1101 B11R1.86 CC1CCCCC1OC(=O)Cl Amb27648622 [0,0,0,1,0,0|2,0,0]=3 1102 B11R1.86 CC1CCCCN1CC(=O)O Amb6356107 [0,0,0,1,0,0|1,0,0]=2 1103 B11R1.86 CC1CCCCN1CC(N)=O Amb6528335 [0,0,0,1,0,0|2,0,0]=3 1104 B11R1.86 CC1CCCCN1CC(N)=S Amb6271415 [0,0,0,1,0,0|2,1,0]=4 1105 B11R1.86 CC1CCCCN1C[C@@H](C)O Amb27165625 [0,0,0,1,0,0|2,0,1]=4 1106 B11R1.86 CC1CCNCC1CC(=O)O Amb28652859 [0,0,0,1,0,0|1,0,0]=2 1107 B11R1.86 CC1CCNCC1CC(=O)O Amb8387926 [0,0,0,1,0,0|1,0,0]=2 1108 B11R1.86 CC1CNCCC1CC(=O)O Amb8387925 [0,0,0,1,0,0|1,0,0]=2 1109 B11R1.86 CC1CNCCN1CC(=O)O Amb18286635 [0,0,0,1,0,0|2,0,0]=3 1110 B11R1.86 CC1COCCC1NC(=O)Cl Amb35633374 [0,0,0,1,0,0|3,0,0]=4 1111 B11R1.86 CC1CSCCN1CC(=O)O Amb27454283 [0,0,0,1,0,0|2,0,0]=3 1112 B11R1.86 CC1CSCCN1CC(N)=O Amb27761150 [0,0,0,1,0,0|3,0,0]=4 1113 B11R1.86 CC1NCCCC1CC(=O)O Amb32662853 [0,0,0,1,0,0|1,0,0]=2 1114 B11R1.86 CC1NCCCC1CC(=O)O Amb8387928 [0,0,0,1,0,0|1,0,0]=2 1115 B11R1.86 CC1NCCCC1CC(N)=O Amb27186162 [0,0,0,1,0,0|2,0,0]=3 1116 B11R1.86 CC1NCCCC1NC(N)=O Amb27951215 [0,0,0,1,0,0|3,0,0]=4 1117 B11R1.86 CC1SCCCC1CC(=O)O Amb27235116 [0,0,0,1,0,0|1,0,0]=2 1118 B11R1.86 CN(O)CC1CCCCN1C Amb33323476 [0,0,0,1,0,0|3,0,0]=4 1119 B11R1.86 CN1CC=CCC1CC(=O)O Amb35748096 [0,0,0,1,0,0|1,0,2]=4 1120 B11R1.86 CN1CC=CCC1CC(=O)O Amb35749372 [0,0,0,1,0,0|1,0,2]=4 1121 B11R1.86 CN1CCCCC1CC(=N)N Amb33323210 [0,0,0,1,0,0|3,0,0]=4 1122 B11R1.86 CN1CCCCC1CC(=O)O Amb1076959 [0,0,0,1,0,0|1,0,0]=2 1123 B11R1.86 CN1CCCCC1CC(=O)O Amb13885783 [0,0,0,1,0,0|1,0,0]=2 1124 B11R1.86 CN1CCCCC1CC(N)=O Amb26606500 [0,0,0,1,0,0|2,0,0]=3 1125 B11R1.86 CN1CCCCC1CC(N)=S Amb33322430 [0,0,0,1,0,0|2,1,0]=4 1126 B11R1.86 CN1CCCCC1C[N+](=O)[O-] Amb33322710 [0,0,0,1,0,0|2,0,1]=4 1127 B11R1.86 CN1CCNCC1CC(=O)O Amb18199894 [0,0,0,1,0,0|2,0,0]=3 1128 B11R1.86 CN1CCNCC1CC(N)=O Amb27754167 [0,0,0,1,0,0|3,0,0]=4 1129 B11R1.86 CN1CCOCC1CC(=O)O Amb18199876 [0,0,0,1,0,0|2,0,0]=3 1130 B11R1.86 CN1CCOCC1CC(=O)O Amb33328716 [0,0,0,1,0,0|2,0,0]=3 1131 B11R1.86 C[C@@H](O)CC1CCCCN1C Amb33322724 [0,0,0,1,0,0|2,0,1]=4 1132 B11R1.86 C[C@@H](O)C[C@@H]1CCCCN1C Amb23603937 [0,0,0,1,0,0|2,0,1]=4 1133 B11R1.86 C[C@@H]1CNCCN1CC(=O)O Amb28314163 [0,0,0,1,0,0|2,0,0]=3 1134 B11R1.86 C[C@@H]1CNCCN1CC(N)=O Amb27215868 [0,0,0,1,0,0|3,0,0]=4 1135 B11R1.86 C[C@@H]1NCCC[C@@H]1NC(N)=O Amb27228136 [0,0,0,1,0,0|3,0,0]=4 1136 B11R1.86 C[C@H](O)CC1CCCCN1C Amb33322726 [0,0,0,1,0,0|2,0,1]=4 1137 B11R1.86 C[C@H](O)C[C@H]1CCCCN1C Amb26891961 [0,0,0,1,0,0|2,0,1]=4 1138 B11R1.86 C[C@H]1CNCCN1CC(=O)O Amb25843322 [0,0,0,1,0,0|2,0,0]=3 1139 B11R1.86 NC(=O)CC1CCCCC1=O Amb25829482 [0,0,0,1,0,0|2,0,1]=4 1140 B11R1.86 NC(=O)CC1CCCCC1O Amb25700984 [0,0,0,1,0,0|2,0,0]=3 1141 B11R1.86 NC(=O)CC1CCNCC1O Amb27186418 [0,0,0,1,0,0|3,0,0]=4 1142 B11R1.86 NC(=O)CC1COCCC1O Amb27658867 [0,0,0,1,0,0|3,0,0]=4 1143 B11R1.86 NC(=O)NC1CCCCC1O Amb18182354 [0,0,0,1,0,0|3,0,0]=4 1144 B11R1.86 NC(=O)N[C@@H]1CCCC[C@@H]1O Amb28384057 [0,0,0,1,0,0|3,0,0]=4 1145 B11R1.86 NC(=O)N[C@@H]1CCCC[C@H]1F Amb27231936 [0,0,0,1,0,0|3,0,0]=4 1146 B11R1.86 NC(=O)N[C@@H]1CCCC[C@H]1O Amb27822934 [0,0,0,1,0,0|3,0,0]=4 1147 B11R1.86 NC(=O)O[C@@H]1CCCC[C@H]1Cl Amb27657603 [0,0,0,1,0,0|3,0,0]=4 1148 B11R1.86 NC1=C(CC(=O)O)CCCC1 Amb27657786 [0,0,0,1,0,0|1,0,2]=4 1149 B11R1.86 NC1CCCCC1CC(=O)O Amb24509773 [0,0,0,1,0,0|1,0,0]=2 1150 B11R1.86 NC1CCCCC1CC(=O)O Amb28652992 [0,0,0,1,0,0|1,0,0]=2 1151 B11R1.86 NC1CCCCN1CC(=O)O Amb25152865 [0,0,0,1,0,0|2,0,0]=3 1152 B11R1.86 NC1CCCC\C1=C/C(=O)O Amb28285400 [0,0,0,1,0,0|1,0,2]=4 1153 B11R1.86 NC1CCNCC1CC(=O)O Amb32863483 [0,0,0,1,0,0|2,0,0]=3 1154 B11R1.86 NC1CCOCC1CC(=O)O Amb32992077 [0,0,0,1,0,0|2,0,0]=3 1155 B11R1.86 NC1CCSCC1CC(=O)O Amb32863486 [0,0,0,1,0,0|2,0,0]=3 1156 B11R1.86 NC1CSCCC1CC(=O)O Amb27229405 [0,0,0,1,0,0|2,0,0]=3 1157 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Amb26528136 [0,0,0,1,0,0|1,0,0]=2 1158 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Amb32661117 [0,0,0,1,0,0|1,0,0]=2 1159 B11R1.86 N[C@@H]1CCCC[C@H]1CC(=O)O Amb28199039 [0,0,0,1,0,0|1,0,0]=2 1160 B11R1.86 N[C@H]1CCCC[C@H]1CC(=O)O Amb24561031 [0,0,0,1,0,0|1,0,0]=2 1161 B11R1.86 O=C(Cl)OC1CCCCC1Cl Amb27233656 [0,0,0,1,0,0|3,0,0]=4 1162 B11R1.86 O=C(O)CC1C=CCCC1O Amb27481606 [0,0,0,1,0,0|1,0,2]=4 1163 B11R1.86 O=C(O)CC1CC=CCC1O Amb18125963 [0,0,0,1,0,0|1,0,2]=4 1164 B11R1.86 O=C(O)CC1CCCCC1=O Amb18125947 [0,0,0,1,0,0|1,0,1]=3 1165 B11R1.86 O=C(O)CC1CCCCC1F Amb24697602 [0,0,0,1,0,0|1,0,0]=2 1166 B11R1.86 O=C(O)CC1CCCCC1O Amb8009303 [0,0,0,1,0,0|1,0,0]=2 1167 B11R1.86 O=C(O)CC1CCCC[C@H]1O Amb25792260 [0,0,0,1,0,0|1,0,0]=2 1168 B11R1.86 O=C(O)CC1CCCNC1=O Amb18200017 [0,0,0,1,0,0|2,0,1]=4 1169 B11R1.86 O=C(O)CC1CCOCC1=O Amb18199924 [0,0,0,1,0,0|2,0,1]=4 1170 B11R1.86 O=C(O)CC1CCOCC1O Amb18199849 [0,0,0,1,0,0|2,0,0]=3 1171 B11R1.86 O=C(O)CC1CCSCC1=O Amb18197571 [0,0,0,1,0,0|2,0,1]=4 1172 B11R1.86 O=C(O)CC1CCSCC1O Amb18196580 [0,0,0,1,0,0|2,0,0]=3 1173 B11R1.86 O=C(O)CC1CNCCC1F Amb27592671 [0,0,0,1,0,0|2,0,0]=3 1174 B11R1.86 O=C(O)CC1COCCC1=O Amb18199923 [0,0,0,1,0,0|2,0,1]=4 1175 B11R1.86 O=C(O)CC1COCCC1O Amb18199848 [0,0,0,1,0,0|2,0,0]=3 1176 B11R1.86 O=C(O)CC1CSCCC1=O Amb18197570 [0,0,0,1,0,0|2,0,1]=4 1177 B11R1.86 O=C(O)CC1CSCCC1F Amb27445619 [0,0,0,1,0,0|2,0,0]=3 1178 B11R1.86 O=C(O)CC1CSCCC1O Amb18196579 [0,0,0,1,0,0|2,0,0]=3 1179 B11R1.86 O=C(O)CC1OCCCC1=O Amb18199925 [0,0,0,1,0,0|2,0,1]=4 1180 B11R1.86 O=C(O)CN1CCCCC1=O Amb6751288 [0,0,0,1,0,0|2,0,1]=4 1181 B11R1.86 O=C(O)C[C@@H]1C=CCC[C@@H]1O Amb27818039 [0,0,0,1,0,0|1,0,2]=4 1182 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1F Amb25168843 [0,0,0,1,0,0|1,0,0]=2 1183 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O Amb28057566 [0,0,0,1,0,0|1,0,0]=2 1184 B11R1.86 O=C(O)C[C@@H]1OCCC[C@H]1O Amb27232764 [0,0,0,1,0,0|2,0,0]=3 1185 B11R1.86 O=C(O)C[C@H]1CCCC[C@@H]1O Amb25274080 [0,0,0,1,0,0|1,0,0]=2 1186 B11R1.86 O=C(O)C[C@H]1CCCC[C@H]1O Amb27419962 [0,0,0,1,0,0|1,0,0]=2 1187 B11R1.86 O=C(O)\C=C1\CCCCC1O Amb27241357 [0,0,0,1,0,0|1,0,2]=4 1188 B11R1.90 C=C(C)CCC1CCCC1O Amb24460073 [0,0,0,1,0,0|3,0,0]=4 1189 B11R1.90 C=C(C)CC[C@@H]1CCC[C@H]1O Amb32950846 [0,0,0,1,0,0|3,0,0]=4 1190 B11R1.90 C=C(Cl)CNC1CCCC1C Amb27226378 [0,0,0,1,0,0|3,0,0]=4 1191 B11R1.90 CC(=N)NCC1CCCC1C Amb28072360 [0,0,0,1,0,0|3,0,0]=4 1192 B11R1.90 CC(=O)CCC1CCCN1C Amb25145698 [0,0,0,1,0,0|2,0,0]=3 1193 B11R1.90 CC(=O)CCC1CCOC1C Amb33426815 [0,0,0,1,0,0|2,0,0]=3 1194 B11R1.90 CC(=O)COC1CCCC1O Amb27599458 [0,0,0,1,0,0|3,0,0]=4 1195 B11R1.90 CC(=O)CSC1CCOC1C Amb28077033 [0,0,0,1,0,0|3,0,0]=4 1196 B11R1.90 CC(=O)NCC1CCCC1C Amb27617362 [0,0,0,1,0,0|2,0,0]=3 1197 B11R1.90 CC(=O)NCC1CCCN1C Amb27758772 [0,0,0,1,0,0|3,0,0]=4 1198 B11R1.90 CC(=O)NC[C@@H]1CCC[C@@H]1C Amb27216289 [0,0,0,1,0,0|2,0,0]=3 1199 B11R1.90 CC(=O)NC[C@@H]1CCC[C@@H]1O Amb28197193 [0,0,0,1,0,0|3,0,0]=4 1200 B11R1.90 CC(=O)NC[C@@H]1CCC[C@H]1O Amb27254214 [0,0,0,1,0,0|3,0,0]=4 1201 B11R1.90 CC(=O)NC[C@H]1CCC[C@@H]1O Amb27235919 [0,0,0,1,0,0|3,0,0]=4 1202 B11R1.90 CC(=O)OCC1CCCN1C Amb25199931 [0,0,0,1,0,0|3,0,0]=4 1203 B11R1.90 CC(=O)OCC1OCCC1C Amb25710223 [0,0,0,1,0,0|3,0,0]=4 1204 B11R1.90 CC(=O)OC[C@H]1CCC[C@@H]1O Amb27972537 [0,0,0,1,0,0|3,0,0]=4 1205 B11R1.90 CC(O)CCC1CCCN1C Amb26490146 [0,0,0,1,0,0|2,0,1]=4 1206 B11R1.90 CC(O)CCC1CCOC1C Amb33427208 [0,0,0,1,0,0|2,0,1]=4 1207 B11R1.90 CC(O)CC[C@H]1CCC[C@@H]1C Amb27198020 [0,0,0,1,0,0|1,0,1]=3 1208 B11R1.90 CC(O)CC[C@H]1CCC[C@H]1C Amb27472609 [0,0,0,1,0,0|1,0,1]=3 1209 B11R1.90 CC(O)CNC1CCCC1C Amb27160374 [0,0,0,1,0,0|2,0,1]=4 1210 B11R1.90 CC1CCCC1CNC(=N)N Amb27976508 [0,0,0,1,0,0|3,0,0]=4 1211 B11R1.90 CC1CCCC1CNC(=O)Cl Amb35633347 [0,0,0,1,0,0|2,0,0]=3 1212 B11R1.90 CC1CCCC1CNC(N)=S Amb28364620 [0,0,0,1,0,0|2,1,0]=4 1213 B11R1.90 CC1CCCC1NC[C@@H](C)O Amb28454671 [0,0,0,1,0,0|2,0,1]=4 1214 B11R1.90 CC1CCCN1\C=C\C(=O)O Amb27644330 [0,0,0,1,0,0|1,0,2]=4 1215 B11R1.90 CC1CCNC1C#CC(=O)O Amb33169032 [0,0,0,1,0,0|1,0,2]=4 1216 B11R1.90 CC1CCNC1CCC(N)=O Amb27638874 [0,0,0,1,0,0|2,0,0]=3 1217 B11R1.90 CC1COCC1NCC(=O)O Amb35632271 [0,0,0,1,0,0|2,0,0]=3 1218 B11R1.90 CC1COCC1NCC(N)=O Amb35630658 [0,0,0,1,0,0|3,0,0]=4 1219 B11R1.90 CC1CSCC1NCC(=O)O Amb27652020 [0,0,0,1,0,0|2,0,0]=3 1220 B11R1.90 CC1NCCC1C#CC(=O)O Amb33169066 [0,0,0,1,0,0|1,0,2]=4 1221 B11R1.90 CC1OCCC1C#CC(=O)O Amb28182482 [0,0,0,1,0,0|1,0,2]=4 1222 B11R1.90 CC1OCCC1CCC(=O)O Amb33427953 [0,0,0,1,0,0|1,0,0]=2 1223 B11R1.90 CC1OCCC1CC[C@@H](C)O Amb33427206 [0,0,0,1,0,0|2,0,1]=4 1224 B11R1.90 CC1OCCC1CC[C@H](C)O Amb33427207 [0,0,0,1,0,0|2,0,1]=4 1225 B11R1.90 CC1OCCC1CC[N+](=O)[O-] Amb33427187 [0,0,0,1,0,0|2,0,1]=4 1226 B11R1.90 CC1OCCC1CNC(=O)Cl Amb35633571 [0,0,0,1,0,0|3,0,0]=4 1227 B11R1.90 CC1OCCC1NCC(N)=O Amb27834248 [0,0,0,1,0,0|3,0,0]=4 1228 B11R1.90 CC1OCCC1OCC(=O)O Amb33426781 [0,0,0,1,0,0|2,0,0]=3 1229 B11R1.90 CC1OCCC1SCC(N)=O Amb27978985 [0,0,0,1,0,0|3,0,0]=4 1230 B11R1.90 CC1OCCC1\C=C\C(=O)O Amb33427648 [0,0,0,1,0,0|1,0,2]=4 1231 B11R1.90 CN(O)CCC1CCCN1C Amb33321412 [0,0,0,1,0,0|3,0,0]=4 1232 B11R1.90 CN1CCCC1C#CC(=O)O Amb33168996 [0,0,0,1,0,0|1,0,2]=4 1233 B11R1.90 CN1CCCC1CCC(=N)N Amb32954383 [0,0,0,1,0,0|3,0,0]=4 1234 B11R1.90 CN1CCCC1CCC(=O)O Amb17504569 [0,0,0,1,0,0|1,0,0]=2 1235 B11R1.90 CN1CCCC1CCC(=O)O Amb28872305 [0,0,0,1,0,0|1,0,0]=2 1236 B11R1.90 CN1CCCC1CCC(N)=S Amb26974009 [0,0,0,1,0,0|2,1,0]=4 1237 B11R1.90 CN1CCCC1CC[N+](=O)[O-] Amb33320702 [0,0,0,1,0,0|2,0,1]=4 1238 B11R1.90 CN1CCCC1CNC(=O)Cl Amb35625807 [0,0,0,1,0,0|3,0,0]=4 1239 B11R1.90 CN1CCCC1CNC(N)=O Amb27628463 [0,0,0,1,0,0|3,0,0]=4 1240 B11R1.90 CN1CCC[C@@H]1COC(=O)Cl Amb33297287 [0,0,0,1,0,0|3,0,0]=4 1241 B11R1.90 CN1CCC[C@@H]1\C=C\C(=O)O Amb33714876 [0,0,0,1,0,0|1,0,2]=4 1242 B11R1.90 CN1CCN=C1CCC(=O)O Amb18200191 [0,0,0,1,0,0|2,0,1]=4 1243 B11R1.90 CS(=O)CCC1CCCC1Cl Amb28073494 [0,0,0,1,0,0|3,0,0]=4 1244 B11R1.90 C[C@@H](O)CCC1CCCN1C Amb33321287 [0,0,0,1,0,0|2,0,1]=4 1245 B11R1.90 C[C@@H](O)CC[C@H]1CCCN1C Amb27653132 [0,0,0,1,0,0|2,0,1]=4 1246 B11R1.90 C[C@H](O)CCC1CCCN1C Amb33321288 [0,0,0,1,0,0|2,0,1]=4 1247 B11R1.90 C[C@H]1CCC[C@@H]1CCC(=O)O Amb28455731 [0,0,0,1,0,0|0,0,0]=1 1248 B11R1.90 NC(=O)CN[C@@H]1CCC[C@H]1O Amb24709070 [0,0,0,1,0,0|3,0,0]=4 1249 B11R1.90 NC(=O)NCC1CCCC1O Amb28324663 [0,0,0,1,0,0|3,0,0]=4 1250 B11R1.90 N[C@@H]1CCC[C@H]1CCC(=O)O Amb28244799 [0,0,0,1,0,0|1,0,0]=2 1251 B11R1.90 O=C(O)CCC1CCCC1=O Amb17400002 [0,0,0,1,0,0|1,0,1]=3 1252 B11R1.90 O=C(O)CCC1CCCC1F Amb27623706 [0,0,0,1,0,0|1,0,0]=2 1253 B11R1.90 O=C(O)CCC1CCOC1=O Amb10669454 [0,0,0,1,0,0|2,0,1]=4 1254 B11R1.90 O=C(O)CCC1CCSC1=O Amb27233557 [0,0,0,1,0,0|2,0,1]=4 1255 B11R1.90 O=C(O)CCC1NCCC1O Amb27162121 [0,0,0,1,0,0|2,0,0]=3 1256 B11R1.90 O=C(O)CCC1OCCC1O Amb27755061 [0,0,0,1,0,0|2,0,0]=3 1257 B11R1.90 O=C(O)CCN1CCCC1=O Amb1138316 [0,0,0,1,0,0|2,0,1]=4 1258 B11R1.90 O=C(O)CC[C@@H]1NCC[C@@H]1O Amb27640642 [0,0,0,1,0,0|2,0,0]=3 1259 B11R1.90 O=C(O)CN[C@@H]1COC[C@H]1O Amb28399698 [0,0,0,1,0,0|3,0,0]=4 1260 B11R1.90 O=C(O)CN[C@@H]1COC[C@H]1O Amb33620544 [0,0,0,1,0,0|3,0,0]=4 1261 B11R1.90 O=C(O)CSC1CCCC1O Amb18292041 [0,0,0,1,0,0|2,0,0]=3 1262 B11R1.91 C=C(Br)COC1CCCCC1 Amb28065511 [0,0,0,1,0,0|3,0,0]=4 1263 B11R1.91 C=C(C)CCC1CCCNC1 Amb27755579 [0,0,0,1,0,0|3,0,0]=4 1264 B11R1.91 C=C(C)CCN1CCCCC1 Amb27840134 [0,0,0,1,0,0|3,0,0]=4 1265 B11R1.91 C=C(C)CNC1CCCCC1 Amb17308768 [0,0,0,1,0,0|3,0,0]=4 1266 B11R1.91 CC(=O)C#CC1CCCCC1 Amb17593738 [0,0,0,1,0,0|1,0,2]=4 1267 B11R1.91 CC(=O)CCC1CC=CCC1 Amb24456632 [0,0,0,1,0,0|1,0,2]=4 1268 B11R1.91 CC(=O)CCC1CCCCC1 Amb9031564 [0,0,0,1,0,0|1,0,0]=2 1269 B11R1.91 CC(=O)CCC1CCCCN1 Amb27881489 [0,0,0,1,0,0|2,0,0]=3 1270 B11R1.91 CC(=O)CCC1CCCCO1 Amb26040132 [0,0,0,1,0,0|2,0,0]=3 1271 B11R1.91 CC(=O)CCC1CCCNC1 Amb25041564 [0,0,0,1,0,0|2,0,0]=3 1272 B11R1.91 CC(=O)CCC1CCCOC1 Amb26058874 [0,0,0,1,0,0|2,0,0]=3 1273 B11R1.91 CC(=O)CCC1CCCSC1 Amb32726147 [0,0,0,1,0,0|2,0,0]=3 1274 B11R1.91 CC(=O)CCC1CCNCC1 Amb24377330 [0,0,0,1,0,0|2,0,0]=3 1275 B11R1.91 CC(=O)CCC1CCOCC1 Amb18182100 [0,0,0,1,0,0|2,0,0]=3 1276 B11R1.91 CC(=O)CCN1CCCCC1 Amb1130395 [0,0,0,1,0,0|2,0,0]=3 1277 B11R1.91 CC(=O)CCN1CCCCC1 Amb33548792 [0,0,0,1,0,0|2,0,0]=3 1278 B11R1.91 CC(=O)CCN1CCNCC1 Amb33715439 [0,0,0,1,0,0|3,0,0]=4 1279 B11R1.91 CC(=O)CCN1CCOCC1 Amb1152970 [0,0,0,1,0,0|3,0,0]=4 1280 B11R1.91 CC(=O)COC1CCNCC1 Amb25789702 [0,0,0,1,0,0|3,0,0]=4 1281 B11R1.91 CC(=O)NCC1CCCCN1 Amb28555668 [0,0,0,1,0,0|3,0,0]=4 1282 B11R1.91 CC(=O)NCC1CCCCN1 Amb6249084 [0,0,0,1,0,0|3,0,0]=4 1283 B11R1.91 CC(=O)NCC1CCCNC1 Amb4304393 [0,0,0,1,0,0|3,0,0]=4 1284 B11R1.91 CC(=O)NCC1CCCSC1 Amb27802138 [0,0,0,1,0,0|3,0,0]=4 1285 B11R1.91 CC(=O)NCC1CCNCC1 Amb10205333 [0,0,0,1,0,0|3,0,0]=4 1286 B11R1.91 CC(=O)NCC1CCNCC1 Amb1095014 [0,0,0,1,0,0|3,0,0]=4 1287 B11R1.91 CC(=O)NCC1CCNCC1 Amb11012597 [0,0,0,1,0,0|3,0,0]=4 1288 B11R1.91 CC(=O)NCC1CCOCC1 Amb27823275 [0,0,0,1,0,0|3,0,0]=4 1289 B11R1.91 CC(=O)NCC1CCSCC1 Amb27165594 [0,0,0,1,0,0|3,0,0]=4 1290 B11R1.91 CC(=O)NCN1CCCCC1 Amb10568234 [0,0,0,1,0,0|3,0,0]=4 1291 B11R1.91 CC(=O)OCC1CCCCC1 Amb24323616 [0,0,0,1,0,0|2,0,0]=3 1292 B11R1.91 CC(=O)OCC1CCCCN1 Amb25717263 [0,0,0,1,0,0|3,0,0]=4 1293 B11R1.91 CC(=O)OCC1CCCCN1 Amb34202134 [0,0,0,1,0,0|3,0,0]=4 1294 B11R1.91 CC(=O)OCC1CCCCO1 Amb4012775 [0,0,0,1,0,0|3,0,0]=4 1295 B11R1.91 CC(=O)OCC1CCCNC1 Amb28251060 [0,0,0,1,0,0|3,0,0]=4 1296 B11R1.91 CC(=O)OCC1CCCOC1 Amb27810025 [0,0,0,1,0,0|3,0,0]=4 1297 B11R1.91 CC(=O)OCC1CCOCC1 Amb26911055 [0,0,0,1,0,0|3,0,0]=4 1298 B11R1.91 CC(=O)OC[C@H]1CCCNC1 Amb27603139 [0,0,0,1,0,0|3,0,0]=4 1299 B11R1.91 CC(=O)SCC1CCCOC1 Amb28292895 [0,0,0,1,0,0|3,0,0]=4 1300 B11R1.91 CC(=O)\C=C/C1CCCCC1 Amb28141273 [0,0,0,1,0,0|1,0,2]=4 1301 B11R1.91 CC(=O)\C=C\C1CCCCC1 Amb24625780 [0,0,0,1,0,0|1,0,2]=4 1302 B11R1.91 CC(=O)\C=N\C1CCCCC1 Amb28052310 [0,0,0,1,0,0|2,0,1]=4 1303 B11R1.91 CC(Br)CCC1CCCCC1 Amb24657044 [0,0,0,1,0,0|2,0,1]=4 1304 B11R1.91 CC(Cl)CCC1CCCCC1 Amb27592650 [0,0,0,1,0,0|2,0,1]=4 1305 B11R1.91 CC(N)CCC1CCCCC1 Amb9031768 [0,0,0,1,0,0|2,0,1]=4 1306 B11R1.91 CC(O)CCC1CCCCC1 Amb18799747 [0,0,0,1,0,0|1,0,1]=3 1307 B11R1.91 CC(O)CCC1CCCCN1 Amb18126090 [0,0,0,1,0,0|2,0,1]=4 1308 B11R1.91 CC(O)CCC1CCCCO1 Amb26933007 [0,0,0,1,0,0|2,0,1]=4 1309 B11R1.91 CC(O)CCC1CCCNC1 Amb18830545 [0,0,0,1,0,0|2,0,1]=4 1310 B11R1.91 CC(O)CCC1CCCOC1 Amb24593425 [0,0,0,1,0,0|2,0,1]=4 1311 B11R1.91 CC(O)CCC1CCCSC1 Amb32726233 [0,0,0,1,0,0|2,0,1]=4 1312 B11R1.91 CC(O)CCC1CCNCC1 Amb28208697 [0,0,0,1,0,0|2,0,1]=4 1313 B11R1.91 CC(O)CCC1CCOCC1 Amb18182366 [0,0,0,1,0,0|2,0,1]=4 1314 B11R1.91 CC(O)CNC1CCCCC1 Amb4007468 [0,0,0,1,0,0|2,0,1]=4 1315 B11R1.91 CC(O)COC1CCCCC1 Amb18799952 [0,0,0,1,0,0|2,0,1]=4 1316 B11R1.91 CC(O)CPC1CCCCC1 Amb27853726 [0,0,0,1,0,0|2,0,1]=4 1317 B11R1.91 CN(O)CCC1CCCCC1 Amb33326187 [0,0,0,1,0,0|2,0,0]=3 1318 B11R1.91 CS(=O)CCC1CCCNC1 Amb27397729 [0,0,0,1,0,0|3,0,0]=4 1319 B11R1.91 CS(=O)CCC1CCNCC1 Amb28348942 [0,0,0,1,0,0|3,0,0]=4 1320 B11R1.91 C[C@@H](N)CCC1CCCCC1 Amb33361710 [0,0,0,1,0,0|2,0,1]=4 1321 B11R1.91 C[C@@H](O)CCC1CCCCC1 Amb33361711 [0,0,0,1,0,0|1,0,1]=3 1322 B11R1.91 C[C@@H](O)CCC1CCCCO1 Amb33375639 [0,0,0,1,0,0|2,0,1]=4 1323 B11R1.91 C[C@@H](O)CCC1CCCOC1 Amb33322150 [0,0,0,1,0,0|2,0,1]=4 1324 B11R1.91 C[C@@H](O)CCC1CCCSC1 Amb32726231 [0,0,0,1,0,0|2,0,1]=4 1325 B11R1.91 C[C@@H](O)CCC1CCOCC1 Amb33419071 [0,0,0,1,0,0|2,0,1]=4 1326 B11R1.91 C[C@@H](O)CC[C@@H]1CCCCO1 Amb27422519 [0,0,0,1,0,0|2,0,1]=4 1327 B11R1.91 C[C@@H](O)CC[C@H]1CCCCO1 Amb28345049 [0,0,0,1,0,0|2,0,1]=4 1328 B11R1.91 C[C@@H](O)COC1CCCCC1 Amb27955797 [0,0,0,1,0,0|2,0,1]=4 1329 B11R1.91 C[C@H](N)CCC1CCCCC1 Amb33361709 [0,0,0,1,0,0|2,0,1]=4 1330 B11R1.91 C[C@H](O)CCC1CCCCC1 Amb33361713 [0,0,0,1,0,0|1,0,1]=3 1331 B11R1.91 C[C@H](O)CCC1CCCCO1 Amb33375640 [0,0,0,1,0,0|2,0,1]=4 1332 B11R1.91 C[C@H](O)CCC1CCCOC1 Amb33322152 [0,0,0,1,0,0|2,0,1]=4 1333 B11R1.91 C[C@H](O)CCC1CCCSC1 Amb32726232 [0,0,0,1,0,0|2,0,1]=4 1334 B11R1.91 C[C@H](O)CCC1CCOCC1 Amb33419644 [0,0,0,1,0,0|2,0,1]=4 1335 B11R1.91 C[C@H](O)COC1CCCCC1 Amb27823663 [0,0,0,1,0,0|2,0,1]=4 1336 B11R1.91 C[C@H](O)CSC1CCCCC1 Amb27763218 [0,0,0,1,0,0|2,0,1]=4 1337 B11R1.91 N=C(N)CCC1CCCCC1 Amb24392724 [0,0,0,1,0,0|2,0,0]=3 1338 B11R1.91 N=C(N)CCC1CCCCO1 Amb30020321 [0,0,0,1,0,0|3,0,0]=4 1339 B11R1.91 N=C(N)CCC1CCNCC1 Amb27852163 [0,0,0,1,0,0|3,0,0]=4 1340 B11R1.91 N=C(N)CCC1CCOCC1 Amb27425153 [0,0,0,1,0,0|3,0,0]=4 1341 B11R1.91 N=C(N)CCN1CCCCC1 Amb2695188 [0,0,0,1,0,0|3,0,0]=4 1342 B11R1.91 N=C(N)CCN1CCCCC1 Amb33552446 [0,0,0,1,0,0|3,0,0]=4 1343 B11R1.91 N=C(N)COC1CCCCC1 Amb6262478 [0,0,0,1,0,0|3,0,0]=4 1344 B11R1.91 N=C(N)CSC1CCCCC1 Amb18794587 [0,0,0,1,0,0|3,0,0]=4 1345 B11R1.91 N=C(N)NCC1CCCCC1 Amb18796912 [0,0,0,1,0,0|3,0,0]=4 1346 B11R1.91 N=C(N)NCC1CCCCC1 Amb20631271 [0,0,0,1,0,0|3,0,0]=4 1347 B11R1.91 N=C(N)NCC1CCCCC1 Amb32670879 [0,0,0,1,0,0|3,0,0]=4 1348 B11R1.91 N=C(N)SCC1CCCCC1 Amb20676029 [0,0,0,1,0,0|3,0,0]=4 1349 B11R1.91 NC(=O)CCC1CCCCC1 Amb6430126 [0,0,0,1,0,0|1,0,0]=2 1350 B11R1.91 NC(=O)CCC1CCCCN1 Amb18295940 [0,0,0,1,0,0|2,0,0]=3 1351 B11R1.91 NC(=O)CCC1CCCNC1 Amb10607788 [0,0,0,1,0,0|2,0,0]=3 1352 B11R1.91 NC(=O)CCC1CCCNC1 Amb13949150 [0,0,0,1,0,0|2,0,0]=3 1353 B11R1.91 NC(=O)CCC1CCCOC1 Amb28280723 [0,0,0,1,0,0|2,0,0]=3 1354 B11R1.91 NC(=O)CCC1CCNCC1 Amb8011291 [0,0,0,1,0,0|2,0,0]=3 1355 B11R1.91 NC(=O)CCC1CCNCC1 Amb8503428 [0,0,0,1,0,0|2,0,0]=3 1356 B11R1.91 NC(=O)CCC1CCOCC1 Amb28139505 [0,0,0,1,0,0|2,0,0]=3 1357 B11R1.91 NC(=O)CCN1CCCCC1 Amb9681664 [0,0,0,1,0,0|2,0,0]=3 1358 B11R1.91 NC(=O)CCN1CCCCN1 Amb27867743 [0,0,0,1,0,0|3,0,0]=4 1359 B11R1.91 NC(=O)CCN1CCNCC1 Amb1101061 [0,0,0,1,0,0|3,0,0]=4 1360 B11R1.91 NC(=O)CCN1CCNCC1 Amb22586736 [0,0,0,1,0,0|3,0,0]=4 1361 B11R1.91 NC(=O)CCN1CCOCC1 Amb9681663 [0,0,0,1,0,0|3,0,0]=4 1362 B11R1.91 NC(=O)CC[C@@H]1CCCNC1 Amb28043282 [0,0,0,1,0,0|2,0,0]=3 1363 B11R1.91 NC(=O)CNC1CCCCC1 Amb6661332 [0,0,0,1,0,0|2,0,0]=3 1364 B11R1.91 NC(=O)CNC1CCCOC1 Amb28197908 [0,0,0,1,0,0|3,0,0]=4 1365 B11R1.91 NC(=O)CNC1CCOCC1 Amb32676662 [0,0,0,1,0,0|3,0,0]=4 1366 B11R1.91 NC(=O)CNC1CCOCC1 Amb9472286 [0,0,0,1,0,0|3,0,0]=4 1367 B11R1.91 NC(=O)COC1CCCCC1 Amb18791809 [0,0,0,1,0,0|2,0,0]=3 1368 B11R1.91 NC(=O)COC1CCNCC1 Amb19149366 [0,0,0,1,0,0|3,0,0]=4 1369 B11R1.91 NC(=O)COC1CCNCC1 Amb8858928 [0,0,0,1,0,0|3,0,0]=4 1370 B11R1.91 NC(=O)CSC1CCCNC1 Amb27816874 [0,0,0,1,0,0|3,0,0]=4 1371 B11R1.91 NC(=O)NCC1CCCCC1 Amb4016522 [0,0,0,1,0,0|2,0,0]=3 1372 B11R1.91 NC(=O)NCC1CCCCN1 Amb13952202 [0,0,0,1,0,0|3,0,0]=4 1373 B11R1.91 NC(=O)NCC1CCCCN1 Amb6252003 [0,0,0,1,0,0|3,0,0]=4 1374 B11R1.91 NC(=O)NCC1CCCNC1 Amb9712654 [0,0,0,1,0,0|3,0,0]=4 1375 B11R1.91 NC(=O)NCC1CCCOC1 Amb18179808 [0,0,0,1,0,0|3,0,0]=4 1376 B11R1.91 NC(=O)NCC1CCNCC1 Amb10205334 [0,0,0,1,0,0|3,0,0]=4 1377 B11R1.91 NC(=O)NCC1CCNCC1 Amb10610152 [0,0,0,1,0,0|3,0,0]=4 1378 B11R1.91 NC(=O)NCC1CCNCC1 Amb6244524 [0,0,0,1,0,0|3,0,0]=4 1379 B11R1.91 NC(=O)NCC1CCSCC1 Amb27475866 [0,0,0,1,0,0|3,0,0]=4 1380 B11R1.91 NC(=O)NCN1CCCCC1 Amb27858744 [0,0,0,1,0,0|3,0,0]=4 1381 B11R1.91 NC(=O)OCC1CCCCC1 Amb28458479 [0,0,0,1,0,0|2,0,0]=3 1382 B11R1.91 NC(=O)OCC1CCCCN1 Amb27404153 [0,0,0,1,0,0|3,0,0]=4 1383 B11R1.91 NC(=O)OCC1CCCNC1 Amb27877206 [0,0,0,1,0,0|3,0,0]=4 1384 B11R1.91 NC(=S)CCC1CCCCC1 Amb18627059 [0,0,0,1,0,0|1,1,0]=3 1385 B11R1.91 NC(=S)CCC1CCCCO1 Amb35641038 [0,0,0,1,0,0|2,1,0]=4 1386 B11R1.91 NC(=S)CCC1CCNCC1 Amb27217125 [0,0,0,1,0,0|2,1,0]=4 1387 B11R1.91 NC(=S)CCN1CCCCC1 Amb6266370 [0,0,0,1,0,0|2,1,0]=4 1388 B11R1.91 NC(=S)NCC1CCCCC1 Amb8954486 [0,0,0,1,0,0|2,1,0]=4 1389 B11R1.91 NS(=O)CCC1CCCCC1 Amb32720441 [0,0,0,1,0,0|2,0,0]=3 1390 B11R1.91 NS(=O)CCC1CCCCO1 Amb32720512 [0,0,0,1,0,0|3,0,0]=4 1391 B11R1.91 NS(=O)CCC1CCOCC1 Amb32720682 [0,0,0,1,0,0|3,0,0]=4 1392 B11R1.91 N[C@@H](O)CCC1CCCCC1 Amb27960693 [0,0,0,1,0,0|1,0,1]=3 1393 B11R1.91 O=C(Cl)CCC1CCCCC1 Amb2720380 [0,0,0,1,0,0|1,0,0]=2 1394 B11R1.91 O=C(Cl)NCC1CCCCC1 Amb35637043 [0,0,0,1,0,0|2,0,0]=3 1395 B11R1.91 O=C(Cl)NCC1CCCCO1 Amb35625804 [0,0,0,1,0,0|3,0,0]=4 1396 B11R1.91 O=C(Cl)NCC1CCCCS1 Amb35633546 [0,0,0,1,0,0|3,0,0]=4 1397 B11R1.91 O=C(Cl)NCC1CCCOC1 Amb35625786 [0,0,0,1,0,0|3,0,0]=4 1398 B11R1.91 O=C(Cl)NCC1CCCSC1 Amb35633574 [0,0,0,1,0,0|3,0,0]=4 1399 B11R1.91 O=C(Cl)NCC1CCOCC1 Amb35625743 [0,0,0,1,0,0|3,0,0]=4 1400 B11R1.91 O=C(Cl)NCC1CCSCC1 Amb35625876 [0,0,0,1,0,0|3,0,0]=4 1401 B11R1.91 O=C(Cl)OCC1CCCCC1 Amb25140788 [0,0,0,1,0,0|2,0,0]=3 1402 B11R1.91 O=C(Cl)OCC1CCCCO1 Amb27171806 [0,0,0,1,0,0|3,0,0]=4 1403 B11R1.91 O=C(Cl)OCC1CCCSC1 Amb28051652 [0,0,0,1,0,0|3,0,0]=4 1404 B11R1.91 O=C(Cl)OCC1CCOCC1 Amb22642257 [0,0,0,1,0,0|3,0,0]=4 1405 B11R1.91 O=C(Cl)OCC1CCSCC1 Amb27789054 [0,0,0,1,0,0|3,0,0]=4 1406 B11R1.91 O=C(O)C#CC1CCCCC1 Amb21963916 [0,0,0,1,0,0|0,0,2]=3 1407 B11R1.91 O=C(O)C#CC1CCCCN1 Amb33168942 [0,0,0,1,0,0|1,0,2]=4 1408 B11R1.91 O=C(O)C#CC1CCCCO1 Amb25266171 [0,0,0,1,0,0|1,0,2]=4 1409 B11R1.91 O=C(O)C#CC1CCCCS1 Amb33169039 [0,0,0,1,0,0|1,0,2]=4 1410 B11R1.91 O=C(O)C#CC1CCCNC1 Amb28722508 [0,0,0,1,0,0|1,0,2]=4 1411 B11R1.91 O=C(O)C#CC1CCCNC1 Amb32664897 [0,0,0,1,0,0|1,0,2]=4 1412 B11R1.91 O=C(O)C#CC1CCCOC1 Amb25151250 [0,0,0,1,0,0|1,0,2]=4 1413 B11R1.91 O=C(O)C#CC1CCCSC1 Amb33169033 [0,0,0,1,0,0|1,0,2]=4 1414 B11R1.91 O=C(O)C#CC1CCNCC1 Amb27855658 [0,0,0,1,0,0|1,0,2]=4 1415 B11R1.91 O=C(O)C#CC1CCNCC1 Amb28721181 [0,0,0,1,0,0|1,0,2]=4 1416 B11R1.91 O=C(O)C#CC1CCOCC1 Amb33546193 [0,0,0,1,0,0|1,0,2]=4 1417 B11R1.91 O=C(O)C#CC1CCSCC1 Amb33169017 [0,0,0,1,0,0|1,0,2]=4 1418 B11R1.91 O=C(O)CC=C1CCNCC1 Amb27626202 [0,0,0,1,0,0|1,0,2]=4 1419 B11R1.91 O=C(O)CC=C1CCSCC1 Amb23441815 [0,0,0,1,0,0|1,0,2]=4 1420 B11R1.91 O=C(O)CCC1=CCCCC1 Amb25775024 [0,0,0,1,0,0|0,0,2]=3 1421 B11R1.91 O=C(O)CCC1=CCCCO1 Amb27642956 [0,0,0,1,0,0|1,0,2]=4 1422 B11R1.91 O=C(O)CCC1=COCCC1 Amb33416024 [0,0,0,1,0,0|1,0,2]=4 1423 B11R1.91 O=C(O)CCC1=NCCCN1 Amb25148116 [0,0,0,1,0,0|2,0,1]=4 1424 B11R1.91 O=C(O)CCC1=NCCCN1 Amb33329359 [0,0,0,1,0,0|2,0,1]=4 1425 B11R1.91 O=C(O)CCC1CC=CCC1 Amb26491506 [0,0,0,1,0,0|0,0,2]=3 1426 B11R1.91 O=C(O)CCC1CCC=CO1 Amb27829016 [0,0,0,1,0,0|1,0,2]=4 1427 B11R1.91 O=C(O)CCC1CCCCC1 Amb3939828 [0,0,0,1,0,0|0,0,0]=1 1428 B11R1.91 O=C(O)CCC1CCCCN1 Amb1102729 [0,0,0,1,0,0|1,0,0]=2 1429 B11R1.91 O=C(O)CCC1CCCCN1 Amb8630249 [0,0,0,1,0,0|1,0,0]=2 1430 B11R1.91 O=C(O)CCC1CCCCO1 Amb17506864 [0,0,0,1,0,0|1,0,0]=2 1431 B11R1.91 O=C(O)CCC1CCCCS1 Amb33470228 [0,0,0,1,0,0|1,0,0]=2 1432 B11R1.91 O=C(O)CCC1CCCNC1 Amb10576190 [0,0,0,1,0,0|1,0,0]=2 1433 B11R1.91 O=C(O)CCC1CCCNC1 Amb1101056 [0,0,0,1,0,0|1,0,0]=2 1434 B11R1.91 O=C(O)CCC1CCCOC1 Amb33529911 [0,0,0,1,0,0|1,0,0]=2 1435 B11R1.91 O=C(O)CCC1CCCSC1 Amb18825218 [0,0,0,1,0,0|1,0,0]=2 1436 B11R1.91 O=C(O)CCC1CCC[NH2+]C1 Amb2694709 [0,0,0,1,0,0|1,0,0]=2 1437 B11R1.91 O=C(O)CCC1CCNCC1 Amb10609864 [0,0,0,1,0,0|1,0,0]=2 1438 B11R1.91 O=C(O)CCC1CCNCC1 Amb10609915 [0,0,0,1,0,0|1,0,0]=2 1439 B11R1.91 O=C(O)CCC1CCNCC1 Amb2696646 [0,0,0,1,0,0|1,0,0]=2 1440 B11R1.91 O=C(O)CCC1CCOCC1 Amb18990337 [0,0,0,1,0,0|1,0,0]=2 1441 B11R1.91 O=C(O)CCC1CCSCC1 Amb18197511 [0,0,0,1,0,0|1,0,0]=2 1442 B11R1.91 O=C(O)CCC1CNCCN1 Amb22229402 [0,0,0,1,0,0|2,0,0]=3 1443 B11R1.91 O=C(O)CCC1CNCCO1 Amb18061965 [0,0,0,1,0,0|2,0,0]=3 1444 B11R1.91 O=C(O)CCC1CNCCO1 Amb34155769 [0,0,0,1,0,0|2,0,0]=3 1445 B11R1.91 O=C(O)CCC1COCCN1 Amb10603708 [0,0,0,1,0,0|2,0,0]=3 1446 B11R1.91 O=C(O)CCC1COCCO1 Amb545206 [0,0,0,1,0,0|2,0,0]=3 1447 B11R1.91 O=C(O)CCC1OCCCO1 Amb6305245 [0,0,0,1,0,0|2,0,0]=3 1448 B11R1.91 O=C(O)CCN1CCCCC1 Amb10609748 [0,0,0,1,0,0|1,0,0]=2 1449 B11R1.91 O=C(O)CCN1CCCCC1 Amb594197 [0,0,0,1,0,0|1,0,0]=2 1450 B11R1.91 O=C(O)CCN1CCCCO1 Amb13949096 [0,0,0,1,0,0|2,0,0]=3 1451 B11R1.91 O=C(O)CCN1CCCCO1 Amb8009617 [0,0,0,1,0,0|2,0,0]=3 1452 B11R1.91 O=C(O)CCN1CCNCC1 Amb10609986 [0,0,0,1,0,0|2,0,0]=3 1453 B11R1.91 O=C(O)CCN1CCNCC1 Amb10610059 [0,0,0,1,0,0|2,0,0]=3 1454 B11R1.91 O=C(O)CCN1CCNCC1 Amb2690366 [0,0,0,1,0,0|2,0,0]=3 1455 B11R1.91 O=C(O)CCN1CCOCC1 Amb1098976 [0,0,0,1,0,0|2,0,0]=3 1456 B11R1.91 O=C(O)CCN1CCOCC1 Amb1294360 [0,0,0,1,0,0|2,0,0]=3 1457 B11R1.91 O=C(O)CCN1CCOCC1 Amb22504586 [0,0,0,1,0,0|2,0,0]=3 1458 B11R1.91 O=C(O)CCN1CCSCC1 Amb6307195 [0,0,0,1,0,0|2,0,0]=3 1459 B11R1.91 O=C(O)CNC1=NCCCC1 Amb10976583 [0,0,0,1,0,0|2,0,1]=4 1460 B11R1.91 O=C(O)CNC1CCCCC1 Amb19263851 [0,0,0,1,0,0|1,0,0]=2 1461 B11R1.91 O=C(O)CNC1CCCCC1 Amb840542 [0,0,0,1,0,0|1,0,0]=2 1462 B11R1.91 O=C(O)CNC1CCCSC1 Amb18301750 [0,0,0,1,0,0|2,0,0]=3 1463 B11R1.91 O=C(O)CNC1CCNCC1 Amb18289709 [0,0,0,1,0,0|2,0,0]=3 1464 B11R1.91 O=C(O)CNC1CCNCC1 Amb24271155 [0,0,0,1,0,0|2,0,0]=3 1465 B11R1.91 O=C(O)CNC1CCOCC1 Amb9472619 [0,0,0,1,0,0|2,0,0]=3 1466 B11R1.91 O=C(O)COC1CC=CCC1 Amb33318657 [0,0,0,1,0,0|1,0,2]=4 1467 B11R1.91 O=C(O)COC1CCCCC1 Amb2693120 [0,0,0,1,0,0|1,0,0]=2 1468 B11R1.91 O=C(O)COC1CCCCO1 Amb28325642 [0,0,0,1,0,0|2,0,0]=3 1469 B11R1.91 O=C(O)COC1CCCNC1 Amb13783632 [0,0,0,1,0,0|2,0,0]=3 1470 B11R1.91 O=C(O)COC1CCCNC1 Amb32661916 [0,0,0,1,0,0|2,0,0]=3 1471 B11R1.91 O=C(O)COC1CCCOC1 Amb27467259 [0,0,0,1,0,0|2,0,0]=3 1472 B11R1.91 O=C(O)COC1CCCSC1 Amb25117929 [0,0,0,1,0,0|2,0,0]=3 1473 B11R1.91 O=C(O)COC1CCNCC1 Amb10603194 [0,0,0,1,0,0|2,0,0]=3 1474 B11R1.91 O=C(O)COC1CCNCC1 Amb21960053 [0,0,0,1,0,0|2,0,0]=3 1475 B11R1.91 O=C(O)COC1CCOCC1 Amb18975304 [0,0,0,1,0,0|2,0,0]=3 1476 B11R1.91 O=C(O)CSC1CCCCC1 Amb6537757 [0,0,0,1,0,0|1,0,0]=2 1477 B11R1.91 O=C(O)CSC1CCCCO1 Amb26481367 [0,0,0,1,0,0|2,0,0]=3 1478 B11R1.91 O=C(O)CSC1CCNCC1 Amb17502143 [0,0,0,1,0,0|2,0,0]=3 1479 B11R1.91 O=C(O)\C=C\C1CCCCC1 Amb31330735 [0,0,0,1,0,0|0,0,2]=3 1480 B11R1.91 O=C(O)\C=C\C1CCCCO1 Amb33475332 [0,0,0,1,0,0|1,0,2]=4 1481 B11R1.91 O=C(O)\C=C\C1CCCCS1 Amb33470059 [0,0,0,1,0,0|1,0,2]=4 1482 B11R1.91 O=C(O)\C=C\C1CCCNC1 Amb27783604 [0,0,0,1,0,0|1,0,2]=4 1483 B11R1.91 O=C(O)\C=C\C1CCCOC1 Amb33042780 [0,0,0,1,0,0|1,0,2]=4 1484 B11R1.91 O=C(O)\C=C\C1CCCSC1 Amb33474065 [0,0,0,1,0,0|1,0,2]=4 1485 B11R1.91 O=C(O)\C=C\C1CCOCC1 Amb18961299 [0,0,0,1,0,0|1,0,2]=4 1486 B11R1.91 O=C(O)\C=C\C1CCSCC1 Amb27619229 [0,0,0,1,0,0|1,0,2]=4 1487 B11R1.91 O=C(O)\C=C\N1CCCCC1 Amb27217215 [0,0,0,1,0,0|1,0,2]=4 1488 B11R1.91 O=C([O-])CCC1CNCCN1 Amb28652876 [0,0,0,1,0,0|2,0,1]=4 1489 B11R1.91 O=C([O-])CCN1CCNCC1 Amb7969600 [0,0,0,1,0,0|2,0,1]=4 1490 B11R1.91 O=C([O-])CCN1CCOCC1 Amb22728336 [0,0,0,1,0,0|2,0,1]=4 1491 B11R1.91 O=S(Cl)CCC1CCCCC1 Amb32720440 [0,0,0,1,0,0|2,0,0]=3 1492 B11R1.91 O=S(Cl)CCC1CCCCO1 Amb32720510 [0,0,0,1,0,0|3,0,0]=4 1493 B11R1.91 O=S(Cl)CCC1CCOCC1 Amb32720671 [0,0,0,1,0,0|3,0,0]=4 1494 B11R1.91 O=S([O-])CCC1CCCCC1 Amb32755538 [0,0,0,1,0,0|1,0,1]=3 1495 B11R1.91 O=S([O-])CCC1CCCCO1 Amb32755661 [0,0,0,1,0,0|2,0,1]=4 1496 B11R1.91 O=S([O-])CCC1CCOCC1 Amb32754957 [0,0,0,1,0,0|2,0,1]=4 1497 B11R1.91 O=[N+]([O-])CCC1CCCCC1 Amb25911033 [0,0,0,1,0,0|1,0,1]=3 1498 B11R1.91 O=[N+]([O-])CCC1CCCCO1 Amb33375534 [0,0,0,1,0,0|2,0,1]=4 1499 B11R1.91 O=[N+]([O-])CCC1CCCOC1 Amb33322135 [0,0,0,1,0,0|2,0,1]=4 1500 B11R1.91 O=[N+]([O-])CCC1CCCSC1 Amb32726214 [0,0,0,1,0,0|2,0,1]=4 1501 B11R1.91 O=[N+]([O-])CCC1CCOCC1 Amb33418705 [0,0,0,1,0,0|2,0,1]=4 1502 B11R1.91 O=[N+]([O-])OCC1CCCCC1 Amb27751251 [0,0,0,1,0,0|2,0,1]=4 1503 B11R1.91 OB(O)CCC1CCCCC1 Amb27881671 [0,0,0,1,0,0|1,0,1]=3 1504 B11R1.91 OB(O)CCC1CCCCO1 Amb29888708 [0,0,0,1,0,0|2,0,1]=4 1505 B11R1.99 CCCCCCOCC1CO1 Amb7761629 [0,0,0,1,0,0|2,0,1]=4 1506 B11R1.101 ClC1CCCCCCCCC1 Amb26603797 [0,0,0,1,0,0|2,0,1]=4 1507 B11R1.101 NC1CCCCCCCCC1 Amb17593887 [0,0,0,1,0,0|2,0,1]=4 1508 B11R1.101 NC1CCCCCCCCC1 Amb29837926 [0,0,0,1,0,0|2,0,1]=4 1509 B11R1.101 O=C1C=CCCCCCCC1 Amb28254479 [0,0,0,1,0,0|1,0,1]=3 1510 B11R1.101 O=C1CC=CCCCCCC1 Amb26880464 [0,0,0,1,0,0|1,0,2]=4 1511 B11R1.101 O=C1CCC=CCCCCC1 Amb4034899 [0,0,0,1,0,0|1,0,2]=4 1512 B11R1.101 O=C1CCCCCCCCC1 Amb2778532 [0,0,0,1,0,0|1,0,0]=2 1513 B11R1.101 O=C1CCCCCCCCN1 Amb4034840 [0,0,0,1,0,0|1,0,0]=2 1514 B11R1.101 O=C1CCNCCCCCN1 Amb32679586 [0,0,0,1,0,0|2,0,0]=3 1515 B11R1.101 O=C1CCNCCOCCN1 Amb32667957 [0,0,0,1,0,0|3,0,0]=4 1516 B11R1.101 O=C1CNCCCCCCN1 Amb28044832 [0,0,0,1,0,0|2,0,0]=3 1517 B11R1.101 OB1CCCCNCCCC1 Amb28326087 [0,0,0,1,0,0|3,0,0]=4 1518 B11R1.101 OC1CCCCCCCCC1 Amb22008249 [0,0,0,1,0,0|1,0,1]=3 1519 B11R1.101 O[C@H]1C#CCCCCCCC1 Amb27833371 [0,0,0,1,0,0|1,0,2]=4 1520 B11R1.101 O[C@H]1C=CCCCCCCC1 Amb28206118 [0,0,0,1,0,0|1,0,2]=4 1521 B11R1.101 S=C1CCCCCCCCN1 Amb27636863 [0,0,0,1,0,0|1,1,0]=3 1522 B11R1.102 CC1CC1NC\C=C\C(=O)O Amb28386718 [0,0,0,1,0,0|1,0,2]=4 1523 B11R1.107 CC1=CCCCCCC(=O)C1 Amb28381149 [0,0,0,1,0,0|1,0,2]=4 1524 B11R1.107 CC1CCC=CCCC(=O)N1 Amb26922309 [0,0,0,1,0,0|1,0,2]=4 1525 B11R1.107 CC1CCCCCCC(=O)C1 Amb28200023 [0,0,0,1,0,0|1,0,0]=2 1526 B11R1.107 O=C1CCCCCCC(=O)C1 Amb17593852 [0,0,0,1,0,0|2,0,1]=4 1527 B11R1.107 O=C1CCCCCCC(=O)O1 Amb27437831 [0,0,0,1,0,0|1,0,1]=3 1528 B11R1.110 C=CCC1CCCCC(=O)N1 Amb2612993 [0,0,0,1,0,0|1,0,2]=4 1529 B11R1.110 C=CC[C@@H]1CCCCC(=O)N1 Amb27176471 [0,0,0,1,0,0|1,0,2]=4 1530 B11R1.110 C=CC[C@H]1CCCCC(=O)N1 Amb27455068 [0,0,0,1,0,0|1,0,2]=4 1531 B11R1.110 CCCC1=C[C@@H](O)CCCC1 Amb27823537 [0,0,0,1,0,0|1,0,2]=4 1532 B11R1.110 CCCC1=C[C@H](O)CCCC1 Amb24485909 [0,0,0,1,0,0|1,0,2]=4 1533 B11R1.110 CCCC1CCCCC(=O)N1 Amb2229640 [0,0,0,1,0,0|1,0,0]=2 1534 B11R1.110 CCCC1CCCCC(Cl)C1 Amb27981131 [0,0,0,1,0,0|2,0,1]=4 1535 B11R1.110 CCCC1CCNCC(C)O1 Amb32679919 [0,0,0,1,0,0|2,0,1]=4 1536 B11R1.110 CCCN1CCCNC(=O)C1 Amb27176452 [0,0,0,1,0,0|3,0,0]=4 1537 B11R1.110 CCC[C@@H]1CCC=CC(=O)N1 Amb27960353 [0,0,0,1,0,0|1,0,2]=4 1538 B11R1.110 CCC[C@@H]1CCCSC(N)=N1 Amb27778552 [0,0,0,1,0,0|3,0,0]=4 1539 B11R1.110 CCC[C@@H]1CSCCC(=O)N1 Amb27169108 [0,0,0,1,0,0|2,0,0]=3 1540 B11R1.110 CCC[C@H]1CSCCC(=N)N1 Amb27231671 [0,0,0,1,0,0|3,0,0]=4 1541 B11R1.110 COCC1CCCCC(=O)C1 Amb27246950 [0,0,0,1,0,0|2,0,0]=3 1542 B11R1.110 N#CCC1CCCCC(=O)C1 Amb27174178 [0,0,0,1,0,0|2,0,1]=4 1543 B11R1.110 N#CCC1CCCCC(=O)N1 Amb19515431 [0,0,0,1,0,0|2,0,1]=4 1544 B11R1.110 N=C1CCCCC(CCO)N1 Amb27249527 [0,0,0,1,0,0|3,0,0]=4 1545 B11R1.110 NCCC1CCCCC(=O)N1 Amb19515432 [0,0,0,1,0,0|2,0,0]=3 1546 B11R1.110 NCCC1CCCNC(=O)C1 Amb27468807 [0,0,0,1,0,0|3,0,0]=4 1547 B11R1.110 O=C1CCCCC(CCCl)O1 Amb27407753 [0,0,0,1,0,0|1,0,0]=2 1548 B11R1.110 O=C1CCCC[C@@H](CCO)O1 Amb27197176 [0,0,0,1,0,0|1,0,0]=2 1549 B11R1.110 O=CCC1CCCCC(=O)C1 Amb28286724 [0,0,0,1,0,0|2,0,1]=4 1550 B11R1.130 CCOC1CC1C#CC(=O)O Amb35671227 [0,0,0,1,0,0|1,0,2]=4 1551 B11R1.143 C=C(C)C1CCCCCC1O Amb25788203 [0,0,0,1,0,0|3,0,0]=4 1552 B11R1.143 C=C(C)[C@@H]1CCCCC[C@H]1O Amb32944787 [0,0,0,1,0,0|3,0,0]=4 1553 B11R1.143 CC(=O)C1CCCCC=C1C Amb27261169 [0,0,0,1,0,0|1,0,2]=4 1554 B11R1.143 CC(=O)C1CCCCCC1=O Amb18796759 [0,0,0,1,0,0|2,0,1]=4 1555 B11R1.143 CC(=O)C1CCCCCC1C Amb35725700 [0,0,0,1,0,0|1,0,0]=2 1556 B11R1.143 CC(=O)C1CCCCCC1N Amb26968176 [0,0,0,1,0,0|2,0,0]=3 1557 B11R1.143 CC(=O)C1CCCCCC1O Amb32945460 [0,0,0,1,0,0|2,0,0]=3 1558 B11R1.143 CC(=O)C1CCCCCN1C Amb27963187 [0,0,0,1,0,0|2,0,0]=3 1559 B11R1.143 CC(=O)N1CCOCCC1C Amb28349810 [0,0,0,1,0,0|3,0,0]=4 1560 B11R1.143 CC(=O)[C@@H]1CCCCC[C@@H]1N Amb33307461 [0,0,0,1,0,0|2,0,0]=3 1561 B11R1.143 CC(=O)[C@@H]1CCCCC[C@H]1O Amb32945317 [0,0,0,1,0,0|2,0,0]=3 1562 B11R1.143 CC(Br)C1CCCCCC1C Amb35721309 [0,0,0,1,0,0|2,0,1]=4 1563 B11R1.143 CC(Cl)C1CCCCCC1C Amb35721305 [0,0,0,1,0,0|2,0,1]=4 1564 B11R1.143 CC(O)C1CCCCCC1C Amb35672756 [0,0,0,1,0,0|1,0,1]=3 1565 B11R1.143 CC(O)C1CCCCCC1N Amb35587050 [0,0,0,1,0,0|2,0,1]=4 1566 B11R1.143 CC1CCCCCC1N(C)N Amb35681285 [0,0,0,1,0,0|3,0,0]=4 1567 B11R1.143 CC1CCNCCC1C(=O)O Amb27445777 [0,0,0,1,0,0|1,0,0]=2 1568 B11R1.143 CC1CCOCCC1C(=O)O Amb27861013 [0,0,0,1,0,0|1,0,0]=2 1569 B11R1.143 CC1CCOCCN1C(=O)Cl Amb32864025 [0,0,0,1,0,0|3,0,0]=4 1570 B11R1.143 CC1CCOCCN1C(N)=O Amb27805933 [0,0,0,1,0,0|3,0,0]=4 1571 B11R1.143 CC1CCSCCN1C(=O)Cl Amb27266352 [0,0,0,1,0,0|3,0,0]=4 1572 B11R1.143 CC1NCCCCC1C(=O)O Amb27597000 [0,0,0,1,0,0|1,0,0]=2 1573 B11R1.143 CN1CCCCCC1C(=O)O Amb3941310 [0,0,0,1,0,0|1,0,0]=2 1574 B11R1.143 CN1CCCCCC1C(=O)O Amb8503498 [0,0,0,1,0,0|1,0,0]=2 1575 B11R1.143 CN1CCCCCC1C(N)=O Amb27607657 [0,0,0,1,0,0|2,0,0]=3 1576 B11R1.143 CN1CCCOCC1C(=O)O Amb27842358 [0,0,0,1,0,0|2,0,0]=3 1577 B11R1.143 C[C@@H]1NCCCC[C@H]1C(=O)O Amb18199981 [0,0,0,1,0,0|1,0,0]=2 1578 B11R1.143 C[C@H]1NCCCC[C@@H]1C(=O)O Amb27420245 [0,0,0,1,0,0|1,0,0]=2 1579 B11R1.143 NC(=O)C1CCCCCC1N Amb20668797 [0,0,0,1,0,0|2,0,0]=3 1580 B11R1.143 NC(=O)C1CCCCCC1N Amb22059737 [0,0,0,1,0,0|2,0,0]=3 1581 B11R1.143 NC(=O)C1CCCCCC1O Amb25760752 [0,0,0,1,0,0|2,0,0]=3 1582 B11R1.143 NC(=O)C1CCNCCC1F Amb27636642 [0,0,0,1,0,0|3,0,0]=4 1583 B11R1.143 NC(=O)C1CCNCCC1O Amb27843740 [0,0,0,1,0,0|3,0,0]=4 1584 B11R1.143 NC(=O)C1CNCCCC1O Amb27814437 [0,0,0,1,0,0|3,0,0]=4 1585 B11R1.143 NC(=O)[C@@H]1CCCCC[C@H]1O Amb28137536 [0,0,0,1,0,0|2,0,0]=3 1586 B11R1.143 NC1CCCCCC1C(=O)O Amb2694961 [0,0,0,1,0,0|1,0,0]=2 1587 B11R1.143 NC1CCCCCC1C(=O)O Amb8630073 [0,0,0,1,0,0|1,0,0]=2 1588 B11R1.143 NC1CCNCCC1C(=O)O Amb26917458 [0,0,0,1,0,0|2,0,0]=3 1589 B11R1.143 NC1CCOCCC1C(=O)O Amb28051653 [0,0,0,1,0,0|2,0,0]=3 1590 B11R1.143 NC1CCSCCC1C(=O)O Amb28051654 [0,0,0,1,0,0|2,0,0]=3 1591 B11R1.143 NS(=O)C1CCCCCC1F Amb32720762 [0,0,0,1,0,0|3,0,0]=4 1592 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1993851 [0,0,0,1,0,0|1,0,0]=2 1593 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1994004 [0,0,0,1,0,0|1,0,0]=2 1594 B11R1.143 N[C@@H]1CCCCC[C@H]1C(=O)O Amb27635591 [0,0,0,1,0,0|1,0,0]=2 1595 B11R1.143 N[C@H]1CCCCC[C@@H]1C(=O)O Amb28411250 [0,0,0,1,0,0|1,0,0]=2 1596 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1993850 [0,0,0,1,0,0|1,0,0]=2 1597 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1994003 [0,0,0,1,0,0|1,0,0]=2 1598 B11R1.143 O=C(O)C1=C(Cl)CCCCC1 Amb27858604 [0,0,0,1,0,0|1,0,2]=4 1599 B11R1.143 O=C(O)C1CCCCCC1O Amb18280963 [0,0,0,1,0,0|1,0,0]=2 1600 B11R1.143 O=C(O)C1CCCCCC1S Amb18949212 [0,0,0,1,0,0|1,0,0]=2 1601 B11R1.143 O=C(O)C1CCCCNC1=O Amb33803563 [0,0,0,1,0,0|2,0,1]=4 1602 B11R1.143 O=C(O)C1CCOCCC1O Amb27613245 [0,0,0,1,0,0|2,0,0]=3 1603 B11R1.143 O=C(O)[C@@H]1CCCCC[C@@H]1O Amb27848050 [0,0,0,1,0,0|1,0,0]=2 1604 B11R1.143 O=C(O)[C@H]1CCCCC[C@@H]1O Amb27848051 [0,0,0,1,0,0|1,0,0]=2 1605 B11R1.143 O=S(Cl)C1CCCCCC1F Amb32720756 [0,0,0,1,0,0|3,0,0]=4 1606 B11R1.143 O=S([O-])C1CCCCCC1F Amb32755065 [0,0,0,1,0,0|2,0,1]=4 1607 B11R1.143 O=[N+]([O-])C1CCCCCC1O Amb18199867 [0,0,0,1,0,0|2,0,1]=4 1608 B11R1.161 C=C(C)CCNC1CCC1C Amb27266945 [0,0,0,1,0,0|3,0,0]=4 1609 B11R1.161 CC(O)CCCN1CCC1C Amb27269123 [0,0,0,1,0,0|2,0,1]=4 1610 B11R1.161 CC(O)CCNC1CCC1C Amb27270142 [0,0,0,1,0,0|2,0,1]=4 1611 B11R1.161 CC1CCC1CCCC(=O)O Amb27266949 [0,0,0,1,0,0|0,0,0]=1 1612 B11R1.161 CC1CCC1NCCC(=O)O Amb27270129 [0,0,0,1,0,0|1,0,0]=2 1613 B11R1.161 CC1CCC1NCCC(N)=O Amb27270131 [0,0,0,1,0,0|2,0,0]=3 1614 B11R1.161 CC1CCC1NCC[C@@H](C)O Amb27988973 [0,0,0,1,0,0|2,0,1]=4 1615 B11R1.161 CC1CCC1NCC[C@H](C)O Amb28386997 [0,0,0,1,0,0|2,0,1]=4 1616 B11R1.161 CC1CC\C1=N/OCC(=O)O Amb27400924 [0,0,0,1,0,0|2,0,1]=4 1617 B11R1.172 C=C(C)CNCC1CCCC1 Amb18796741 [0,0,0,1,0,0|3,0,0]=4 1618 B11R1.172 CC(=O)CCC=C1CCCC1 Amb28202156 [0,0,0,1,0,0|1,0,2]=4 1619 B11R1.172 CC(=O)CCCC1CCCC1 Amb26076138 [0,0,0,1,0,0|1,0,0]=2 1620 B11R1.172 CC(=O)CCCN1CCCC1 Amb9659032 [0,0,0,1,0,0|2,0,0]=3 1621 B11R1.172 CC(=O)CCOC1CCOC1 Amb27271547 [0,0,0,1,0,0|3,0,0]=4 1622 B11R1.172 CC(=O)COCC1CCCC1 Amb28386909 [0,0,0,1,0,0|2,0,0]=3 1623 B11R1.172 CC(=O)COCC1CCCO1 Amb9664734 [0,0,0,1,0,0|3,0,0]=4 1624 B11R1.172 CC(=O)CSCC1CCCC1 Amb27269541 [0,0,0,1,0,0|2,0,0]=3 1625 B11R1.172 CC(=O)NCCC1CCCC1 Amb8328911 [0,0,0,1,0,0|2,0,0]=3 1626 B11R1.172 CC(=O)NCCC1CCCN1 Amb27789209 [0,0,0,1,0,0|3,0,0]=4 1627 B11R1.172 CC(=O)NCCC1CCNC1 Amb24477543 [0,0,0,1,0,0|3,0,0]=4 1628 B11R1.172 CC(=O)NCCN1CCCC1 Amb24723020 [0,0,0,1,0,0|3,0,0]=4 1629 B11R1.172 CC(=O)NCC[C@H]1CCCN1 Amb27427200 [0,0,0,1,0,0|3,0,0]=4 1630 B11R1.172 CC(=O)OCCC1CCCC1 Amb28326525 [0,0,0,1,0,0|2,0,0]=3 1631 B11R1.172 CC(=O)OCCC1CCCO1 Amb28326526 [0,0,0,1,0,0|3,0,0]=4 1632 B11R1.172 CC(=O)\C=C\CC1CCCC1 Amb33378003 [0,0,0,1,0,0|1,0,2]=4 1633 B11R1.172 CC(Br)CCCC1CCCC1 Amb26076992 [0,0,0,1,0,0|2,0,1]=4 1634 B11R1.172 CC(C)=CCCC1CCCC1 Amb30023888 [0,0,0,1,0,0|2,0,1]=4 1635 B11R1.172 CC(N)CCCC1CCCC1 Amb26992747 [0,0,0,1,0,0|2,0,1]=4 1636 B11R1.172 CC(O)CCCC1CCCC1 Amb26992742 [0,0,0,1,0,0|1,0,1]=3 1637 B11R1.172 CC(O)CCCC1CCNC1 Amb27671426 [0,0,0,1,0,0|2,0,1]=4 1638 B11R1.172 CC(O)CCCC1CCOC1 Amb28080595 [0,0,0,1,0,0|2,0,1]=4 1639 B11R1.172 CC(O)CCCN1CCCC1 Amb18787711 [0,0,0,1,0,0|2,0,1]=4 1640 B11R1.172 CC(O)CCNC1CCCC1 Amb26650559 [0,0,0,1,0,0|2,0,1]=4 1641 B11R1.172 CC(O)CCSC1CCCC1 Amb28387135 [0,0,0,1,0,0|2,0,1]=4 1642 B11R1.172 CC(O)COCC1CCCC1 Amb28386905 [0,0,0,1,0,0|2,0,1]=4 1643 B11R1.172 CC(O)CSCC1CCCC1 Amb27269539 [0,0,0,1,0,0|2,0,1]=4 1644 B11R1.172 CN(O)CCCC1CCCC1 Amb33374912 [0,0,0,1,0,0|2,0,0]=3 1645 B11R1.172 CN(O)CCCN1CCCC1 Amb33448120 [0,0,0,1,0,0|3,0,0]=4 1646 B11R1.172 CS(=O)CCCC1CCCN1 Amb27670386 [0,0,0,1,0,0|3,0,0]=4 1647 B11R1.172 CS(=O)CCNC1CCCC1 Amb27988444 [0,0,0,1,0,0|3,0,0]=4 1648 B11R1.172 C[C@@H](N)CCCC1CCCC1 Amb33378383 [0,0,0,1,0,0|2,0,1]=4 1649 B11R1.172 C[C@@H](O)CCCC1CCCC1 Amb33378384 [0,0,0,1,0,0|1,0,1]=3 1650 B11R1.172 C[C@@H](O)CCCN1CCCC1 Amb33275204 [0,0,0,1,0,0|2,0,1]=4 1651 B11R1.172 C[C@@H](O)CCNC1CCCC1 Amb27988974 [0,0,0,1,0,0|2,0,1]=4 1652 B11R1.172 C[C@H](N)CCCC1CCCC1 Amb33378382 [0,0,0,1,0,0|2,0,1]=4 1653 B11R1.172 C[C@H](O)CCCC1CCCC1 Amb33378386 [0,0,0,1,0,0|1,0,1]=3 1654 B11R1.172 C[C@H](O)CCCN1CCCC1 Amb33275200 [0,0,0,1,0,0|2,0,1]=4 1655 B11R1.172 C[C@H](O)CCNC1CCCC1 Amb28386998 [0,0,0,1,0,0|2,0,1]=4 1656 B11R1.172 N=C(N)CCCC1CCCC1 Amb33379884 [0,0,0,1,0,0|2,0,0]=3 1657 B11R1.172 N=C(N)CCCC1CCOC1 Amb28080640 [0,0,0,1,0,0|3,0,0]=4 1658 B11R1.172 N=C(N)CCCN1CCCC1 Amb2695191 [0,0,0,1,0,0|3,0,0]=4 1659 B11R1.172 N=C(N)CCOC1CCCC1 Amb6266303 [0,0,0,1,0,0|3,0,0]=4 1660 B11R1.172 N=C(N)COCC1CCCC1 Amb28386906 [0,0,0,1,0,0|3,0,0]=4 1661 B11R1.172 N=C(N)CSCC1CCCC1 Amb27269547 [0,0,0,1,0,0|3,0,0]=4 1662 B11R1.172 NC(=O)CCCC1CCCO1 Amb27818759 [0,0,0,1,0,0|2,0,0]=3 1663 B11R1.172 NC(=O)CCCN1CCCC1 Amb17142881 [0,0,0,1,0,0|2,0,0]=3 1664 B11R1.172 NC(=O)CCNC1CCCC1 Amb8841120 [0,0,0,1,0,0|2,0,0]=3 1665 B11R1.172 NC(=O)CCOC1CCOC1 Amb27271533 [0,0,0,1,0,0|3,0,0]=4 1666 B11R1.172 NC(=O)CNCC1CCCO1 Amb6713864 [0,0,0,1,0,0|3,0,0]=4 1667 B11R1.172 NC(=O)CNCC1CCOC1 Amb1112314 [0,0,0,1,0,0|3,0,0]=4 1668 B11R1.172 NC(=O)CNOC1CCCC1 Amb27271183 [0,0,0,1,0,0|3,0,0]=4 1669 B11R1.172 NC(=O)COCC1CCCC1 Amb28386904 [0,0,0,1,0,0|2,0,0]=3 1670 B11R1.172 NC(=O)COCC1CCCO1 Amb18797499 [0,0,0,1,0,0|3,0,0]=4 1671 B11R1.172 NC(=O)COCC1CCOC1 Amb18797501 [0,0,0,1,0,0|3,0,0]=4 1672 B11R1.172 NC(=O)COC[C@@H]1CCCN1 Amb17083737 [0,0,0,1,0,0|3,0,0]=4 1673 B11R1.172 NC(=O)CSCC1CCCC1 Amb27269544 [0,0,0,1,0,0|2,0,0]=3 1674 B11R1.172 NC(=O)NCC[C@@H]1CCCN1 Amb27872929 [0,0,0,1,0,0|3,0,0]=4 1675 B11R1.172 NC(=O)OCCC1CCNC1 Amb27671522 [0,0,0,1,0,0|3,0,0]=4 1676 B11R1.172 NC(=S)CCCC1CCCC1 Amb33379883 [0,0,0,1,0,0|1,1,0]=3 1677 B11R1.172 NC(=S)CCCC1CCOC1 Amb27673208 [0,0,0,1,0,0|2,1,0]=4 1678 B11R1.172 NC(=S)CCCN1CCCC1 Amb6259041 [0,0,0,1,0,0|2,1,0]=4 1679 B11R1.172 NC(=S)CCOC1CCCC1 Amb6269189 [0,0,0,1,0,0|2,1,0]=4 1680 B11R1.172 NC(=S)COCC1CCCC1 Amb28386903 [0,0,0,1,0,0|2,1,0]=4 1681 B11R1.172 NC(=S)NCCC1CCCC1 Amb18794588 [0,0,0,1,0,0|2,1,0]=4 1682 B11R1.172 NS(=O)CCCC1CCOC1 Amb32720870 [0,0,0,1,0,0|3,0,0]=4 1683 B11R1.172 O=C(Cl)NCCC1CCCC1 Amb35625732 [0,0,0,1,0,0|2,0,0]=3 1684 B11R1.172 O=C(Cl)NCCC1CCOC1 Amb35633406 [0,0,0,1,0,0|3,0,0]=4 1685 B11R1.172 O=C(Cl)NCCN1CCCC1 Amb35625510 [0,0,0,1,0,0|3,0,0]=4 1686 B11R1.172 O=C(O)C#CCC1CCCC1 Amb28370188 [0,0,0,1,0,0|0,0,2]=3 1687 B11R1.172 O=C(O)CC#CC1CCCC1 Amb26346554 [0,0,0,1,0,0|0,0,2]=3 1688 B11R1.172 O=C(O)CCCC1=CCCC1 Amb18125777 [0,0,0,1,0,0|0,0,2]=3 1689 B11R1.172 O=C(O)CCCC1=NCCN1 Amb27674406 [0,0,0,1,0,0|2,0,1]=4 1690 B11R1.172 O=C(O)CCCC1CCCC1 Amb19149142 [0,0,0,1,0,0|0,0,0]=1 1691 B11R1.172 O=C(O)CCCC1CCCN1 Amb18199969 [0,0,0,1,0,0|1,0,0]=2 1692 B11R1.172 O=C(O)CCCC1CCCO1 Amb26990705 [0,0,0,1,0,0|1,0,0]=2 1693 B11R1.172 O=C(O)CCCC1CCCS1 Amb26659241 [0,0,0,1,0,0|1,0,0]=2 1694 B11R1.172 O=C(O)CCCC1CCOC1 Amb24755490 [0,0,0,1,0,0|1,0,0]=2 1695 B11R1.172 O=C(O)CCCC1CCSC1 Amb27989571 [0,0,0,1,0,0|1,0,0]=2 1696 B11R1.172 O=C(O)CCCN1CC=CC1 Amb27670978 [0,0,0,1,0,0|1,0,2]=4 1697 B11R1.172 O=C(O)CCCN1CCCC1 Amb2607773 [0,0,0,1,0,0|1,0,0]=2 1698 B11R1.172 O=C(O)CCCN1CCCC1 Amb33551514 [0,0,0,1,0,0|1,0,0]=2 1699 B11R1.172 O=C(O)CCNC1=NCCC1 Amb10976572 [0,0,0,1,0,0|2,0,1]=4 1700 B11R1.172 O=C(O)CCNC1CC=CC1 Amb27271207 [0,0,0,1,0,0|1,0,2]=4 1701 B11R1.172 O=C(O)CCNC1CCCC1 Amb1109669 [0,0,0,1,0,0|1,0,0]=2 1702 B11R1.172 O=C(O)CCNC1CCCC1 Amb13951292 [0,0,0,1,0,0|1,0,0]=2 1703 B11R1.172 O=C(O)CCOC1CCCC1 Amb6275835 [0,0,0,1,0,0|1,0,0]=2 1704 B11R1.172 O=C(O)CCOC1CCOC1 Amb27271540 [0,0,0,1,0,0|2,0,0]=3 1705 B11R1.172 O=C(O)CCSC1CCCC1 Amb6274643 [0,0,0,1,0,0|1,0,0]=2 1706 B11R1.172 O=C(O)CCSC1CCOC1 Amb27271544 [0,0,0,1,0,0|2,0,0]=3 1707 B11R1.172 O=C(O)CNCC1CCCN1 Amb27673661 [0,0,0,1,0,0|2,0,0]=3 1708 B11R1.172 O=C(O)CNCC1CCCO1 Amb7766544 [0,0,0,1,0,0|2,0,0]=3 1709 B11R1.172 O=C(O)CNCC1CCOC1 Amb8827655 [0,0,0,1,0,0|2,0,0]=3 1710 B11R1.172 O=C(O)CNCC1CCSC1 Amb27989553 [0,0,0,1,0,0|2,0,0]=3 1711 B11R1.172 O=C(O)CNOC1CCCC1 Amb27271182 [0,0,0,1,0,0|2,0,0]=3 1712 B11R1.172 O=C(O)COCC1CCCC1 Amb21963936 [0,0,0,1,0,0|1,0,0]=2 1713 B11R1.172 O=C(O)COCC1CCCN1 Amb19516849 [0,0,0,1,0,0|2,0,0]=3 1714 B11R1.172 O=C(O)COCC1CCCN1 Amb22587360 [0,0,0,1,0,0|2,0,0]=3 1715 B11R1.172 O=C(O)COCC1CCCO1 Amb9720381 [0,0,0,1,0,0|2,0,0]=3 1716 B11R1.172 O=C(O)COCC1CCOC1 Amb18307774 [0,0,0,1,0,0|2,0,0]=3 1717 B11R1.172 O=C(O)CSCC1=CCCC1 Amb28080558 [0,0,0,1,0,0|1,0,2]=4 1718 B11R1.172 O=C(O)CSCC1CCCO1 Amb9708921 [0,0,0,1,0,0|2,0,0]=3 1719 B11R1.172 O=C(O)C\C=C\C1CCCC1 Amb24473377 [0,0,0,1,0,0|0,0,2]=3 1720 B11R1.172 O=C(O)\C=C\CC1CCCC1 Amb33172382 [0,0,0,1,0,0|0,0,2]=3 1721 B11R1.172 O=C(O)\C=C\CN1CCCC1 Amb33969252 [0,0,0,1,0,0|1,0,2]=4 1722 B11R1.172 O=C(O)\C=C\CN1CCCC1 Amb34916713 [0,0,0,1,0,0|1,0,2]=4 1723 B11R1.172 O=S(Cl)CCCC1CCOC1 Amb32720869 [0,0,0,1,0,0|3,0,0]=4 1724 B11R1.172 O=S([O-])CCCC1CCOC1 Amb32755495 [0,0,0,1,0,0|2,0,1]=4 1725 B11R1.172 O=S([O-])CCCN1CCCC1 Amb32755392 [0,0,0,1,0,0|2,0,1]=4 1726 B11R1.172 O=[N+]([O-])CCCC1CCCC1 Amb33378376 [0,0,0,1,0,0|1,0,1]=3 1727 B11R1.172 O=[N+]([O-])CCCN1CCCC1 Amb33275169 [0,0,0,1,0,0|2,0,1]=4 1728 B11R1.172 OB(O)CCCC1CCCC1 Amb28388132 [0,0,0,1,0,0|1,0,1]=3 1729 B11R1.172 OB(O)CCCC1CCOC1 Amb28080611 [0,0,0,1,0,0|2,0,1]=4 1730 B11R1.174 CC(=O)NCCCC1CCN1 Amb27674421 [0,0,0,1,0,0|3,0,0]=4 1731 B11R1.174 CC(=O)NCCCC1CNC1 Amb27674417 [0,0,0,1,0,0|3,0,0]=4 1732 B11R1.174 CC(=O)NCCNC1CCC1 Amb18799705 [0,0,0,1,0,0|3,0,0]=4 1733 B11R1.174 CC(=O)NCCOC1CCC1 Amb28351910 [0,0,0,1,0,0|3,0,0]=4 1734 B11R1.174 NC(=O)NCCCC1CCN1 Amb27674267 [0,0,0,1,0,0|3,0,0]=4 1735 B11R1.174 NC(=O)NCCCC1CNC1 Amb27674265 [0,0,0,1,0,0|3,0,0]=4 1736 B11R1.174 NC(=O)NCCNC1CCC1 Amb27670475 [0,0,0,1,0,0|3,0,0]=4 1737 B11R1.174 NC(=O)NCCOC1CCC1 Amb28078464 [0,0,0,1,0,0|3,0,0]=4 1738 B11R1.174 NS(=O)CCOCC1CCC1 Amb32720860 [0,0,0,1,0,0|3,0,0]=4 1739 B11R1.174 O=C(O)C#CCOC1CCC1 Amb28132228 [0,0,0,1,0,0|1,0,2]=4 1740 B11R1.174 O=C(O)\C=C\CNC1CCC1 Amb28386721 [0,0,0,1,0,0|1,0,2]=4 1741 B11R1.174 O=C(O)\C=C\COC1CCC1 Amb19020651 [0,0,0,1,0,0|1,0,2]=4 1742 B11R1.174 O=C(O)\C=C\NCC1CCC1 Amb27495005 [0,0,0,1,0,0|1,0,2]=4 1743 B11R1.174 O=S(Cl)CCOCC1CCC1 Amb32720859 [0,0,0,1,0,0|3,0,0]=4 1744 B11R1.174 O=S([O-])CCOCC1CCC1 Amb32755522 [0,0,0,1,0,0|2,0,1]=4 1745 B11R1.176 O=C(O)CCCOCC1CC1 Amb6680910 [0,0,0,1,0,0|1,0,0]=2 1746 B11R1.176 O=C(O)\C=C\NCCC1CC1 Amb28386716 [0,0,0,1,0,0|1,0,2]=4 1747 B11R1.191 CC1(O)CCCCC1CCN Amb27210420 [0,0,0,1,0,0|2,0,1]=4 1748 B11R1.191 CCCC1CCCCC1(C)O Amb32945232 [0,0,0,1,0,0|1,0,1]=3 1749 B11R1.191 CCCC1CCCNS1(=O)=O Amb33298924 [0,0,0,1,0,0|2,0,1]=4 1750 B11R1.191 CCC[C@@H]1CCCC[C@@]1(C)O Amb33213723 [0,0,0,1,0,0|1,0,1]=3 1751 B11R1.191 CCNC1CCCCC1(C)O Amb35664251 [0,0,0,1,0,0|2,0,1]=4 1752 B11R1.191 CCN[C@@H]1CCCC[C@@]1(C)O Amb35665709 [0,0,0,1,0,0|2,0,1]=4 1753 B11R1.191 CCSC1CCCCC1(C)O Amb35667558 [0,0,0,1,0,0|2,0,1]=4 1754 B11R1.191 CCS[C@@H]1CCCC[C@@]1(C)O Amb35667462 [0,0,0,1,0,0|2,0,1]=4 1755 B11R1.191 CNCC1CCCCC1(C)O Amb27964214 [0,0,0,1,0,0|2,0,1]=4 1756 B11R1.191 CNCC1CCCCS1(=O)=O Amb27462932 [0,0,0,1,0,0|2,0,1]=4 1757 B11R1.191 COCC1CCCCC1(C)O Amb32945980 [0,0,0,1,0,0|2,0,1]=4 1758 B11R1.191 COC[C@@H]1CCCC[C@@]1(C)O Amb33212847 [0,0,0,1,0,0|2,0,1]=4 1759 B11R1.191 NCCC1CCCCS1(=O)=O Amb35673021 [0,0,0,1,0,0|2,0,1]=4 1760 B11R1.193 C#CCC1CCCC1C(C)=O Amb25759595 [0,0,0,1,0,0|1,0,2]=4 1761 B11R1.193 C#CCN1CCCC1C(=O)O Amb32752563 [0,0,0,1,0,0|1,0,2]=4 1762 B11R1.193 C#CCN1CCCC1C(=O)O Amb9300941 [0,0,0,1,0,0|1,0,2]=4 1763 B11R1.193 C#CCN1CCC[C@@H]1C(=O)O Amb19316312 [0,0,0,1,0,0|1,0,2]=4 1764 B11R1.193 C#CCN1CCC[C@@H]1C(=O)O Amb34915396 [0,0,0,1,0,0|1,0,2]=4 1765 B11R1.193 C#CCN1CCC[C@H]1C(=O)O Amb32665805 [0,0,0,1,0,0|1,0,2]=4 1766 B11R1.193 C=CCN1CCCC1C(=O)O Amb17622159 [0,0,0,1,0,0|1,0,2]=4 1767 B11R1.193 C=CCN1CCCC1C(=O)O Amb2382744 [0,0,0,1,0,0|1,0,2]=4 1768 B11R1.193 C=CCN1CCC[C@@H]1C(=O)O Amb17934249 [0,0,0,1,0,0|1,0,2]=4 1769 B11R1.193 C=CCN1CCC[C@@H]1C(=O)O Amb26487854 [0,0,0,1,0,0|1,0,2]=4 1770 B11R1.193 C=CCN1CCC[C@H]1C(=O)O Amb22587502 [0,0,0,1,0,0|1,0,2]=4 1771 B11R1.193 C=CCN1CCC[C@H]1C(=O)O Amb8630855 [0,0,0,1,0,0|1,0,2]=4 1772 B11R1.193 C=CC[C@@H]1CCC[C@H]1C(C)=O Amb27227228 [0,0,0,1,0,0|1,0,2]=4 1773 B11R1.193 C=CC[C@H]1CCN[C@@H]1C(=O)O Amb25198766 [0,0,0,1,0,0|1,0,2]=4 1774 B11R1.193 CC(=O)C1CCCC1CC#N Amb27951586 [0,0,0,1,0,0|2,0,1]=4 1775 B11R1.193 CC(=O)[C@@H]1CCC[C@H]1CC=O Amb27467933 [0,0,0,1,0,0|2,0,1]=4 1776 B11R1.193 CCCC1CCCC1C(=O)O Amb18644850 [0,0,0,1,0,0|0,0,0]=1 1777 B11R1.193 CCCC1CCCN1C(=O)Cl Amb27493472 [0,0,0,1,0,0|2,0,0]=3 1778 B11R1.193 CCCC1CCCN1C(C)=N Amb27252244 [0,0,0,1,0,0|3,0,0]=4 1779 B11R1.193 CCCC1CCCN1C(N)=S Amb27795050 [0,0,0,1,0,0|2,1,0]=4 1780 B11R1.193 CCCC1CCNC1C(=O)O Amb25241187 [0,0,0,1,0,0|1,0,0]=2 1781 B11R1.193 CCCC1CCNC1C(=O)O Amb28652947 [0,0,0,1,0,0|1,0,0]=2 1782 B11R1.193 CCCC1CCN[C@@H]1C(=O)O Amb28340938 [0,0,0,1,0,0|1,0,0]=2 1783 B11R1.193 CCCC1COCC1C(=O)O Amb27864218 [0,0,0,1,0,0|1,0,0]=2 1784 B11R1.193 CCCC1COCC1C(C)=O Amb29882922 [0,0,0,1,0,0|2,0,0]=3 1785 B11R1.193 CCCC1COCC1C(C)O Amb35651594 [0,0,0,1,0,0|2,0,1]=4 1786 B11R1.193 CCCC1SCCN1C(C)=O Amb28061197 [0,0,0,1,0,0|3,0,0]=4 1787 B11R1.193 CCCN1CCCC1C(=O)O Amb9704298 [0,0,0,1,0,0|1,0,0]=2 1788 B11R1.193 CCCN1CCCC1C(N)=O Amb26327231 [0,0,0,1,0,0|2,0,0]=3 1789 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27591265 [0,0,0,1,0,0|1,0,0]=2 1790 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27839891 [0,0,0,1,0,0|1,0,0]=2 1791 B11R1.193 CCCN1CCC[C@H]1C(=O)O Amb25864864 [0,0,0,1,0,0|1,0,0]=2 1792 B11R1.193 CCCN1CCC[C@H]1C(N)=O Amb26480008 [0,0,0,1,0,0|2,0,0]=3 1793 B11R1.193 CCCN1CSCC1C(N)=O Amb27775349 [0,0,0,1,0,0|3,0,0]=4 1794 B11R1.193 CCC[C@@H]1CC=C[C@H]1C(C)=O Amb27629704 [0,0,0,1,0,0|1,0,2]=4 1795 B11R1.193 CCC[C@@H]1CCC[C@@H]1C(=O)O Amb27878683 [0,0,0,1,0,0|0,0,0]=1 1796 B11R1.193 CCC[C@@H]1CCN[C@H]1C(=O)O Amb26452406 [0,0,0,1,0,0|1,0,0]=2 1797 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992396 [0,0,0,1,0,0|1,0,0]=2 1798 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992397 [0,0,0,1,0,0|1,0,0]=2 1799 B11R1.193 CCNC1COCC1C(C)=O Amb25698028 [0,0,0,1,0,0|3,0,0]=4 1800 B11R1.193 CCOC1=C(C(=O)O)CCC1 Amb24487805 [0,0,0,1,0,0|1,0,2]=4 1801 B11R1.193 CCOC1CNCC1C(=O)O Amb35592518 [0,0,0,1,0,0|2,0,0]=3 1802 B11R1.193 CCOC1CNCC1C(C)=O Amb29869780 [0,0,0,1,0,0|3,0,0]=4 1803 B11R1.193 CCOC1CNCC1C(N)=O Amb29869636 [0,0,0,1,0,0|3,0,0]=4 1804 B11R1.193 CNCC1CCCC1C(=O)O Amb27654981 [0,0,0,1,0,0|1,0,0]=2 1805 B11R1.193 CNC[C@@H]1CCCN1C(C)=O Amb22227518 [0,0,0,1,0,0|3,0,0]=4 1806 B11R1.193 CNOC1CCCC1C(C)=O Amb24484596 [0,0,0,1,0,0|3,0,0]=4 1807 B11R1.193 COCC1CCCC1C(=O)O Amb25200900 [0,0,0,1,0,0|1,0,0]=2 1808 B11R1.193 COCC1CCCN1C(=O)Cl Amb26914646 [0,0,0,1,0,0|3,0,0]=4 1809 B11R1.193 COCC1CCCN1C(C)=O Amb27872243 [0,0,0,1,0,0|3,0,0]=4 1810 B11R1.193 COCC1CCNC1C(N)=O Amb28245800 [0,0,0,1,0,0|3,0,0]=4 1811 B11R1.193 COC[C@@H]1CCCN1C(=O)Cl Amb25945308 [0,0,0,1,0,0|3,0,0]=4 1812 B11R1.193 COC[C@@H]1CCCN1C(C)=O Amb27834362 [0,0,0,1,0,0|3,0,0]=4 1813 B11R1.193 COC[C@@H]1CCC[C@@H]1C(=O)O Amb27758197 [0,0,0,1,0,0|1,0,0]=2 1814 B11R1.193 COC[C@H]1CCCN1C(=O)Cl Amb33296755 [0,0,0,1,0,0|3,0,0]=4 1815 B11R1.193 COC[C@H]1CCCN1C(N)=O Amb25797982 [0,0,0,1,0,0|3,0,0]=4 1816 B11R1.193 COC[C@H]1CCC[C@H]1C(=O)O Amb25295380 [0,0,0,1,0,0|1,0,0]=2 1817 B11R1.193 COC[C@H]1CCO[C@H]1C(=O)O Amb27867716 [0,0,0,1,0,0|2,0,0]=3 1818 B11R1.193 CSCC1CCCN1C(N)=O Amb27456218 [0,0,0,1,0,0|3,0,0]=4 1819 B11R1.193 N#CCC1CCC[C@@H]1C(=O)O Amb27427596 [0,0,0,1,0,0|1,0,1]=3 1820 B11R1.193 N#CCC1CCNC1C(=O)O Amb28397459 [0,0,0,1,0,0|2,0,1]=4 1821 B11R1.193 N#CCN1CCCC1C(=O)O Amb9300470 [0,0,0,1,0,0|2,0,1]=4 1822 B11R1.193 N#CCN1CCC[C@H]1C(=O)O Amb8630393 [0,0,0,1,0,0|2,0,1]=4 1823 B11R1.193 N#CC[C@@H]1CCN[C@@H]1C(=O)O Amb27974231 [0,0,0,1,0,0|2,0,1]=4 1824 B11R1.193 N#CNC1CCCC1C(=O)O Amb30031712 [0,0,0,1,0,0|2,0,1]=4 1825 B11R1.193 N#CN[C@H]1CCC[C@H]1C(=O)O Amb30040314 [0,0,0,1,0,0|2,0,1]=4 1826 B11R1.193 NC(=O)[C@@H]1CCCN1CCF Amb27250728 [0,0,0,1,0,0|3,0,0]=4 1827 B11R1.193 NCCN1CCCC1C(=O)O Amb27764990 [0,0,0,1,0,0|2,0,0]=3 1828 B11R1.193 NCCN1CCCC1C(N)=O Amb6750989 [0,0,0,1,0,0|3,0,0]=4 1829 B11R1.193 NC\C=C1\CCCC1C(=O)O Amb27263894 [0,0,0,1,0,0|1,0,2]=4 1830 B11R1.193 O=C(O)C1CCCC1CCF Amb27635907 [0,0,0,1,0,0|1,0,0]=2 1831 B11R1.193 O=C(O)C1CNCC1CCO Amb2696583 [0,0,0,1,0,0|2,0,0]=3 1832 B11R1.193 O=C(O)[C@@H]1CCCN1CCO Amb27839895 [0,0,0,1,0,0|2,0,0]=3 1833 B11R1.193 O=C(O)[C@H]1CCCN1CCO Amb25700707 [0,0,0,1,0,0|2,0,0]=3 1834 B11R1.193 O=CCC1CCCC1C(=O)O Amb28367096 [0,0,0,1,0,0|1,0,1]=3 1835 B11R1.193 O=CC[C@@H]1CCC[C@@H]1C(=O)O Amb27234851 [0,0,0,1,0,0|1,0,1]=3 1836 B11R1.193 O=CN[C@H]1CCC[C@H]1C(=O)O Amb29892074 [0,0,0,1,0,0|2,0,1]=4 1837 B11R1.193 [N-]=[N+]=N[C@H]1CCC[C@@H]1C(=O)O Amb28250919 [0,0,0,1,0,0|3,0,0]=4 1838 B11R1.204 C=CCSC1CCC1C(=O)O Amb27492190 [0,0,0,1,0,0|1,0,2]=4 1839 B11R1.204 CC(=O)N1CCC1CCCN Amb27674411 [0,0,0,1,0,0|3,0,0]=4 1840 B11R1.204 CCCCC1=C(C(C)=O)CC1 Amb28080144 [0,0,0,1,0,0|1,0,2]=4 1841 B11R1.204 CCCCN1CC[C@H]1C(N)=O Amb27272273 [0,0,0,1,0,0|2,0,0]=3 1842 B11R1.204 CCONC1CCC1C(=O)O Amb28386717 [0,0,0,1,0,0|2,0,0]=3 1843 B11R1.204 CNCCC1CCN1C(C)=O Amb27674412 [0,0,0,1,0,0|3,0,0]=4 1844 B11R1.204 CNCCC1CCN1C(N)=O Amb27674262 [0,0,0,1,0,0|3,0,0]=4 1845 B11R1.204 CNCCN1CCC1C(N)=O Amb33252127 [0,0,0,1,0,0|3,0,0]=4 1846 B11R1.204 COCCN1CCC1C(=O)O Amb26998103 [0,0,0,1,0,0|2,0,0]=3 1847 B11R1.204 CSCCC1CCC1C(=O)O Amb27986354 [0,0,0,1,0,0|1,0,0]=2 1848 B11R1.204 NC(=O)N1CCC1CCCO Amb27674315 [0,0,0,1,0,0|3,0,0]=4 1849 B11R1.204 NCCCC1CCN1C(N)=O Amb27674263 [0,0,0,1,0,0|3,0,0]=4 1850 B11R1.204 NCCCN1CCC1C(N)=O Amb33195356 [0,0,0,1,0,0|3,0,0]=4 1851 B11R1.204 NCCNC1CCC1C(=O)O Amb28386725 [0,0,0,1,0,0|2,0,0]=3 1852 B11R1.204 O=C(O)C1NCC1CCCO Amb27673478 [0,0,0,1,0,0|2,0,0]=3 1853 B11R1.233 CCCSC1CCCC1(C)O Amb28126056 [0,0,0,1,0,0|2,0,1]=4 1854 B11R1.233 CNCCC1CCCS1(=O)=O Amb35673547 [0,0,0,1,0,0|2,0,1]=4 1855 B11R1.233 NCCCC1CCCS1(=O)=O Amb17063304 [0,0,0,1,0,0|2,0,1]=4 1856 B11R1.233 O=S1(=O)CCCC1CCCBr Amb32690553 [0,0,0,1,0,0|2,0,1]=4 1857 B11R1.233 O=S1(=O)CCCC1CCCCl Amb32690552 [0,0,0,1,0,0|2,0,1]=4 1858 B11R1.233 O=S1(=O)CCCC1CCCO Amb35723305 [0,0,0,1,0,0|2,0,1]=4 1859 B11R1.241 CCC1CC1N\C=C\C(=O)O Amb28284841 [0,0,0,1,0,0|1,0,2]=4 1860 B11R1.245 C=CC1CCCCCC(=O)N1 Amb28290513 [0,0,0,1,0,0|1,0,2]=4 1861 B11R1.245 CCC1CCCC=CC(=O)C1 Amb27954110 [0,0,0,1,0,0|1,0,2]=4 1862 B11R1.245 CCC1CCCCCC(=O)N1 Amb25313080 [0,0,0,1,0,0|1,0,0]=2 1863 B11R1.245 COC1CCCCCC(=O)C1 Amb27164648 [0,0,0,1,0,0|2,0,0]=3 1864 B11R1.271 C=C(Br)CNC1CCC1CC Amb27272150 [0,0,0,1,0,0|3,0,0]=4 1865 B11R1.271 C=C(C)CCC1CCC1CN Amb27988104 [0,0,0,1,0,0|3,0,0]=4 1866 B11R1.271 C=C(C)CCN1CCC1CC Amb27986909 [0,0,0,1,0,0|3,0,0]=4 1867 B11R1.271 C=C(C)CNC1CCC1CC Amb27272151 [0,0,0,1,0,0|3,0,0]=4 1868 B11R1.271 C=C(Cl)CNC1CCC1CC Amb27272152 [0,0,0,1,0,0|3,0,0]=4 1869 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1CO Amb31308520 [0,0,0,1,0,0|3,0,0]=4 1870 B11R1.271 CCC1CCC1NCC(C)O Amb27272155 [0,0,0,1,0,0|2,0,1]=4 1871 B11R1.271 CCC1CCC1NCC(N)=O Amb27272153 [0,0,0,1,0,0|2,0,0]=3 1872 B11R1.271 CCC1CCN1CCC(=O)O Amb27986912 [0,0,0,1,0,0|1,0,0]=2 1873 B11R1.271 CCC1CCN1CCC(C)=O Amb27986910 [0,0,0,1,0,0|2,0,0]=3 1874 B11R1.271 CCC1CCN1CCC(N)=O Amb27986696 [0,0,0,1,0,0|2,0,0]=3 1875 B11R1.271 CCN1CCC1C#CC(=O)O Amb33169073 [0,0,0,1,0,0|1,0,2]=4 1876 B11R1.543 CC1(O)CCCCCCCC1 Amb22342433 [0,0,0,1,0,0|1,0,1]=3 1877 B11R1.706 CC(=O)C1=CCCCCCC1 Amb27473365 [0,0,0,1,0,0|1,0,2]=4 1878 B11R1.706 CC(=O)C1C=CCCCCC1 Amb22011813 [0,0,0,1,0,0|1,0,2]=4 1879 B11R1.706 CC(=O)C1CCCCCCC1 Amb25327542 [0,0,0,1,0,0|1,0,0]=2 1880 B11R1.706 CC(C)=C1CCCCCCC1 Amb22356359 [0,0,0,1,0,0|2,0,1]=4 1881 B11R1.706 CC(Cl)C1CCCCCCC1 Amb27218660 [0,0,0,1,0,0|2,0,1]=4 1882 B11R1.706 CC(N)C1CCCCCCC1 Amb26478080 [0,0,0,1,0,0|2,0,1]=4 1883 B11R1.706 C[C@@H](N)C1CCCCCCC1 Amb26593788 [0,0,0,1,0,0|2,0,1]=4 1884 B11R1.706 C[C@H](N)C1CCCCCCC1 Amb26034933 [0,0,0,1,0,0|2,0,1]=4 1885 B11R1.706 ClC(Cl)C1CCCCCCC1 Amb27955897 [0,0,0,1,0,0|2,0,1]=4 1886 B11R1.706 N=C(N)N1CCCCCCC1 Amb6750466 [0,0,0,1,0,0|3,0,0]=4 1887 B11R1.706 O=C(Cl)C1CCC=CCCC1 Amb24465111 [0,0,0,1,0,0|1,0,2]=4 1888 B11R1.706 O=C(Cl)C1CCCCCCC1 Amb25760237 [0,0,0,1,0,0|1,0,0]=2 1889 B11R1.706 O=C(O)C1C=CCCCCC1 Amb27401809 [0,0,0,1,0,0|0,0,2]=3 1890 B11R1.706 O=C(O)C1CCC=CCCC1 Amb26853121 [0,0,0,1,0,0|0,0,2]=3 1891 B11R1.706 O=C(O)C1CCCCCCC1 Amb18278612 [0,0,0,1,0,0|0,0,0]=1 1892 B11R1.706 O=C(O)C1CCCCCCN1 Amb27760420 [0,0,0,1,0,0|1,0,0]=2 1893 B11R1.706 O=C(O)C1CCCCCCN1 Amb28652940 [0,0,0,1,0,0|1,0,0]=2 1894 B11R1.706 O=C(O)C1CCCSCCC1 Amb28239756 [0,0,0,1,0,0|1,0,0]=2 1895 B11R1.706 O=[N+]([O-])C1CCCCCCC1 Amb33299000 [0,0,0,1,0,0|1,0,1]=3 1896 B11R1.706 OC(O)C1CCCCCCC1 Amb28065889 [0,0,0,1,0,0|0,0,2]=3 1897 B11R1.742 C=C(Br)CN1CCCCCC1 Amb27807225 [0,0,0,1,0,0|3,0,0]=4 1898 B11R1.742 CC(=N)NC1CCCCCC1 Amb27213610 [0,0,0,1,0,0|3,0,0]=4 1899 B11R1.742 CC(=O)C=C1CCCCCC1 Amb27948607 [0,0,0,1,0,0|1,0,2]=4 1900 B11R1.742 CC(=O)CC1=CCCCCC1 Amb28122365 [0,0,0,1,0,0|1,0,2]=4 1901 B11R1.742 CC(=O)CC1CCCCCC1 Amb25094261 [0,0,0,1,0,0|1,0,0]=2 1902 B11R1.742 CC(=O)CC1CCCCCN1 Amb23585599 [0,0,0,1,0,0|2,0,0]=3 1903 B11R1.742 CC(=O)CC1CCCOCC1 Amb27486093 [0,0,0,1,0,0|2,0,0]=3 1904 B11R1.742 CC(=O)CN1CCCCCC1 Amb8427988 [0,0,0,1,0,0|2,0,0]=3 1905 B11R1.742 CC(=O)CN1CCCCCC1 Amb9173328 [0,0,0,1,0,0|2,0,0]=3 1906 B11R1.742 CC(=O)CN1CCCNCC1 Amb18284149 [0,0,0,1,0,0|3,0,0]=4 1907 B11R1.742 CC(=O)C[C@@H]1C=CCCCC1 Amb27227101 [0,0,0,1,0,0|1,0,2]=4 1908 B11R1.742 CC(=O)NC1CCCSCC1 Amb35691520 [0,0,0,1,0,0|3,0,0]=4 1909 B11R1.742 CC(=O)OC1CCCCCC1 Amb26487005 [0,0,0,1,0,0|2,0,0]=3 1910 B11R1.742 CC(Br)CC1CCCCCC1 Amb33432623 [0,0,0,1,0,0|2,0,1]=4 1911 B11R1.742 CC(N)CC1CCCCCC1 Amb26317267 [0,0,0,1,0,0|2,0,1]=4 1912 B11R1.742 CC(O)CC1CCCCCC1 Amb27195551 [0,0,0,1,0,0|1,0,1]=3 1913 B11R1.742 CC(O)CC1CCCCCN1 Amb23596665 [0,0,0,1,0,0|2,0,1]=4 1914 B11R1.742 CC(O)CN1CCCCCC1 Amb4605883 [0,0,0,1,0,0|2,0,1]=4 1915 B11R1.742 CN(O)CC1CCCCCC1 Amb33224395 [0,0,0,1,0,0|2,0,0]=3 1916 B11R1.742 CS(=O)CC1CCCCNC1 Amb35611340 [0,0,0,1,0,0|3,0,0]=4 1917 B11R1.742 C[C@@H](N)CC1CCCCCC1 Amb33267285 [0,0,0,1,0,0|2,0,1]=4 1918 B11R1.742 C[C@@H](O)CC1CCCCCC1 Amb33267867 [0,0,0,1,0,0|1,0,1]=3 1919 B11R1.742 C[C@H](N)CC1CCCCCC1 Amb33267282 [0,0,0,1,0,0|2,0,1]=4 1920 B11R1.742 C[C@H](O)CC1CCCCCC1 Amb33267868 [0,0,0,1,0,0|1,0,1]=3 1921 B11R1.742 N=C(N)CC1CCCCCC1 Amb32882353 [0,0,0,1,0,0|2,0,0]=3 1922 B11R1.742 N=C(N)CN1CCCCCC1 Amb6261374 [0,0,0,1,0,0|3,0,0]=4 1923 B11R1.742 N=C(N)NC1CCCCCC1 Amb6429445 [0,0,0,1,0,0|3,0,0]=4 1924 B11R1.742 NC(=O)CC1CCCCCC1 Amb24487974 [0,0,0,1,0,0|1,0,0]=2 1925 B11R1.742 NC(=O)CC1CCCNCC1 Amb24363656 [0,0,0,1,0,0|2,0,0]=3 1926 B11R1.742 NC(=O)CC1CCCNCC1 Amb26473933 [0,0,0,1,0,0|2,0,0]=3 1927 B11R1.742 NC(=O)CC1CCCNCC1 Amb32663654 [0,0,0,1,0,0|2,0,0]=3 1928 B11R1.742 NC(=O)CC1CCOCCN1 Amb27186165 [0,0,0,1,0,0|3,0,0]=4 1929 B11R1.742 NC(=O)CC1COCCCN1 Amb27438569 [0,0,0,1,0,0|3,0,0]=4 1930 B11R1.742 NC(=O)CN1CCCCCC1 Amb8326954 [0,0,0,1,0,0|2,0,0]=3 1931 B11R1.742 NC(=O)CN1CCCNCC1 Amb1111888 [0,0,0,1,0,0|3,0,0]=4 1932 B11R1.742 NC(=O)CN1CCCNCC1 Amb33527072 [0,0,0,1,0,0|3,0,0]=4 1933 B11R1.742 NC(=O)CN1CCCSCC1 Amb18183874 [0,0,0,1,0,0|3,0,0]=4 1934 B11R1.742 NC(=O)NC1CCCCCC1 Amb4008281 [0,0,0,1,0,0|2,0,0]=3 1935 B11R1.742 NC(=O)NC1CCCNCC1 Amb24595706 [0,0,0,1,0,0|3,0,0]=4 1936 B11R1.742 NC(=O)NC1CCCNCC1 Amb35753064 [0,0,0,1,0,0|3,0,0]=4 1937 B11R1.742 NC(=O)NC1CCCSCC1 Amb29861268 [0,0,0,1,0,0|3,0,0]=4 1938 B11R1.742 NC(=O)OC1CCCNCC1 Amb35723380 [0,0,0,1,0,0|3,0,0]=4 1939 B11R1.742 NC(=S)CC1CCCCCC1 Amb33267826 [0,0,0,1,0,0|1,1,0]=3 1940 B11R1.742 NC(=S)CN1CCCCCC1 Amb6263113 [0,0,0,1,0,0|2,1,0]=4 1941 B11R1.742 NC(=S)NC1CCCCCC1 Amb8999214 [0,0,0,1,0,0|2,1,0]=4 1942 B11R1.742 O=C(Cl)NC1CCCCCC1 Amb35637080 [0,0,0,1,0,0|2,0,0]=3 1943 B11R1.742 O=C(Cl)NC1CCCOCC1 Amb35633431 [0,0,0,1,0,0|3,0,0]=4 1944 B11R1.742 O=C(Cl)NC1CCCSCC1 Amb35633351 [0,0,0,1,0,0|3,0,0]=4 1945 B11R1.742 O=C(Cl)OC1CCCCCC1 Amb28365356 [0,0,0,1,0,0|2,0,0]=3 1946 B11R1.742 O=C(O)C=C1CCCCCC1 Amb6749176 [0,0,0,1,0,0|0,0,2]=3 1947 B11R1.742 O=C(O)CC1C=CCCCC1 Amb26951387 [0,0,0,1,0,0|0,0,2]=3 1948 B11R1.742 O=C(O)CC1CCC=CCC1 Amb26054605 [0,0,0,1,0,0|0,0,2]=3 1949 B11R1.742 O=C(O)CC1CCCCCC1 Amb6749261 [0,0,0,1,0,0|0,0,0]=1 1950 B11R1.742 O=C(O)CC1CCCCCN1 Amb18199972 [0,0,0,1,0,0|1,0,0]=2 1951 B11R1.742 O=C(O)CC1CCCCCO1 Amb27823132 [0,0,0,1,0,0|1,0,0]=2 1952 B11R1.742 O=C(O)CC1CCCCNC1 Amb18199974 [0,0,0,1,0,0|1,0,0]=2 1953 B11R1.742 O=C(O)CC1CCCNCC1 Amb18199994 [0,0,0,1,0,0|1,0,0]=2 1954 B11R1.742 O=C(O)CC1CCCNCC1 Amb30584770 [0,0,0,1,0,0|1,0,0]=2 1955 B11R1.742 O=C(O)CC1CCCOCC1 Amb18199912 [0,0,0,1,0,0|1,0,0]=2 1956 B11R1.742 O=C(O)CC1CCCSCC1 Amb18197457 [0,0,0,1,0,0|1,0,0]=2 1957 B11R1.742 O=C(O)CC1COCCOC1 Amb27847958 [0,0,0,1,0,0|2,0,0]=3 1958 B11R1.742 O=C(O)CN1CCCCCC1 Amb2536986 [0,0,0,1,0,0|1,0,0]=2 1959 B11R1.742 O=C(O)CN1CCCCCC1 Amb9677404 [0,0,0,1,0,0|1,0,0]=2 1960 B11R1.742 O=C(O)CN1CCCNCC1 Amb13952776 [0,0,0,1,0,0|2,0,0]=3 1961 B11R1.742 O=C(O)CN1CCCNCC1 Amb9380317 [0,0,0,1,0,0|2,0,0]=3 1962 B11R1.742 O=C(O)CN1CCSSCC1 Amb28325599 [0,0,0,1,0,0|3,0,0]=4 1963 B11R1.742 O=C(O)CN1CSCCSC1 Amb28904241 [0,0,0,1,0,0|3,0,0]=4 1964 B11R1.742 O=C(O)\C=C1\CCCOCC1 Amb28313065 [0,0,0,1,0,0|1,0,2]=4 1965 B11R1.742 O=C(O)\C=C1\CCCSCC1 Amb35691471 [0,0,0,1,0,0|1,0,2]=4 1966 B11R1.742 O=[N+]([O-])CC1CCCCCC1 Amb33267271 [0,0,0,1,0,0|1,0,1]=3 1967 B11R1.742 O=[N+]([O-])CN1CCCCCC1 Amb27406586 [0,0,0,1,0,0|2,0,1]=4 1968 B11R1.753 CCCCOC1CC1C(=O)O Amb9677555 [0,0,0,1,0,0|1,0,0]=2 1969 B11R1.753 CCC\C=C\C1CC1C(=O)O Amb33327169 [0,0,0,1,0,0|0,0,2]=3 1970 B11R1.753 CCC\C=C\[C@@H]1C[C@H]1C(=O)O Amb33327155 [0,0,0,1,0,0|0,0,2]=3 1971 B11R1.944 CCC1CCCCCC1(C)O Amb35721138 [0,0,0,1,0,0|1,0,1]=3 1972 B8R0.4 BrCCCCCCCBr Amb10069015 [2,0,0,0,0,0|2,0,0]=4 1973 B8R0.4 C#CCCCCCC=O Amb25779363 [2,0,0,0,0,0|0,0,2]=4 1974 B8R0.4 C#CCCCCCCC Amb3940501 [2,0,0,0,0,0|0,0,2]=4 1975 B8R0.4 C#CCCCCCCO Amb16231466 [2,0,0,0,0,0|0,0,2]=4 1976 B8R0.4 C=CCCCCCC=O Amb26017982 [2,0,0,0,0,0|0,0,2]=4 1977 B8R0.4 C=CCCCCCCBr Amb3940223 [2,0,0,0,0,0|1,0,1]=4 1978 B8R0.4 C=CCCCCCCC Amb3940502 [2,0,0,0,0,0|0,0,1]=3 1979 B8R0.4 C=CCCCCCCCl Amb6298879 [2,0,0,0,0,0|1,0,1]=4 1980 B8R0.4 C=CCCCCCCI Amb26577493 [2,0,0,0,0,0|1,0,1]=4 1981 B8R0.4 C=CCCCCCCN Amb33543931 [2,0,0,0,0,0|1,0,1]=4 1982 B8R0.4 C=CCCCCCCO Amb22230162 [2,0,0,0,0,0|0,0,2]=4 1983 B8R0.4 C=CCCCCCNC Amb19335339 [2,0,0,0,0,0|1,0,1]=4 1984 B8R0.4 C=CCCCCCSC Amb27780646 [2,0,0,0,0,0|1,0,1]=4 1985 B8R0.4 C=CCCCCNCC Amb27461423 [2,0,0,0,0,0|1,0,1]=4 1986 B8R0.4 C=CCCSCCCC Amb28078650 [2,0,0,0,0,0|1,0,1]=4 1987 B8R0.4 C=CCNCCCCC Amb6706493 [2,0,0,0,0,0|1,0,1]=4 1988 B8R0.4 C=CCSCCCCC Amb27837635 [2,0,0,0,0,0|1,0,1]=4 1989 B8R0.4 C=CNCCCCCC Amb27398596 [2,0,0,0,0,0|1,0,1]=4 1990 B8R0.4 C=COCCCCCC Amb24440550 [2,0,0,0,0,0|1,0,1]=4 1991 B8R0.4 CC#CCCCCC=O Amb27827379 [2,0,0,0,0,0|0,0,2]=4 1992 B8R0.4 CC#CCCCCCO Amb27243915 [2,0,0,0,0,0|0,0,2]=4 1993 B8R0.4 CCC#CCCCCO Amb26362942 [2,0,0,0,0,0|0,0,2]=4 1994 B8R0.4 CCCCBCCCC Amb27624537 [2,0,0,0,0,0|1,0,1]=4 1995 B8R0.4 CCCCC#CCCO Amb2721716 [2,0,0,0,0,0|0,0,2]=4 1996 B8R0.4 CCCCCC#CC=O Amb9825881 [2,0,0,0,0,0|0,0,2]=4 1997 B8R0.4 CCCCCCCC#N Amb7764637 [2,0,0,0,0,0|1,0,1]=4 1998 B8R0.4 CCCCCCCC=O Amb6891949 [2,0,0,0,0,0|0,0,0]=2 1999 B8R0.4 CCCCCCCCBr Amb2689971 [2,0,0,0,0,0|1,0,0]=3 2000 B8R0.4 CCCCCCCCC Amb8513269 [2,0,0,0,0,0|0,0,1]=3 2001 B8R0.4 CCCCCCCCCl Amb7757832 [2,0,0,0,0,0|1,0,0]=3 2002 B8R0.4 CCCCCCCCF Amb10840379 [2,0,0,0,0,0|1,0,0]=3 2003 B8R0.4 CCCCCCCCI Amb637144 [2,0,0,0,0,0|1,0,0]=3 2004 B8R0.4 CCCCCCCCN Amb2720240 [2,0,0,0,0,0|1,0,0]=3 2005 B8R0.4 CCCCCCCCN Amb3940466 [2,0,0,0,0,0|1,0,0]=3 2006 B8R0.4 CCCCCCCCO Amb6608788 [2,0,0,0,0,0|0,0,0]=2 2007 B8R0.4 CCCCCCCCS Amb8513530 [2,0,0,0,0,0|0,1,0]=3 2008 B8R0.4 CCCCCCCC[SiH3] Amb19893984 [2,0,0,0,0,0|0,1,0]=3 2009 B8R0.4 CCCCCCCNC Amb7761453 [2,0,0,0,0,0|1,0,1]=4 2010 B8R0.4 CCCCCCCNN Amb7794376 [2,0,0,0,0,0|2,0,0]=4 2011 B8R0.4 CCCCCCCOC Amb24584912 [2,0,0,0,0,0|1,0,1]=4 2012 B8R0.4 CCCCCCCSC Amb22359861 [2,0,0,0,0,0|1,0,1]=4 2013 B8R0.4 CCCCCCN=C=O Amb8516659 [2,0,0,0,0,0|1,0,1]=4 2014 B8R0.4 CCCCCCNC=S Amb27880264 [2,0,0,0,0,0|1,1,0]=4 2015 B8R0.4 CCCCCCNCC Amb6730567 [2,0,0,0,0,0|1,0,1]=4 2016 B8R0.4 CCCCCCOCC Amb17672946 [2,0,0,0,0,0|1,0,1]=4 2017 B8R0.4 CCCCCCOCCl Amb27473208 [2,0,0,0,0,0|2,0,0]=4 2018 B8R0.4 CCCCCCON=O Amb17672945 [2,0,0,0,0,0|2,0,0]=4 2019 B8R0.4 CCCCCC\C=C\Br Amb24677708 [2,0,0,0,0,0|1,0,1]=4 2020 B8R0.4 CCCCCC\C=C\I Amb24446897 [2,0,0,0,0,0|1,0,1]=4 2021 B8R0.4 CCCCCNCCC Amb6688182 [2,0,0,0,0,0|1,0,1]=4 2022 B8R0.4 CCCCCNCCCl Amb17334288 [2,0,0,0,0,0|2,0,0]=4 2023 B8R0.4 CCCCCNCCI Amb27411190 [2,0,0,0,0,0|2,0,0]=4 2024 B8R0.4 CCCCCNCCN Amb17091049 [2,0,0,0,0,0|2,0,0]=4 2025 B8R0.4 CCCCCNCCO Amb3940022 [2,0,0,0,0,0|1,0,0]=3 2026 B8R0.4 CCCCCOCC=O Amb27230502 [2,0,0,0,0,0|1,0,0]=3 2027 B8R0.4 CCCCCOCCCl Amb8902963 [2,0,0,0,0,0|2,0,0]=4 2028 B8R0.4 CCCCCOCCO Amb22264988 [2,0,0,0,0,0|1,0,0]=3 2029 B8R0.4 CCCCCOCCS Amb27752940 [2,0,0,0,0,0|1,1,0]=4 2030 B8R0.4 CCCCCSCCCl Amb25887277 [2,0,0,0,0,0|2,0,0]=4 2031 B8R0.4 CCCCCSCCN Amb6275043 [2,0,0,0,0,0|2,0,0]=4 2032 B8R0.4 CCCCCSCCO Amb1032987 [2,0,0,0,0,0|1,0,0]=3 2033 B8R0.4 CCCCC\C=C\CO Amb33038088 [2,0,0,0,0,0|0,0,2]=4 2034 B8R0.4 CCCCNCCCBr Amb28399869 [2,0,0,0,0,0|2,0,0]=4 2035 B8R0.4 CCCCNCCCC Amb22348285 [2,0,0,0,0,0|1,0,1]=4 2036 B8R0.4 CCCCNCCCC Amb3939027 [2,0,0,0,0,0|1,0,1]=4 2037 B8R0.4 CCCCNCCCC Amb4017913 [2,0,0,0,0,0|1,0,1]=4 2038 B8R0.4 CCCCNCCCCl Amb24529030 [2,0,0,0,0,0|2,0,0]=4 2039 B8R0.4 CCCCNCCCCl Amb33164142 [2,0,0,0,0,0|2,0,0]=4 2040 B8R0.4 CCCCNCCCN Amb17315267 [2,0,0,0,0,0|2,0,0]=4 2041 B8R0.4 CCCCNCCCO Amb4304116 [2,0,0,0,0,0|1,0,0]=3 2042 B8R0.4 CCCCNOCCO Amb27956595 [2,0,0,0,0,0|2,0,0]=4 2043 B8R0.4 CCCCOCCC=O Amb27880111 [2,0,0,0,0,0|1,0,0]=3 2044 B8R0.4 CCCCOCCCBr Amb8895241 [2,0,0,0,0,0|2,0,0]=4 2045 B8R0.4 CCCCOCCCC Amb8513426 [2,0,0,0,0,0|1,0,1]=4 2046 B8R0.4 CCCCOCCCN Amb3939348 [2,0,0,0,0,0|2,0,0]=4 2047 B8R0.4 CCCCOCNC=O Amb27392745 [2,0,0,0,0,0|2,0,0]=4 2048 B8R0.4 CCCCPCCCC Amb22730293 [2,0,0,0,0,0|1,0,1]=4 2049 B8R0.4 CCCCPCCCN Amb27217298 [2,0,0,0,0,0|2,0,0]=4 2050 B8R0.4 CCCCSCCCF Amb27449027 [2,0,0,0,0,0|2,0,0]=4 2051 B8R0.4 CCCCSCCCN Amb9261123 [2,0,0,0,0,0|2,0,0]=4 2052 B8R0.4 CCCCSCCCS Amb28453845 [2,0,0,0,0,0|1,1,0]=4 2053 B8R0.4 CCCCSCNC=O Amb27656061 [2,0,0,0,0,0|2,0,0]=4 2054 B8R0.4 CCCC[NH2+]CCCC Amb22732582 [2,0,0,0,0,0|1,0,1]=4 2055 B8R0.4 CCCC[NH2+]CCCC Amb8516289 [2,0,0,0,0,0|1,0,1]=4 2056 B8R0.4 CCCC[SnH4+2]CCCC Amb22045422 [2,0,0,0,0,0|1,0,1]=4 2057 B8R0.4 CCCC[SnH4+2]CCCC Amb22045423 [2,0,0,0,0,0|1,0,1]=4 2058 B8R0.4 CCCC\C=C/CCO Amb26586236 [2,0,0,0,0,0|0,0,2]=4 2059 B8R0.4 CCCC\C=C\CCO Amb9134733 [2,0,0,0,0,0|0,0,2]=4 2060 B8R0.4 CCCNCCCCI Amb28072729 [2,0,0,0,0,0|2,0,0]=4 2061 B8R0.4 CCCNCCCCN Amb17334115 [2,0,0,0,0,0|2,0,0]=4 2062 B8R0.4 CCCNCCCCS Amb28349265 [2,0,0,0,0,0|1,1,0]=4 2063 B8R0.4 CCCOCCCC=O Amb27795367 [2,0,0,0,0,0|1,0,0]=3 2064 B8R0.4 CCCOCCCCBr Amb8874783 [2,0,0,0,0,0|2,0,0]=4 2065 B8R0.4 CCCOCCCCCl Amb18181651 [2,0,0,0,0,0|2,0,0]=4 2066 B8R0.4 CCCOCCCCO Amb27395455 [2,0,0,0,0,0|1,0,0]=3 2067 B8R0.4 CCCSCCCCCl Amb18798739 [2,0,0,0,0,0|2,0,0]=4 2068 B8R0.4 CCCSCCCCN Amb9391521 [2,0,0,0,0,0|2,0,0]=4 2069 B8R0.4 CCCSCCCCO Amb9370795 [2,0,0,0,0,0|1,0,0]=3 2070 B8R0.4 CCCSCCCCS Amb27766901 [2,0,0,0,0,0|1,1,0]=4 2071 B8R0.4 CCCSCCNC=O Amb27630895 [2,0,0,0,0,0|2,0,0]=4 2072 B8R0.4 CCC\C=C\CCC=O Amb33172232 [2,0,0,0,0,0|0,0,2]=4 2073 B8R0.4 CCNCCCCCF Amb27956469 [2,0,0,0,0,0|2,0,0]=4 2074 B8R0.4 CCNCCCCCI Amb27761837 [2,0,0,0,0,0|2,0,0]=4 2075 B8R0.4 CCNCCCCCN Amb27447573 [2,0,0,0,0,0|2,0,0]=4 2076 B8R0.4 CCNCCCCCO Amb17334130 [2,0,0,0,0,0|1,0,0]=3 2077 B8R0.4 CCNCCCNC=O Amb27220690 [2,0,0,0,0,0|2,0,0]=4 2078 B8R0.4 CCNCCOCCO Amb6736237 [2,0,0,0,0,0|2,0,0]=4 2079 B8R0.4 CCOCCCCCBr Amb24502334 [2,0,0,0,0,0|2,0,0]=4 2080 B8R0.4 CCOCCCCCCl Amb9001650 [2,0,0,0,0,0|2,0,0]=4 2081 B8R0.4 CCOCCCCCS Amb27835597 [2,0,0,0,0,0|1,1,0]=4 2082 B8R0.4 CCOCCOCC=O Amb33539619 [2,0,0,0,0,0|2,0,0]=4 2083 B8R0.4 CCOCCOCCO Amb8513162 [2,0,0,0,0,0|2,0,0]=4 2084 B8R0.4 CCOCSCCCO Amb27842168 [2,0,0,0,0,0|2,0,0]=4 2085 B8R0.4 CCONCCCCO Amb28326276 [2,0,0,0,0,0|2,0,0]=4 2086 B8R0.4 CCSCCCCC=O Amb24690525 [2,0,0,0,0,0|1,0,0]=3 2087 B8R0.4 CCSCCCCCBr Amb25887441 [2,0,0,0,0,0|2,0,0]=4 2088 B8R0.4 CCSCCCCCCl Amb9304998 [2,0,0,0,0,0|2,0,0]=4 2089 B8R0.4 CCSCCCCCF Amb28207049 [2,0,0,0,0,0|2,0,0]=4 2090 B8R0.4 CCSCCCCCN Amb28049047 [2,0,0,0,0,0|2,0,0]=4 2091 B8R0.4 CCSCCCNC=O Amb27457130 [2,0,0,0,0,0|2,0,0]=4 2092 B8R0.4 CCSCCNCCO Amb27454287 [2,0,0,0,0,0|2,0,0]=4 2093 B8R0.4 CC\C=C/CCCCO Amb22052636 [2,0,0,0,0,0|0,0,2]=4 2094 B8R0.4 CC\C=C\CCCC=O Amb33171685 [2,0,0,0,0,0|0,0,2]=4 2095 B8R0.4 CNCCCCCCF Amb28137350 [2,0,0,0,0,0|2,0,0]=4 2096 B8R0.4 CNCCCCCCN Amb22641938 [2,0,0,0,0,0|2,0,0]=4 2097 B8R0.4 CNCCCCCCN Amb32667312 [2,0,0,0,0,0|2,0,0]=4 2098 B8R0.4 CNCCCCCCO Amb2721293 [2,0,0,0,0,0|1,0,0]=3 2099 B8R0.4 CNCCCOCCO Amb27855882 [2,0,0,0,0,0|2,0,0]=4 2100 B8R0.4 COCCCCCC=O Amb27467958 [2,0,0,0,0,0|1,0,0]=3 2101 B8R0.4 COCCCCCCBr Amb26928164 [2,0,0,0,0,0|2,0,0]=4 2102 B8R0.4 COCCCCCCCl Amb18180174 [2,0,0,0,0,0|2,0,0]=4 2103 B8R0.4 COCCCCCCN Amb27799019 [2,0,0,0,0,0|2,0,0]=4 2104 B8R0.4 COCCCCCCO Amb28189816 [2,0,0,0,0,0|1,0,0]=3 2105 B8R0.4 COCCCNCCO Amb9213213 [2,0,0,0,0,0|2,0,0]=4 2106 B8R0.4 COCCCOCCO Amb26344833 [2,0,0,0,0,0|2,0,0]=4 2107 B8R0.4 COCCNCCCO Amb9246587 [2,0,0,0,0,0|2,0,0]=4 2108 B8R0.4 COCCOCCC=O Amb26078964 [2,0,0,0,0,0|2,0,0]=4 2109 B8R0.4 COCCOCCCO Amb26608683 [2,0,0,0,0,0|2,0,0]=4 2110 B8R0.4 COCCSCCC=O Amb27837422 [2,0,0,0,0,0|2,0,0]=4 2111 B8R0.4 COCOCCCC=O Amb27234488 [2,0,0,0,0,0|2,0,0]=4 2112 B8R0.4 CSCCCCCC=O Amb27981887 [2,0,0,0,0,0|1,0,0]=3 2113 B8R0.4 CSCCCCCCN Amb24532830 [2,0,0,0,0,0|2,0,0]=4 2114 B8R0.4 CSCCCCCCO Amb22367888 [2,0,0,0,0,0|1,0,0]=3 2115 B8R0.4 CSCCCCCCS Amb27801758 [2,0,0,0,0,0|1,1,0]=4 2116 B8R0.4 CSCCCCNC=O Amb28366040 [2,0,0,0,0,0|2,0,0]=4 2117 B8R0.4 CSCCCOCC=O Amb28286017 [2,0,0,0,0,0|2,0,0]=4 2118 B8R0.4 CSCCOCCC=O Amb27823932 [2,0,0,0,0,0|2,0,0]=4 2119 B8R0.4 CSCCSCCC=O Amb27956184 [2,0,0,0,0,0|2,0,0]=4 2120 B8R0.4 C\C=C/CCCCC=O Amb26854801 [2,0,0,0,0,0|0,0,2]=4 2121 B8R0.4 C\C=C/CCCCCC Amb27478896 [2,0,0,0,0,0|1,0,1]=4 2122 B8R0.4 C\C=C\CCCCCC Amb19930200 [2,0,0,0,0,0|1,0,1]=4 2123 B8R0.4 C\C=C\CCCCCO Amb25247777 [2,0,0,0,0,0|0,0,2]=4 2124 B8R0.4 ClCCCCCCCBr Amb24323576 [2,0,0,0,0,0|2,0,0]=4 2125 B8R0.4 ClCCCCCCCCl Amb22232563 [2,0,0,0,0,0|2,0,0]=4 2126 B8R0.4 N#CCCCCCC=O Amb18642301 [2,0,0,0,0,0|1,0,1]=4 2127 B8R0.4 NCCCCCCCBr Amb27817795 [2,0,0,0,0,0|2,0,0]=4 2128 B8R0.4 NCCCCCCCBr Amb33321489 [2,0,0,0,0,0|2,0,0]=4 2129 B8R0.4 NCCCCCCCF Amb25918508 [2,0,0,0,0,0|2,0,0]=4 2130 B8R0.4 NCCCCCCCN Amb3370862 [2,0,0,0,0,0|2,0,0]=4 2131 B8R0.4 NCCCCCCCO Amb24120448 [2,0,0,0,0,0|1,0,0]=3 2132 B8R0.4 NCCCCCCCO Amb33544521 [2,0,0,0,0,0|1,0,0]=3 2133 B8R0.4 NCCCCCCCS Amb25147209 [2,0,0,0,0,0|1,1,0]=4 2134 B8R0.4 NCCCCNCCO Amb8394908 [2,0,0,0,0,0|2,0,0]=4 2135 B8R0.4 NCCCCOCCO Amb6681146 [2,0,0,0,0,0|2,0,0]=4 2136 B8R0.4 NCCCCSCCO Amb17500958 [2,0,0,0,0,0|2,0,0]=4 2137 B8R0.4 NCCCNCCCO Amb19959935 [2,0,0,0,0,0|2,0,0]=4 2138 B8R0.4 NCCCOCCCO Amb35788244 [2,0,0,0,0,0|2,0,0]=4 2139 B8R0.4 NCCCOCCCO Amb9392882 [2,0,0,0,0,0|2,0,0]=4 2140 B8R0.4 NCCCSCCCO Amb17500713 [2,0,0,0,0,0|2,0,0]=4 2141 B8R0.4 O=CCCCCCCBr Amb22755463 [2,0,0,0,0,0|1,0,0]=3 2142 B8R0.4 O=CCCCCCCCl Amb27262031 [2,0,0,0,0,0|1,0,0]=3 2143 B8R0.4 O=CCCOCCCO Amb28428559 [2,0,0,0,0,0|2,0,0]=4 2144 B8R0.4 OCCCCCCCBr Amb9787726 [2,0,0,0,0,0|1,0,0]=3 2145 B8R0.4 OCCCCCCCF Amb25381297 [2,0,0,0,0,0|1,0,0]=3 2146 B8R0.4 OCCCCCCCI Amb32411247 [2,0,0,0,0,0|1,0,0]=3 2147 B8R0.4 OCCCCCCCO Amb8513178 [2,0,0,0,0,0|1,0,0]=3 2148 B8R0.4 OCCCCNCCO Amb28049076 [2,0,0,0,0,0|2,0,0]=4 2149 B8R0.4 OCCCCOCCO Amb25185198 [2,0,0,0,0,0|2,0,0]=4 2150 B8R0.4 OCCCNCCCO Amb28984089 [2,0,0,0,0,0|2,0,0]=4 2151 B8R0.4 OCCCNCCCO Amb8393926 [2,0,0,0,0,0|2,0,0]=4 2152 B8R0.4 OCCCOCCCCl Amb28058754 [2,0,0,0,0,0|2,0,0]=4 2153 B8R0.4 OCCCOCCCO Amb24626114 [2,0,0,0,0,0|2,0,0]=4 2154 B8R0.4 [C-]#[N+]CCCCCC=O Amb27424636 [2,0,0,0,0,0|1,0,1]=4 2155 B8R0.4 [C-]#[N+]CCCCCCC Amb33747260 [2,0,0,0,0,0|1,0,1]=4 2156 B8R0.7 C#CCCCCC(=O)O Amb2721485 [2,0,0,0,0,0|0,0,2]=4 2157 B8R0.7 C=C(C)CCCCCC Amb6298939 [2,0,0,0,0,0|2,0,0]=4 2158 B8R0.7 C=CCCCCC(=O)O Amb6299578 [2,0,0,0,0,0|0,0,2]=4 2159 B8R0.7 CC#CCCCC(=O)O Amb28046337 [2,0,0,0,0,0|0,0,2]=4 2160 B8R0.7 CC(=O)CCCCCBr Amb27401578 [2,0,0,0,0,0|2,0,0]=4 2161 B8R0.7 CC(=O)CCCCCCl Amb26591097 [2,0,0,0,0,0|2,0,0]=4 2162 B8R0.7 CC(=O)CCCCCN Amb22641918 [2,0,0,0,0,0|2,0,0]=4 2163 B8R0.7 CC(=O)CCCCCN Amb24113384 [2,0,0,0,0,0|2,0,0]=4 2164 B8R0.7 CC(=O)CCCCCO Amb27237283 [2,0,0,0,0,0|2,0,0]=4 2165 B8R0.7 CCC#CCCC(=O)O Amb28046178 [2,0,0,0,0,0|0,0,2]=4 2166 B8R0.7 CCCC#CCC(=O)O Amb17593307 [2,0,0,0,0,0|0,0,2]=4 2167 B8R0.7 CCCCC#CC(=O)O Amb2721486 [2,0,0,0,0,0|0,0,2]=4 2168 B8R0.7 CCCCCCB(O)O Amb2722519 [2,0,0,0,0,0|1,0,1]=4 2169 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [2,0,0,0,0,0|1,0,0]=3 2170 B8R0.7 CCCCCCC(=O)O Amb34915914 [2,0,0,0,0,0|0,0,0]=2 2171 B8R0.7 CCCCCCC(=O)O Amb3499439 [2,0,0,0,0,0|0,0,0]=2 2172 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [2,0,0,0,0,0|0,0,1]=3 2173 B8R0.7 CCCCCCC(C)=O Amb6891961 [2,0,0,0,0,0|1,0,0]=3 2174 B8R0.7 CCCCCCC(C)O Amb3940385 [2,0,0,0,0,0|1,0,1]=4 2175 B8R0.7 CCCCCCC(N)=O Amb8858816 [2,0,0,0,0,0|1,0,0]=3 2176 B8R0.7 CCCCCCC(O)O Amb27451028 [2,0,0,0,0,0|0,0,2]=4 2177 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [2,0,0,0,0,0|1,0,1]=4 2178 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [2,0,0,0,0,0|1,0,1]=4 2179 B8R0.7 CCCCCNC(N)=O Amb6246936 [2,0,0,0,0,0|2,0,0]=4 2180 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [2,0,0,0,0,0|2,0,0]=4 2181 B8R0.7 CCCCCOC(N)=O Amb27655610 [2,0,0,0,0,0|2,0,0]=4 2182 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [2,0,0,0,0,0|2,0,0]=4 2183 B8R0.7 CCCCNCC(=O)O Amb7766471 [2,0,0,0,0,0|1,0,0]=3 2184 B8R0.7 CCCCNCC(N)=O Amb1126543 [2,0,0,0,0,0|2,0,0]=4 2185 B8R0.7 CCCCNCC(N)=O Amb7969721 [2,0,0,0,0,0|2,0,0]=4 2186 B8R0.7 CCCCOCC(=O)O Amb8514871 [2,0,0,0,0,0|1,0,0]=3 2187 B8R0.7 CCCCOCC(N)=O Amb27855875 [2,0,0,0,0,0|2,0,0]=4 2188 B8R0.7 CCCCSCC(=O)O Amb1138789 [2,0,0,0,0,0|1,0,0]=3 2189 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [2,0,0,0,0,0|0,0,2]=4 2190 B8R0.7 CCCNCCC(=O)O Amb18633174 [2,0,0,0,0,0|1,0,0]=3 2191 B8R0.7 CCCNCCC(=O)O Amb2372065 [2,0,0,0,0,0|1,0,0]=3 2192 B8R0.7 CCCNCCC(C)=O Amb24700442 [2,0,0,0,0,0|2,0,0]=4 2193 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [2,0,0,0,0,0|2,0,0]=4 2194 B8R0.7 CCCOCCC(=O)O Amb8874502 [2,0,0,0,0,0|1,0,0]=3 2195 B8R0.7 CCCOCCC(C)=O Amb8874915 [2,0,0,0,0,0|2,0,0]=4 2196 B8R0.7 CCCONCC(=O)O Amb27401902 [2,0,0,0,0,0|2,0,0]=4 2197 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [2,0,0,0,0,0|0,0,2]=4 2198 B8R0.7 CCNCCCC(=O)O Amb30585148 [2,0,0,0,0,0|1,0,0]=3 2199 B8R0.7 CCNCCCC(=O)O Amb6253896 [2,0,0,0,0,0|1,0,0]=3 2200 B8R0.7 CCNCCCC(N)=O Amb24709859 [2,0,0,0,0,0|2,0,0]=4 2201 B8R0.7 CCOCCCC(=O)O Amb6257602 [2,0,0,0,0,0|1,0,0]=3 2202 B8R0.7 CCSCCCC(=O)O Amb6680204 [2,0,0,0,0,0|1,0,0]=3 2203 B8R0.7 CCSCCCC(C)=O Amb9660283 [2,0,0,0,0,0|2,0,0]=4 2204 B8R0.7 CCSSCCC(=O)O Amb27837279 [2,0,0,0,0,0|2,0,0]=4 2205 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [2,0,0,0,0,0|0,0,2]=4 2206 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [2,0,0,0,0,0|0,0,2]=4 2207 B8R0.7 CNCCCCC(=O)O Amb10605773 [2,0,0,0,0,0|1,0,0]=3 2208 B8R0.7 CNCCCCC(=O)O Amb24340485 [2,0,0,0,0,0|1,0,0]=3 2209 B8R0.7 CNCCCCC(N)=O Amb27780478 [2,0,0,0,0,0|2,0,0]=4 2210 B8R0.7 CNCCOCC(=O)O Amb18630741 [2,0,0,0,0,0|2,0,0]=4 2211 B8R0.7 COCCCCC(=O)O Amb9207785 [2,0,0,0,0,0|1,0,0]=3 2212 B8R0.7 COCCCCC(C)=O Amb9659801 [2,0,0,0,0,0|2,0,0]=4 2213 B8R0.7 COCCNCC(=O)O Amb19514667 [2,0,0,0,0,0|2,0,0]=4 2214 B8R0.7 COCCNCC(=O)O Amb7766415 [2,0,0,0,0,0|2,0,0]=4 2215 B8R0.7 COCCOCC(=O)O Amb2721259 [2,0,0,0,0,0|2,0,0]=4 2216 B8R0.7 COCCSCC(=O)O Amb6245777 [2,0,0,0,0,0|2,0,0]=4 2217 B8R0.7 COCOCCC(=O)O Amb27784860 [2,0,0,0,0,0|2,0,0]=4 2218 B8R0.7 COCSCCC(=O)O Amb27263382 [2,0,0,0,0,0|2,0,0]=4 2219 B8R0.7 CSCCCCC(=O)O Amb17503764 [2,0,0,0,0,0|1,0,0]=3 2220 B8R0.7 CSCCCCC(C)=O Amb27815140 [2,0,0,0,0,0|2,0,0]=4 2221 B8R0.7 CSCCCCC(N)=O Amb27662727 [2,0,0,0,0,0|2,0,0]=4 2222 B8R0.7 CSCCNCC(=O)O Amb24401934 [2,0,0,0,0,0|2,0,0]=4 2223 B8R0.7 CSCCNCC(=O)O Amb28934977 [2,0,0,0,0,0|2,0,0]=4 2224 B8R0.7 CSCCOCC(=O)O Amb27392229 [2,0,0,0,0,0|2,0,0]=4 2225 B8R0.7 CSCCSCC(=O)O Amb27964765 [2,0,0,0,0,0|2,0,0]=4 2226 B8R0.7 CSSCCCC(=O)O Amb25269470 [2,0,0,0,0,0|2,0,0]=4 2227 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [2,0,0,0,0,0|0,0,2]=4 2228 B8R0.7 N#CCCCCC(=O)O Amb17593332 [2,0,0,0,0,0|1,0,1]=4 2229 B8R0.7 NC(=O)CCCCCBr Amb2685265 [2,0,0,0,0,0|2,0,0]=4 2230 B8R0.7 NC(=O)CCCCCCl Amb27392074 [2,0,0,0,0,0|2,0,0]=4 2231 B8R0.7 NC(=O)CCCCCF Amb27837777 [2,0,0,0,0,0|2,0,0]=4 2232 B8R0.7 NC(=O)CCCCCO Amb22524369 [2,0,0,0,0,0|2,0,0]=4 2233 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [2,0,0,0,0,0|2,0,0]=4 2234 B8R0.7 NCCCCCC(=O)O Amb17607928 [2,0,0,0,0,0|1,0,0]=3 2235 B8R0.7 NCCCCCC(=O)O Amb1905625 [2,0,0,0,0,0|1,0,0]=3 2236 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [2,0,0,0,0,0|1,0,1]=4 2237 B8R0.7 NCCCOCC(=O)O Amb18111435 [2,0,0,0,0,0|2,0,0]=4 2238 B8R0.7 NCCCOCC(=O)O Amb31217489 [2,0,0,0,0,0|2,0,0]=4 2239 B8R0.7 NCCCSCC(=O)O Amb17500676 [2,0,0,0,0,0|2,0,0]=4 2240 B8R0.7 NCCNCCC(=O)O Amb20668304 [2,0,0,0,0,0|2,0,0]=4 2241 B8R0.7 NCCNCCC(=O)O Amb22058790 [2,0,0,0,0,0|2,0,0]=4 2242 B8R0.7 NCCOCCC(=O)O Amb18630461 [2,0,0,0,0,0|2,0,0]=4 2243 B8R0.7 NCCOCCC(=O)O Amb33330744 [2,0,0,0,0,0|2,0,0]=4 2244 B8R0.7 NCCSCCC(=O)O Amb21988844 [2,0,0,0,0,0|2,0,0]=4 2245 B8R0.7 NOCCCCC(=O)O Amb27596055 [2,0,0,0,0,0|2,0,0]=4 2246 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [2,0,0,0,0,0|2,0,0]=4 2247 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [2,0,0,0,0,0|2,0,0]=4 2248 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [2,0,0,0,0,0|2,0,0]=4 2249 B8R0.7 O=C(F)CCCCCCl Amb27173031 [2,0,0,0,0,0|2,0,0]=4 2250 B8R0.7 O=C(O)CCCCCBr Amb2081955 [2,0,0,0,0,0|1,0,0]=3 2251 B8R0.7 O=C(O)CCCCCCl Amb18796646 [2,0,0,0,0,0|1,0,0]=3 2252 B8R0.7 O=C(O)CCCCCF Amb26063796 [2,0,0,0,0,0|1,0,0]=3 2253 B8R0.7 O=C(O)CCCCCI Amb22736492 [2,0,0,0,0,0|1,0,0]=3 2254 B8R0.7 O=C(O)CCCCCO Amb8515991 [2,0,0,0,0,0|1,0,0]=3 2255 B8R0.7 O=C(O)CCCCNO Amb28410171 [2,0,0,0,0,0|2,0,0]=4 2256 B8R0.7 O=C(O)CCNCCF Amb27954272 [2,0,0,0,0,0|2,0,0]=4 2257 B8R0.7 O=C(O)CCNCCO Amb1110010 [2,0,0,0,0,0|2,0,0]=4 2258 B8R0.7 O=C(O)CCNCCS Amb28285239 [2,0,0,0,0,0|2,0,0]=4 2259 B8R0.7 O=C(O)CCOCCBr Amb24057757 [2,0,0,0,0,0|2,0,0]=4 2260 B8R0.7 O=C(O)CCOCCF Amb27807548 [2,0,0,0,0,0|2,0,0]=4 2261 B8R0.7 O=C(O)CCOCCO Amb6680916 [2,0,0,0,0,0|2,0,0]=4 2262 B8R0.7 O=C(O)CCOCCS Amb27226892 [2,0,0,0,0,0|2,0,0]=4 2263 B8R0.7 O=C(O)CCSCCBr Amb27468126 [2,0,0,0,0,0|2,0,0]=4 2264 B8R0.7 O=C(O)CCSCCF Amb27172860 [2,0,0,0,0,0|2,0,0]=4 2265 B8R0.7 O=C(O)CCSCCS Amb18126456 [2,0,0,0,0,0|2,0,0]=4 2266 B8R0.7 O=C(O)CNCCCCl Amb28055692 [2,0,0,0,0,0|2,0,0]=4 2267 B8R0.7 O=C(O)CNCCCF Amb27649256 [2,0,0,0,0,0|2,0,0]=4 2268 B8R0.7 O=C(O)CNCCCO Amb9325805 [2,0,0,0,0,0|2,0,0]=4 2269 B8R0.7 O=C(O)COCCCO Amb28288633 [2,0,0,0,0,0|2,0,0]=4 2270 B8R0.7 O=C([O-])CCCCCO Amb22491268 [2,0,0,0,0,0|1,0,1]=4 2271 B8R0.7 O=CCCCCC(=O)O Amb18642763 [2,0,0,0,0,0|1,0,1]=4 2272 B10R0.3 CCCC(=O)CCCC(=O)O Amb6305240 [1,1,0,0,0,0|0,0,1]=3 2273 B10R0.3 CCCC(=O)NCCC(=O)O Amb5741938 [1,1,0,0,0,0|1,0,1]=4 2274 B10R0.3 CCCC(C)CCCC(=O)O Amb20669051 [1,1,0,0,0,0|0,0,0]=2 2275 B10R0.3 CCCC(C)CCCC(C)=O Amb32668762 [1,1,0,0,0,0|1,0,0]=3 2276 B10R0.3 CCCC(C)CCOC(C)=O Amb24087389 [1,1,0,0,0,0|2,0,0]=4 2277 B10R0.3 CCCC(S)CCOC(C)=O Amb10071332 [1,1,0,0,0,0|2,0,0]=4 2278 B10R0.3 CCNC(=O)CCCC(=O)O Amb3365014 [1,1,0,0,0,0|1,0,1]=4 2279 B10R0.3 CCOC(=O)CCCC(=O)O Amb3939878 [1,1,0,0,0,0|1,0,1]=4 2280 B10R0.3 CCOC(C)CCCC(=O)O Amb33425000 [1,1,0,0,0,0|1,0,0]=3 2281 B10R0.3 CN(CCN)CCCC(=O)O Amb32684701 [1,1,0,0,0,0|2,0,0]=4 2282 B10R0.3 CN(CCN)CCCC(=O)O Amb32684702 [1,1,0,0,0,0|2,0,0]=4 2283 B10R0.3 CN(CCO)CCCC(=O)O Amb5767540 [1,1,0,0,0,0|2,0,0]=4 2284 B10R0.6 CC#CCCC(O)CC(=O)O Amb27990189 [1,1,0,0,0,0|0,0,2]=4 2285 B10R0.6 CCCCCC(C)CC(=O)O Amb19375410 [1,1,0,0,0,0|0,0,0]=2 2286 B10R0.6 CCCCCC(N)CC(=O)O Amb21857987 [1,1,0,0,0,0|0,0,0]=2 2287 B10R0.6 CCCCCC(N)CC(=O)O Amb31307614 [1,1,0,0,0,0|0,0,0]=2 2288 B10R0.6 CCCCCC(N)CC(N)=O Amb33255748 [1,1,0,0,0,0|1,0,0]=3 2289 B10R0.6 CCCCCC(O)CC(=O)O Amb18797787 [1,1,0,0,0,0|0,0,0]=2 2290 B10R0.6 CCCCC[C@@H](O)CC(=O)O Amb31308365 [1,1,0,0,0,0|0,0,0]=2 2291 B10R0.6 CCCCC[C@H](O)CC(=O)O Amb33872470 [1,1,0,0,0,0|0,0,0]=2 2292 B10R0.6 CCCSCC(N)CC(=O)O Amb32687888 [1,1,0,0,0,0|1,0,0]=3 2293 B10R0.6 CCC\C=C\C(C)CC(=O)O Amb33448450 [1,1,0,0,0,0|0,0,2]=4 2294 B10R0.6 CCC\C=C\C(N)CC(=O)O Amb33429157 [1,1,0,0,0,0|0,0,2]=4 2295 B10R0.6 CCC\C=C\C(O)CC(=O)O Amb33448690 [1,1,0,0,0,0|0,0,2]=4 2296 B10R0.6 CCC\C=C\[C@@H](O)CC(=O)O Amb33449488 [1,1,0,0,0,0|0,0,2]=4 2297 B10R0.6 CCC\C=C\[C@H](O)CC(=O)O Amb33358660 [1,1,0,0,0,0|0,0,2]=4 2298 B10R0.6 CCSCCC(N)CC(=O)O Amb33254745 [1,1,0,0,0,0|1,0,0]=3 2299 B10R0.6 CCSCCC(N)CC(N)=O Amb33308127 [1,1,0,0,0,0|2,0,0]=4 2300 B10R0.6 CSCCCC(N)CC(=O)O Amb33308380 [1,1,0,0,0,0|1,0,0]=3 2301 B10R0.6 CSCCCC(N)CC(N)=O Amb32787351 [1,1,0,0,0,0|2,0,0]=4 2302 B10R0.6 NCCCC[C@@H](N)CC(=O)O Amb22746256 [1,1,0,0,0,0|1,0,0]=3 2303 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb16184018 [1,1,0,0,0,0|1,0,0]=3 2304 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb22369388 [1,1,0,0,0,0|1,0,0]=3 2305 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb33929234 [1,1,0,0,0,0|1,0,0]=3 2306 B10R0.6 NCCCC[C@H](N)CC(N)=O Amb32650909 [1,1,0,0,0,0|2,0,0]=4 2307 B10R0.22 CCCCCCCP(=O)(O)O Amb9786420 [1,1,0,0,0,0|1,0,0]=3 2308 B10R0.22 CCCCCCCS(=O)(=O)Cl Amb13951952 [1,1,0,0,0,0|1,0,1]=4 2309 B10R0.22 CCCCCCCS(=O)(=O)F Amb32718315 [1,1,0,0,0,0|1,0,1]=4 2310 B10R0.22 CCCCCCCS(=O)(=O)[O-] Amb2688650 [1,1,0,0,0,0|1,0,1]=4 2311 B10R0.22 CCCCCCCS(=O)(=O)[O-] Amb8516651 [1,1,0,0,0,0|1,0,1]=4 2312 B10R0.22 CCCCCCCS(N)(=O)=O Amb16191919 [1,1,0,0,0,0|1,0,1]=4 2313 B10R0.55 CCC(=O)CCCCC(=O)O Amb6305227 [1,1,0,0,0,0|0,0,1]=3 2314 B10R0.55 CCC(C)CCCCC(=O)O Amb24271145 [1,1,0,0,0,0|0,0,0]=2 2315 B10R0.55 CNC(=O)CCCCC(=O)O Amb9390746 [1,1,0,0,0,0|1,0,1]=4 2316 B10R0.55 COC(=O)CCCCC(=O)O Amb3939891 [1,1,0,0,0,0|1,0,1]=4 2317 B10R0.55 O=C(O)CCCCC(F)CBr Amb22547639 [1,1,0,0,0,0|1,0,0]=3 2318 B10R0.74 CCCCC#CCC(=O)OC Amb27673306 [1,1,0,0,0,0|0,0,2]=4 2319 B10R0.74 CCCCCC#CC(=O)OC Amb2721698 [1,1,0,0,0,0|0,0,2]=4 2320 B10R0.74 CCCCCCCC(=O)CC Amb6366429 [1,1,0,0,0,0|1,0,0]=3 2321 B10R0.74 CCCCCCCC(=O)NN Amb6564834 [1,1,0,0,0,0|1,0,0]=3 2322 B10R0.74 CCCCCCCC(=O)NO Amb7764666 [1,1,0,0,0,0|0,0,0]=2 2323 B10R0.74 CCCCCCCC(=O)OC Amb8516706 [1,1,0,0,0,0|0,0,0]=2 2324 B10R0.74 CCCCCCNC(=O)CBr Amb17331633 [1,1,0,0,0,0|2,0,0]=4 2325 B10R0.74 CCCCCCNC(=O)CCl Amb6753822 [1,1,0,0,0,0|2,0,0]=4 2326 B10R0.74 CCCCCCNC(=O)CN Amb9279196 [1,1,0,0,0,0|2,0,0]=4 2327 B10R0.74 CCCCCCOC(=O)C=O Amb17614962 [1,1,0,0,0,0|1,0,1]=4 2328 B10R0.74 CCCCCCOC(=O)CCl Amb9787731 [1,1,0,0,0,0|2,0,0]=4 2329 B10R0.74 CCCCCCOC(=O)CN Amb2688622 [1,1,0,0,0,0|2,0,0]=4 2330 B10R0.74 CCCCCCOC(=O)CS Amb2778632 [1,1,0,0,0,0|1,1,0]=4 2331 B10R0.74 CCCCC\C=C\C(=O)OC Amb24066773 [1,1,0,0,0,0|0,0,2]=4 2332 B10R0.74 CCOCCOCC(=O)OC Amb9206358 [1,1,0,0,0,0|2,0,0]=4 2333 B10R0.74 CCSSCCCC(=O)OC Amb33040837 [1,1,0,0,0,0|2,0,0]=4 2334 B10R0.74 COC(=O)CCCCCCBr Amb10604007 [1,1,0,0,0,0|1,0,0]=3 2335 B10R0.74 COC(=O)CCCCCCI Amb32410699 [1,1,0,0,0,0|1,0,0]=3 2336 B10R0.74 COC(=O)CCCCCCN Amb35747961 [1,1,0,0,0,0|1,0,0]=3 2337 B10R0.74 COC(=O)CCCCCCN Amb7762677 [1,1,0,0,0,0|1,0,0]=3 2338 B10R0.74 COC(=O)CCCCCCN Amb7969645 [1,1,0,0,0,0|1,0,0]=3 2339 B10R0.74 COC(=O)CCCCCCO Amb13887312 [1,1,0,0,0,0|1,0,0]=3 2340 B10R0.74 COC(=O)CCCOCCN Amb18109319 [1,1,0,0,0,0|2,0,0]=4 2341 B10R0.74 COC(=O)CCCSCCN Amb8961281 [1,1,0,0,0,0|2,0,0]=4 2342 B10R0.74 COC(=O)CCCSCCO Amb9362988 [1,1,0,0,0,0|2,0,0]=4 2343 B10R0.74 COC(=O)CCNCCCO Amb9243307 [1,1,0,0,0,0|2,0,0]=4 2344 B10R0.74 COC(=O)CCSCCCN Amb9482011 [1,1,0,0,0,0|2,0,0]=4 2345 B10R0.74 COCCCNCC(=O)OC Amb9204008 [1,1,0,0,0,0|2,0,0]=4 2346 B10R0.74 COCCNCCC(=O)OC Amb33545712 [1,1,0,0,0,0|2,0,0]=4 2347 B10R0.74 NNC(=O)CCCCCCCl Amb33713990 [1,1,0,0,0,0|2,0,0]=4 2348 B10R0.75 C=CCCCCC(N)C(=O)O Amb34184143 [1,1,0,0,0,0|0,0,2]=4 2349 B10R0.75 C=CCCCC[C@@H](N)C(=O)O Amb22747247 [1,1,0,0,0,0|0,0,2]=4 2350 B10R0.75 C=CCCCC[C@H](N)C(=O)O Amb22270014 [1,1,0,0,0,0|0,0,2]=4 2351 B10R0.75 CC#CCCCC(N)C(=O)O Amb27673466 [1,1,0,0,0,0|0,0,2]=4 2352 B10R0.75 CC(SCCCCN)C(=O)O Amb17500920 [1,1,0,0,0,0|2,0,0]=4 2353 B10R0.75 CCCCCCC(Br)C(=O)Br Amb24061160 [1,1,0,0,0,0|1,0,0]=3 2354 B10R0.75 CCCCCCC(C)C(=O)O Amb10843971 [1,1,0,0,0,0|0,0,0]=2 2355 B10R0.75 CCCCCCC(F)C(=O)O Amb32663880 [1,1,0,0,0,0|0,0,0]=2 2356 B10R0.75 CCCCCCC(N)C(=O)O Amb2613445 [1,1,0,0,0,0|0,0,0]=2 2357 B10R0.75 CCCCCCC(N)C(N)=O Amb18791950 [1,1,0,0,0,0|1,0,0]=3 2358 B10R0.75 CCCCCC[C@@H](N)C(=O)O Amb16183913 [1,1,0,0,0,0|0,0,0]=2 2359 B10R0.75 CCCCCC[C@H](N)C(=O)O Amb16183914 [1,1,0,0,0,0|0,0,0]=2 2360 B10R0.75 CCCOCCC(N)C(=O)O Amb18177730 [1,1,0,0,0,0|1,0,0]=3 2361 B10R0.75 CCCOCCC(N)C(N)=O Amb18787994 [1,1,0,0,0,0|2,0,0]=4 2362 B10R0.75 CCCOCC[C@@H](N)C(=O)O Amb33036139 [1,1,0,0,0,0|1,0,0]=3 2363 B10R0.75 CCCOCC[C@H](N)C(=O)O Amb33065384 [1,1,0,0,0,0|1,0,0]=3 2364 B10R0.75 CCC\C=C\CC(C)C(=O)O Amb33171981 [1,1,0,0,0,0|0,0,2]=4 2365 B10R0.75 CCC\C=C\CC(N)C(=O)O Amb33327187 [1,1,0,0,0,0|0,0,2]=4 2366 B10R0.75 CCOCCCC(N)C(=O)O Amb33036943 [1,1,0,0,0,0|1,0,0]=3 2367 B10R0.75 CCOCCCC(N)C(N)=O Amb33308891 [1,1,0,0,0,0|2,0,0]=4 2368 B10R0.75 CCOCCC[C@@H](N)C(=O)O Amb33065544 [1,1,0,0,0,0|1,0,0]=3 2369 B10R0.75 CCOCCC[C@H](N)C(=O)O Amb33065515 [1,1,0,0,0,0|1,0,0]=3 2370 B10R0.75 CCOCCOC(C)C(=O)O Amb6262432 [1,1,0,0,0,0|2,0,0]=4 2371 B10R0.75 CCSCCCC(C)C(=O)O Amb33449009 [1,1,0,0,0,0|1,0,0]=3 2372 B10R0.75 CCSCCCC(N)C(=O)O Amb32865930 [1,1,0,0,0,0|1,0,0]=3 2373 B10R0.75 CCSCCCC(N)C(N)=O Amb33065711 [1,1,0,0,0,0|2,0,0]=4 2374 B10R0.75 CCSCCC[C@@H](N)C(=O)O Amb33066174 [1,1,0,0,0,0|1,0,0]=3 2375 B10R0.75 CCSCCC[C@H](N)C(=O)O Amb32937037 [1,1,0,0,0,0|1,0,0]=3 2376 B10R0.75 CC\C=C\CCC(C)C(=O)O Amb33267859 [1,1,0,0,0,0|0,0,2]=4 2377 B10R0.75 CNCCCC[C@H](N)C(=O)O Amb33786042 [1,1,0,0,0,0|1,0,0]=3 2378 B10R0.75 COCCCCC(C)C(=O)O Amb32953450 [1,1,0,0,0,0|1,0,0]=3 2379 B10R0.75 COCCCCC(N)C(=O)O Amb33066324 [1,1,0,0,0,0|1,0,0]=3 2380 B10R0.75 COCCCCC(N)C(N)=O Amb33065768 [1,1,0,0,0,0|2,0,0]=4 2381 B10R0.75 COCCCC[C@@H](N)C(=O)O Amb33308996 [1,1,0,0,0,0|1,0,0]=3 2382 B10R0.75 COCCCC[C@H](N)C(=O)O Amb33036987 [1,1,0,0,0,0|1,0,0]=3 2383 B10R0.75 COCCOCC(N)C(=O)O Amb18177789 [1,1,0,0,0,0|2,0,0]=4 2384 B10R0.75 COCCOC[C@@H](N)C(=O)O Amb33308732 [1,1,0,0,0,0|2,0,0]=4 2385 B10R0.75 COCCOC[C@H](N)C(=O)O Amb32668352 [1,1,0,0,0,0|2,0,0]=4 2386 B10R0.75 COCCSCC(N)C(=O)O Amb6258105 [1,1,0,0,0,0|2,0,0]=4 2387 B10R0.75 CSCCCCC(C)C(=O)O Amb32953968 [1,1,0,0,0,0|1,0,0]=3 2388 B10R0.75 N#CCCCCC(N)C(=O)O Amb33042685 [1,1,0,0,0,0|1,0,1]=4 2389 B10R0.75 N#CCCCC[C@@H](N)C(=O)O Amb33308868 [1,1,0,0,0,0|1,0,1]=4 2390 B10R0.75 N#CCCCC[C@H](N)C(=O)O Amb32788598 [1,1,0,0,0,0|1,0,1]=4 2391 B10R0.75 NC(=O)C(N)CCCCCF Amb32789422 [1,1,0,0,0,0|2,0,0]=4 2392 B10R0.75 NC(=O)C(N)CCCCCO Amb33036732 [1,1,0,0,0,0|2,0,0]=4 2393 B10R0.75 NC(CCCCCF)C(=O)O Amb33036467 [1,1,0,0,0,0|1,0,0]=3 2394 B10R0.75 NC(CCCCCO)C(=O)O Amb33037096 [1,1,0,0,0,0|1,0,0]=3 2395 B10R0.75 NC(CCOCCO)C(=O)O Amb33065845 [1,1,0,0,0,0|2,0,0]=4 2396 B10R0.75 NC(CSCCCO)C(=O)O Amb8390352 [1,1,0,0,0,0|2,0,0]=4 2397 B10R0.75 NCCCSCC(N)C(=O)O Amb28652964 [1,1,0,0,0,0|2,0,0]=4 2398 B10R0.75 NCCCSCC(N)C(=O)O Amb32652572 [1,1,0,0,0,0|2,0,0]=4 2399 B10R0.75 NCCOCCC(N)C(=O)O Amb24081026 [1,1,0,0,0,0|2,0,0]=4 2400 B10R0.75 NCCOCCC(N)C(=O)O Amb32652927 [1,1,0,0,0,0|2,0,0]=4 2401 B10R0.75 NCCSCCC(N)C(=O)O Amb32652508 [1,1,0,0,0,0|2,0,0]=4 2402 B10R0.75 NCCSCCC(N)C(=O)O Amb32652509 [1,1,0,0,0,0|2,0,0]=4 2403 B10R0.75 N[C@@H](CCCCCF)C(=O)O Amb33065721 [1,1,0,0,0,0|1,0,0]=3 2404 B10R0.75 N[C@@H](CCCCCO)C(=O)O Amb33308918 [1,1,0,0,0,0|1,0,0]=3 2405 B10R0.75 N[C@@H](CCOCCO)C(=O)O Amb32864914 [1,1,0,0,0,0|2,0,0]=4 2406 B10R0.75 N[C@@H](CSCCCO)C(=O)O Amb8390824 [1,1,0,0,0,0|2,0,0]=4 2407 B10R0.75 N[C@H](CCCCCF)C(=O)O Amb33036618 [1,1,0,0,0,0|1,0,0]=3 2408 B10R0.75 N[C@H](CCCCCO)C(=O)O Amb33065614 [1,1,0,0,0,0|1,0,0]=3 2409 B10R0.75 N[C@H](CCOCCO)C(=O)O Amb33036125 [1,1,0,0,0,0|2,0,0]=4 2410 B10R0.78 CCCCC(=O)CCC(=O)O Amb6305230 [1,1,0,0,0,0|0,0,1]=3 2411 B10R0.78 CCCCC(=O)NCC(=O)O Amb2794084 [1,1,0,0,0,0|1,0,1]=4 2412 B10R0.78 CCCCC(C)C#CC(=O)O Amb27945976 [1,1,0,0,0,0|0,0,2]=4 2413 B10R0.78 CCCCC(C)CCC(=O)O Amb2689572 [1,1,0,0,0,0|0,0,0]=2 2414 B10R0.78 CCCCC(C)CCC(=O)[O-] Amb33513011 [1,1,0,0,0,0|0,0,1]=3 2415 B10R0.78 CCCCC(N)C#CC(=O)O Amb33168917 [1,1,0,0,0,0|0,0,2]=4 2416 B10R0.78 CCCCC(N)CCC(=O)O Amb33172614 [1,1,0,0,0,0|0,0,0]=2 2417 B10R0.78 CCCCC(O)CCC(=O)O Amb33539237 [1,1,0,0,0,0|0,0,0]=2 2418 B10R0.78 CCCCC(O)CCC(=O)[O-] Amb32674867 [1,1,0,0,0,0|0,0,1]=3 2419 B10R0.78 CCCCN(C)CCC(=O)O Amb5762149 [1,1,0,0,0,0|1,0,0]=3 2420 B10R0.78 CCCCN(C)CCC(N)=O Amb17142891 [1,1,0,0,0,0|2,0,0]=4 2421 B10R0.78 CCCNC(=O)CCC(=O)O Amb1783633 [1,1,0,0,0,0|1,0,1]=4 2422 B10R0.78 CCSCC(N)CCC(=O)O Amb33324077 [1,1,0,0,0,0|1,0,0]=3 2423 B10R0.78 CC\C=C\C(N)CCC(=O)O Amb33268710 [1,1,0,0,0,0|0,0,2]=4 2424 B10R0.78 COCCC(N)CCC(=O)O Amb33377834 [1,1,0,0,0,0|1,0,0]=3 2425 B10R0.78 COCCN(C)CCC(=O)O Amb8428142 [1,1,0,0,0,0|2,0,0]=4 2426 B10R0.78 COCCN(C)CCC(=O)O Amb9173358 [1,1,0,0,0,0|2,0,0]=4 2427 B10R0.78 CSCCC(N)CCC(=O)O Amb33199123 [1,1,0,0,0,0|1,0,0]=3 2428 B10R0.97 C=C(Br)CCCCCC(=O)O Amb6299586 [1,1,0,0,0,0|0,0,2]=4 2429 B10R0.97 C=C(C)CCCCCC(=O)O Amb6299589 [1,1,0,0,0,0|0,0,1]=3 2430 B10R0.97 C=C(Cl)CCCCCC(=O)O Amb6299582 [1,1,0,0,0,0|0,0,2]=4 2431 B10R0.97 C=C(F)CCCCCC(=O)O Amb22641493 [1,1,0,0,0,0|0,0,2]=4 2432 B10R0.97 CC(=O)CCCCCC(=O)O Amb3939939 [1,1,0,0,0,0|0,0,1]=3 2433 B10R0.97 CC(=O)NCCCCC(=O)O Amb22330473 [1,1,0,0,0,0|1,0,1]=4 2434 B10R0.97 CC(C)CCCCCC(=O)O Amb16232096 [1,1,0,0,0,0|0,0,0]=2 2435 B10R0.97 CC(C)CCCOCC(=O)O Amb7790013 [1,1,0,0,0,0|1,0,0]=3 2436 B10R0.97 CC(C)CCNCCC(=O)O Amb1110986 [1,1,0,0,0,0|1,0,0]=3 2437 B10R0.97 CC(C)CNCCCC(=O)O Amb6252909 [1,1,0,0,0,0|1,0,0]=3 2438 B10R0.97 CC(C)OCCCCC(=O)O Amb9207794 [1,1,0,0,0,0|1,0,0]=3 2439 B10R0.97 CC(O)CCCCCC(=O)O Amb24117232 [1,1,0,0,0,0|0,0,0]=2 2440 B10R0.97 CN(C)CCCCCC(=O)O Amb31307243 [1,1,0,0,0,0|1,0,0]=3 2441 B10R0.97 CN(C)CCCCCC(=O)O Amb32410704 [1,1,0,0,0,0|1,0,0]=3 2442 B10R0.97 CN(C)CCNCCC(=O)O Amb7755723 [1,1,0,0,0,0|2,0,0]=4 2443 B10R0.97 CN(C)CCOCCC(=O)O Amb33483275 [1,1,0,0,0,0|2,0,0]=4 2444 B10R0.97 CN(C)CCOCCC(=O)O Amb33607443 [1,1,0,0,0,0|2,0,0]=4 2445 B10R0.97 C[C@H](O)CC#CCCC(=O)O Amb27241370 [1,1,0,0,0,0|0,0,2]=4 2446 B10R0.97 O=C(O)CCCCCB(O)O Amb32661475 [1,1,0,0,0,0|2,0,0]=4 2447 B10R0.97 O=C(O)CCCCCC(=O)O Amb2720869 [1,1,0,0,0,0|1,0,1]=4 2448 B10R0.1 CCCCCCC(C)CCBr Amb28994667 [1,1,0,0,0,0|1,0,1]=4 2449 B10R0.1 CCCCCCC(O)CCN Amb32693327 [1,1,0,0,0,0|1,0,1]=4 2450 B10R0.1 CCCCCC[C@@H](O)CCO Amb8516913 [1,1,0,0,0,0|0,0,1]=3 2451 B10R0.71 BrCCCCCCCCCBr Amb8513101 [1,1,0,0,0,0|1,0,1]=4 2452 B10R0.71 C#CCCCCCCCCO Amb16231465 [1,1,0,0,0,0|0,0,2]=4 2453 B10R0.71 C=CCCCCCCCC=O Amb22734770 [1,1,0,0,0,0|0,0,1]=3 2454 B10R0.71 C=CCCCCCCCCBr Amb9786895 [1,1,0,0,0,0|1,0,0]=3 2455 B10R0.71 C=CCCCCCCCCN Amb28652858 [1,1,0,0,0,0|1,0,0]=3 2456 B10R0.71 C=CCCCCCCCCN Amb32653011 [1,1,0,0,0,0|1,0,0]=3 2457 B10R0.71 C=CCCCCCCCCO Amb6364973 [1,1,0,0,0,0|1,0,0]=3 2458 B10R0.71 CCCCC#CCCNC=O Amb27272587 [1,1,0,0,0,0|0,0,2]=4 2459 B10R0.71 CCCCCCCC#CCO Amb17774678 [1,1,0,0,0,0|0,0,2]=4 2460 B10R0.71 CCCCCCCCCC=O Amb3940437 [1,1,0,0,0,0|0,0,0]=2 2461 B10R0.71 CCCCCCCCCCBr Amb2721517 [1,1,0,0,0,0|1,0,1]=4 2462 B10R0.71 CCCCCCCCCCCl Amb8513081 [1,1,0,0,0,0|1,0,1]=4 2463 B10R0.71 CCCCCCCCCCF Amb2688085 [1,1,0,0,0,0|1,0,1]=4 2464 B10R0.71 CCCCCCCCCCI Amb3940280 [1,1,0,0,0,0|1,0,1]=4 2465 B10R0.71 CCCCCCCCCCN Amb3940460 [1,1,0,0,0,0|1,0,1]=4 2466 B10R0.71 CCCCCCCCCCO Amb3940390 [1,1,0,0,0,0|0,0,1]=3 2467 B10R0.71 CCCCCCCCCCS Amb9787174 [1,1,0,0,0,0|0,1,1]=4 2468 B10R0.71 CCCCCCCCCNC Amb10609826 [1,1,0,0,0,0|1,0,1]=4 2469 B10R0.71 CCCCCCCCCNC Amb7761761 [1,1,0,0,0,0|1,0,1]=4 2470 B10R0.71 CCCCCCCCN=C=O Amb3940552 [1,1,0,0,0,0|0,0,1]=3 2471 B10R0.71 CCCCCCCCN=C=S Amb6572519 [1,1,0,0,0,0|0,1,1]=4 2472 B10R0.71 CCCCCCCCNC=O Amb9787543 [1,1,0,0,0,0|0,0,0]=2 2473 B10R0.71 CCCCCCCCOCC Amb9787535 [1,1,0,0,0,0|1,0,1]=4 2474 B10R0.71 CCCCCCCCOCCl Amb22230404 [1,1,0,0,0,0|1,0,1]=4 2475 B10R0.71 CCCCCCCCSCC Amb17672979 [1,1,0,0,0,0|1,0,1]=4 2476 B10R0.71 CCCCCCCNCCC Amb4313521 [1,1,0,0,0,0|1,0,1]=4 2477 B10R0.71 CCCCCCCNCCO Amb7809068 [1,1,0,0,0,0|0,0,1]=3 2478 B10R0.71 CCCCCCCOCCO Amb8515986 [1,1,0,0,0,0|0,0,1]=3 2479 B10R0.71 CCCCCCCSCCN Amb7794934 [1,1,0,0,0,0|1,0,1]=4 2480 B10R0.71 CCCCCCCSCCO Amb7968786 [1,1,0,0,0,0|0,0,1]=3 2481 B10R0.71 CCCCCCC\C=C\C=O Amb8517160 [1,1,0,0,0,0|0,0,1]=3 2482 B10R0.71 CCCCCCNCCC#N Amb2688717 [1,1,0,0,0,0|1,0,1]=4 2483 B10R0.71 CCCCCCNCCCC Amb6730566 [1,1,0,0,0,0|1,0,1]=4 2484 B10R0.71 CCCCCCNCCCN Amb17315272 [1,1,0,0,0,0|1,0,1]=4 2485 B10R0.71 CCCCCCNCCCO Amb7758124 [1,1,0,0,0,0|0,0,1]=3 2486 B10R0.71 CCCCCCNCCOC Amb7760715 [1,1,0,0,0,0|1,0,1]=4 2487 B10R0.71 CCCCCCOCCC#N Amb7792025 [1,1,0,0,0,0|1,0,1]=4 2488 B10R0.71 CCCCCCOCCCN Amb7764734 [1,1,0,0,0,0|1,0,1]=4 2489 B10R0.71 CCCCCC\C=C\CCO Amb22641690 [1,1,0,0,0,0|0,0,2]=4 2490 B10R0.71 CCCCCNCCCCC Amb3941371 [1,1,0,0,0,0|1,0,1]=4 2491 B10R0.71 CCCCCNCCCOC Amb6730381 [1,1,0,0,0,0|1,0,1]=4 2492 B10R0.71 CCCCCSCCCCC Amb4020127 [1,1,0,0,0,0|1,0,1]=4 2493 B10R0.71 CCCCCSCCCCN Amb17500943 [1,1,0,0,0,0|1,0,1]=4 2494 B10R0.71 CCCCC\C=C\CCC=O Amb33512982 [1,1,0,0,0,0|0,0,1]=3 2495 B10R0.71 CCCCNCCNCCO Amb32454894 [1,1,0,0,0,0|1,0,1]=4 2496 B10R0.71 CCCCNCCOCCO Amb6736236 [1,1,0,0,0,0|1,0,1]=4 2497 B10R0.71 CCCCOCCOCCO Amb8513428 [1,1,0,0,0,0|1,0,1]=4 2498 B10R0.71 CCCCOCCSCCO Amb9787502 [1,1,0,0,0,0|1,0,1]=4 2499 B10R0.71 CCCCSCCOCCO Amb9786123 [1,1,0,0,0,0|1,0,1]=4 2500 B10R0.71 CCCNCCCCCOC Amb18797681 [1,1,0,0,0,0|1,0,1]=4 2501 B10R0.71 CCNCCCNCCCO Amb20171980 [1,1,0,0,0,0|1,0,1]=4 2502 B10R0.71 COCCOCCOCC=O Amb32668382 [1,1,0,0,0,0|2,0,0]=4 2503 B10R0.71 ClCCCCCCCCCCl Amb8513111 [1,1,0,0,0,0|1,0,1]=4 2504 B10R0.71 ICCCCCCCCCI Amb20242392 [1,1,0,0,0,0|1,0,1]=4 2505 B10R0.71 N#CCCCCCCCCO Amb22641582 [1,1,0,0,0,0|0,0,2]=4 2506 B10R0.71 NCCCCCCCCCN Amb8513818 [1,1,0,0,0,0|1,0,1]=4 2507 B10R0.71 NCCCCCCCCCO Amb34183942 [1,1,0,0,0,0|0,0,1]=3 2508 B10R0.71 OCCCCCCCCCBr Amb2694968 [1,1,0,0,0,0|0,0,1]=3 2509 B10R0.71 OCCCCCCCCCI Amb32410519 [1,1,0,0,0,0|0,0,1]=3 2510 B10R0.71 OCCCCCCCCCO Amb2721246 [1,1,0,0,0,0|0,0,1]=3 2511 B10R0.71 OCCCCNCCCCO Amb21858890 [1,1,0,0,0,0|1,0,1]=4 2512 B10R0.71 OCCCCOCCCCCl Amb32663942 [1,1,0,0,0,0|1,0,1]=4 2513 B10R0.71 OCCOCCCCCCCl Amb33719365 [1,1,0,0,0,0|1,0,1]=4 2514 B10R0.71 SCCCCCCCCCS Amb8513270 [1,1,0,0,0,0|0,1,1]=4 2515 B12R0.2 CCSCC(N)CC(C)CC(=O)O Amb32669810 [0,2,0,0,0,0|1,0,0]=3 2516 B12R0.4 CCCCCCCC(=O)CC(C)=O Amb19068864 [0,2,0,0,0,0|1,0,0]=3 2517 B12R0.4 CCCCCCCC(C)OC(C)=O Amb22734609 [0,2,0,0,0,0|1,0,0]=3 2518 B12R0.4 CCCCCCCC(N)CC(=O)O Amb32666363 [0,2,0,0,0,0|0,0,0]=2 2519 B12R0.4 CCCCCCCC(N)CC(=O)O Amb33141063 [0,2,0,0,0,0|0,0,0]=2 2520 B12R0.4 CCCCCCCC(N)CC(=O)O Amb33533164 [0,2,0,0,0,0|0,0,0]=2 2521 B12R0.4 CCCCCCCC(N)CC(N)=O Amb33253906 [0,2,0,0,0,0|1,0,0]=3 2522 B12R0.4 CCCCCCCC(O)CC(=O)O Amb19071697 [0,2,0,0,0,0|0,0,0]=2 2523 B12R0.4 CCCCCCC[C@@H](N)CC(=O)O Amb33172824 [0,2,0,0,0,0|0,0,0]=2 2524 B12R0.4 CCCCCCC[C@@H](N)CC(=O)O Amb33172825 [0,2,0,0,0,0|0,0,0]=2 2525 B12R0.4 CCCCCCC[C@H](O)CC(=O)O Amb33620732 [0,2,0,0,0,0|0,0,0]=2 2526 B12R0.4 CCCCCCOC(C)NC(C)=O Amb24096324 [0,2,0,0,0,0|2,0,0]=4 2527 B12R0.46 CCCCCCC(O)C(N)C(=O)O Amb1089477 [0,2,0,0,0,0|0,0,0]=2 2528 B12R0.113 CCCCCCC(C)NC(=O)CCl Amb1156522 [0,2,0,0,0,0|2,0,0]=4 2529 B12R0.113 CCCCCCC(C)OC(=O)CCl Amb21858582 [0,2,0,0,0,0|2,0,0]=4 2530 B12R0.113 CCCCCCC(N)CC(=O)OC Amb33254138 [0,2,0,0,0,0|0,0,0]=2 2531 B12R0.113 CCCCCCC(O)CC(=O)OC Amb21928832 [0,2,0,0,0,0|0,0,0]=2 2532 B12R0.113 CCCCCC[C@@H](O)CC(=O)OC Amb31308360 [0,2,0,0,0,0|0,0,0]=2 2533 B12R0.113 CCCCCC\C(C)=C\C(=O)OC Amb33472151 [0,2,0,0,0,0|0,0,2]=4 2534 B12R0.113 CCCCCNC(C)CC(=O)OC Amb9398427 [0,2,0,0,0,0|1,0,0]=3 2535 B12R0.113 CCOCCNC(C)CC(=O)OC Amb9454342 [0,2,0,0,0,0|2,0,0]=4 2536 B12R0.113 COCCCNC(C)CC(=O)OC Amb9398738 [0,2,0,0,0,0|2,0,0]=4 2537 B12R0.113 COCCOCC(N)CC(=O)OC Amb32787373 [0,2,0,0,0,0|2,0,0]=4 2538 B12R0.202 CCCCCCC(CC)OC(C)=O Amb30867684 [0,2,0,0,0,0|2,0,0]=4 2539 B12R0.270 CC(C)CC(=O)NCCCC(=O)O Amb1111465 [0,2,0,0,0,0|1,0,1]=4 2540 B12R0.272 CCCC(C)CCC(C)CC(=O)O Amb32412877 [0,2,0,0,0,0|0,0,0]=2 2541 B12R0.598 CCCCCCC(C)(N)CC(N)=O Amb33255799 [0,2,0,0,0,0|1,0,0]=3 2542 B12R0.598 CCCCNCC(F)(F)CC(=O)O Amb33347088 [0,2,0,0,0,0|1,0,0]=3 2543 B12R0.598 COCCNCC(F)(F)CC(=O)O Amb33347086 [0,2,0,0,0,0|2,0,0]=4 2544 B12R0.42 CC(=O)NCCCC[C@@H](N)C(=O)O Amb24323525 [0,2,0,0,0,0|1,0,1]=4 2545 B12R0.42 CC(=O)NCCCC[C@@H](N)C(=O)O Amb3499375 [0,2,0,0,0,0|1,0,1]=4 2546 B12R0.42 CC(=O)NCCCC[C@H](N)C(=O)O Amb6364971 [0,2,0,0,0,0|1,0,1]=4 2547 B12R0.42 CC(C)CCCCCC(N)C(=O)O Amb33309190 [0,2,0,0,0,0|0,0,0]=2 2548 B12R0.42 CC(C)CCCCCC(N)C(N)=O Amb33036965 [0,2,0,0,0,0|1,0,0]=3 2549 B12R0.42 CC(C)CCCCC[C@@H](N)C(=O)O Amb33127588 [0,2,0,0,0,0|0,0,0]=2 2550 B12R0.42 CC(C)CCCCC[C@H](N)C(=O)O Amb33069964 [0,2,0,0,0,0|0,0,0]=2 2551 B12R0.42 CC(C)CCOCCC(N)C(=O)O Amb19060473 [0,2,0,0,0,0|1,0,0]=3 2552 B12R0.42 CC(C)CCOCCC(N)C(N)=O Amb19047190 [0,2,0,0,0,0|2,0,0]=4 2553 B12R0.42 CC(C)CCOCC[C@@H](N)C(=O)O Amb33066283 [0,2,0,0,0,0|1,0,0]=3 2554 B12R0.42 CC(C)CCOCC[C@H](N)C(=O)O Amb33065735 [0,2,0,0,0,0|1,0,0]=3 2555 B12R0.42 CC(C)N(C)CCCCCC(=O)O Amb33473987 [0,2,0,0,0,0|1,0,0]=3 2556 B12R0.42 CC(N)C(=O)NCCCCC(=O)O Amb35789672 [0,2,0,0,0,0|1,0,1]=4 2557 B12R0.42 CC(N)C(=O)NCCCCC(=O)O Amb35789787 [0,2,0,0,0,0|1,0,1]=4 2558 B12R0.42 CC(N)C(N)CCCCCC(=O)O Amb24118082 [0,2,0,0,0,0|0,0,0]=2 2559 B12R0.42 CC(N)C(N)CCCCCC(=O)O Amb32667508 [0,2,0,0,0,0|0,0,0]=2 2560 B12R0.42 CC(N)CCCSCC(=O)C(=O)O Amb33069816 [0,2,0,0,0,0|1,0,1]=4 2561 B12R0.42 CC(O)CCCSCC(=O)C(=O)O Amb33069721 [0,2,0,0,0,0|1,0,1]=4 2562 B12R0.42 C[C@@H](N)C(=O)CCCCCC(=O)O Amb24118049 [0,2,0,0,0,0|0,0,1]=3 2563 B12R0.42 NC(CCCCCC(=O)O)C(=O)O Amb10807509 [0,2,0,0,0,0|1,0,1]=4 2564 B12R0.42 N[C@@H](CCCCCC(=O)O)C(=O)O Amb17678794 [0,2,0,0,0,0|1,0,1]=4 2565 B12R0.42 N[C@H](CCCCCC(=O)O)C(=O)O Amb33757551 [0,2,0,0,0,0|1,0,1]=4 2566 B12R0.137 CC(C)(C)NCCCCCC(=O)O Amb33164111 [0,2,0,0,0,0|1,0,0]=3 2567 B12R0.137 CC(C)(C)NCCCCCC(=O)O Amb33545668 [0,2,0,0,0,0|1,0,0]=3 2568 B12R0.137 CC(C)(C)OCCNCCC(=O)O Amb28556099 [0,2,0,0,0,0|2,0,0]=4 2569 B12R0.137 CC(C)(C)OCCOCCC(=O)O Amb32648090 [0,2,0,0,0,0|2,0,0]=4 2570 B12R0.137 CS(=O)(=O)NCCCCCC(=O)O Amb1105833 [0,2,0,0,0,0|2,0,0]=4 2571 B12R0.137 NS(=O)(=O)CCCCCCC(=O)O Amb26304268 [0,2,0,0,0,0|2,0,0]=4 2572 B12R0.184 CC(C)CCCCCOC(=O)CS Amb22168040 [0,2,0,0,0,0|1,1,0]=4 2573 B12R0.184 CCC(=O)NCCCCCC(=O)O Amb1137874 [0,2,0,0,0,0|0,0,1]=3 2574 B12R0.184 COC(=O)CCCCCCC(=O)O Amb3940370 [0,2,0,0,0,0|0,0,1]=3 2575 B12R0.184 COC(=O)CCCCCCC(C)C Amb21928858 [0,2,0,0,0,0|0,0,0]=2 2576 B12R0.184 COC(=O)CCNCCCN(C)C Amb6364763 [0,2,0,0,0,0|2,0,0]=4 2577 B12R0.184 COC(=O)CC[NH2+]CCC[NH+](C)C Amb33513220 [0,2,0,0,0,0|2,0,0]=4 2578 B12R0.184 O=C(O)CCCCCNC(=O)CCl Amb2282836 [0,2,0,0,0,0|1,0,1]=4 2579 B12R0.1 C=CCCCCCCC(=O)OCC Amb6298913 [0,2,0,0,0,0|0,0,2]=4 2580 B12R0.1 CCCCCCCCC(=O)OCC Amb8515442 [0,2,0,0,0,0|0,0,0]=2 2581 B12R0.1 CCCCCCCCC(=O)OCCl Amb32414071 [0,2,0,0,0,0|0,0,0]=2 2582 B12R0.1 CCCCCCCCC(O)CCC Amb9787107 [0,2,0,0,0,0|1,0,1]=4 2583 B12R0.1 CCCCCCCNC(=O)CC#N Amb1225538 [0,2,0,0,0,0|2,0,0]=4 2584 B12R0.1 CCCCCCCNC(=O)CCCl Amb3365413 [0,2,0,0,0,0|2,0,0]=4 2585 B12R0.1 CCCCCCCNC(=O)CNC Amb20141923 [0,2,0,0,0,0|2,0,0]=4 2586 B12R0.1 CCCCCNCCC(=O)OCC Amb9024160 [0,2,0,0,0,0|1,0,0]=3 2587 B12R0.1 CCCNCCCOC(=O)COC Amb18928632 [0,2,0,0,0,0|2,0,0]=4 2588 B12R0.1 CCOC(=O)CCCCCCCBr Amb10604167 [0,2,0,0,0,0|1,0,0]=3 2589 B12R0.1 CCOC(=O)CCCCCCCCl Amb22002672 [0,2,0,0,0,0|1,0,0]=3 2590 B12R0.1 CCOC(=O)CCCCCCCI Amb32410617 [0,2,0,0,0,0|1,0,0]=3 2591 B12R0.1 CCOC(=O)CCCCCCCN Amb19375589 [0,2,0,0,0,0|1,0,0]=3 2592 B12R0.1 CCOC(=O)CCCCCCCN Amb33309141 [0,2,0,0,0,0|1,0,0]=3 2593 B12R0.1 CCOC(=O)CCCCCCCO Amb32662870 [0,2,0,0,0,0|1,0,0]=3 2594 B12R0.1 CCOC(=O)CCNCCCOC Amb9024208 [0,2,0,0,0,0|2,0,0]=4 2595 B12R0.1 CCOCCNCCC(=O)OCC Amb9454393 [0,2,0,0,0,0|2,0,0]=4 2596 B12R0.49 C#CCCCCCC(N)C(=O)OC Amb33309029 [0,2,0,0,0,0|0,0,2]=4 2597 B12R0.49 C=CCCCCCC(N)C(=O)OC Amb33036821 [0,2,0,0,0,0|0,0,2]=4 2598 B12R0.49 CCCCCCCC(N)C(=O)OC Amb19059295 [0,2,0,0,0,0|0,0,0]=2 2599 B12R0.49 CCCCCNCC(C)C(=O)OC Amb9253076 [0,2,0,0,0,0|1,0,0]=3 2600 B12R0.49 CCCCNCCC(N)C(=O)OC Amb32993438 [0,2,0,0,0,0|1,0,0]=3 2601 B12R0.49 CCCCOCCC(N)C(=O)OC Amb19040683 [0,2,0,0,0,0|1,0,0]=3 2602 B12R0.49 CCOCCNCC(C)C(=O)OC Amb9454340 [0,2,0,0,0,0|2,0,0]=4 2603 B12R0.49 COC(=O)C(N)CCCCCC#N Amb33065743 [0,2,0,0,0,0|1,0,1]=4 2604 B12R0.49 COC(=O)C(N)CCCCCCO Amb33066043 [0,2,0,0,0,0|1,0,0]=3 2605 B12R0.49 COCCCNCC(C)C(=O)OC Amb9253107 [0,2,0,0,0,0|2,0,0]=4 2606 B12R0.49 COCCNCCC(N)C(=O)OC Amb32993433 [0,2,0,0,0,0|2,0,0]=4 2607 B12R0.49 COCCOCCC(N)C(=O)OC Amb18317632 [0,2,0,0,0,0|2,0,0]=4 2608 B12R0.57 CCCCCCCCC(CC)CO Amb28984598 [0,2,0,0,0,0|1,0,1]=4 2609 B12R0.142 CCC\C=C\C(N)CCC(=O)OC Amb33424812 [0,2,0,0,0,0|0,0,2]=4 2610 B12R0.183 COC(=O)CCCCCC(=O)OC Amb8513790 [0,2,0,0,0,0|1,0,1]=4 2611 B12R0.183 COC(=O)CNCCCC(C)OC Amb33133295 [0,2,0,0,0,0|2,0,0]=4 2612 B12R0.248 C=CC(=O)NCCCCCCCC Amb28556071 [0,2,0,0,0,0|1,0,0]=3 2613 B12R0.248 C=CC(=O)OCCCCCCCC Amb2778626 [0,2,0,0,0,0|1,0,0]=3 2614 B12R0.248 C=CCCCCCCCC(=O)OC Amb533244 [0,2,0,0,0,0|0,0,1]=3 2615 B12R0.248 CCCCCCCCCC(=O)NN Amb6530432 [0,2,0,0,0,0|1,0,0]=3 2616 B12R0.248 CCCCCCCCCC(=O)NO Amb33548521 [0,2,0,0,0,0|0,0,0]=2 2617 B12R0.248 CCCCCCCCCC(=O)OC Amb4378003 [0,2,0,0,0,0|0,0,0]=2 2618 B12R0.248 CCCCCCCCCC(C)C=O Amb3940427 [0,2,0,0,0,0|1,0,1]=4 2619 B12R0.248 CCCCCCCCNC(=O)CBr Amb17329848 [0,2,0,0,0,0|1,0,0]=3 2620 B12R0.248 CCCCCCCCNC(=O)CCl Amb9786173 [0,2,0,0,0,0|1,0,0]=3 2621 B12R0.248 CCCCCCCCNC(=O)CN Amb24115163 [0,2,0,0,0,0|1,0,0]=3 2622 B12R0.248 CCCCCCCCNC(=S)NN Amb2689974 [0,2,0,0,0,0|1,1,0]=4 2623 B12R0.248 CCCCCCCCOC(=O)CN Amb2688623 [0,2,0,0,0,0|1,0,0]=3 2624 B12R0.248 CCCCCCCCOC(=O)C[NH3+] Amb22049491 [0,2,0,0,0,0|1,0,0]=3 2625 B12R0.248 CCCCC\C=C/CCC(=O)OC Amb24093816 [0,2,0,0,0,0|0,0,1]=3 2626 B12R0.248 CCCCOCCCNC(=O)CBr Amb17329849 [0,2,0,0,0,0|2,0,0]=4 2627 B12R0.248 CCCCOCCCNC(=O)CN Amb24115103 [0,2,0,0,0,0|2,0,0]=4 2628 B12R0.248 CCNCCOCCCC(=O)OC Amb18107249 [0,2,0,0,0,0|1,0,0]=3 2629 B12R0.248 COC(=O)CCCCCCCC=O Amb8391799 [0,2,0,0,0,0|0,0,1]=3 2630 B12R0.248 COC(=O)CCCCCCCCBr Amb34913614 [0,2,0,0,0,0|0,0,0]=2 2631 B12R0.248 COC(=O)CCCCCCCCO Amb17616943 [0,2,0,0,0,0|0,0,0]=2 2632 B12R0.248 COC(=O)CCCCCCN=[N+]=[N-] Amb33711870 [0,2,0,0,0,0|2,0,0]=4 2633 B12R0.248 COC(=O)CCCSCCCCN Amb17500973 [0,2,0,0,0,0|1,0,0]=3 2634 B12R0.248 COCCCCCNCC(=O)OC Amb33133279 [0,2,0,0,0,0|1,0,0]=3 2635 B12R0.251 C=CCCCCCC[C@@H](N)C(=O)O Amb33802212 [0,2,0,0,0,0|0,0,1]=3 2636 B12R0.251 C=CCCCCCC[C@H](N)C(=O)O Amb33802213 [0,2,0,0,0,0|0,0,1]=3 2637 B12R0.251 CCCCCCCCC(=O)C(F)F Amb35744492 [0,2,0,0,0,0|1,0,0]=3 2638 B12R0.251 CCCCCCCCC(Br)C(=O)O Amb22347926 [0,2,0,0,0,0|0,0,0]=2 2639 B12R0.251 CCCCCCCCC(C)C(=O)O Amb19058533 [0,2,0,0,0,0|0,0,0]=2 2640 B12R0.251 CCCCCCCCC(F)=C(F)F Amb10840896 [0,2,0,0,0,0|2,0,0]=4 2641 B12R0.251 CCCCCCCCC(N)C(=O)O Amb4134809 [0,2,0,0,0,0|0,0,0]=2 2642 B12R0.251 CCCCCCCCC(N)C(N)=O Amb32937043 [0,2,0,0,0,0|1,0,0]=3 2643 B12R0.251 CCCCCCCCC(O)C(=O)O Amb6295799 [0,2,0,0,0,0|0,0,0]=2 2644 B12R0.251 CCCCCCCCN(C)C(C)=O Amb24096791 [0,2,0,0,0,0|1,0,0]=3 2645 B12R0.251 CCCCCCCC[C@@H](N)C(=O)O Amb22745440 [0,2,0,0,0,0|0,0,0]=2 2646 B12R0.251 CCCCCCCC[C@H](N)C(=O)O Amb28974737 [0,2,0,0,0,0|0,0,0]=2 2647 B12R0.251 CCCCCCCNC(=O)C(C)Cl Amb17326983 [0,2,0,0,0,0|2,0,0]=4 2648 B12R0.251 CCCCCCCSC(C)C(=O)O Amb7794235 [0,2,0,0,0,0|0,0,0]=2 2649 B12R0.251 CCCCOCCNC(=O)C(=O)O Amb19077636 [0,2,0,0,0,0|1,0,1]=4 2650 B12R0.251 CCCNCCSCC(=O)C(=O)O Amb33069824 [0,2,0,0,0,0|1,0,1]=4 2651 B12R0.251 CCNCCCSCC(=O)C(=O)O Amb33069819 [0,2,0,0,0,0|1,0,1]=4 2652 B12R0.251 CCOCCOCCC(N)C(=O)O Amb19041139 [0,2,0,0,0,0|1,0,0]=3 2653 B12R0.251 CCOCCOCCC(N)C(N)=O Amb19040935 [0,2,0,0,0,0|2,0,0]=4 2654 B12R0.251 CCOCCOCC[C@@H](N)C(=O)O Amb33308864 [0,2,0,0,0,0|1,0,0]=3 2655 B12R0.251 CCOCCOCC[C@H](N)C(=O)O Amb33066024 [0,2,0,0,0,0|1,0,0]=3 2656 B12R0.251 CNCCCCSCC(=O)C(=O)O Amb33069872 [0,2,0,0,0,0|1,0,1]=4 2657 B12R0.251 COCCCOCCC(N)C(=O)O Amb19041138 [0,2,0,0,0,0|1,0,0]=3 2658 B12R0.251 COCCCOCCC(N)C(N)=O Amb19040934 [0,2,0,0,0,0|2,0,0]=4 2659 B12R0.251 COCCCOCC[C@@H](N)C(=O)O Amb33036667 [0,2,0,0,0,0|1,0,0]=3 2660 B12R0.251 COCCCOCC[C@H](N)C(=O)O Amb33308728 [0,2,0,0,0,0|1,0,0]=3 2661 B12R0.251 COCCOCCCC(N)C(=O)O Amb33036966 [0,2,0,0,0,0|1,0,0]=3 2662 B12R0.251 COCCOCCCC(N)C(N)=O Amb33065407 [0,2,0,0,0,0|2,0,0]=4 2663 B12R0.251 COCCOCCC[C@@H](N)C(=O)O Amb33308666 [0,2,0,0,0,0|1,0,0]=3 2664 B12R0.251 COCCOCCC[C@H](N)C(=O)O Amb33034716 [0,2,0,0,0,0|1,0,0]=3 2665 B12R0.251 NCCCCCSCC(=O)C(=O)O Amb33069796 [0,2,0,0,0,0|1,0,1]=4 2666 B12R0.251 NCCCCNCC[C@@H](N)C(=O)O Amb31031097 [0,2,0,0,0,0|1,0,0]=3 2667 B12R0.251 NCCCNCCC[C@@H](N)C(=O)O Amb31031096 [0,2,0,0,0,0|1,0,0]=3 2668 B12R0.251 O=C(O)C(=O)CSCCCCCBr Amb33069745 [0,2,0,0,0,0|1,0,1]=4 2669 B12R0.251 O=C(O)C(=O)CSCCCCCCl Amb33069763 [0,2,0,0,0,0|1,0,1]=4 2670 B12R0.251 O=C(O)C(=O)CSCCCCCO Amb33069713 [0,2,0,0,0,0|1,0,1]=4 2671 B12R0.251 O=C(O)C(=O)CSCCCCCS Amb33069990 [0,2,0,0,0,0|1,0,1]=4 2672 B12R0.312 C=CS(=O)(=O)CCCCCCCC Amb7968840 [0,2,0,0,0,0|1,0,1]=4 2673 B12R0.312 CCCCCCCCS(=O)(=O)NC Amb32691981 [0,2,0,0,0,0|1,0,1]=4 2674 B12R0.58 CCCCCCCC(C)(C)C(=O)O Amb2687559 [0,2,0,0,0,0|0,0,0]=2 2675 B12R0.58 CCCCCNCC(F)(F)C(=O)O Amb33170716 [0,2,0,0,0,0|1,0,0]=3 2676 B12R0.58 CCCCCNCC(F)(F)C(N)=O Amb33188919 [0,2,0,0,0,0|2,0,0]=4 2677 B12R0.58 CCCCCOCC(F)(F)C(=O)O Amb33169251 [0,2,0,0,0,0|1,0,0]=3 2678 B12R0.58 CCCCCSCC(F)(F)C(=O)O Amb33171162 [0,2,0,0,0,0|1,0,0]=3 2679 B12R0.58 CCOCCNCC(F)(F)C(=O)O Amb33170740 [0,2,0,0,0,0|2,0,0]=4 2680 B12R0.58 CCOCCOCC(F)(F)C(=O)O Amb33169255 [0,2,0,0,0,0|2,0,0]=4 2681 B12R0.58 CCSCCNCC(F)(F)C(=O)O Amb33170876 [0,2,0,0,0,0|2,0,0]=4 2682 B12R0.58 CCSCCOCC(F)(F)C(=O)O Amb33169259 [0,2,0,0,0,0|2,0,0]=4 2683 B12R0.58 COCCCNCC(F)(F)C(=O)O Amb33170859 [0,2,0,0,0,0|2,0,0]=4 2684 B12R0.58 COCCCOCC(F)(F)C(=O)O Amb33169256 [0,2,0,0,0,0|2,0,0]=4 2685 B12R0.58 COCCCSCC(F)(F)C(=O)O Amb33171175 [0,2,0,0,0,0|2,0,0]=4 2686 B12R0.58 CSCCCNCC(F)(F)C(=O)O Amb33170872 [0,2,0,0,0,0|2,0,0]=4 2687 B12R0.58 CSCCCOCC(F)(F)C(=O)O Amb33169285 [0,2,0,0,0,0|2,0,0]=4 2688 B12R0.58 CSCCCSCC(F)(F)C(=O)O Amb33169293 [0,2,0,0,0,0|2,0,0]=4 2689 B12R0.58 NCCCCSCC(F)(F)C(=O)O Amb33169290 [0,2,0,0,0,0|2,0,0]=4 2690 B12R0.58 O=C(O)C(F)(F)CNCCCCF Amb33170865 [0,2,0,0,0,0|2,0,0]=4 2691 B12R0.58 O=C(O)C(F)(F)CNCCCCO Amb33170744 [0,2,0,0,0,0|2,0,0]=4 2692 B12R0.237 CCCCCCCC(C)S(=O)(=O)Cl Amb32692837 [0,2,0,0,0,0|1,0,1]=4 2693 B12R0.237 CCCCCCCC(C)S(=O)(=O)F Amb33352428 [0,2,0,0,0,0|1,0,1]=4 2694 B12R0.237 CCCCCCCC(C)S(N)(=O)=O Amb32691756 [0,2,0,0,0,0|1,0,1]=4 2695 B12R0.279 CCCC(N)CSCC(=O)C(=O)O Amb33069831 [0,2,0,0,0,0|1,0,1]=4 2696 B12R0.255 CCCCCCC(=O)NCC(=O)O Amb9013683 [0,2,0,0,0,0|0,0,1]=3 2697 B12R0.255 CCCCCCC(C)NCC(C)O Amb9359357 [0,2,0,0,0,0|1,0,1]=4 2698 B12R0.255 CCCCCCC(O)CCC(=O)O Amb19071689 [0,2,0,0,0,0|0,0,0]=2 2699 B12R0.255 CCCCCCC(O)CCC(=O)[O-] Amb19149307 [0,2,0,0,0,0|0,0,1]=3 2700 B12R0.255 CCCCCCC(O)CCC(=O)[O-] Amb31145472 [0,2,0,0,0,0|0,0,1]=3 2701 B12R0.255 CCCCCNC(=O)CCC(=O)Cl Amb17143340 [0,2,0,0,0,0|1,0,1]=4 2702 B12R0.255 CCCCCNC(=O)CCC(N)=O Amb17143033 [0,2,0,0,0,0|1,0,1]=4 2703 B12R0.255 COCCCCN(C)CCC(=O)O Amb33339167 [0,2,0,0,0,0|1,0,0]=3 2704 B12R0.255 COCCCNC(=O)CCC(=O)O Amb2102010 [0,2,0,0,0,0|1,0,1]=4 2705 B12R0.210 CCS(=O)(=O)CCCCCC(=O)O Amb32411167 [0,2,0,0,0,0|1,0,0]=3 2706 B12R0.240 C=C(C)CCCC(C)CC(O)CC Amb24093803 [0,2,0,0,0,0|2,0,0]=4 2707 B12R0.277 CCCC(=O)CCCCCC(=O)O Amb6305242 [0,2,0,0,0,0|0,0,0]=2 2708 B12R0.277 CCOC(=O)CCCCCC(=O)O Amb2692048 [0,2,0,0,0,0|0,0,1]=3 2709 B12R0.233 C=CCCCC(O)CCCC(=O)[O-] Amb32751163 [0,2,0,0,0,0|0,0,2]=4 2710 B12R0.233 CCCCCC(=O)CCCC(=O)O Amb6305235 [0,2,0,0,0,0|0,0,0]=2 2711 B12R0.233 CCCCCC(C)NCCC(C)O Amb33455994 [0,2,0,0,0,0|1,0,1]=4 2712 B12R0.233 CCCCNC(=O)COCC(=O)O Amb1888825 [0,2,0,0,0,0|1,0,1]=4 2713 B12R0.254 CCCCC(CC)CCNC(C)=O Amb24072187 [0,2,0,0,0,0|2,0,0]=4 2714 B12R0.254 CCCCN(CC)CCCC(N)=O Amb17143042 [0,2,0,0,0,0|2,0,0]=4 2715 B12R0.331 CCCCS(=O)(=O)CCCC(=O)O Amb9479725 [0,2,0,0,0,0|1,0,0]=3 2716 B12R0.331 CCCCS(=O)(=O)NCCC(=O)O Amb1117386 [0,2,0,0,0,0|2,0,0]=4 2717 B12R0.331 NCCCS(=O)(=O)CCCC(=O)O Amb17500859 [0,2,0,0,0,0|2,0,0]=4 2718 B12R0.95 CCCCC(=O)CCCCC(=O)O Amb6305232 [0,2,0,0,0,0|0,0,0]=2 2719 B12R0.95 CCCCC(=O)NCCCC(=O)O Amb5741970 [0,2,0,0,0,0|0,0,1]=3 2720 B12R0.119 CCCCCCCCCS(=O)(=O)Cl Amb22387375 [0,2,0,0,0,0|1,0,1]=4 2721 B12R0.119 CCCCCCCCCS(=O)(=O)F Amb32755112 [0,2,0,0,0,0|1,0,1]=4 2722 B12R0.119 CCCCCCCCCS(=O)(=O)[O-] Amb8515940 [0,2,0,0,0,0|1,0,1]=4 2723 B12R0.119 CCCCCCCCCS(N)(=O)=O Amb32715391 [0,2,0,0,0,0|1,0,1]=4 2724 B12R0.119 CCCCCCCCOS(=O)(=O)[O-] Amb8516739 [0,2,0,0,0,0|1,0,1]=4 2725 B12R0.119 CCCCCCOCCS(=O)(=O)Cl Amb32940011 [0,2,0,0,0,0|1,0,1]=4 2726 B12R0.119 CCCCCOCCCS(=O)(=O)Cl Amb32939811 [0,2,0,0,0,0|1,0,1]=4 2727 B12R0.119 CCCCOCCCCS(=O)(=O)Cl Amb32940392 [0,2,0,0,0,0|1,0,1]=4 2728 B12R0.119 CCCOCCCCCS(=O)(=O)Cl Amb32939825 [0,2,0,0,0,0|1,0,1]=4 2729 B12R0.119 CCOCCCCCCS(=O)(=O)Cl Amb32939864 [0,2,0,0,0,0|1,0,1]=4 2730 B12R0.234 C#CCCCCCCCCC(=O)O Amb536933 [0,2,0,0,0,0|0,0,0]=2 2731 B12R0.234 C=C(Br)CCCCCCCCCC Amb6298937 [0,2,0,0,0,0|2,0,0]=4 2732 B12R0.234 C=C(Cl)CCCCCCCCCC Amb6298931 [0,2,0,0,0,0|2,0,0]=4 2733 B12R0.234 C=CCCCCCCCCC(=O)Cl Amb2721637 [0,2,0,0,0,0|1,0,0]=3 2734 B12R0.234 C=CCCCCCCCCC(=O)O Amb533736 [0,2,0,0,0,0|0,0,0]=2 2735 B12R0.234 CC#CCCCCCCCC(=O)O Amb6565389 [0,2,0,0,0,0|0,0,0]=2 2736 B12R0.234 CC(=O)NCCCNCCCCN Amb22641893 [0,2,0,0,0,0|2,0,0]=4 2737 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [0,2,0,0,0,0|1,0,0]=3 2738 B12R0.234 CCCCCCCCCCB(O)O Amb19958787 [0,2,0,0,0,0|1,0,1]=4 2739 B12R0.234 CCCCCCCCCCC(=O)Cl Amb9787304 [0,2,0,0,0,0|1,0,0]=3 2740 B12R0.234 CCCCCCCCCCC(=O)O Amb3941499 [0,2,0,0,0,0|0,0,0]=2 2741 B12R0.234 CCCCCCCCCCC(C)=O Amb6366439 [0,2,0,0,0,0|1,0,0]=3 2742 B12R0.234 CCCCCCCCCOC(=S)[S-] Amb534232 [0,2,0,0,0,0|0,2,0]=4 2743 B12R0.234 CCCCCCCCCOC(C)=O Amb6366259 [0,2,0,0,0,0|1,0,0]=3 2744 B12R0.234 CCCCCCCCOCC(=O)O Amb7790043 [0,2,0,0,0,0|0,0,0]=2 2745 B12R0.234 CCCCCCCC\C=C\C(=O)O Amb33987634 [0,2,0,0,0,0|0,0,0]=2 2746 B12R0.234 CCOCCOCCCCC(=O)O Amb9207787 [0,2,0,0,0,0|0,0,0]=2 2747 B12R0.234 COCCOCCOCCC(=O)O Amb16184341 [0,2,0,0,0,0|1,0,0]=3 2748 B12R0.234 N#CCCCCCCCCC(=O)O Amb4008315 [0,2,0,0,0,0|0,0,0]=2 2749 B12R0.234 NCCCCCCCCCC(=O)O Amb2229638 [0,2,0,0,0,0|0,0,0]=2 2750 B12R0.234 NCCCCCCCCCC(=O)O Amb31030991 [0,2,0,0,0,0|0,0,0]=2 2751 B12R0.234 NCCOCCSCCCC(=O)O Amb17502011 [0,2,0,0,0,0|1,0,0]=3 2752 B12R0.234 O=C(O)CCCCCCCC#CBr Amb32422815 [0,2,0,0,0,0|0,0,1]=3 2753 B12R0.234 O=C(O)CCCCCCCCCBr Amb4014619 [0,2,0,0,0,0|0,0,0]=2 2754 B12R0.234 O=C(O)CCCCCCCCCO Amb3940517 [0,2,0,0,0,0|0,0,0]=2 2755 B12R0.234 O=C(O)CCCCCCCN=C=S Amb33471542 [0,2,0,0,0,0|0,0,1]=3 2756 B12R0.234 O=C(O)\C=C\CCCCCCCO Amb33757093 [0,2,0,0,0,0|0,0,1]=3 2757 B12R0.234 O=C=NCCCCCCCC(=O)O Amb32665820 [0,2,0,0,0,0|0,0,1]=3 2758 B12R0.234 [N-]=[N+]=NCCCCCCCC(=O)O Amb34932690 [0,2,0,0,0,0|1,0,0]=3 2759 B12R0.268 C=C(F)CCCCCCCC(=O)O Amb22641501 [0,2,0,0,0,0|0,0,1]=3 2760 B12R0.268 CC(=O)CCCCCCCC(=O)O Amb17938671 [0,2,0,0,0,0|0,0,0]=2 2761 B12R0.268 CC(=O)CCCCC\C=C\C(=O)O Amb2610938 [0,2,0,0,0,0|0,0,2]=4 2762 B12R0.268 CC(C)CCCCCCCC(=O)O Amb24117911 [0,2,0,0,0,0|0,0,0]=2 2763 B12R0.268 CC(C)CCOCCCCC(=O)O Amb9207788 [0,2,0,0,0,0|0,0,0]=2 2764 B12R0.268 CC(C)SCCCCCCC(=O)O Amb32410629 [0,2,0,0,0,0|0,0,0]=2 2765 B12R0.268 O=C(Cl)CCCCCCCC(=O)Cl Amb3940246 [0,2,0,0,0,0|1,0,1]=4 2766 B12R0.268 O=C(O)CCCCCCCC(=O)O Amb33550139 [0,2,0,0,0,0|0,0,1]=3 2767 B12R0.268 O=C(O)CCCNCCCC(=O)O Amb30988047 [0,2,0,0,0,0|1,0,1]=4 2768 B12R0.172 CCCS(=O)(=O)CCCCC(=O)O Amb9303342 [0,2,0,0,0,0|1,0,0]=3 2769 B12R0.172 CCCS(=O)(=O)NCCCC(=O)O Amb1121368 [0,2,0,0,0,0|2,0,0]=4 2770 B10R1.10 CCCC1=CC(=O)CCC1 Amb25704046 [1,0,0,1,0,0|1,0,1]=4 2771 B10R1.10 CCCC1CC(=O)CCN1 Amb18643754 [1,0,0,1,0,0|2,0,0]=4 2772 B10R1.10 CCCC1CC(=O)CCN1 Amb22235732 [1,0,0,1,0,0|2,0,0]=4 2773 B10R1.10 CCCC1CC(=O)CCO1 Amb24661952 [1,0,0,1,0,0|2,0,0]=4 2774 B10R1.10 CCCC1CC(=O)CCS1 Amb25759710 [1,0,0,1,0,0|2,0,0]=4 2775 B10R1.10 CCCC1CC=CC(=O)O1 Amb24099235 [1,0,0,1,0,0|0,0,2]=4 2776 B10R1.10 CCCC1CCCC(=N)N1 Amb27434746 [1,0,0,1,0,0|2,0,0]=4 2777 B10R1.10 CCCC1CCCC(=O)C1 Amb22754799 [1,0,0,1,0,0|1,0,0]=3 2778 B10R1.10 CCCC1CCCC(O)C1 Amb25337284 [1,0,0,1,0,0|1,0,1]=4 2779 B10R1.10 CCCC1CCNC(=O)C1 Amb26026704 [1,0,0,1,0,0|2,0,0]=4 2780 B10R1.10 CCCC1CCNC(=O)N1 Amb26026362 [1,0,0,1,0,0|2,0,0]=4 2781 B10R1.10 CCCC1CNCC(=O)N1 Amb27953604 [1,0,0,1,0,0|2,0,0]=4 2782 B10R1.10 CCCN1CCCC(=O)C1 Amb16187099 [1,0,0,1,0,0|2,0,0]=4 2783 B10R1.10 CCC[C@H]1CC(=O)CCN1 Amb27208619 [1,0,0,1,0,0|2,0,0]=4 2784 B10R1.10 CCC[C@H]1CCCC(=O)C1 Amb27436290 [1,0,0,1,0,0|1,0,0]=3 2785 B10R1.10 CCC[C@H]1CCCC(=O)N1 Amb27770582 [1,0,0,1,0,0|1,0,0]=3 2786 B10R1.10 CCC[C@H]1CCC[C@@H](O)C1 Amb27465936 [1,0,0,1,0,0|1,0,1]=4 2787 B10R1.10 CCC[C@H]1COCC(=O)N1 Amb27473283 [1,0,0,1,0,0|2,0,0]=4 2788 B10R1.10 CCOC1CCCC(=O)C1 Amb27880749 [1,0,0,1,0,0|2,0,0]=4 2789 B10R1.10 CNCC1CCCC(=O)N1 Amb26503825 [1,0,0,1,0,0|2,0,0]=4 2790 B10R1.10 COCC1CCCC(=O)C1 Amb25070154 [1,0,0,1,0,0|2,0,0]=4 2791 B10R1.10 CSCC1CCCC(=O)C1 Amb27429893 [1,0,0,1,0,0|2,0,0]=4 2792 B10R1.10 NCCC1CCCC(=O)C1 Amb27191780 [1,0,0,1,0,0|2,0,0]=4 2793 B10R1.10 NCCC1CCCC(=O)N1 Amb18831623 [1,0,0,1,0,0|2,0,0]=4 2794 B10R1.10 NCCC1CCCC(=O)S1 Amb27626339 [1,0,0,1,0,0|1,1,0]=4 2795 B10R1.10 O=C1CCCC(CCBr)C1 Amb27607892 [1,0,0,1,0,0|2,0,0]=4 2796 B10R1.10 O=C1CCCC(CCBr)O1 Amb28120676 [1,0,0,1,0,0|1,0,0]=3 2797 B10R1.10 O=C1CCCC(CCCl)O1 Amb27234609 [1,0,0,1,0,0|1,0,0]=3 2798 B10R1.10 O=C1CCCC(CCO)C1 Amb26539684 [1,0,0,1,0,0|2,0,0]=4 2799 B10R1.10 O=C1CCC[C@@H](CCO)O1 Amb28205971 [1,0,0,1,0,0|1,0,0]=3 2800 B10R1.16 CCCCC1CC(=O)CO1 Amb35718938 [1,0,0,1,0,0|2,0,0]=4 2801 B10R1.16 CCCCC1CCC(=O)O1 Amb8513275 [1,0,0,1,0,0|0,0,0]=2 2802 B10R1.16 CCCCC1CCS(=O)C1 Amb27776452 [1,0,0,1,0,0|2,0,0]=4 2803 B10R1.16 CCCCC1CNC(=O)C1 Amb26346287 [1,0,0,1,0,0|2,0,0]=4 2804 B10R1.16 CCCCC1CNC(=O)O1 Amb27830443 [1,0,0,1,0,0|1,0,0]=3 2805 B10R1.16 CCCCC1CNC(O)=N1 Amb27806163 [1,0,0,1,0,0|2,0,0]=4 2806 B10R1.16 CCCCC1COC(=O)N1 Amb24482077 [1,0,0,1,0,0|2,0,0]=4 2807 B10R1.16 CCCC[C@@H]1CCC(=O)N1 Amb28134882 [1,0,0,1,0,0|1,0,0]=3 2808 B10R1.16 CCCC[C@@H]1CNC(=O)C1 Amb27770599 [1,0,0,1,0,0|2,0,0]=4 2809 B10R1.16 CCCC[C@@H]1COC(=O)N1 Amb22225366 [1,0,0,1,0,0|2,0,0]=4 2810 B10R1.16 CCCC[C@H]1CCC(O)C1 Amb27833604 [1,0,0,1,0,0|1,0,1]=4 2811 B10R1.16 CCCOC1CCC(=O)C1 Amb28183094 [1,0,0,1,0,0|2,0,0]=4 2812 B10R1.16 CCCOC1CCC(=O)N1 Amb28067614 [1,0,0,1,0,0|2,0,0]=4 2813 B10R1.16 CCNCC1CCC(=O)N1 Amb27839151 [1,0,0,1,0,0|2,0,0]=4 2814 B10R1.16 CCOCC1CCC(=O)C1 Amb26649290 [1,0,0,1,0,0|2,0,0]=4 2815 B10R1.16 CCOCC1COC(=O)O1 Amb27613885 [1,0,0,1,0,0|2,0,0]=4 2816 B10R1.16 CCSCC1CNC(=O)O1 Amb33323377 [1,0,0,1,0,0|2,0,0]=4 2817 B10R1.16 COCCC1CNC(=O)O1 Amb33377305 [1,0,0,1,0,0|2,0,0]=4 2818 B10R1.16 CSCCC1CNC(=O)O1 Amb33203358 [1,0,0,1,0,0|2,0,0]=4 2819 B10R1.16 NCCCC1CCC(=O)O1 Amb27776907 [1,0,0,1,0,0|1,0,0]=3 2820 B10R1.16 O=C1CCC(CCCBr)C1 Amb27768574 [1,0,0,1,0,0|2,0,0]=4 2821 B10R1.16 O=C1CCC(CCCO)O1 Amb27968758 [1,0,0,1,0,0|1,0,0]=3 2822 B10R1.16 O=C1CC[C@H](CCCO)O1 Amb27205711 [1,0,0,1,0,0|1,0,0]=3 2823 B10R1.18 C=C(Br)CC1CCCCC1 Amb17938627 [1,0,0,1,0,0|2,0,0]=4 2824 B10R1.18 CC(=O)CC1CCCCC1 Amb4034580 [1,0,0,1,0,0|1,0,0]=3 2825 B10R1.18 CC(=O)CC1CCCCN1 Amb10607341 [1,0,0,1,0,0|2,0,0]=4 2826 B10R1.18 CC(=O)CC1CCCCO1 Amb25298544 [1,0,0,1,0,0|2,0,0]=4 2827 B10R1.18 CC(=O)CC1CCCNC1 Amb26047010 [1,0,0,1,0,0|2,0,0]=4 2828 B10R1.18 CC(=O)CC1CCCOC1 Amb26842438 [1,0,0,1,0,0|2,0,0]=4 2829 B10R1.18 CC(=O)CC1CCCSC1 Amb32726331 [1,0,0,1,0,0|2,0,0]=4 2830 B10R1.18 CC(=O)CC1CCNCC1 Amb22227662 [1,0,0,1,0,0|2,0,0]=4 2831 B10R1.18 CC(=O)CC1CCNCC1 Amb27395398 [1,0,0,1,0,0|2,0,0]=4 2832 B10R1.18 CC(=O)CC1CCOCC1 Amb19374940 [1,0,0,1,0,0|2,0,0]=4 2833 B10R1.18 CC(=O)CN1CCCCC1 Amb8427989 [1,0,0,1,0,0|2,0,0]=4 2834 B10R1.18 CC(=O)C[C@H]1CCCCN1 Amb27807842 [1,0,0,1,0,0|2,0,0]=4 2835 B10R1.18 CC(=O)NC1CCCCC1 Amb2237063 [1,0,0,1,0,0|2,0,0]=4 2836 B10R1.18 CC(O)CC1CCCCC1 Amb26513002 [1,0,0,1,0,0|1,0,1]=4 2837 B10R1.18 CN(O)CC1CCCCC1 Amb33362038 [1,0,0,1,0,0|2,0,0]=4 2838 B10R1.18 CS(=O)CC1CCCCC1 Amb28197111 [1,0,0,1,0,0|2,0,0]=4 2839 B10R1.18 C[C@@H](O)CC1CCCCC1 Amb26381356 [1,0,0,1,0,0|1,0,1]=4 2840 B10R1.18 C[C@H](O)CC1CCCCC1 Amb27839520 [1,0,0,1,0,0|1,0,1]=4 2841 B10R1.18 N=C(N)CC1CCCCC1 Amb6279225 [1,0,0,1,0,0|2,0,0]=4 2842 B10R1.18 N=C(N)CC1CCCCC1 Amb8630603 [1,0,0,1,0,0|2,0,0]=4 2843 B10R1.18 NC(=O)CC1CCCCC1 Amb33551594 [1,0,0,1,0,0|1,0,0]=3 2844 B10R1.18 NC(=O)CC1CCCCN1 Amb1076649 [1,0,0,1,0,0|2,0,0]=4 2845 B10R1.18 NC(=O)CC1CCCCN1 Amb22283730 [1,0,0,1,0,0|2,0,0]=4 2846 B10R1.18 NC(=O)CC1CCCCO1 Amb27439121 [1,0,0,1,0,0|2,0,0]=4 2847 B10R1.18 NC(=O)CC1CCCNC1 Amb18962911 [1,0,0,1,0,0|2,0,0]=4 2848 B10R1.18 NC(=O)CC1CCCNC1 Amb20623575 [1,0,0,1,0,0|2,0,0]=4 2849 B10R1.18 NC(=O)CC1CCNCC1 Amb22001615 [1,0,0,1,0,0|2,0,0]=4 2850 B10R1.18 NC(=O)CC1CCNCC1 Amb6267154 [1,0,0,1,0,0|2,0,0]=4 2851 B10R1.18 NC(=O)CC1CCOCC1 Amb22546405 [1,0,0,1,0,0|2,0,0]=4 2852 B10R1.18 NC(=O)CC1CCSCC1 Amb27830749 [1,0,0,1,0,0|2,0,0]=4 2853 B10R1.18 NC(=O)CN1CCCCC1 Amb17142861 [1,0,0,1,0,0|2,0,0]=4 2854 B10R1.18 NC(=O)C[C@@H]1CCCCO1 Amb28341399 [1,0,0,1,0,0|2,0,0]=4 2855 B10R1.18 NC(=O)NC1CCCCC1 Amb1151266 [1,0,0,1,0,0|2,0,0]=4 2856 B10R1.18 NC(=O)OC1CCCCC1 Amb4012086 [1,0,0,1,0,0|2,0,0]=4 2857 B10R1.18 NC(=O)SC1CCCCC1 Amb27607116 [1,0,0,1,0,0|2,0,0]=4 2858 B10R1.18 NC(=S)CC1CCCCC1 Amb6264814 [1,0,0,1,0,0|1,1,0]=4 2859 B10R1.18 NS(=O)CC1CCCCC1 Amb32720317 [1,0,0,1,0,0|2,0,0]=4 2860 B10R1.18 O=C(Cl)CC1CCCCC1 Amb33528414 [1,0,0,1,0,0|1,0,0]=3 2861 B10R1.18 O=C(Cl)CC1CCOCC1 Amb6572390 [1,0,0,1,0,0|2,0,0]=4 2862 B10R1.18 O=C(Cl)NC1CCCCC1 Amb26068583 [1,0,0,1,0,0|2,0,0]=4 2863 B10R1.18 O=C(Cl)OC1CCCCC1 Amb8390640 [1,0,0,1,0,0|2,0,0]=4 2864 B10R1.18 O=C(Cl)SC1CCCCC1 Amb32679652 [1,0,0,1,0,0|2,0,0]=4 2865 B10R1.18 O=C(F)NC1CCCCC1 Amb27242067 [1,0,0,1,0,0|2,0,0]=4 2866 B10R1.18 O=C(O)C=C1CCCCC1 Amb2429191 [1,0,0,1,0,0|0,0,2]=4 2867 B10R1.18 O=C(O)CC1=CCCCC1 Amb2721175 [1,0,0,1,0,0|0,0,2]=4 2868 B10R1.18 O=C(O)CC1C=CCCC1 Amb18124573 [1,0,0,1,0,0|0,0,2]=4 2869 B10R1.18 O=C(O)CC1CC=CCC1 Amb18643595 [1,0,0,1,0,0|0,0,2]=4 2870 B10R1.18 O=C(O)CC1CCCCC1 Amb3939015 [1,0,0,1,0,0|0,0,0]=2 2871 B10R1.18 O=C(O)CC1CCCCN1 Amb10576328 [1,0,0,1,0,0|1,0,0]=3 2872 B10R1.18 O=C(O)CC1CCCCN1 Amb1083025 [1,0,0,1,0,0|1,0,0]=3 2873 B10R1.18 O=C(O)CC1CCCCN1 Amb22587703 [1,0,0,1,0,0|1,0,0]=3 2874 B10R1.18 O=C(O)CC1CCCCO1 Amb1091980 [1,0,0,1,0,0|1,0,0]=3 2875 B10R1.18 O=C(O)CC1CCCNC1 Amb13952813 [1,0,0,1,0,0|1,0,0]=3 2876 B10R1.18 O=C(O)CC1CCCNC1 Amb2684000 [1,0,0,1,0,0|1,0,0]=3 2877 B10R1.18 O=C(O)CC1CCCOC1 Amb33544408 [1,0,0,1,0,0|1,0,0]=3 2878 B10R1.18 O=C(O)CC1CCCSC1 Amb18199274 [1,0,0,1,0,0|1,0,0]=3 2879 B10R1.18 O=C(O)CC1CCC[NH2+]C1 Amb2695000 [1,0,0,1,0,0|1,0,0]=3 2880 B10R1.18 O=C(O)CC1CCNCC1 Amb2683992 [1,0,0,1,0,0|1,0,0]=3 2881 B10R1.18 O=C(O)CC1CCNCC1 Amb33544417 [1,0,0,1,0,0|1,0,0]=3 2882 B10R1.18 O=C(O)CC1CCOCC1 Amb2684134 [1,0,0,1,0,0|1,0,0]=3 2883 B10R1.18 O=C(O)CC1CCSCC1 Amb18283322 [1,0,0,1,0,0|1,0,0]=3 2884 B10R1.18 O=C(O)CC1CNCCN1 Amb8630816 [1,0,0,1,0,0|2,0,0]=4 2885 B10R1.18 O=C(O)CC1CNCCO1 Amb21959647 [1,0,0,1,0,0|2,0,0]=4 2886 B10R1.18 O=C(O)CC1CNCCO1 Amb2695419 [1,0,0,1,0,0|2,0,0]=4 2887 B10R1.18 O=C(O)CC1CNCCS1 Amb27447972 [1,0,0,1,0,0|2,0,0]=4 2888 B10R1.18 O=C(O)CC1COCCN1 Amb21964558 [1,0,0,1,0,0|2,0,0]=4 2889 B10R1.18 O=C(O)CC1COCCN1 Amb2699908 [1,0,0,1,0,0|2,0,0]=4 2890 B10R1.18 O=C(O)CC1COCCO1 Amb17507064 [1,0,0,1,0,0|2,0,0]=4 2891 B10R1.18 O=C(O)CC1CSCCN1 Amb18199026 [1,0,0,1,0,0|2,0,0]=4 2892 B10R1.18 O=C(O)CC1CSCCO1 Amb27444857 [1,0,0,1,0,0|2,0,0]=4 2893 B10R1.18 O=C(O)CC1CSCCS1 Amb28068478 [1,0,0,1,0,0|2,0,0]=4 2894 B10R1.18 O=C(O)CC1NCCCS1 Amb18645532 [1,0,0,1,0,0|2,0,0]=4 2895 B10R1.18 O=C(O)CC1OCCCO1 Amb26656959 [1,0,0,1,0,0|2,0,0]=4 2896 B10R1.18 O=C(O)CN1CCCCC1 Amb1098973 [1,0,0,1,0,0|1,0,0]=3 2897 B10R1.18 O=C(O)CN1CCCCC1 Amb8503500 [1,0,0,1,0,0|1,0,0]=3 2898 B10R1.18 O=C(O)CN1CCNCC1 Amb22728245 [1,0,0,1,0,0|2,0,0]=4 2899 B10R1.18 O=C(O)CN1CCNCC1 Amb2700795 [1,0,0,1,0,0|2,0,0]=4 2900 B10R1.18 O=C(O)CN1CCOCC1 Amb1099394 [1,0,0,1,0,0|2,0,0]=4 2901 B10R1.18 O=C(O)CN1CCOCC1 Amb8513036 [1,0,0,1,0,0|2,0,0]=4 2902 B10R1.18 O=C(O)CN1CCSCC1 Amb10072976 [1,0,0,1,0,0|2,0,0]=4 2903 B10R1.18 O=C(O)CN1CCSCC1 Amb6307186 [1,0,0,1,0,0|2,0,0]=4 2904 B10R1.18 O=C(O)C[C@@H]1CC=CCC1 Amb25921210 [1,0,0,1,0,0|0,0,2]=4 2905 B10R1.18 O=C(O)C[C@@H]1CCCCN1 Amb13885774 [1,0,0,1,0,0|1,0,0]=3 2906 B10R1.18 O=C(O)C[C@@H]1CCCCN1 Amb33296463 [1,0,0,1,0,0|1,0,0]=3 2907 B10R1.18 O=C(O)C[C@@H]1CCCNC1 Amb25889983 [1,0,0,1,0,0|1,0,0]=3 2908 B10R1.18 O=C(O)C[C@@H]1CCCNC1 Amb32407008 [1,0,0,1,0,0|1,0,0]=3 2909 B10R1.18 O=C(O)C[C@@H]1CNCCO1 Amb22747184 [1,0,0,1,0,0|2,0,0]=4 2910 B10R1.18 O=C(O)C[C@@H]1COCCN1 Amb34913922 [1,0,0,1,0,0|2,0,0]=4 2911 B10R1.18 O=C(O)C[C@H]1CCCCN1 Amb13885779 [1,0,0,1,0,0|1,0,0]=3 2912 B10R1.18 O=C(O)C[C@H]1CCCCN1 Amb33456128 [1,0,0,1,0,0|1,0,0]=3 2913 B10R1.18 O=C(O)C[C@H]1CCCNC1 Amb23401360 [1,0,0,1,0,0|1,0,0]=3 2914 B10R1.18 O=C(O)C[C@H]1CCCNC1 Amb28077035 [1,0,0,1,0,0|1,0,0]=3 2915 B10R1.18 O=C(O)C[C@H]1CNCCO1 Amb27751203 [1,0,0,1,0,0|2,0,0]=4 2916 B10R1.18 O=C(O)C[C@H]1CNCCO1 Amb33801282 [1,0,0,1,0,0|2,0,0]=4 2917 B10R1.18 O=C(O)C[C@H]1COCCN1 Amb25992590 [1,0,0,1,0,0|2,0,0]=4 2918 B10R1.18 O=C(O)C[C@H]1COCCN1 Amb34913503 [1,0,0,1,0,0|2,0,0]=4 2919 B10R1.18 O=C(O)C[NH+]1CCCCC1 Amb4255653 [1,0,0,1,0,0|1,0,0]=3 2920 B10R1.18 O=C(O)C[S+]1CCSCC1 Amb27176492 [1,0,0,1,0,0|2,0,0]=4 2921 B10R1.18 O=C(O)NC1CCCCC1 Amb22039352 [1,0,0,1,0,0|1,0,0]=3 2922 B10R1.18 O=C([O-])CC1CCOCC1 Amb33512920 [1,0,0,1,0,0|1,0,1]=4 2923 B10R1.18 O=S(Cl)CC1CCCCC1 Amb28195256 [1,0,0,1,0,0|2,0,0]=4 2924 B10R1.18 O=S(O)CC1CCCCC1 Amb27452532 [1,0,0,1,0,0|1,0,0]=3 2925 B10R1.18 O=S([O-])CC1CCCCC1 Amb24461100 [1,0,0,1,0,0|1,0,1]=4 2926 B10R1.18 O=[N+]([O-])CC1CCCCC1 Amb25146243 [1,0,0,1,0,0|1,0,1]=4 2927 B10R1.18 OB(O)CC1CCCCC1 Amb13890397 [1,0,0,1,0,0|1,0,1]=4 2928 B10R1.24 CCCCC[C@H]1C[C@H](O)C1 Amb28280564 [1,0,0,1,0,0|1,0,1]=4 2929 B10R1.24 O=C1CC(CCCCO)O1 Amb28079077 [1,0,0,1,0,0|1,0,0]=3 2930 B10R1.24 O=C1CC(CSCCO)O1 Amb28050783 [1,0,0,1,0,0|2,0,0]=4 2931 B10R1.24 O=CCCCC1CC(=O)O1 Amb27854923 [1,0,0,1,0,0|1,0,1]=4 2932 B10R1.38 CCC1CCCCC1(C)O Amb25353397 [1,0,0,1,0,0|1,0,1]=4 2933 B10R1.38 CC[C@@H]1CCCC[C@@]1(C)O Amb32950509 [1,0,0,1,0,0|1,0,1]=4 2934 B10R1.39 CC(=O)C1CCCC1CCl Amb28251128 [1,0,0,1,0,0|2,0,0]=4 2935 B10R1.39 CC(=O)C1CCCC1CN Amb25169358 [1,0,0,1,0,0|2,0,0]=4 2936 B10R1.39 CC(=O)[C@@H]1CCC[C@@H]1CN Amb27243633 [1,0,0,1,0,0|2,0,0]=4 2937 B10R1.39 CCC1=C(C(=O)O)CCC1 Amb29864676 [1,0,0,1,0,0|0,0,2]=4 2938 B10R1.39 CCC1CCC=C1C(=O)O Amb27788569 [1,0,0,1,0,0|0,0,2]=4 2939 B10R1.39 CCC1CCCC1C(=O)O Amb18643940 [1,0,0,1,0,0|0,0,0]=2 2940 B10R1.39 CCC1CCCN1C(=O)Cl Amb26053464 [1,0,0,1,0,0|2,0,0]=4 2941 B10R1.39 CCC1CCNC1C(=O)O Amb18644001 [1,0,0,1,0,0|1,0,0]=3 2942 B10R1.39 CCC1CCNC1C(=O)O Amb32932458 [1,0,0,1,0,0|1,0,0]=3 2943 B10R1.39 CCC1CCN[C@@H]1C(=O)O Amb27259157 [1,0,0,1,0,0|1,0,0]=3 2944 B10R1.39 CCC1CCOC1C(=O)O Amb32666976 [1,0,0,1,0,0|1,0,0]=3 2945 B10R1.39 CCC1CNCC1C(=O)O Amb18831583 [1,0,0,1,0,0|1,0,0]=3 2946 B10R1.39 CCC1CNCC1C(N)=O Amb28139079 [1,0,0,1,0,0|2,0,0]=4 2947 B10R1.39 CCC1COCC1C(C)=O Amb29882928 [1,0,0,1,0,0|2,0,0]=4 2948 B10R1.39 CCC1NCCC1C(=O)O Amb18118150 [1,0,0,1,0,0|1,0,0]=3 2949 B10R1.39 CCC1NCCC1C(=O)O Amb28896015 [1,0,0,1,0,0|1,0,0]=3 2950 B10R1.39 CCC1NCCC1C(C)=O Amb33131417 [1,0,0,1,0,0|2,0,0]=4 2951 B10R1.39 CCC1NCCC1C(N)=O Amb28057799 [1,0,0,1,0,0|2,0,0]=4 2952 B10R1.39 CCC1OCCC1C(=O)O Amb27238092 [1,0,0,1,0,0|1,0,0]=3 2953 B10R1.39 CCC1OCCC1C(C)=O Amb27170224 [1,0,0,1,0,0|2,0,0]=4 2954 B10R1.39 CCN1CCCC1C(=O)O Amb9173743 [1,0,0,1,0,0|1,0,0]=3 2955 B10R1.39 CCN1CCCC1C(C)=O Amb27617177 [1,0,0,1,0,0|2,0,0]=4 2956 B10R1.39 CCN1CCCC1C(N)=O Amb25233484 [1,0,0,1,0,0|2,0,0]=4 2957 B10R1.39 CCN1CCC[C@@H]1C(=O)O Amb22587552 [1,0,0,1,0,0|1,0,0]=3 2958 B10R1.39 CCN1CCC[C@@H]1C(=O)O Amb23385271 [1,0,0,1,0,0|1,0,0]=3 2959 B10R1.39 CCN1CCC[C@@H]1C(N)=O Amb22799563 [1,0,0,1,0,0|2,0,0]=4 2960 B10R1.39 CCN1CCC[C@H]1C(=O)O Amb19516987 [1,0,0,1,0,0|1,0,0]=3 2961 B10R1.39 CCN1CCC[C@H]1C(N)=O Amb19944682 [1,0,0,1,0,0|2,0,0]=4 2962 B10R1.39 CC[C@@H]1CCN[C@@H]1C(=O)O Amb27846259 [1,0,0,1,0,0|1,0,0]=3 2963 B10R1.39 CC[C@@H]1CCN[C@H]1C(=O)O Amb28428507 [1,0,0,1,0,0|1,0,0]=3 2964 B10R1.39 CC[C@@H]1CCO[C@@H]1C(=O)O Amb32667304 [1,0,0,1,0,0|1,0,0]=3 2965 B10R1.39 CC[C@@H]1CNC[C@@H]1C(=O)O Amb28057536 [1,0,0,1,0,0|1,0,0]=3 2966 B10R1.39 CC[C@@H]1NCC[C@H]1C(=O)O Amb18202480 [1,0,0,1,0,0|1,0,0]=3 2967 B10R1.39 CC[C@@H]1OCC[C@H]1C(=O)O Amb32685282 [1,0,0,1,0,0|1,0,0]=3 2968 B10R1.39 CC[C@H]1CCC[C@@H]1C(N)=O Amb27786258 [1,0,0,1,0,0|1,0,0]=3 2969 B10R1.39 CC[C@H]1CCN[C@@H]1C(=O)O Amb28411335 [1,0,0,1,0,0|1,0,0]=3 2970 B10R1.39 CC[C@H]1CCN[C@@H]1C(N)=O Amb27203311 [1,0,0,1,0,0|2,0,0]=4 2971 B10R1.39 CNC1CCCC1C(=O)O Amb26637848 [1,0,0,1,0,0|1,0,0]=3 2972 B10R1.39 CNC1CCCC1C(N)=O Amb25296216 [1,0,0,1,0,0|2,0,0]=4 2973 B10R1.39 CNC1COCC1C(=O)O Amb27409265 [1,0,0,1,0,0|2,0,0]=4 2974 B10R1.39 COC1CCCC1C(=O)Cl Amb27159232 [1,0,0,1,0,0|2,0,0]=4 2975 B10R1.39 COC1CCCC1C(=O)O Amb18967397 [1,0,0,1,0,0|1,0,0]=3 2976 B10R1.39 COC1CCCC1C(N)=O Amb24677907 [1,0,0,1,0,0|2,0,0]=4 2977 B10R1.39 COC1CCNC1C(=O)O Amb18644194 [1,0,0,1,0,0|2,0,0]=4 2978 B10R1.39 CO[C@@H]1CCC[C@@H]1C(=O)Cl Amb26426311 [1,0,0,1,0,0|2,0,0]=4 2979 B10R1.39 CO[C@@H]1CCC[C@@H]1C(=O)O Amb28203935 [1,0,0,1,0,0|1,0,0]=3 2980 B10R1.39 CO[C@H]1CCCC1C(=O)O Amb27947835 [1,0,0,1,0,0|1,0,0]=3 2981 B10R1.39 CO[C@H]1CCC[C@@H]1C(=O)Cl Amb27803948 [1,0,0,1,0,0|2,0,0]=4 2982 B10R1.39 CO[C@H]1CCC[C@@H]1C(=O)O Amb25956783 [1,0,0,1,0,0|1,0,0]=3 2983 B10R1.39 CO[C@H]1CCC[C@H]1C(=O)O Amb26931198 [1,0,0,1,0,0|1,0,0]=3 2984 B10R1.39 CSC1CCCC1C(=O)O Amb18288540 [1,0,0,1,0,0|1,0,0]=3 2985 B10R1.39 CSC1CCCC1C(N)=O Amb28207455 [1,0,0,1,0,0|2,0,0]=4 2986 B10R1.39 N#C[C@H]1CCC[C@@H]1C(=O)O Amb27231107 [1,0,0,1,0,0|1,0,1]=4 2987 B10R1.39 NC(=O)[C@H]1CCC[C@H]1CO Amb27788752 [1,0,0,1,0,0|2,0,0]=4 2988 B10R1.39 NCC1CCCC1C(=O)O Amb25283657 [1,0,0,1,0,0|1,0,0]=3 2989 B10R1.39 NCC1CCCC1C(=O)O Amb32661245 [1,0,0,1,0,0|1,0,0]=3 2990 B10R1.39 NCC1OCCC1C(=O)O Amb28145201 [1,0,0,1,0,0|2,0,0]=4 2991 B10R1.39 NCC1OCCC1C(=O)O Amb28920815 [1,0,0,1,0,0|2,0,0]=4 2992 B10R1.39 NCN1CCCC1C(=O)O Amb27838065 [1,0,0,1,0,0|2,0,0]=4 2993 B10R1.39 NC[C@@H]1CCC[C@@H]1C(=O)O Amb26903999 [1,0,0,1,0,0|1,0,0]=3 2994 B10R1.39 NC[C@@H]1CCC[C@@H]1C(=O)O Amb33249753 [1,0,0,1,0,0|1,0,0]=3 2995 B10R1.39 NC[C@@H]1CCO[C@@H]1C(=O)O Amb32671492 [1,0,0,1,0,0|2,0,0]=4 2996 B10R1.39 NC[C@@H]1CCO[C@@H]1C(=O)O Amb32992350 [1,0,0,1,0,0|2,0,0]=4 2997 B10R1.39 NC[C@@H]1OCC[C@@H]1C(=O)O Amb27666152 [1,0,0,1,0,0|2,0,0]=4 2998 B10R1.39 NC[C@@H]1OCC[C@@H]1C(=O)O Amb32663319 [1,0,0,1,0,0|2,0,0]=4 2999 B10R1.39 NC[C@H]1CCC[C@H]1C(=O)O Amb28293248 [1,0,0,1,0,0|1,0,0]=3 3000 B10R1.39 NC[C@H]1CCC[C@H]1C(=O)O Amb28641946 [1,0,0,1,0,0|1,0,0]=3 3001 B10R1.39 NC[C@H]1CCC[C@H]1C(N)=O Amb27788090 [1,0,0,1,0,0|2,0,0]=4 3002 B10R1.39 O=C(O)C1CCCC1CBr Amb18130990 [1,0,0,1,0,0|1,0,0]=3 3003 B10R1.39 O=C(O)C1CCCC1CF Amb20668095 [1,0,0,1,0,0|1,0,0]=3 3004 B10R1.39 O=C(O)C1CCNC1CO Amb28195171 [1,0,0,1,0,0|2,0,0]=4 3005 B10R1.39 O=C(O)C1CCSC1CS Amb28422354 [1,0,0,1,0,0|2,0,0]=4 3006 B10R1.39 O=C(O)C1CNCC1CO Amb2696581 [1,0,0,1,0,0|2,0,0]=4 3007 B10R1.39 O=C(O)C1CSCC1CS Amb27872260 [1,0,0,1,0,0|2,0,0]=4 3008 B10R1.39 O=C(O)[C@@H]1CCC[C@H]1CF Amb32721623 [1,0,0,1,0,0|1,0,0]=3 3009 B10R1.39 O=C(O)[C@@H]1CCN[C@H]1CO Amb18202111 [1,0,0,1,0,0|2,0,0]=4 3010 B10R1.39 O=C(O)[C@H]1CCC[C@@H]1CBr Amb27435607 [1,0,0,1,0,0|1,0,0]=3 3011 B10R1.39 O=C[C@@H]1CCC[C@@H]1C(=O)O Amb27643790 [1,0,0,1,0,0|1,0,1]=4 3012 B10R1.56 CCCCCCC1CC1O Amb27836897 [1,0,0,1,0,0|1,0,1]=4 3013 B10R1.56 CCCCCC[C@@H]1C[C@@H]1O Amb27220217 [1,0,0,1,0,0|1,0,1]=4 3014 B10R1.61 CC(=O)C1CCCCC1Br Amb25926848 [1,0,0,1,0,0|2,0,0]=4 3015 B10R1.61 CC(=O)C1CCCCC1C Amb26021911 [1,0,0,1,0,0|1,0,0]=3 3016 B10R1.61 CC(=O)C1CCCCC1F Amb27755308 [1,0,0,1,0,0|2,0,0]=4 3017 B10R1.61 CC(=O)C1CCCCC1N Amb18124599 [1,0,0,1,0,0|2,0,0]=4 3018 B10R1.61 CC(=O)C1CCCCC1N Amb33447090 [1,0,0,1,0,0|2,0,0]=4 3019 B10R1.61 CC(=O)C1CCCCC1O Amb25735279 [1,0,0,1,0,0|2,0,0]=4 3020 B10R1.61 CC(=O)C1CCCCN1C Amb25763077 [1,0,0,1,0,0|2,0,0]=4 3021 B10R1.61 CC(=O)C1CCCNC1C Amb26040936 [1,0,0,1,0,0|2,0,0]=4 3022 B10R1.61 CC(=O)C1CCNCC1C Amb26849111 [1,0,0,1,0,0|2,0,0]=4 3023 B10R1.61 CC(=O)C1CCOCC1C Amb28041252 [1,0,0,1,0,0|2,0,0]=4 3024 B10R1.61 CC(=O)C1CNCCC1C Amb30007896 [1,0,0,1,0,0|2,0,0]=4 3025 B10R1.61 CC(=O)C1NCCCC1C Amb32410373 [1,0,0,1,0,0|2,0,0]=4 3026 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1C Amb28131403 [1,0,0,1,0,0|1,0,0]=3 3027 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1N Amb33307705 [1,0,0,1,0,0|2,0,0]=4 3028 B10R1.61 CC(=O)[C@@H]1CCCC[C@H]1C Amb25948878 [1,0,0,1,0,0|1,0,0]=3 3029 B10R1.61 CC(=O)[C@@H]1CCCC[C@H]1O Amb26451216 [1,0,0,1,0,0|2,0,0]=4 3030 B10R1.61 CC(=O)[C@H]1CCCC[C@@H]1C Amb28052336 [1,0,0,1,0,0|1,0,0]=3 3031 B10R1.61 CC(=O)[C@H]1CCCC[C@@H]1O Amb28196697 [1,0,0,1,0,0|2,0,0]=4 3032 B10R1.61 CC(=O)[C@H]1CCCN[C@H]1C Amb33307649 [1,0,0,1,0,0|2,0,0]=4 3033 B10R1.61 CC(O)[C@@H]1CCCC[C@H]1C Amb27660322 [1,0,0,1,0,0|1,0,1]=4 3034 B10R1.61 CC1=C(C(=O)O)CCCC1 Amb18643592 [1,0,0,1,0,0|0,0,2]=4 3035 B10R1.61 CC1=CCCCC1C(=O)O Amb27960195 [1,0,0,1,0,0|0,0,2]=4 3036 B10R1.61 CC1CC=CCC1C(=O)O Amb18124583 [1,0,0,1,0,0|0,0,2]=4 3037 B10R1.61 CC1CCCC=C1C(=O)O Amb22407010 [1,0,0,1,0,0|0,0,2]=4 3038 B10R1.61 CC1CCCCC1B(O)O Amb25073840 [1,0,0,1,0,0|1,0,1]=4 3039 B10R1.61 CC1CCCCC1C(=O)Br Amb27635544 [1,0,0,1,0,0|1,0,0]=3 3040 B10R1.61 CC1CCCCC1C(=O)O Amb1923858 [1,0,0,1,0,0|0,0,0]=2 3041 B10R1.61 CC1CCCCC1C(N)=O Amb4035366 [1,0,0,1,0,0|1,0,0]=3 3042 B10R1.61 CC1CCCCC1S(=O)Cl Amb35681055 [1,0,0,1,0,0|2,0,0]=4 3043 B10R1.61 CC1CCCCC1S(=O)O Amb35683280 [1,0,0,1,0,0|1,0,0]=3 3044 B10R1.61 CC1CCCCC1S(=O)[O-] Amb35683282 [1,0,0,1,0,0|1,0,1]=4 3045 B10R1.61 CC1CCCCN1C(=O)Cl Amb17563085 [1,0,0,1,0,0|2,0,0]=4 3046 B10R1.61 CC1CCCCN1C(O)=S Amb27860338 [1,0,0,1,0,0|1,1,0]=4 3047 B10R1.61 CC1CCCNC1C(=O)O Amb18644006 [1,0,0,1,0,0|1,0,0]=3 3048 B10R1.61 CC1CCCNC1C(=O)O Amb33421964 [1,0,0,1,0,0|1,0,0]=3 3049 B10R1.61 CC1CCCNC1C(N)=O Amb18279452 [1,0,0,1,0,0|2,0,0]=4 3050 B10R1.61 CC1CCNCC1C(=O)O Amb18124644 [1,0,0,1,0,0|1,0,0]=3 3051 B10R1.61 CC1CCNCC1C(=O)O Amb33330563 [1,0,0,1,0,0|1,0,0]=3 3052 B10R1.61 CC1CCNCC1C(N)=O Amb35673225 [1,0,0,1,0,0|2,0,0]=4 3053 B10R1.61 CC1CNCCC1C(=O)O Amb2694911 [1,0,0,1,0,0|1,0,0]=3 3054 B10R1.61 CC1CNCCC1C(=O)O Amb28555510 [1,0,0,1,0,0|1,0,0]=3 3055 B10R1.61 CC1COCCC1C(=O)Cl Amb27752623 [1,0,0,1,0,0|2,0,0]=4 3056 B10R1.61 CC1COCCC1C(=O)O Amb27975751 [1,0,0,1,0,0|1,0,0]=3 3057 B10R1.61 CC1COCCC1C(N)=O Amb27837972 [1,0,0,1,0,0|2,0,0]=4 3058 B10R1.61 CC1CSCCC1C(=O)O Amb27214025 [1,0,0,1,0,0|1,0,0]=3 3059 B10R1.61 CC1NCCCC1C(=O)O Amb18124643 [1,0,0,1,0,0|1,0,0]=3 3060 B10R1.61 CC1NCCCC1C(=O)O Amb33548991 [1,0,0,1,0,0|1,0,0]=3 3061 B10R1.61 CC1NCCNC1C(=O)O Amb27172839 [1,0,0,1,0,0|2,0,0]=4 3062 B10R1.61 CC1OCCCC1C(=O)O Amb26904538 [1,0,0,1,0,0|1,0,0]=3 3063 B10R1.61 CC1OCCCC1C(N)=O Amb27665082 [1,0,0,1,0,0|2,0,0]=4 3064 B10R1.61 CC1OCCNC1C(=O)O Amb18061972 [1,0,0,1,0,0|2,0,0]=4 3065 B10R1.61 CC1OCCNC1C(=O)O Amb32666147 [1,0,0,1,0,0|2,0,0]=4 3066 B10R1.61 CN1CCCCC1C(=O)O Amb1102591 [1,0,0,1,0,0|1,0,0]=3 3067 B10R1.61 CN1CCCCC1C(=O)O Amb2694386 [1,0,0,1,0,0|1,0,0]=3 3068 B10R1.61 CN1CCCCC1C(N)=O Amb16233756 [1,0,0,1,0,0|2,0,0]=4 3069 B10R1.61 CN1CCCC[C@@H]1C(=O)O Amb22744921 [1,0,0,1,0,0|1,0,0]=3 3070 B10R1.61 CN1CCCC[C@@H]1C(=O)O Amb30594706 [1,0,0,1,0,0|1,0,0]=3 3071 B10R1.61 CN1CCCC[C@H]1C(=O)O Amb27171753 [1,0,0,1,0,0|1,0,0]=3 3072 B10R1.61 CN1CCNCC1C(=O)O Amb22587701 [1,0,0,1,0,0|2,0,0]=4 3073 B10R1.61 CN1CCNCC1C(=O)O Amb32410569 [1,0,0,1,0,0|2,0,0]=4 3074 B10R1.61 CN1CCNCC1C(=O)O Amb8385522 [1,0,0,1,0,0|2,0,0]=4 3075 B10R1.61 CN1CCOCC1C(=O)O Amb22754706 [1,0,0,1,0,0|2,0,0]=4 3076 B10R1.61 CN1CCOCC1C(=O)O Amb8010634 [1,0,0,1,0,0|2,0,0]=4 3077 B10R1.61 CN1CCOC[C@@H]1C(=O)O Amb22748786 [1,0,0,1,0,0|2,0,0]=4 3078 B10R1.61 CN1CCOC[C@@H]1C(=O)O Amb30526868 [1,0,0,1,0,0|2,0,0]=4 3079 B10R1.61 CN1CCOC[C@H]1C(=O)O Amb28126959 [1,0,0,1,0,0|2,0,0]=4 3080 B10R1.61 CN1CCOC[C@H]1C(=O)O Amb30526870 [1,0,0,1,0,0|2,0,0]=4 3081 B10R1.61 CN1CCSCC1C(=O)O Amb27816216 [1,0,0,1,0,0|2,0,0]=4 3082 B10R1.61 C[C@@H]1C=CCC[C@@H]1C(=O)O Amb10843958 [1,0,0,1,0,0|0,0,2]=4 3083 B10R1.61 C[C@@H]1CC=CC[C@H]1C(=O)O Amb25799158 [1,0,0,1,0,0|0,0,2]=4 3084 B10R1.61 C[C@@H]1CCCCN1C(=O)Cl Amb25349193 [1,0,0,1,0,0|2,0,0]=4 3085 B10R1.61 C[C@@H]1CCCC[C@H]1C(=O)O Amb10843965 [1,0,0,1,0,0|0,0,0]=2 3086 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O Amb13886260 [1,0,0,1,0,0|1,0,0]=3 3087 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O Amb31177924 [1,0,0,1,0,0|1,0,0]=3 3088 B10R1.61 C[C@@H]1CCCN[C@@H]1C(N)=O Amb24392330 [1,0,0,1,0,0|2,0,0]=4 3089 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O Amb25911818 [1,0,0,1,0,0|1,0,0]=3 3090 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O Amb32967641 [1,0,0,1,0,0|1,0,0]=3 3091 B10R1.61 C[C@@H]1CNCC[C@@H]1C(=O)O Amb33715674 [1,0,0,1,0,0|1,0,0]=3 3092 B10R1.61 C[C@@H]1COCC[C@H]1C(N)=O Amb28130095 [1,0,0,1,0,0|2,0,0]=4 3093 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O Amb27881535 [1,0,0,1,0,0|1,0,0]=3 3094 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O Amb32656204 [1,0,0,1,0,0|1,0,0]=3 3095 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O Amb18202482 [1,0,0,1,0,0|1,0,0]=3 3096 B10R1.61 C[C@@H]1OCCC[C@@H]1C(=O)O Amb27160030 [1,0,0,1,0,0|1,0,0]=3 3097 B10R1.61 C[C@@H]1OCCN[C@H]1C(=O)O Amb22746793 [1,0,0,1,0,0|2,0,0]=4 3098 B10R1.61 C[C@@H]1OCCN[C@H]1C(=O)O Amb22755786 [1,0,0,1,0,0|2,0,0]=4 3099 B10R1.61 C[C@@H]1OCCO[C@@H]1C(=O)O Amb32666699 [1,0,0,1,0,0|2,0,0]=4 3100 B10R1.61 C[C@H]1C=CCC[C@@H]1C(=O)O Amb27473415 [1,0,0,1,0,0|0,0,2]=4 3101 B10R1.61 C[C@H]1C=CCC[C@H]1C(=O)O Amb10843952 [1,0,0,1,0,0|0,0,2]=4 3102 B10R1.61 C[C@H]1CC=CC[C@@H]1C(=O)O Amb27421976 [1,0,0,1,0,0|0,0,2]=4 3103 B10R1.61 C[C@H]1CCCC[C@@H]1B(O)O Amb27976049 [1,0,0,1,0,0|1,0,1]=4 3104 B10R1.61 C[C@H]1CCCN[C@@H]1C(=O)O Amb27814735 [1,0,0,1,0,0|1,0,0]=3 3105 B10R1.61 C[C@H]1CCCN[C@H]1C(=O)O Amb2695237 [1,0,0,1,0,0|1,0,0]=3 3106 B10R1.61 C[C@H]1CCCN[C@H]1C(=O)O Amb28593755 [1,0,0,1,0,0|1,0,0]=3 3107 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O Amb26419672 [1,0,0,1,0,0|1,0,0]=3 3108 B10R1.61 C[C@H]1NCCC[C@H]1C(N)=O Amb27945004 [1,0,0,1,0,0|2,0,0]=4 3109 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O Amb10608849 [1,0,0,1,0,0|2,0,0]=4 3110 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O Amb28856264 [1,0,0,1,0,0|2,0,0]=4 3111 B10R1.61 NC(=O)C1CCCCC1Cl Amb27180588 [1,0,0,1,0,0|2,0,0]=4 3112 B10R1.61 NC(=O)C1CCCCC1F Amb32943802 [1,0,0,1,0,0|2,0,0]=4 3113 B10R1.61 NC(=O)C1CCCCC1N Amb1125131 [1,0,0,1,0,0|2,0,0]=4 3114 B10R1.61 NC(=O)C1CCCCC1N Amb20623397 [1,0,0,1,0,0|2,0,0]=4 3115 B10R1.61 NC(=O)C1CCCCC1O Amb25724469 [1,0,0,1,0,0|2,0,0]=4 3116 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N Amb8515028 [1,0,0,1,0,0|2,0,0]=4 3117 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1O Amb8515026 [1,0,0,1,0,0|2,0,0]=4 3118 B10R1.61 NC(=O)[C@@H]1CCCC[C@H]1N Amb1994026 [1,0,0,1,0,0|2,0,0]=4 3119 B10R1.61 NC(=O)[C@@H]1CCCC[C@H]1O Amb6356272 [1,0,0,1,0,0|2,0,0]=4 3120 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1Cl Amb27983650 [1,0,0,1,0,0|2,0,0]=4 3121 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N Amb10608207 [1,0,0,1,0,0|2,0,0]=4 3122 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N Amb22757841 [1,0,0,1,0,0|2,0,0]=4 3123 B10R1.61 NC1CCCCC1C(=O)O Amb20626164 [1,0,0,1,0,0|1,0,0]=3 3124 B10R1.61 NC1CCCCC1C(=O)O Amb2694788 [1,0,0,1,0,0|1,0,0]=3 3125 B10R1.61 NC1CCCNC1C(=O)O Amb35750913 [1,0,0,1,0,0|2,0,0]=4 3126 B10R1.61 NC1CCCNC1C(=O)O Amb35751901 [1,0,0,1,0,0|2,0,0]=4 3127 B10R1.61 NC1CCCOC1C(=O)O Amb18202149 [1,0,0,1,0,0|2,0,0]=4 3128 B10R1.61 NC1CCNCC1C(=O)O Amb13886611 [1,0,0,1,0,0|2,0,0]=4 3129 B10R1.61 NC1CCOCC1C(=O)O Amb18202373 [1,0,0,1,0,0|2,0,0]=4 3130 B10R1.61 NC1CNCCC1C(=O)O Amb27790638 [1,0,0,1,0,0|2,0,0]=4 3131 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O Amb19148605 [1,0,0,1,0,0|1,0,0]=3 3132 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O Amb22224856 [1,0,0,1,0,0|1,0,0]=3 3133 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993721 [1,0,0,1,0,0|1,0,0]=3 3134 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993765 [1,0,0,1,0,0|1,0,0]=3 3135 B10R1.61 N[C@@H]1COCC[C@@H]1C(=O)O Amb23399726 [1,0,0,1,0,0|2,0,0]=4 3136 B10R1.61 N[C@@H]1COCC[C@@H]1C(=O)O Amb33484156 [1,0,0,1,0,0|2,0,0]=4 3137 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O Amb22224868 [1,0,0,1,0,0|1,0,0]=3 3138 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb1993720 [1,0,0,1,0,0|1,0,0]=3 3139 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb6365686 [1,0,0,1,0,0|1,0,0]=3 3140 B10R1.61 N[C@H]1CNCC[C@H]1C(=O)O Amb28345659 [1,0,0,1,0,0|2,0,0]=4 3141 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O Amb26014626 [1,0,0,1,0,0|2,0,0]=4 3142 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O Amb33482769 [1,0,0,1,0,0|2,0,0]=4 3143 B10R1.61 O=C(Cl)C1CCCCC1Cl Amb26539683 [1,0,0,1,0,0|2,0,0]=4 3144 B10R1.61 O=C(Cl)C1CCCCC1F Amb27663686 [1,0,0,1,0,0|2,0,0]=4 3145 B10R1.61 O=C(O)C1CCCCC1=O Amb16230759 [1,0,0,1,0,0|1,0,1]=4 3146 B10R1.61 O=C(O)C1CCCCC1=S Amb27657573 [1,0,0,1,0,0|1,0,1]=4 3147 B10R1.61 O=C(O)C1CCCCC1Br Amb27425110 [1,0,0,1,0,0|1,0,0]=3 3148 B10R1.61 O=C(O)C1CCCCC1Cl Amb18126348 [1,0,0,1,0,0|1,0,0]=3 3149 B10R1.61 O=C(O)C1CCCCC1F Amb32667613 [1,0,0,1,0,0|1,0,0]=3 3150 B10R1.61 O=C(O)C1CCCCC1O Amb2694762 [1,0,0,1,0,0|1,0,0]=3 3151 B10R1.61 O=C(O)C1CCCCN1O Amb24445203 [1,0,0,1,0,0|2,0,0]=4 3152 B10R1.61 O=C(O)C1CCNCC1F Amb24077319 [1,0,0,1,0,0|2,0,0]=4 3153 B10R1.61 O=C(O)C1CCNCC1F Amb25287074 [1,0,0,1,0,0|2,0,0]=4 3154 B10R1.61 O=C(O)C1CCOCC1F Amb27968266 [1,0,0,1,0,0|2,0,0]=4 3155 B10R1.61 O=C(O)C1CCSCC1F Amb28290523 [1,0,0,1,0,0|2,0,0]=4 3156 B10R1.61 O=C(O)C1CNCCC1F Amb24331967 [1,0,0,1,0,0|2,0,0]=4 3157 B10R1.61 O=C(O)C1NCCCC1O Amb18124725 [1,0,0,1,0,0|2,0,0]=4 3158 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1Cl Amb28288041 [1,0,0,1,0,0|1,0,0]=3 3159 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1O Amb16204296 [1,0,0,1,0,0|1,0,0]=3 3160 B10R1.61 O=C(O)[C@@H]1CCNC[C@H]1O Amb22748902 [1,0,0,1,0,0|2,0,0]=4 3161 B10R1.61 O=C(O)[C@@H]1NCCC[C@@H]1O Amb25214386 [1,0,0,1,0,0|2,0,0]=4 3162 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O Amb28411494 [1,0,0,1,0,0|2,0,0]=4 3163 B10R1.61 O=C(O)[C@H]1CCCC[C@@H]1Cl Amb27634391 [1,0,0,1,0,0|1,0,0]=3 3164 B10R1.61 O=C(O)[C@H]1CCCC[C@H]1O Amb4022448 [1,0,0,1,0,0|1,0,0]=3 3165 B10R1.61 O=C(O)[C@H]1CNCC[C@@H]1S Amb28199242 [1,0,0,1,0,0|2,0,0]=4 3166 B10R1.61 O=C(O)[C@H]1CNCC[C@H]1S Amb27444152 [1,0,0,1,0,0|2,0,0]=4 3167 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O Amb25340376 [1,0,0,1,0,0|2,0,0]=4 3168 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O Amb25912162 [1,0,0,1,0,0|2,0,0]=4 3169 B10R1.64 CC(=O)CC1CCCC1C Amb24480371 [1,0,0,1,0,0|1,0,0]=3 3170 B10R1.64 CC(=O)CC1CCCC1N Amb33130291 [1,0,0,1,0,0|2,0,0]=4 3171 B10R1.64 CC(=O)CC1CCCC1O Amb27171126 [1,0,0,1,0,0|2,0,0]=4 3172 B10R1.64 CC(=O)CC1CCCN1C Amb27259135 [1,0,0,1,0,0|2,0,0]=4 3173 B10R1.64 CC(=O)CC1CCOC1C Amb33427952 [1,0,0,1,0,0|2,0,0]=4 3174 B10R1.64 CC(=O)CC1CNCC1C Amb33132731 [1,0,0,1,0,0|2,0,0]=4 3175 B10R1.64 CC(=O)CC1OCCC1C Amb24722883 [1,0,0,1,0,0|2,0,0]=4 3176 B10R1.64 CC(=O)CN1CCCC1C Amb22292307 [1,0,0,1,0,0|2,0,0]=4 3177 B10R1.64 CC(=O)C[C@@H]1CCCN1C Amb19132763 [1,0,0,1,0,0|2,0,0]=4 3178 B10R1.64 CC(=O)C[C@@H]1CCC[C@H]1C Amb27768009 [1,0,0,1,0,0|1,0,0]=3 3179 B10R1.64 CC(=O)C[C@@H]1CCC[C@H]1N Amb33308036 [1,0,0,1,0,0|2,0,0]=4 3180 B10R1.64 CC(=O)C[C@@H]1CNC[C@H]1C Amb33132736 [1,0,0,1,0,0|2,0,0]=4 3181 B10R1.64 CC(=O)C[C@H]1CCCN1C Amb17615973 [1,0,0,1,0,0|2,0,0]=4 3182 B10R1.64 CC(=O)C[C@H]1COC[C@@H]1C Amb27844184 [1,0,0,1,0,0|2,0,0]=4 3183 B10R1.64 CC(=O)C[C@H]1OCC[C@@H]1C Amb27201954 [1,0,0,1,0,0|2,0,0]=4 3184 B10R1.64 CC1CCCC1CC(=O)O Amb2696312 [1,0,0,1,0,0|0,0,0]=2 3185 B10R1.64 CC1CCCC1CC(N)=O Amb27828187 [1,0,0,1,0,0|1,0,0]=3 3186 B10R1.64 CC1CCCC1NC(=O)Cl Amb35625932 [1,0,0,1,0,0|2,0,0]=4 3187 B10R1.64 CC1CCCN1CC(=O)O Amb18954282 [1,0,0,1,0,0|1,0,0]=3 3188 B10R1.64 CC1CCCN1CC(=O)O Amb32653298 [1,0,0,1,0,0|1,0,0]=3 3189 B10R1.64 CC1CCC\C1=C/C(=O)O Amb20622694 [1,0,0,1,0,0|0,0,2]=4 3190 B10R1.64 CC1CCNC1CC(=O)O Amb28059641 [1,0,0,1,0,0|1,0,0]=3 3191 B10R1.64 CC1CCOC1CC(=O)O Amb33620696 [1,0,0,1,0,0|1,0,0]=3 3192 B10R1.64 CC1CNCC1CC(=O)O Amb27643325 [1,0,0,1,0,0|1,0,0]=3 3193 B10R1.64 CC1CNCC1CC(=O)O Amb32753538 [1,0,0,1,0,0|1,0,0]=3 3194 B10R1.64 CC1COCC1CC(=O)O Amb35736018 [1,0,0,1,0,0|1,0,0]=3 3195 B10R1.64 CC1CSCC1CC(=O)O Amb28068257 [1,0,0,1,0,0|1,0,0]=3 3196 B10R1.64 CC1NCCC1CC(N)=O Amb27230373 [1,0,0,1,0,0|2,0,0]=4 3197 B10R1.64 CC1SCCC1CC(=O)O Amb18199391 [1,0,0,1,0,0|1,0,0]=3 3198 B10R1.64 CN1CCCC1CC(=O)O Amb22586774 [1,0,0,1,0,0|1,0,0]=3 3199 B10R1.64 CN1CCCC1CC(=O)O Amb8009896 [1,0,0,1,0,0|1,0,0]=3 3200 B10R1.64 CN1CCCC1CC(N)=O Amb27222533 [1,0,0,1,0,0|2,0,0]=4 3201 B10R1.64 C[C@@H]1CNC[C@H]1CC(=O)O Amb32683471 [1,0,0,1,0,0|1,0,0]=3 3202 B10R1.64 C[C@@H]1CNC[C@H]1CC(=O)O Amb32684495 [1,0,0,1,0,0|1,0,0]=3 3203 B10R1.64 C[C@@H]1NCC[C@H]1CC(=O)O Amb18202479 [1,0,0,1,0,0|1,0,0]=3 3204 B10R1.64 C[C@H]1CCC[C@@H]1CB(O)O Amb27650215 [1,0,0,1,0,0|1,0,1]=4 3205 B10R1.64 C[C@H]1NCC[C@@H]1CC(=O)O Amb27782907 [1,0,0,1,0,0|1,0,0]=3 3206 B10R1.64 NC(=O)CC1CCCC1N Amb27770579 [1,0,0,1,0,0|2,0,0]=4 3207 B10R1.64 NC(=O)C[C@@H]1CCC[C@H]1N Amb35725167 [1,0,0,1,0,0|2,0,0]=4 3208 B10R1.64 NC(=O)C[C@H]1CCC[C@H]1O Amb27253148 [1,0,0,1,0,0|2,0,0]=4 3209 B10R1.64 NC1CCCC1CC(=O)O Amb2694936 [1,0,0,1,0,0|1,0,0]=3 3210 B10R1.64 NC1CCCC1CC(=O)O Amb8630072 [1,0,0,1,0,0|1,0,0]=3 3211 B10R1.64 NC1CSCC1CC(=O)O Amb18199825 [1,0,0,1,0,0|2,0,0]=4 3212 B10R1.64 N[C@@H]1CCC[C@H]1CC(=O)O Amb26580643 [1,0,0,1,0,0|1,0,0]=3 3213 B10R1.64 N[C@@H]1CCC[C@H]1CC(=O)O Amb32664820 [1,0,0,1,0,0|1,0,0]=3 3214 B10R1.64 N[C@@H]1COC[C@H]1CC(=O)O Amb27627825 [1,0,0,1,0,0|2,0,0]=4 3215 B10R1.64 N[C@H]1CCC[C@@H]1CC(=O)O Amb27461253 [1,0,0,1,0,0|1,0,0]=3 3216 B10R1.64 N[C@H]1CCC[C@H]1CC(=O)O Amb34914988 [1,0,0,1,0,0|1,0,0]=3 3217 B10R1.64 O=C(O)CC1CCCC1=O Amb18643831 [1,0,0,1,0,0|1,0,1]=4 3218 B10R1.64 O=C(O)CC1CCCC1O Amb18202404 [1,0,0,1,0,0|1,0,0]=3 3219 B10R1.64 O=C(O)CC1CNCC1F Amb27434632 [1,0,0,1,0,0|2,0,0]=4 3220 B10R1.64 O=C(O)CC1CNCC1O Amb27789865 [1,0,0,1,0,0|2,0,0]=4 3221 B10R1.64 O=C(O)CC1NCCC1F Amb32990262 [1,0,0,1,0,0|2,0,0]=4 3222 B10R1.64 O=C(O)CN1CCC[C@@H]1O Amb10067047 [1,0,0,1,0,0|2,0,0]=4 3223 B10R1.64 O=C(O)C[C@@H]1CCC[C@H]1O Amb25960224 [1,0,0,1,0,0|1,0,0]=3 3224 B10R1.64 O=C(O)C[C@@H]1COC[C@H]1O Amb32904239 [1,0,0,1,0,0|2,0,0]=4 3225 B10R1.64 O=C(O)C[C@H]1CCC[C@H]1O Amb27489875 [1,0,0,1,0,0|1,0,0]=3 3226 B10R1.64 O=C(O)C[C@H]1NCC[C@@H]1O Amb20242369 [1,0,0,1,0,0|2,0,0]=4 3227 B10R1.66 CC(=O)CCC1CCCC1 Amb19374837 [1,0,0,1,0,0|1,0,0]=3 3228 B10R1.66 CC(=O)CCC1CCCN1 Amb24363350 [1,0,0,1,0,0|2,0,0]=4 3229 B10R1.66 CC(=O)CCC1CCCO1 Amb4056391 [1,0,0,1,0,0|2,0,0]=4 3230 B10R1.66 CC(=O)CCC1CCCS1 Amb33416798 [1,0,0,1,0,0|2,0,0]=4 3231 B10R1.66 CC(=O)CCC1CCNC1 Amb28050353 [1,0,0,1,0,0|2,0,0]=4 3232 B10R1.66 CC(=O)CCC1CCOC1 Amb25271586 [1,0,0,1,0,0|2,0,0]=4 3233 B10R1.66 CC(=O)CCC1CCSC1 Amb33141522 [1,0,0,1,0,0|2,0,0]=4 3234 B10R1.66 CC(=O)CCN1CCCC1 Amb1127641 [1,0,0,1,0,0|2,0,0]=4 3235 B10R1.66 CC(=O)CNC1CCCC1 Amb25291662 [1,0,0,1,0,0|2,0,0]=4 3236 B10R1.66 CC(=O)OCC1CCCC1 Amb27856070 [1,0,0,1,0,0|2,0,0]=4 3237 B10R1.66 CC(=O)SCC1CCCC1 Amb25169354 [1,0,0,1,0,0|2,0,0]=4 3238 B10R1.66 CC(O)CCC1CCCC1 Amb25852366 [1,0,0,1,0,0|1,0,1]=4 3239 B10R1.66 CN(O)CCC1CCCC1 Amb33378683 [1,0,0,1,0,0|2,0,0]=4 3240 B10R1.66 C[C@@H](O)CCC1CCCC1 Amb33315752 [1,0,0,1,0,0|1,0,1]=4 3241 B10R1.66 C[C@H](O)CCC1CCCC1 Amb33315753 [1,0,0,1,0,0|1,0,1]=4 3242 B10R1.66 N=C(N)CCC1CCCC1 Amb26504801 [1,0,0,1,0,0|2,0,0]=4 3243 B10R1.66 NC(=O)CCC1CCCC1 Amb3742782 [1,0,0,1,0,0|1,0,0]=3 3244 B10R1.66 NC(=O)CCC1CCOC1 Amb28125489 [1,0,0,1,0,0|2,0,0]=4 3245 B10R1.66 NC(=O)CCN1CCCC1 Amb17142863 [1,0,0,1,0,0|2,0,0]=4 3246 B10R1.66 NC(=O)CCN1CCCC1 Amb28895968 [1,0,0,1,0,0|2,0,0]=4 3247 B10R1.66 NC(=O)CNC1CCCC1 Amb1121300 [1,0,0,1,0,0|2,0,0]=4 3248 B10R1.66 NC(=O)CNC1CCCC1 Amb19373254 [1,0,0,1,0,0|2,0,0]=4 3249 B10R1.66 NC(=O)COC1CCCC1 Amb22523400 [1,0,0,1,0,0|2,0,0]=4 3250 B10R1.66 NC(=S)CCC1CCCC1 Amb26037198 [1,0,0,1,0,0|1,1,0]=4 3251 B10R1.66 NS(=O)CCC1CCCC1 Amb32720445 [1,0,0,1,0,0|2,0,0]=4 3252 B10R1.66 O=C(Cl)CCC1CCCC1 Amb3939147 [1,0,0,1,0,0|1,0,0]=3 3253 B10R1.66 O=C(Cl)CCC1CCCO1 Amb27480205 [1,0,0,1,0,0|2,0,0]=4 3254 B10R1.66 O=C(Cl)CCC1CCOC1 Amb27846285 [1,0,0,1,0,0|2,0,0]=4 3255 B10R1.66 O=C(Cl)NCC1CCCC1 Amb35625671 [1,0,0,1,0,0|2,0,0]=4 3256 B10R1.66 O=C(Cl)OCC1CCCC1 Amb27652154 [1,0,0,1,0,0|2,0,0]=4 3257 B10R1.66 O=C(O)C#CC1CCCC1 Amb26613602 [1,0,0,1,0,0|0,0,2]=4 3258 B10R1.66 O=C(O)CCC1=CCCC1 Amb27591549 [1,0,0,1,0,0|0,0,2]=4 3259 B10R1.66 O=C(O)CCC1CC=CC1 Amb27619695 [1,0,0,1,0,0|0,0,2]=4 3260 B10R1.66 O=C(O)CCC1CCCC1 Amb2792875 [1,0,0,1,0,0|0,0,0]=2 3261 B10R1.66 O=C(O)CCC1CCCN1 Amb28895981 [1,0,0,1,0,0|1,0,0]=3 3262 B10R1.66 O=C(O)CCC1CCCN1 Amb8630849 [1,0,0,1,0,0|1,0,0]=3 3263 B10R1.66 O=C(O)CCC1CCCO1 Amb9776130 [1,0,0,1,0,0|1,0,0]=3 3264 B10R1.66 O=C(O)CCC1CCCS1 Amb18645411 [1,0,0,1,0,0|1,0,0]=3 3265 B10R1.66 O=C(O)CCC1CCNC1 Amb20668417 [1,0,0,1,0,0|1,0,0]=3 3266 B10R1.66 O=C(O)CCC1CCNC1 Amb22059448 [1,0,0,1,0,0|1,0,0]=3 3267 B10R1.66 O=C(O)CCC1CCOC1 Amb18296305 [1,0,0,1,0,0|1,0,0]=3 3268 B10R1.66 O=C(O)CCC1CCSC1 Amb18199268 [1,0,0,1,0,0|1,0,0]=3 3269 B10R1.66 O=C(O)CCC1OCCO1 Amb10605303 [1,0,0,1,0,0|2,0,0]=4 3270 B10R1.66 O=C(O)CCN1CCCC1 Amb15740874 [1,0,0,1,0,0|1,0,0]=3 3271 B10R1.66 O=C(O)CCN1CCCC1 Amb6356101 [1,0,0,1,0,0|1,0,0]=3 3272 B10R1.66 O=C(O)CCN1CCCO1 Amb22586923 [1,0,0,1,0,0|2,0,0]=4 3273 B10R1.66 O=C(O)CCN1CCCO1 Amb8009618 [1,0,0,1,0,0|2,0,0]=4 3274 B10R1.66 O=C(O)CC[C@@H]1CCCN1 Amb22745695 [1,0,0,1,0,0|1,0,0]=3 3275 B10R1.66 O=C(O)CC[C@@H]1CCCN1 Amb33291298 [1,0,0,1,0,0|1,0,0]=3 3276 B10R1.66 O=C(O)CC[C@H]1CCCN1 Amb26602714 [1,0,0,1,0,0|1,0,0]=3 3277 B10R1.66 O=C(O)CC[C@H]1CCCN1 Amb33868957 [1,0,0,1,0,0|1,0,0]=3 3278 B10R1.66 O=C(O)CC[S+]1CCCC1 Amb27863517 [1,0,0,1,0,0|1,0,0]=3 3279 B10R1.66 O=C(O)CN=C1CCCC1 Amb27624290 [1,0,0,1,0,0|1,0,1]=4 3280 B10R1.66 O=C(O)CNC1CCCC1 Amb1109994 [1,0,0,1,0,0|1,0,0]=3 3281 B10R1.66 O=C(O)CNC1CCCC1 Amb34914964 [1,0,0,1,0,0|1,0,0]=3 3282 B10R1.66 O=C(O)CNC1CCSC1 Amb8827748 [1,0,0,1,0,0|2,0,0]=4 3283 B10R1.66 O=C(O)COC1CCCC1 Amb6258899 [1,0,0,1,0,0|1,0,0]=3 3284 B10R1.66 O=C(O)COC1CCCO1 Amb26609205 [1,0,0,1,0,0|2,0,0]=4 3285 B10R1.66 O=C(O)COC1CCOC1 Amb20623899 [1,0,0,1,0,0|2,0,0]=4 3286 B10R1.66 O=C(O)COC1CCSC1 Amb28436563 [1,0,0,1,0,0|2,0,0]=4 3287 B10R1.66 O=C(O)CO[C@@H]1CCNC1 Amb33330500 [1,0,0,1,0,0|2,0,0]=4 3288 B10R1.66 O=C(O)CO[C@@H]1CCNC1 Amb33339046 [1,0,0,1,0,0|2,0,0]=4 3289 B10R1.66 O=C(O)CO[C@@H]1CCOC1 Amb32946276 [1,0,0,1,0,0|2,0,0]=4 3290 B10R1.66 O=C(O)CO[C@H]1CCNC1 Amb33330499 [1,0,0,1,0,0|2,0,0]=4 3291 B10R1.66 O=C(O)CO[C@H]1CCNC1 Amb33330621 [1,0,0,1,0,0|2,0,0]=4 3292 B10R1.66 O=C(O)CO[C@H]1CCOC1 Amb28252407 [1,0,0,1,0,0|2,0,0]=4 3293 B10R1.66 O=C(O)CSC1CCCC1 Amb6273990 [1,0,0,1,0,0|1,0,0]=3 3294 B10R1.66 O=C(O)\C=C/C1CCCC1 Amb28072852 [1,0,0,1,0,0|0,0,2]=4 3295 B10R1.66 O=C(O)\C=C\C1CCCC1 Amb18285121 [1,0,0,1,0,0|0,0,2]=4 3296 B10R1.66 O=C([O-])CCN1CCCC1 Amb7969625 [1,0,0,1,0,0|1,0,1]=4 3297 B10R1.66 O=S(Cl)CCC1CCCC1 Amb32720444 [1,0,0,1,0,0|2,0,0]=4 3298 B10R1.66 O=S([O-])CCC1CCCC1 Amb32755554 [1,0,0,1,0,0|1,0,1]=4 3299 B10R1.66 O=[N+]([O-])CCC1CCCC1 Amb33315743 [1,0,0,1,0,0|1,0,1]=4 3300 B10R1.73 CC1CC1CCCC(=O)O Amb25921322 [1,0,0,1,0,0|0,0,0]=2 3301 B10R1.73 CC1CC1CNCC(N)=O Amb27164882 [1,0,0,1,0,0|2,0,0]=4 3302 B10R1.73 CC1CC1NCCC(=O)O Amb19025693 [1,0,0,1,0,0|1,0,0]=3 3303 B10R1.73 CC1CC1NCCC(N)=O Amb18310753 [1,0,0,1,0,0|2,0,0]=4 3304 B10R1.73 C[C@@H]1C[C@@H]1CCCC(=O)O Amb27494069 [1,0,0,1,0,0|0,0,0]=2 3305 B10R1.77 C[C@@H]1CCCCC[C@@H](O)C1 Amb27981954 [1,0,0,1,0,0|1,0,1]=4 3306 B10R1.77 O=C1CCCCCC(=O)O1 Amb26512145 [1,0,0,1,0,0|1,0,1]=4 3307 B10R1.78 O=C1C#CCCCCCC1 Amb27409529 [1,0,0,1,0,0|1,0,1]=4 3308 B10R1.78 O=C1C=CCCCCCC1 Amb22363956 [1,0,0,1,0,0|1,0,1]=4 3309 B10R1.78 O=C1CCCCCCCC1 Amb16185450 [1,0,0,1,0,0|1,0,0]=3 3310 B10R1.78 O=C1CCCCCCCN1 Amb8513494 [1,0,0,1,0,0|1,0,0]=3 3311 B10R1.78 O=C1CCCCOCCN1 Amb27201667 [1,0,0,1,0,0|2,0,0]=4 3312 B10R1.78 O=C1CCCCSCCC1 Amb28144124 [1,0,0,1,0,0|2,0,0]=4 3313 B10R1.78 OC1CCCCCCCC1 Amb26514614 [1,0,0,1,0,0|1,0,1]=4 3314 B10R1.78 OC1CCCCCCCO1 Amb27219804 [1,0,0,1,0,0|0,0,2]=4 3315 B10R1.86 CCCC1CCN1C(N)=O Amb27223621 [1,0,0,1,0,0|2,0,0]=4 3316 B10R1.86 CCCN1CCC1C(=O)O Amb22011891 [1,0,0,1,0,0|1,0,0]=3 3317 B10R1.86 CCCN1CC[C@@H]1C(=O)O Amb30869401 [1,0,0,1,0,0|1,0,0]=3 3318 B10R1.86 CCCN1CC[C@H]1C(=O)O Amb33801596 [1,0,0,1,0,0|1,0,0]=3 3319 B10R1.86 O=C(O)C1CCC1CCF Amb27229342 [1,0,0,1,0,0|1,0,0]=3 3320 B10R1.86 O=C(O)[C@@H]1CCN1CCF Amb32643949 [1,0,0,1,0,0|2,0,0]=4 3321 B10R1.97 CCCC1CC1NC(=O)Cl Amb35633481 [1,0,0,1,0,0|2,0,0]=4 3322 B10R1.126 CC(=O)CCNCC1CC1 Amb33307828 [1,0,0,1,0,0|2,0,0]=4 3323 B10R1.126 CC(=O)CSCCC1CC1 Amb27650340 [1,0,0,1,0,0|2,0,0]=4 3324 B10R1.126 CC(=O)NCCCC1CC1 Amb28060659 [1,0,0,1,0,0|2,0,0]=4 3325 B10R1.126 CC(=O)SCCCC1CC1 Amb32680259 [1,0,0,1,0,0|2,0,0]=4 3326 B10R1.126 CC(O)CCCCC1CC1 Amb27839308 [1,0,0,1,0,0|1,0,1]=4 3327 B10R1.126 NC(=O)CCCNC1CC1 Amb28281193 [1,0,0,1,0,0|2,0,0]=4 3328 B10R1.126 NC(=O)CCOCC1CC1 Amb27463679 [1,0,0,1,0,0|2,0,0]=4 3329 B10R1.126 O=C(O)CCCCC1CC1 Amb24480443 [1,0,0,1,0,0|0,0,0]=2 3330 B10R1.126 O=C(O)CCNCC1CC1 Amb7766419 [1,0,0,1,0,0|1,0,0]=3 3331 B10R1.126 O=C(O)CCOCC1CC1 Amb6680907 [1,0,0,1,0,0|1,0,0]=3 3332 B10R1.126 O=C(O)CCSCC1CC1 Amb9422823 [1,0,0,1,0,0|1,0,0]=3 3333 B10R1.127 CC(=O)CCCC1COC1 Amb27866248 [1,0,0,1,0,0|2,0,0]=4 3334 B10R1.127 CC(=O)CCCN1CCC1 Amb27663262 [1,0,0,1,0,0|2,0,0]=4 3335 B10R1.127 CC(=O)CCNC1CCC1 Amb32675825 [1,0,0,1,0,0|2,0,0]=4 3336 B10R1.127 CC(=O)CSCC1CCC1 Amb27753589 [1,0,0,1,0,0|2,0,0]=4 3337 B10R1.127 CC(=O)OCCC1CCC1 Amb27981998 [1,0,0,1,0,0|2,0,0]=4 3338 B10R1.127 CC(O)CCCC1CCC1 Amb27959698 [1,0,0,1,0,0|1,0,1]=4 3339 B10R1.127 O=C(Cl)NCCC1CCC1 Amb35633269 [1,0,0,1,0,0|2,0,0]=4 3340 B10R1.127 O=C(O)C#CCC1CCC1 Amb27615169 [1,0,0,1,0,0|0,0,2]=4 3341 B10R1.127 O=C(O)CCCC1CCC1 Amb26345789 [1,0,0,1,0,0|0,0,0]=2 3342 B10R1.127 O=C(O)CCCC1CSC1 Amb27968148 [1,0,0,1,0,0|1,0,0]=3 3343 B10R1.127 O=C(O)CCNN1CCC1 Amb32658350 [1,0,0,1,0,0|2,0,0]=4 3344 B10R1.127 O=C(O)CCOC1COC1 Amb25783190 [1,0,0,1,0,0|2,0,0]=4 3345 B10R1.127 O=C(O)CCOC1CSC1 Amb27870269 [1,0,0,1,0,0|2,0,0]=4 3346 B10R1.127 O=C(O)COCC1CCC1 Amb24417123 [1,0,0,1,0,0|1,0,0]=3 3347 B10R1.127 O=C(O)COCC1CCN1 Amb27968240 [1,0,0,1,0,0|2,0,0]=4 3348 B10R1.127 O=C(O)COCC1COC1 Amb27621603 [1,0,0,1,0,0|2,0,0]=4 3349 B10R1.127 O=C(O)COCC1CSC1 Amb27638952 [1,0,0,1,0,0|2,0,0]=4 3350 B10R1.127 O=C(O)CSCC1CCC1 Amb28071843 [1,0,0,1,0,0|1,0,0]=3 3351 B10R1.144 CCCCC1=C[C@@H]1C(=O)O Amb27258425 [1,0,0,1,0,0|0,0,2]=4 3352 B10R1.144 CCCCC1CC1B(O)O Amb26982121 [1,0,0,1,0,0|1,0,1]=4 3353 B10R1.144 CCCCC1CC1C(=O)O Amb10608641 [1,0,0,1,0,0|0,0,0]=2 3354 B10R1.144 CCCCC1CC1C(C)O Amb27191849 [1,0,0,1,0,0|1,0,1]=4 3355 B10R1.144 CCCCC1OC1C(C)=O Amb27750786 [1,0,0,1,0,0|2,0,0]=4 3356 B10R1.144 CCCC[C@@H]1C[C@@H]1C(C)=O Amb27619227 [1,0,0,1,0,0|1,0,0]=3 3357 B10R1.144 CCCC[C@@H]1C[C@@H]1[C@H](C)O Amb28138611 [1,0,0,1,0,0|1,0,1]=4 3358 B10R1.144 CCCC[C@@H]1C[C@H]1B(O)O Amb27644880 [1,0,0,1,0,0|1,0,1]=4 3359 B10R1.144 CCCC[C@@H]1C[C@H]1C(=O)O Amb25960764 [1,0,0,1,0,0|0,0,0]=2 3360 B10R1.144 CCCC[C@@H]1O[C@H]1C(=O)O Amb24585157 [1,0,0,1,0,0|1,0,0]=3 3361 B10R1.144 CCCC[C@@H]1O[C@H]1C(C)=O Amb28244724 [1,0,0,1,0,0|2,0,0]=4 3362 B10R1.144 CCCC[C@H]1C[C@@H]1B(O)O Amb27475274 [1,0,0,1,0,0|1,0,1]=4 3363 B10R1.144 CCOCC1CC1C(=O)O Amb28071192 [1,0,0,1,0,0|1,0,0]=3 3364 B10R1.144 CCOC[C@@H]1C[C@H]1C(=O)O Amb26947700 [1,0,0,1,0,0|1,0,0]=3 3365 B10R1.144 CCSCC1CC1C(=O)O Amb33324041 [1,0,0,1,0,0|1,0,0]=3 3366 B10R1.144 CCSC[C@@H]1C[C@H]1C(=O)O Amb33324038 [1,0,0,1,0,0|1,0,0]=3 3367 B10R1.144 CC\C=C\C1CC1C(=O)O Amb33080031 [1,0,0,1,0,0|0,0,2]=4 3368 B10R1.144 CC\C=C\[C@@H]1C[C@H]1C(=O)O Amb33269506 [1,0,0,1,0,0|0,0,2]=4 3369 B10R1.144 COCCC1CC1C(=O)O Amb33377829 [1,0,0,1,0,0|1,0,0]=3 3370 B10R1.144 COCC[C@@H]1C[C@H]1C(=O)O Amb33377827 [1,0,0,1,0,0|1,0,0]=3 3371 B10R1.144 CSCCC1CC1C(=O)O Amb33198761 [1,0,0,1,0,0|1,0,0]=3 3372 B10R1.144 CSCC[C@@H]1C[C@H]1C(=O)O Amb33198757 [1,0,0,1,0,0|1,0,0]=3 3373 B10R1.156 CCC1CC1CNC(=O)Cl Amb35633499 [1,0,0,1,0,0|2,0,0]=4 3374 B10R1.156 CC[C@@H]1C[C@H]1CNC(=O)Cl Amb35636906 [1,0,0,1,0,0|2,0,0]=4 3375 B10R1.156 CC[C@@H]1C[C@H]1CNC(C)=O Amb27471144 [1,0,0,1,0,0|2,0,0]=4 3376 B10R1.156 CC[C@@H]1C[C@H]1CNC(N)=O Amb27228042 [1,0,0,1,0,0|2,0,0]=4 3377 B10R1.162 CCC1CCCCC(=O)C1 Amb28126018 [1,0,0,1,0,0|1,0,0]=3 3378 B10R1.162 CCC1CCCNC(=O)C1 Amb27627781 [1,0,0,1,0,0|2,0,0]=4 3379 B10R1.162 CCC1CSCCC(=O)N1 Amb28068841 [1,0,0,1,0,0|2,0,0]=4 3380 B10R1.162 CC[C@@H]1CCCCC(=O)C1 Amb27236500 [1,0,0,1,0,0|1,0,0]=3 3381 B10R1.162 CC[C@H]1CCCCC(=O)C1 Amb27615128 [1,0,0,1,0,0|1,0,0]=3 3382 B10R1.162 NCC1CCCCC(=O)N1 Amb19515401 [1,0,0,1,0,0|2,0,0]=4 3383 B10R1.162 O=C1CCCCC(CBr)O1 Amb28342313 [1,0,0,1,0,0|1,0,0]=3 3384 B10R1.162 O=C1CCCCC(CCl)N1 Amb19515430 [1,0,0,1,0,0|2,0,0]=4 3385 B10R1.162 O=C1CCCCC(CO)N1 Amb19515428 [1,0,0,1,0,0|2,0,0]=4 3386 B10R1.162 O=C1CCCCC(CO)O1 Amb27663769 [1,0,0,1,0,0|1,0,0]=3 3387 B10R1.162 O=C1CCCCC(CO)S1 Amb27850067 [1,0,0,1,0,0|1,1,0]=4 3388 B10R1.162 O=C1CCCC[C@@H](CO)N1 Amb24117963 [1,0,0,1,0,0|2,0,0]=4 3389 B10R1.173 CCC1CCN1CC(N)=O Amb27835541 [1,0,0,1,0,0|2,0,0]=4 3390 B10R1.173 CCN1CCC1CC(=O)O Amb27238754 [1,0,0,1,0,0|1,0,0]=3 3391 B10R1.173 CNC1CCC1CC(N)=O Amb27852280 [1,0,0,1,0,0|2,0,0]=4 3392 B10R1.177 CCCCCCCC1CO1 Amb26986702 [1,0,0,1,0,0|1,0,1]=4 3393 B10R1.177 CCCCCCC[C@@H]1CO1 Amb27175386 [1,0,0,1,0,0|1,0,1]=4 3394 B10R1.295 CC1(O)CCCCCCC1 Amb4034573 [1,0,0,1,0,0|1,0,1]=4 3395 B10R1.300 CC1CCCCCC1(C)O Amb35721262 [1,0,0,1,0,0|1,0,1]=4 3396 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [1,0,0,1,0,0|1,0,0]=3 3397 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [1,0,0,1,0,0|2,0,0]=4 3398 B10R1.348 CC(=O)C1CCCOCC1 Amb27772516 [1,0,0,1,0,0|2,0,0]=4 3399 B10R1.348 CC(=O)C1CCCSCC1 Amb30031083 [1,0,0,1,0,0|2,0,0]=4 3400 B10R1.348 CC(=O)N1CCCCCC1 Amb6340881 [1,0,0,1,0,0|2,0,0]=4 3401 B10R1.348 CC(O)C1CCCCCC1 Amb24712689 [1,0,0,1,0,0|1,0,1]=4 3402 B10R1.348 C[C@@H](O)C1CCCCCC1 Amb27801050 [1,0,0,1,0,0|1,0,1]=4 3403 B10R1.348 C[C@H](O)C1CCCCCC1 Amb27248256 [1,0,0,1,0,0|1,0,1]=4 3404 B10R1.348 N=C(N)C1CCCCCC1 Amb2696076 [1,0,0,1,0,0|2,0,0]=4 3405 B10R1.348 N=C(N)C1CCCCCC1 Amb33803881 [1,0,0,1,0,0|2,0,0]=4 3406 B10R1.348 NC(=O)C1CCCCCC1 Amb24182051 [1,0,0,1,0,0|1,0,0]=3 3407 B10R1.348 NC(=O)C1CCCCCN1 Amb23596651 [1,0,0,1,0,0|2,0,0]=4 3408 B10R1.348 NC(=O)C1CCCCNC1 Amb27483476 [1,0,0,1,0,0|2,0,0]=4 3409 B10R1.348 NC(=O)C1CCCSCC1 Amb30030983 [1,0,0,1,0,0|2,0,0]=4 3410 B10R1.348 NC(=O)N1CCCCCC1 Amb1107239 [1,0,0,1,0,0|2,0,0]=4 3411 B10R1.348 NC(=S)C1CCCCCC1 Amb27787519 [1,0,0,1,0,0|1,1,0]=4 3412 B10R1.348 NS(=O)C1CCCCCC1 Amb32720551 [1,0,0,1,0,0|2,0,0]=4 3413 B10R1.348 O=C(Cl)C1CCCCCC1 Amb18797932 [1,0,0,1,0,0|1,0,0]=3 3414 B10R1.348 O=C(Cl)C1CCCSCC1 Amb35649671 [1,0,0,1,0,0|2,0,0]=4 3415 B10R1.348 O=C(Cl)N1CCCCCC1 Amb17563067 [1,0,0,1,0,0|2,0,0]=4 3416 B10R1.348 O=C(O)C1=CCCCCC1 Amb26605756 [1,0,0,1,0,0|0,0,2]=4 3417 B10R1.348 O=C(O)C1CCC=CCC1 Amb22364688 [1,0,0,1,0,0|0,0,2]=4 3418 B10R1.348 O=C(O)C1CCCCCC1 Amb2721236 [1,0,0,1,0,0|0,0,0]=2 3419 B10R1.348 O=C(O)C1CCCCCN1 Amb542684 [1,0,0,1,0,0|1,0,0]=3 3420 B10R1.348 O=C(O)C1CCCCCN1 Amb8504180 [1,0,0,1,0,0|1,0,0]=3 3421 B10R1.348 O=C(O)C1CCCCCO1 Amb28294213 [1,0,0,1,0,0|1,0,0]=3 3422 B10R1.348 O=C(O)C1CCCCNC1 Amb30586509 [1,0,0,1,0,0|1,0,0]=3 3423 B10R1.348 O=C(O)C1CCCCNC1 Amb8630383 [1,0,0,1,0,0|1,0,0]=3 3424 B10R1.348 O=C(O)C1CCCCNN1 Amb28287718 [1,0,0,1,0,0|2,0,0]=4 3425 B10R1.348 O=C(O)C1CCCNCC1 Amb18831588 [1,0,0,1,0,0|1,0,0]=3 3426 B10R1.348 O=C(O)C1CCCNCC1 Amb33189342 [1,0,0,1,0,0|1,0,0]=3 3427 B10R1.348 O=C(O)C1CCCOCC1 Amb18831505 [1,0,0,1,0,0|1,0,0]=3 3428 B10R1.348 O=C(O)C1CCCSCC1 Amb18199262 [1,0,0,1,0,0|1,0,0]=3 3429 B10R1.348 O=C(O)C1CCNCCO1 Amb27632727 [1,0,0,1,0,0|2,0,0]=4 3430 B10R1.348 O=C(O)C1CNCCCN1 Amb25890339 [1,0,0,1,0,0|2,0,0]=4 3431 B10R1.348 O=C(O)C1CNCCCN1 Amb28896027 [1,0,0,1,0,0|2,0,0]=4 3432 B10R1.348 O=C(O)C1CNCCCO1 Amb17739810 [1,0,0,1,0,0|2,0,0]=4 3433 B10R1.348 O=C(O)C1CNCCOC1 Amb27600407 [1,0,0,1,0,0|2,0,0]=4 3434 B10R1.348 O=C(O)C1CNCCOC1 Amb32664315 [1,0,0,1,0,0|2,0,0]=4 3435 B10R1.348 O=C(O)C1CNCCSC1 Amb27813931 [1,0,0,1,0,0|2,0,0]=4 3436 B10R1.348 O=C(O)C1COCCOC1 Amb26443379 [1,0,0,1,0,0|2,0,0]=4 3437 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb2699229 [1,0,0,1,0,0|1,0,0]=3 3438 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb8630384 [1,0,0,1,0,0|1,0,0]=3 3439 B10R1.348 O=C(O)[C@@H]1CCCNCC1 Amb27411309 [1,0,0,1,0,0|1,0,0]=3 3440 B10R1.348 O=C(O)[C@@H]1CCCOCC1 Amb27839414 [1,0,0,1,0,0|1,0,0]=3 3441 B10R1.348 O=C(O)[C@@H]1CSCCCN1 Amb28121128 [1,0,0,1,0,0|2,0,0]=4 3442 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb27770395 [1,0,0,1,0,0|1,0,0]=3 3443 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb33299452 [1,0,0,1,0,0|1,0,0]=3 3444 B10R1.348 O=C(O)[C@H]1CCCNCC1 Amb24479341 [1,0,0,1,0,0|1,0,0]=3 3445 B10R1.348 O=C(O)[C@H]1CCCOCC1 Amb27604305 [1,0,0,1,0,0|1,0,0]=3 3446 B10R1.348 O=S(Cl)C1CCCCCC1 Amb32720550 [1,0,0,1,0,0|2,0,0]=4 3447 B10R1.348 O=S([O-])C1CCCCCC1 Amb32754517 [1,0,0,1,0,0|1,0,1]=4 3448 B10R1.348 O=[N+]([O-])C1CCCCCC1 Amb4036167 [1,0,0,1,0,0|1,0,1]=4 3449 B10R1.4 C=C1CCCCC1CCBr Amb28437183 [1,0,0,1,0,0|2,0,0]=4 3450 B10R1.4 C=C1CCCCC1CCO Amb27839461 [1,0,0,1,0,0|2,0,0]=4 3451 B10R1.4 C=CCC1CCCCC1=O Amb2720504 [1,0,0,1,0,0|0,0,2]=4 3452 B10R1.4 C=CCC1CCCCC1Cl Amb18800074 [1,0,0,1,0,0|2,0,0]=4 3453 B10R1.4 C=CCC1CCCCC1N Amb18285972 [1,0,0,1,0,0|2,0,0]=4 3454 B10R1.4 C=CCC1CCCCC1O Amb17939272 [1,0,0,1,0,0|2,0,0]=4 3455 B10R1.4 C=CCC1NCCCC1C Amb27763454 [1,0,0,1,0,0|2,0,0]=4 3456 B10R1.4 C=CC[C@@H]1CCCC[C@@H]1O Amb27208223 [1,0,0,1,0,0|2,0,0]=4 3457 B10R1.4 C=CC[C@@H]1CCCC[C@H]1O Amb22801953 [1,0,0,1,0,0|2,0,0]=4 3458 B10R1.4 C=CC[C@H]1CCCC[C@@H]1N Amb27969775 [1,0,0,1,0,0|2,0,0]=4 3459 B10R1.4 C=CC[C@H]1CCCC[C@H]1O Amb28133377 [1,0,0,1,0,0|2,0,0]=4 3460 B10R1.4 CC#CC1CCCCC1=O Amb24736857 [1,0,0,1,0,0|0,0,2]=4 3461 B10R1.4 CC1CC=CCC1CC=O Amb27256521 [1,0,0,1,0,0|0,0,2]=4 3462 B10R1.4 CC1CCCCC1CCBr Amb25268141 [1,0,0,1,0,0|1,0,1]=4 3463 B10R1.4 CC1CCCCC1CCCl Amb24480580 [1,0,0,1,0,0|1,0,1]=4 3464 B10R1.4 CC1CCCCC1CCN Amb17226686 [1,0,0,1,0,0|1,0,1]=4 3465 B10R1.4 CC1CCCCC1CCO Amb28050625 [1,0,0,1,0,0|0,0,1]=3 3466 B10R1.4 CC1CCCCC1N=C=O Amb17506222 [1,0,0,1,0,0|1,0,1]=4 3467 B10R1.4 CC1CCCCC1NC=O Amb27589339 [1,0,0,1,0,0|1,0,0]=3 3468 B10R1.4 CC1CCCCC1\C=C\Br Amb33135579 [1,0,0,1,0,0|1,0,1]=4 3469 B10R1.4 CC1CCCCN1CCO Amb9370152 [1,0,0,1,0,0|1,0,1]=4 3470 B10R1.4 CC1CCCC\C1=C/C=O Amb25951883 [1,0,0,1,0,0|0,0,2]=4 3471 B10R1.4 CC1CCCNC1CCO Amb27391619 [1,0,0,1,0,0|1,0,1]=4 3472 B10R1.4 CC1CNCCN1CC=O Amb27442045 [1,0,0,1,0,0|2,0,0]=4 3473 B10R1.4 CC1CSCCN1CC=O Amb27837574 [1,0,0,1,0,0|2,0,0]=4 3474 B10R1.4 CCCC1=CCCCC1=O Amb24722898 [1,0,0,1,0,0|0,0,2]=4 3475 B10R1.4 CCCC1CCC=CC1=O Amb27750345 [1,0,0,1,0,0|0,0,2]=4 3476 B10R1.4 CCCC1CCCCC1=O Amb22228916 [1,0,0,1,0,0|0,0,0]=2 3477 B10R1.4 CCCC1CCCCC1C Amb22227983 [1,0,0,1,0,0|1,0,1]=4 3478 B10R1.4 CCCC1CCCCC1N Amb18282859 [1,0,0,1,0,0|1,0,1]=4 3479 B10R1.4 CCCC1CCCCC1O Amb4016404 [1,0,0,1,0,0|0,0,1]=3 3480 B10R1.4 CCCC1CCCCN1N Amb24478422 [1,0,0,1,0,0|2,0,0]=4 3481 B10R1.4 CCCC1CCCNC1=O Amb27475482 [1,0,0,1,0,0|1,0,0]=3 3482 B10R1.4 CCCC1CCCOC1=O Amb25068420 [1,0,0,1,0,0|1,0,0]=3 3483 B10R1.4 CCCC1CCNCC1=O Amb27629020 [1,0,0,1,0,0|1,0,0]=3 3484 B10R1.4 CCCC1CSCCC1=O Amb24736412 [1,0,0,1,0,0|1,0,0]=3 3485 B10R1.4 CCCC1NCCNC1=O Amb18960335 [1,0,0,1,0,0|2,0,0]=4 3486 B10R1.4 CCCN1CCCCC1=S Amb25348522 [1,0,0,1,0,0|1,1,0]=4 3487 B10R1.4 CCCN1CCCNC1=O Amb28049410 [1,0,0,1,0,0|2,0,0]=4 3488 B10R1.4 CCCN1CCNCC1=O Amb18285094 [1,0,0,1,0,0|2,0,0]=4 3489 B10R1.4 CCCN1CCNCC1=O Amb22586868 [1,0,0,1,0,0|2,0,0]=4 3490 B10R1.4 CCCN1CCNCC1=O Amb32412620 [1,0,0,1,0,0|2,0,0]=4 3491 B10R1.4 CCC[C@@H]1CCCCC1=O Amb25146733 [1,0,0,1,0,0|0,0,0]=2 3492 B10R1.4 CCC[C@@H]1CCCC[C@@H]1O Amb28053539 [1,0,0,1,0,0|0,0,1]=3 3493 B10R1.4 CCC[C@@H]1CCCC[C@H]1O Amb28455302 [1,0,0,1,0,0|0,0,1]=3 3494 B10R1.4 CCC[C@@H]1CSCC[C@@H]1O Amb27206130 [1,0,0,1,0,0|1,0,1]=4 3495 B10R1.4 CCC[C@H]1CCCCN1C Amb27975671 [1,0,0,1,0,0|2,0,0]=4 3496 B10R1.4 CCC[C@H]1CCCC[C@@H]1C Amb24594797 [1,0,0,1,0,0|1,0,1]=4 3497 B10R1.4 CCC[C@H]1CCCC[C@H]1C Amb22230418 [1,0,0,1,0,0|1,0,1]=4 3498 B10R1.4 CCC[C@H]1CCCC[C@H]1O Amb27221631 [1,0,0,1,0,0|0,0,1]=3 3499 B10R1.4 CCC[C@H]1CCNC[C@H]1O Amb27203949 [1,0,0,1,0,0|1,0,1]=4 3500 B10R1.4 CCC[C@H]1CNCC[C@H]1O Amb27263789 [1,0,0,1,0,0|1,0,1]=4 3501 B10R1.4 CCC[C@H]1CSCC[C@@H]1O Amb28350245 [1,0,0,1,0,0|1,0,1]=4 3502 B10R1.4 CCC[C@H]1CSCC[C@H]1O Amb27880290 [1,0,0,1,0,0|1,0,1]=4 3503 B10R1.4 CCC[C@H]1NCCC[C@@H]1O Amb28400045 [1,0,0,1,0,0|1,0,1]=4 3504 B10R1.4 CCC[C@H]1SCCNC1=O Amb28042822 [1,0,0,1,0,0|2,0,0]=4 3505 B10R1.4 CCNC1CCCNC1=O Amb18284476 [1,0,0,1,0,0|2,0,0]=4 3506 B10R1.4 CCN[C@@H]1CCCC[C@@H]1O Amb23263425 [1,0,0,1,0,0|1,0,1]=4 3507 B10R1.4 CCN[C@@H]1CCCC[C@H]1O Amb10608084 [1,0,0,1,0,0|1,0,1]=4 3508 B10R1.4 CCN[C@H]1CCCNC1=O Amb28367203 [1,0,0,1,0,0|2,0,0]=4 3509 B10R1.4 CCOC1CCCCC1=O Amb4605921 [1,0,0,1,0,0|1,0,0]=3 3510 B10R1.4 CCOC1CCCCC1O Amb26398852 [1,0,0,1,0,0|1,0,1]=4 3511 B10R1.4 CCOC1CNCCC1=O Amb32674193 [1,0,0,1,0,0|2,0,0]=4 3512 B10R1.4 CCOC1COCCC1=O Amb25838738 [1,0,0,1,0,0|2,0,0]=4 3513 B10R1.4 CCO[C@@H]1CCCC[C@@H]1O Amb28410837 [1,0,0,1,0,0|1,0,1]=4 3514 B10R1.4 CCO[C@@H]1CCCC[C@H]1O Amb25310010 [1,0,0,1,0,0|1,0,1]=4 3515 B10R1.4 CCO[C@H]1CCCC[C@@H]1O Amb27844174 [1,0,0,1,0,0|1,0,1]=4 3516 B10R1.4 CCSC1CCCCC1O Amb18792295 [1,0,0,1,0,0|1,0,1]=4 3517 B10R1.4 CCS[C@@H]1CCCC[C@@H]1O Amb27660252 [1,0,0,1,0,0|1,0,1]=4 3518 B10R1.4 CC\C=C1/CCCCC1=O Amb24690557 [1,0,0,1,0,0|0,0,2]=4 3519 B10R1.4 CN1CCCCC1CC=O Amb27643631 [1,0,0,1,0,0|1,0,0]=3 3520 B10R1.4 CN1CCCCC1CCO Amb839453 [1,0,0,1,0,0|1,0,1]=4 3521 B10R1.4 CN1CCCCC1CNO Amb26875731 [1,0,0,1,0,0|2,0,0]=4 3522 B10R1.4 CN1CCOCC1CC=O Amb27667179 [1,0,0,1,0,0|2,0,0]=4 3523 B10R1.4 CNCC1CCCCC1O Amb18644012 [1,0,0,1,0,0|1,0,1]=4 3524 B10R1.4 CNC[C@@H]1CCCC[C@H]1O Amb28401548 [1,0,0,1,0,0|1,0,1]=4 3525 B10R1.4 COCC1CCCCC1=O Amb25265248 [1,0,0,1,0,0|1,0,0]=3 3526 B10R1.4 COCC1CCCCC1O Amb24727818 [1,0,0,1,0,0|1,0,1]=4 3527 B10R1.4 COCC1COCCC1=O Amb26447203 [1,0,0,1,0,0|2,0,0]=4 3528 B10R1.4 COC[C@@H]1CCCC[C@@H]1O Amb27667023 [1,0,0,1,0,0|1,0,1]=4 3529 B10R1.4 COC[C@@H]1CCCC[C@H]1O Amb33213668 [1,0,0,1,0,0|1,0,1]=4 3530 B10R1.4 C[C@@H]1CCC=C[C@H]1CC=O Amb28247973 [1,0,0,1,0,0|0,0,2]=4 3531 B10R1.4 C[C@@H]1CCCC[C@@H]1N=C=O Amb28053713 [1,0,0,1,0,0|1,0,1]=4 3532 B10R1.4 C[C@H]1CCCCN1CCO Amb28122935 [1,0,0,1,0,0|1,0,1]=4 3533 B10R1.4 C[C@H]1CCCN[C@H]1CCO Amb27881692 [1,0,0,1,0,0|1,0,1]=4 3534 B10R1.4 N#CCC1CCCCC1=O Amb17593484 [1,0,0,1,0,0|1,0,1]=4 3535 B10R1.4 NCCC1CCCCC1=O Amb18202696 [1,0,0,1,0,0|1,0,0]=3 3536 B10R1.4 NCCC1CCCCC1O Amb18202445 [1,0,0,1,0,0|1,0,1]=4 3537 B10R1.4 NCCC1CCCNC1=O Amb18831625 [1,0,0,1,0,0|2,0,0]=4 3538 B10R1.4 NCCC1CCOCC1=O Amb18831579 [1,0,0,1,0,0|2,0,0]=4 3539 B10R1.4 NCCC1CCSCC1=O Amb18830316 [1,0,0,1,0,0|2,0,0]=4 3540 B10R1.4 NCCC1COCCC1=O Amb18831578 [1,0,0,1,0,0|2,0,0]=4 3541 B10R1.4 NCCC1CSCCC1=O Amb18830315 [1,0,0,1,0,0|2,0,0]=4 3542 B10R1.4 NCCC1OCCCC1=O Amb18831580 [1,0,0,1,0,0|2,0,0]=4 3543 B10R1.4 NCCN1CCCCC1=O Amb13951132 [1,0,0,1,0,0|2,0,0]=4 3544 B10R1.4 NCCN1CCCCC1=O Amb21954327 [1,0,0,1,0,0|2,0,0]=4 3545 B10R1.4 NCCN1CCCCC1=O Amb2785016 [1,0,0,1,0,0|2,0,0]=4 3546 B10R1.4 NCC[C@@H]1CCCC[C@@H]1O Amb32719260 [1,0,0,1,0,0|1,0,1]=4 3547 B10R1.4 N[C@@H]1CCCC[C@@H]1CCO Amb33189208 [1,0,0,1,0,0|1,0,1]=4 3548 B10R1.4 O=C1CCCCC1CCO Amb26606412 [1,0,0,1,0,0|1,0,0]=3 3549 B10R1.4 O=C1CCCCN1CCO Amb9370459 [1,0,0,1,0,0|2,0,0]=4 3550 B10R1.4 O=C1CCCCN1CCS Amb27837905 [1,0,0,1,0,0|2,0,0]=4 3551 B10R1.4 O=C1NCCCC1CCF Amb25927286 [1,0,0,1,0,0|2,0,0]=4 3552 B10R1.4 O=C1NCCCC1CCO Amb28189105 [1,0,0,1,0,0|2,0,0]=4 3553 B10R1.4 O=CCC1CCCCC1=O Amb17593548 [1,0,0,1,0,0|1,0,1]=4 3554 B10R1.4 O=CCC1CCCCC1F Amb28132903 [1,0,0,1,0,0|1,0,0]=3 3555 B10R1.4 O=CC[C@@H]1CCCC[C@H]1O Amb27841135 [1,0,0,1,0,0|1,0,0]=3 3556 B10R1.4 O=CC[C@@H]1OCCC[C@H]1O Amb28057497 [1,0,0,1,0,0|2,0,0]=4 3557 B10R1.4 O=CNC1CCCCC1Br Amb28120542 [1,0,0,1,0,0|2,0,0]=4 3558 B10R1.4 O=CNC1CCCCC1Cl Amb28118963 [1,0,0,1,0,0|2,0,0]=4 3559 B10R1.4 O=CN[C@@H]1CCCC[C@H]1O Amb28256004 [1,0,0,1,0,0|2,0,0]=4 3560 B10R1.4 O=COC1CCCCC1O Amb27780535 [1,0,0,1,0,0|2,0,0]=4 3561 B10R1.4 O=CO[C@@H]1CCCC[C@H]1Br Amb27224811 [1,0,0,1,0,0|2,0,0]=4 3562 B10R1.4 O=CO[C@@H]1CCCC[C@H]1Cl Amb27865522 [1,0,0,1,0,0|2,0,0]=4 3563 B10R1.4 O=CO[C@H]1CCCC[C@@H]1O Amb27452411 [1,0,0,1,0,0|2,0,0]=4 3564 B10R1.4 OCCC1CCCCC1F Amb28046356 [1,0,0,1,0,0|1,0,1]=4 3565 B10R1.4 OCCC1CCCCC1O Amb28126038 [1,0,0,1,0,0|1,0,1]=4 3566 B10R1.4 OCC[C@@H]1CCCC[C@@H]1F Amb25163783 [1,0,0,1,0,0|1,0,1]=4 3567 B10R1.4 OCC[C@@H]1CCCC[C@H]1F Amb27456760 [1,0,0,1,0,0|1,0,1]=4 3568 B10R1.4 [C-]#[N+]CC1CCCCC1C Amb27441232 [1,0,0,1,0,0|2,0,0]=4 3569 B10R1.5 C=CC1CCCC1CCO Amb28185135 [1,0,0,1,0,0|2,0,0]=4 3570 B10R1.5 C=CCC1CCCC1CO Amb28065113 [1,0,0,1,0,0|2,0,0]=4 3571 B10R1.5 C=CCC1CCCC1OC Amb27656760 [1,0,0,1,0,0|2,0,0]=4 3572 B10R1.5 C=CC[C@@H]1CCC[C@@H]1C=O Amb27253518 [1,0,0,1,0,0|0,0,2]=4 3573 B10R1.5 C=C[C@H]1CCC[C@H]1CCO Amb27451924 [1,0,0,1,0,0|2,0,0]=4 3574 B10R1.5 CCC1CCCC1CCN Amb27634757 [1,0,0,1,0,0|1,0,1]=4 3575 B10R1.5 CCC1CCCC1CCO Amb28400822 [1,0,0,1,0,0|0,0,1]=3 3576 B10R1.5 CCC1CCCC1CNC Amb28424281 [1,0,0,1,0,0|2,0,0]=4 3577 B10R1.5 CCC1CCCN1CCO Amb27396222 [1,0,0,1,0,0|1,0,1]=4 3578 B10R1.5 CCC1CCNC1CCO Amb32946707 [1,0,0,1,0,0|1,0,1]=4 3579 B10R1.5 CCC1COCC1NC=O Amb35617072 [1,0,0,1,0,0|2,0,0]=4 3580 B10R1.5 CCCC1CCCC1CN Amb25709046 [1,0,0,1,0,0|1,0,1]=4 3581 B10R1.5 CCCC1CCCC1CN Amb32662711 [1,0,0,1,0,0|1,0,1]=4 3582 B10R1.5 CCCC1CNCC1CO Amb28293161 [1,0,0,1,0,0|1,0,1]=4 3583 B10R1.5 CCCC1COCC1C=O Amb29882921 [1,0,0,1,0,0|1,0,0]=3 3584 B10R1.5 CCCC1COCC1CO Amb35651593 [1,0,0,1,0,0|1,0,1]=4 3585 B10R1.5 CCCC1COCC1NO Amb35636439 [1,0,0,1,0,0|2,0,0]=4 3586 B10R1.5 CCCC1OCCC1CO Amb27396359 [1,0,0,1,0,0|1,0,1]=4 3587 B10R1.5 CCCN1CCCC1CO Amb25887502 [1,0,0,1,0,0|1,0,1]=4 3588 B10R1.5 CCCN1CCC[C@@H]1CO Amb27646126 [1,0,0,1,0,0|1,0,1]=4 3589 B10R1.5 CCNC1CCCC1CO Amb27770377 [1,0,0,1,0,0|1,0,1]=4 3590 B10R1.5 COCC1CCCN1C=O Amb26021267 [1,0,0,1,0,0|2,0,0]=4 3591 B10R1.5 COC[C@@H]1CCCN1C=O Amb22366880 [1,0,0,1,0,0|2,0,0]=4 3592 B10R1.5 COC[C@H]1CCCN1C=O Amb26430210 [1,0,0,1,0,0|2,0,0]=4 3593 B10R1.5 CSC1CCCC1NC=O Amb27865129 [1,0,0,1,0,0|2,0,0]=4 3594 B10R1.5 CSCC1CCCN1C=O Amb27779889 [1,0,0,1,0,0|2,0,0]=4 3595 B10R1.5 C\C=C/[C@@H]1CCC[C@H]1C=O Amb27248372 [1,0,0,1,0,0|0,0,2]=4 3596 B10R1.5 NCCC1CCCC1CO Amb27454916 [1,0,0,1,0,0|1,0,1]=4 3597 B10R1.5 O=CCN1CCCC1CO Amb28123870 [1,0,0,1,0,0|2,0,0]=4 3598 B10R1.5 O=CCN1CCC[C@@H]1CO Amb29855350 [1,0,0,1,0,0|2,0,0]=4 3599 B10R1.5 O=CCN1CCC[C@H]1CO Amb35687991 [1,0,0,1,0,0|2,0,0]=4 3600 B10R1.5 O=CC[C@@H]1CCC[C@H]1C=O Amb27971291 [1,0,0,1,0,0|1,0,1]=4 3601 B10R1.5 O=CC[C@H]1CCC[C@@H]1C=O Amb28052715 [1,0,0,1,0,0|1,0,1]=4 3602 B10R1.5 O=CN1CCCC1CCO Amb24480455 [1,0,0,1,0,0|2,0,0]=4 3603 B10R1.5 O=CNC1CCCC1CO Amb27595568 [1,0,0,1,0,0|2,0,0]=4 3604 B10R1.5 OCC1CCCC1CCF Amb28435328 [1,0,0,1,0,0|1,0,1]=4 3605 B10R1.5 OCCC1CCCC1CO Amb28292112 [1,0,0,1,0,0|1,0,1]=4 3606 B10R1.7 C=C1CCCCCCC1O Amb22365222 [1,0,0,1,0,0|2,0,0]=4 3607 B10R1.7 C=C1CCCCCC[C@H]1O Amb27839314 [1,0,0,1,0,0|2,0,0]=4 3608 B10R1.7 CC1=CCCCCCC1=O Amb27951533 [1,0,0,1,0,0|0,0,2]=4 3609 B10R1.7 CC1CCCCCCC1=O Amb4020430 [1,0,0,1,0,0|0,0,0]=2 3610 B10R1.7 C[C@@H]1CCCCCC[C@@H]1O Amb27805357 [1,0,0,1,0,0|0,0,1]=3 3611 B10R1.7 NC1CCCCCCC1=O Amb28050100 [1,0,0,1,0,0|1,0,0]=3 3612 B10R1.7 NC1CCCCCNC1=O Amb26056483 [1,0,0,1,0,0|2,0,0]=4 3613 B10R1.7 N[C@@H]1CCCCCC[C@@H]1O Amb27881602 [1,0,0,1,0,0|1,0,1]=4 3614 B10R1.7 N[C@@H]1CCCCCC[C@H]1O Amb27881642 [1,0,0,1,0,0|1,0,1]=4 3615 B10R1.7 N[C@@H]1CCCCCNC1=O Amb27210584 [1,0,0,1,0,0|2,0,0]=4 3616 B10R1.7 O=C1CCCCCCC1Br Amb26871305 [1,0,0,1,0,0|1,0,0]=3 3617 B10R1.7 O=C1CCCCCCC1Cl Amb22228745 [1,0,0,1,0,0|1,0,0]=3 3618 B10R1.7 O=C1CCCCCCC1F Amb27837778 [1,0,0,1,0,0|1,0,0]=3 3619 B10R1.7 O=C1CCCCCCC1O Amb22896567 [1,0,0,1,0,0|1,0,0]=3 3620 B10R1.7 O=C1NCCCCCC1Br Amb27799738 [1,0,0,1,0,0|2,0,0]=4 3621 B10R1.7 O=C1NCCCCCC1Cl Amb25706288 [1,0,0,1,0,0|2,0,0]=4 3622 B10R1.7 O=C1NCCCCCC1S Amb28074060 [1,0,0,1,0,0|2,0,0]=4 3623 B10R1.7 OC1CCCCCCC1Br Amb26583480 [1,0,0,1,0,0|1,0,1]=4 3624 B10R1.7 OC1CCCCCCC1Cl Amb27657772 [1,0,0,1,0,0|1,0,1]=4 3625 B10R1.7 OC1CCCCCCC1I Amb24675454 [1,0,0,1,0,0|1,0,1]=4 3626 B10R1.7 OC1CCCCCCC1O Amb17593625 [1,0,0,1,0,0|1,0,1]=4 3627 B10R1.7 O[C@@H]1CCCCCC[C@H]1F Amb27668749 [1,0,0,1,0,0|1,0,1]=4 3628 B10R1.7 O[C@H]1CCCCCC[C@@H]1O Amb25984160 [1,0,0,1,0,0|1,0,1]=4 3629 B10R1.7 O[C@H]1CCCCCC[C@H]1O Amb17670030 [1,0,0,1,0,0|1,0,1]=4 3630 B10R1.12 C=CC1CCN1CCCC Amb28122843 [1,0,0,1,0,0|2,0,0]=4 3631 B10R1.12 C=CCCC1CCC1CN Amb27204981 [1,0,0,1,0,0|2,0,0]=4 3632 B10R1.12 C=CCCN1CCC1CC Amb27466590 [1,0,0,1,0,0|2,0,0]=4 3633 B10R1.12 C=CCNC1CCC1CC Amb28453450 [1,0,0,1,0,0|2,0,0]=4 3634 B10R1.12 CCC1CCN1CCCO Amb27805726 [1,0,0,1,0,0|1,0,1]=4 3635 B10R1.12 CCCCC1CCC1CN Amb24427713 [1,0,0,1,0,0|1,0,1]=4 3636 B10R1.12 CCCC[C@H]1CN[C@@H]1CO Amb27446832 [1,0,0,1,0,0|1,0,1]=4 3637 B10R1.17 BrCCCC1CCCCC1 Amb3940591 [1,0,0,1,0,0|1,0,1]=4 3638 B10R1.17 BrCCCC1CCCCO1 Amb25684382 [1,0,0,1,0,0|1,0,1]=4 3639 B10R1.17 Br[Mg]CCC1CCCCC1 Amb6300512 [1,0,0,1,0,0|2,0,0]=4 3640 B10R1.17 Br[Zn]CCC1CCCCC1 Amb22000504 [1,0,0,1,0,0|2,0,0]=4 3641 B10R1.17 Br\C=C\CC1CCCCC1 Amb33135221 [1,0,0,1,0,0|1,0,1]=4 3642 B10R1.17 C#CCCC1CCCCC1 Amb19888351 [1,0,0,1,0,0|1,0,1]=4 3643 B10R1.17 C=CCCC1CCCCN1 Amb27262240 [1,0,0,1,0,0|2,0,0]=4 3644 B10R1.17 C=CCCC1CCCOC1 Amb28050486 [1,0,0,1,0,0|2,0,0]=4 3645 B10R1.17 C=CCCC1CCOCC1 Amb27475927 [1,0,0,1,0,0|2,0,0]=4 3646 B10R1.17 C=CCCC1CCSCC1 Amb28370066 [1,0,0,1,0,0|2,0,0]=4 3647 B10R1.17 C=CCC[C@@H]1CCCOC1 Amb27396055 [1,0,0,1,0,0|2,0,0]=4 3648 B10R1.17 C=CCC[C@@H]1CCCSC1 Amb27751904 [1,0,0,1,0,0|2,0,0]=4 3649 B10R1.17 C=CCNC1CCCCC1 Amb2720306 [1,0,0,1,0,0|2,0,0]=4 3650 B10R1.17 C=CCSC1CCCCC1 Amb27224877 [1,0,0,1,0,0|2,0,0]=4 3651 B10R1.17 C=COCC1CCCCC1 Amb27792573 [1,0,0,1,0,0|2,0,0]=4 3652 B10R1.17 CCCCC1CCCCC1 Amb8513429 [1,0,0,1,0,0|1,0,1]=4 3653 B10R1.17 CCCCC1CCCCN1 Amb2234936 [1,0,0,1,0,0|1,0,1]=4 3654 B10R1.17 CCCCC1CCCCN1 Amb2237216 [1,0,0,1,0,0|1,0,1]=4 3655 B10R1.17 CCCCC1CCCNC1 Amb18296090 [1,0,0,1,0,0|2,0,0]=4 3656 B10R1.17 CCCCC1CCOCO1 Amb27837861 [1,0,0,1,0,0|1,0,1]=4 3657 B10R1.17 CCCCC1CNCCO1 Amb17193971 [1,0,0,1,0,0|1,0,1]=4 3658 B10R1.17 CCCC[C@H]1CCCCN1 Amb27425011 [1,0,0,1,0,0|1,0,1]=4 3659 B10R1.17 CCCC[C@H]1CNCCO1 Amb28128437 [1,0,0,1,0,0|1,0,1]=4 3660 B10R1.17 CCCNC1CCCCO1 Amb27798904 [1,0,0,1,0,0|1,0,1]=4 3661 B10R1.17 CCNCC1C=CCCC1 Amb28050368 [1,0,0,1,0,0|2,0,0]=4 3662 B10R1.17 CCNCC1CCCCO1 Amb10808747 [1,0,0,1,0,0|1,0,1]=4 3663 B10R1.17 CCNCC1CCCCO1 Amb9258711 [1,0,0,1,0,0|1,0,1]=4 3664 B10R1.17 CNCCC1CCCCC1 Amb34913787 [1,0,0,1,0,0|2,0,0]=4 3665 B10R1.17 CNCCC1CCCCC1 Amb8853653 [1,0,0,1,0,0|2,0,0]=4 3666 B10R1.17 CNCCC1CCCCO1 Amb10607311 [1,0,0,1,0,0|1,0,1]=4 3667 B10R1.17 CNCCC1CCCCO1 Amb17505552 [1,0,0,1,0,0|1,0,1]=4 3668 B10R1.17 COCCC1CCCCC1 Amb27424751 [1,0,0,1,0,0|2,0,0]=4 3669 B10R1.17 CSCCC1CCCCC1 Amb28049797 [1,0,0,1,0,0|2,0,0]=4 3670 B10R1.17 ClCCCC1C=CCCC1 Amb27494077 [1,0,0,1,0,0|2,0,0]=4 3671 B10R1.17 ClCCCC1CCCCC1 Amb8858810 [1,0,0,1,0,0|1,0,1]=4 3672 B10R1.17 ICCCC1CCCCC1 Amb27273231 [1,0,0,1,0,0|1,0,1]=4 3673 B10R1.17 N#CCCC1CCCCC1 Amb7969719 [1,0,0,1,0,0|1,0,1]=4 3674 B10R1.17 NCCCC1CCCCC1 Amb6255273 [1,0,0,1,0,0|1,0,1]=4 3675 B10R1.17 NCCCC1CCCCO1 Amb18251264 [1,0,0,1,0,0|1,0,1]=4 3676 B10R1.17 NNCCC1CCCCC1 Amb33527625 [1,0,0,1,0,0|2,0,0]=4 3677 B10R1.17 NNCCC1CCCCC1 Amb6744627 [1,0,0,1,0,0|2,0,0]=4 3678 B10R1.17 NOCCC1CCCCC1 Amb26365361 [1,0,0,1,0,0|2,0,0]=4 3679 B10R1.17 O=C=NCC1CCCCC1 Amb22348012 [1,0,0,1,0,0|1,0,1]=4 3680 B10R1.17 O=CC#CC1CCCCC1 Amb17593454 [1,0,0,1,0,0|0,0,2]=4 3681 B10R1.17 O=CCCC1C=CCCC1 Amb28077624 [1,0,0,1,0,0|0,0,2]=4 3682 B10R1.17 O=CCCC1CC=CCC1 Amb18643322 [1,0,0,1,0,0|0,0,2]=4 3683 B10R1.17 O=CCCC1CCCCC1 Amb3372079 [1,0,0,1,0,0|0,0,0]=2 3684 B10R1.17 O=CCCC1CCCCN1 Amb17593576 [1,0,0,1,0,0|1,0,0]=3 3685 B10R1.17 O=CCCC1CCCCO1 Amb27634719 [1,0,0,1,0,0|1,0,0]=3 3686 B10R1.17 O=CCCC1CCCOC1 Amb25867773 [1,0,0,1,0,0|1,0,0]=3 3687 B10R1.17 O=CCCC1CCCSC1 Amb25312526 [1,0,0,1,0,0|1,0,0]=3 3688 B10R1.17 O=CCCC1CCOCC1 Amb24372180 [1,0,0,1,0,0|1,0,0]=3 3689 B10R1.17 O=CCCN1CCCCC1 Amb25957250 [1,0,0,1,0,0|1,0,0]=3 3690 B10R1.17 O=CCCN1CCNCC1 Amb18991446 [1,0,0,1,0,0|2,0,0]=4 3691 B10R1.17 O=CCCN1CCOCC1 Amb22263099 [1,0,0,1,0,0|2,0,0]=4 3692 B10R1.17 O=CCCN1CCOCC1 Amb22491435 [1,0,0,1,0,0|2,0,0]=4 3693 B10R1.17 O=CCCN1CCOCC1 Amb32882555 [1,0,0,1,0,0|2,0,0]=4 3694 B10R1.17 O=CCC[C@@H]1COCCO1 Amb27762561 [1,0,0,1,0,0|2,0,0]=4 3695 B10R1.17 O=CCOC1CCCCC1 Amb28423544 [1,0,0,1,0,0|1,0,0]=3 3696 B10R1.17 O=CCOC1CCCCO1 Amb18202407 [1,0,0,1,0,0|2,0,0]=4 3697 B10R1.17 O=CCOC1CCOCC1 Amb28381886 [1,0,0,1,0,0|2,0,0]=4 3698 B10R1.17 O=CCSC1CCOCC1 Amb18177709 [1,0,0,1,0,0|2,0,0]=4 3699 B10R1.17 O=CNCC1CCCCC1 Amb27394363 [1,0,0,1,0,0|1,0,0]=3 3700 B10R1.17 O=C\C=C\C1CCCCC1 Amb18643296 [1,0,0,1,0,0|0,0,2]=4 3701 B10R1.17 OCCCC1CCC=CO1 Amb27839340 [1,0,0,1,0,0|1,0,1]=4 3702 B10R1.17 OCCCC1CCCCC1 Amb3354800 [1,0,0,1,0,0|0,0,1]=3 3703 B10R1.17 OCCCC1CCCCN1 Amb22229403 [1,0,0,1,0,0|1,0,1]=4 3704 B10R1.17 OCCCC1CCCCN1 Amb2700051 [1,0,0,1,0,0|1,0,1]=4 3705 B10R1.17 OCCCC1CCCCO1 Amb27471574 [1,0,0,1,0,0|1,0,1]=4 3706 B10R1.17 OCCCC1CCCNC1 Amb2700052 [1,0,0,1,0,0|1,0,1]=4 3707 B10R1.17 OCCCC1CCCOC1 Amb26446849 [1,0,0,1,0,0|1,0,1]=4 3708 B10R1.17 OCCCC1CCCSC1 Amb32726174 [1,0,0,1,0,0|1,0,1]=4 3709 B10R1.17 OCCCC1CCNCC1 Amb13888748 [1,0,0,1,0,0|1,0,1]=4 3710 B10R1.17 OCCCC1CCNCC1 Amb5501634 [1,0,0,1,0,0|1,0,1]=4 3711 B10R1.17 OCCCC1CCOCC1 Amb33531031 [1,0,0,1,0,0|1,0,1]=4 3712 B10R1.17 OCCCN1CCCCC1 Amb3939468 [1,0,0,1,0,0|1,0,1]=4 3713 B10R1.17 OCCNC1CCCCC1 Amb2137276 [1,0,0,1,0,0|1,0,1]=4 3714 B10R1.17 OCCOC1CCCCC1 Amb6893053 [1,0,0,1,0,0|1,0,1]=4 3715 B10R1.17 OCCPC1CCCCC1 Amb28381747 [1,0,0,1,0,0|1,0,1]=4 3716 B10R1.17 OCCSC1CCCCC1 Amb9362993 [1,0,0,1,0,0|1,0,1]=4 3717 B10R1.17 ONCCC1CCCCC1 Amb25355289 [1,0,0,1,0,0|1,0,0]=3 3718 B10R1.17 ONCCC1CCNCC1 Amb35583260 [1,0,0,1,0,0|2,0,0]=4 3719 B10R1.17 SCCCC1CCCCC1 Amb24644638 [1,0,0,1,0,0|0,1,1]=4 3720 B10R1.17 SCCCC1CCCCO1 Amb33374893 [1,0,0,1,0,0|1,0,1]=4 3721 B10R1.17 [C-]#[N+]CCC1CCCCC1 Amb33225140 [1,0,0,1,0,0|2,0,0]=4 3722 B10R1.19 C#CC1CCCCCC1=O Amb27458674 [1,0,0,1,0,0|0,0,2]=4 3723 B10R1.19 C=C1CCCCCC1CC Amb35681185 [1,0,0,1,0,0|1,0,0]=3 3724 B10R1.19 C=CC1CCCCCC1O Amb24748257 [1,0,0,1,0,0|2,0,0]=4 3725 B10R1.19 C=C[C@@H]1CCCCC[C@H]1O Amb32945032 [1,0,0,1,0,0|2,0,0]=4 3726 B10R1.19 CC1CCCCC=C1C=O Amb28240981 [1,0,0,1,0,0|0,0,2]=4 3727 B10R1.19 CC1CCCCCC1C#N Amb35608213 [1,0,0,1,0,0|1,0,1]=4 3728 B10R1.19 CC1CCCCCC1C=O Amb28049958 [1,0,0,1,0,0|0,0,0]=2 3729 B10R1.19 CC1CCCCCC1CBr Amb35721304 [1,0,0,1,0,0|1,0,1]=4 3730 B10R1.19 CC1CCCCCC1CCl Amb35721303 [1,0,0,1,0,0|1,0,1]=4 3731 B10R1.19 CC1CCCCCC1CO Amb27978202 [1,0,0,1,0,0|0,0,1]=3 3732 B10R1.19 CC1CCCCCC1NN Amb35734053 [1,0,0,1,0,0|2,0,0]=4 3733 B10R1.19 CC1CCCCCC1NO Amb35726891 [1,0,0,1,0,0|1,0,0]=3 3734 B10R1.19 CC1CCNCCC1CO Amb27633588 [1,0,0,1,0,0|1,0,1]=4 3735 B10R1.19 CC1CCNCCN1C=O Amb27591904 [1,0,0,1,0,0|2,0,0]=4 3736 B10R1.19 CCC1CCCCCC1=O Amb25948482 [1,0,0,1,0,0|0,0,0]=2 3737 B10R1.19 CCC1CCCCCC1Br Amb27197752 [1,0,0,1,0,0|1,0,1]=4 3738 B10R1.19 CCC1CCCCCC1Cl Amb18800488 [1,0,0,1,0,0|1,0,1]=4 3739 B10R1.19 CCC1CCCCCC1N Amb18279403 [1,0,0,1,0,0|1,0,1]=4 3740 B10R1.19 CCC1CCCCCC1O Amb27972743 [1,0,0,1,0,0|0,0,1]=3 3741 B10R1.19 CCC1CCCCCC1S Amb32788876 [1,0,0,1,0,0|0,1,1]=4 3742 B10R1.19 CCC1CNCCNC1=O Amb27877963 [1,0,0,1,0,0|2,0,0]=4 3743 B10R1.19 CCC1NCCCNC1=O Amb26546872 [1,0,0,1,0,0|2,0,0]=4 3744 B10R1.19 CCN1CCCNCC1=O Amb24524558 [1,0,0,1,0,0|2,0,0]=4 3745 B10R1.19 CCN1CCCNCC1=O Amb33212644 [1,0,0,1,0,0|2,0,0]=4 3746 B10R1.19 CCN1CCNCCC1=O Amb21959077 [1,0,0,1,0,0|2,0,0]=4 3747 B10R1.19 CCN1CCNCCC1=O Amb32410399 [1,0,0,1,0,0|2,0,0]=4 3748 B10R1.19 CC[C@@H]1CCCCC[C@@H]1N Amb27421958 [1,0,0,1,0,0|1,0,1]=4 3749 B10R1.19 CC[C@@H]1CCCCC[C@H]1O Amb33213860 [1,0,0,1,0,0|0,0,1]=3 3750 B10R1.19 CC[C@@H]1NCCCNC1=O Amb32671416 [1,0,0,1,0,0|2,0,0]=4 3751 B10R1.19 CC[C@H]1CCCCCC1=O Amb27951448 [1,0,0,1,0,0|0,0,0]=2 3752 B10R1.19 CC[C@H]1NCCCNC1=O Amb25726155 [1,0,0,1,0,0|2,0,0]=4 3753 B10R1.19 CN1CCCCCC1C=O Amb27633340 [1,0,0,1,0,0|1,0,0]=3 3754 B10R1.19 CN1CCCCCC1CO Amb28343208 [1,0,0,1,0,0|1,0,1]=4 3755 B10R1.19 CNC1CCCCCC1O Amb18944292 [1,0,0,1,0,0|1,0,1]=4 3756 B10R1.19 CNC1CCCCNC1=O Amb9721933 [1,0,0,1,0,0|2,0,0]=4 3757 B10R1.19 CN[C@@H]1CCCCC[C@H]1O Amb27249838 [1,0,0,1,0,0|1,0,1]=4 3758 B10R1.19 COC1CCCCCC1=O Amb26329265 [1,0,0,1,0,0|1,0,0]=3 3759 B10R1.19 COC1CCCCCC1O Amb24478034 [1,0,0,1,0,0|1,0,1]=4 3760 B10R1.19 CO[C@H]1CCCCNC1=O Amb27950636 [1,0,0,1,0,0|2,0,0]=4 3761 B10R1.19 C\C=C1\CCCCCC1=O Amb24698888 [1,0,0,1,0,0|0,0,2]=4 3762 B10R1.19 N#CC1CCCCCC1=O Amb17593482 [1,0,0,1,0,0|1,0,1]=4 3763 B10R1.19 NC1CCCCCC1CO Amb20668019 [1,0,0,1,0,0|1,0,1]=4 3764 B10R1.19 NC1CCCCCC1CO Amb2695457 [1,0,0,1,0,0|1,0,1]=4 3765 B10R1.19 NCC1CCCCCC1=O Amb27965542 [1,0,0,1,0,0|1,0,0]=3 3766 B10R1.19 NCC1CCCCNC1=O Amb33097714 [1,0,0,1,0,0|2,0,0]=4 3767 B10R1.19 NCC1CCCCNC1=O Amb6667851 [1,0,0,1,0,0|2,0,0]=4 3768 B10R1.19 NC[C@@H]1CCCCC[C@@H]1O Amb6336648 [1,0,0,1,0,0|1,0,1]=4 3769 B10R1.19 NC[C@@H]1CCCCC[C@H]1O Amb27788301 [1,0,0,1,0,0|1,0,1]=4 3770 B10R1.19 N[C@@H]1CCCCC[C@@H]1CO Amb32944721 [1,0,0,1,0,0|1,0,1]=4 3771 B10R1.19 N[C@@H]1CCCCC[C@H]1CO Amb27851992 [1,0,0,1,0,0|1,0,1]=4 3772 B10R1.19 N[C@H]1CCCCC[C@H]1CO Amb27467767 [1,0,0,1,0,0|1,0,1]=4 3773 B10R1.19 O=C1CCCCCC1CO Amb27944951 [1,0,0,1,0,0|1,0,0]=3 3774 B10R1.19 O=C1CCCCCN1CCl Amb17949681 [1,0,0,1,0,0|2,0,0]=4 3775 B10R1.19 O=C1CCCCCN1CO Amb1038986 [1,0,0,1,0,0|2,0,0]=4 3776 B10R1.19 O=C1NCCCCC1CBr Amb32675168 [1,0,0,1,0,0|2,0,0]=4 3777 B10R1.19 O=C1NCCCCC1CCl Amb33457891 [1,0,0,1,0,0|2,0,0]=4 3778 B10R1.19 O=C1NCCCCC1CO Amb26391477 [1,0,0,1,0,0|2,0,0]=4 3779 B10R1.19 O=CC1CCCCCC1=O Amb33539530 [1,0,0,1,0,0|1,0,1]=4 3780 B10R1.20 C#C[C@@H]1CCCC[C@H]1C=O Amb27854749 [1,0,0,1,0,0|0,0,2]=4 3781 B10R1.20 C=CC1CCCCC1C=O Amb18643332 [1,0,0,1,0,0|0,0,2]=4 3782 B10R1.20 C=CC1CCCCC1CBr Amb27403504 [1,0,0,1,0,0|2,0,0]=4 3783 B10R1.20 C=CC1CCCCC1CC Amb27662673 [1,0,0,1,0,0|1,0,0]=3 3784 B10R1.20 C=CC1CCCCC1CO Amb27486485 [1,0,0,1,0,0|2,0,0]=4 3785 B10R1.20 C=CC1CCCCC1NC Amb28070721 [1,0,0,1,0,0|2,0,0]=4 3786 B10R1.20 C=CC1NCCCC1CC Amb27838057 [1,0,0,1,0,0|2,0,0]=4 3787 B10R1.20 C=C[C@@H]1CCCC[C@H]1CO Amb28285536 [1,0,0,1,0,0|2,0,0]=4 3788 B10R1.20 C=C[C@@H]1NCCC[C@H]1CC Amb27252158 [1,0,0,1,0,0|2,0,0]=4 3789 B10R1.20 CCC1=C(C=O)CCCC1 Amb28050009 [1,0,0,1,0,0|0,0,2]=4 3790 B10R1.20 CCC1CCCCC1C#N Amb25848765 [1,0,0,1,0,0|1,0,1]=4 3791 B10R1.20 CCC1CCCCC1C=O Amb28069911 [1,0,0,1,0,0|0,0,0]=2 3792 B10R1.20 CCC1CCCCC1CCl Amb28315710 [1,0,0,1,0,0|1,0,1]=4 3793 B10R1.20 CCC1CCCCC1CN Amb25805484 [1,0,0,1,0,0|1,0,1]=4 3794 B10R1.20 CCC1CCCCC1CN Amb28555482 [1,0,0,1,0,0|1,0,1]=4 3795 B10R1.20 CCC1CCCCC1CO Amb28185435 [1,0,0,1,0,0|0,0,1]=3 3796 B10R1.20 CCC1CCCCC1CS Amb25972128 [1,0,0,1,0,0|0,1,1]=4 3797 B10R1.20 CCC1CCCCC1NC Amb18958571 [1,0,0,1,0,0|2,0,0]=4 3798 B10R1.20 CCC1CCCCC1NN Amb27632539 [1,0,0,1,0,0|2,0,0]=4 3799 B10R1.20 CCC1CCCCN1N=O Amb27855215 [1,0,0,1,0,0|2,0,0]=4 3800 B10R1.20 CCC1CCCNC1CO Amb28313797 [1,0,0,1,0,0|1,0,1]=4 3801 B10R1.20 CCC1CSCCN1C=O Amb25374033 [1,0,0,1,0,0|2,0,0]=4 3802 B10R1.20 CCC1NCCCC1CO Amb27495614 [1,0,0,1,0,0|1,0,1]=4 3803 B10R1.20 CCN1CCCCC1C=O Amb23586129 [1,0,0,1,0,0|1,0,0]=3 3804 B10R1.20 CCN1CCCCC1CO Amb15701255 [1,0,0,1,0,0|1,0,1]=4 3805 B10R1.20 CC[C@H]1CCCN[C@@H]1CO Amb27258939 [1,0,0,1,0,0|1,0,1]=4 3806 B10R1.20 CC[C@H]1NCCC[C@@H]1CO Amb27787453 [1,0,0,1,0,0|1,0,1]=4 3807 B10R1.20 CN[C@@H]1CCCC[C@@H]1CO Amb27857106 [1,0,0,1,0,0|1,0,1]=4 3808 B10R1.20 COC1CCCCC1C=O Amb24647644 [1,0,0,1,0,0|1,0,0]=3 3809 B10R1.20 COC1CCCCC1CO Amb26560099 [1,0,0,1,0,0|1,0,1]=4 3810 B10R1.20 COC1CCCCC1NO Amb27758493 [1,0,0,1,0,0|2,0,0]=4 3811 B10R1.20 COC1CCCCN1C=O Amb22228863 [1,0,0,1,0,0|2,0,0]=4 3812 B10R1.20 COC1COCCC1C=O Amb26475803 [1,0,0,1,0,0|2,0,0]=4 3813 B10R1.20 CSC1CCCCC1C=O Amb27973686 [1,0,0,1,0,0|1,0,0]=3 3814 B10R1.20 CS[C@@H]1CCCC[C@@H]1C=O Amb27855012 [1,0,0,1,0,0|1,0,0]=3 3815 B10R1.20 NC[C@@H]1CCCC[C@@H]1CO Amb24724999 [1,0,0,1,0,0|1,0,1]=4 3816 B10R1.20 O=CC1CCCCC1CO Amb18643890 [1,0,0,1,0,0|1,0,0]=3 3817 B10R1.20 O=C[C@H]1CCCC[C@H]1C=O Amb28122054 [1,0,0,1,0,0|1,0,1]=4 3818 B10R1.20 OCC1CCCCC1CBr Amb28140801 [1,0,0,1,0,0|1,0,1]=4 3819 B10R1.20 OCC1CCCCC1CO Amb17593632 [1,0,0,1,0,0|1,0,1]=4 3820 B10R1.20 OCC1CCCCC1CS Amb27651651 [1,0,0,1,0,0|1,0,1]=4 3821 B10R1.20 OC[C@@H]1CCCC[C@H]1CO Amb22224834 [1,0,0,1,0,0|1,0,1]=4 3822 B10R1.20 OC[C@H]1CCCC[C@H]1CO Amb10070740 [1,0,0,1,0,0|1,0,1]=4 3823 B10R1.21 BrCCCCC1CCCC1 Amb25317874 [1,0,0,1,0,0|1,0,1]=4 3824 B10R1.21 BrCCCCC1CCCO1 Amb25839950 [1,0,0,1,0,0|1,0,1]=4 3825 B10R1.21 C#CCCCC1CCCC1 Amb33378004 [1,0,0,1,0,0|1,0,1]=4 3826 B10R1.21 C=CCCCC1CCCC1 Amb27390216 [1,0,0,1,0,0|1,0,0]=3 3827 B10R1.21 C=CCCCC1CCCN1 Amb27839002 [1,0,0,1,0,0|2,0,0]=4 3828 B10R1.21 C=CCCCC1CCSC1 Amb28344683 [1,0,0,1,0,0|2,0,0]=4 3829 B10R1.21 C=CCCCN1CCCC1 Amb27192320 [1,0,0,1,0,0|2,0,0]=4 3830 B10R1.21 C=CCNCC1CCCC1 Amb17231913 [1,0,0,1,0,0|2,0,0]=4 3831 B10R1.21 CCCCCC1CCCC1 Amb22731546 [1,0,0,1,0,0|1,0,1]=4 3832 B10R1.21 CCCCCC1CCCN1 Amb20669608 [1,0,0,1,0,0|1,0,1]=4 3833 B10R1.21 CCCCCC1CCCN1 Amb3788114 [1,0,0,1,0,0|1,0,1]=4 3834 B10R1.21 CCCCCC1CCNC1 Amb25726522 [1,0,0,1,0,0|2,0,0]=4 3835 B10R1.21 CCCCCN1CCCO1 Amb28139187 [1,0,0,1,0,0|1,0,1]=4 3836 B10R1.21 CCCCC[C@@H]1CCNC1 Amb27950140 [1,0,0,1,0,0|2,0,0]=4 3837 B10R1.21 CCCCC[C@H]1CCCN1 Amb28050068 [1,0,0,1,0,0|1,0,1]=4 3838 B10R1.21 CCCCC[C@H]1CCNC1 Amb28041520 [1,0,0,1,0,0|2,0,0]=4 3839 B10R1.21 CCCCNC1C=CCC1 Amb27252122 [1,0,0,1,0,0|2,0,0]=4 3840 B10R1.21 CCCNCC1CCCO1 Amb9751758 [1,0,0,1,0,0|1,0,1]=4 3841 B10R1.21 CCCNC[C@@H]1CCCO1 Amb27605440 [1,0,0,1,0,0|1,0,1]=4 3842 B10R1.21 CCCNC[C@H]1CCCO1 Amb27466411 [1,0,0,1,0,0|1,0,1]=4 3843 B10R1.21 CNCCCC1CCCC1 Amb22586912 [1,0,0,1,0,0|2,0,0]=4 3844 B10R1.21 CNCCCC1CCCC1 Amb8853673 [1,0,0,1,0,0|2,0,0]=4 3845 B10R1.21 CNCCCC1CCCO1 Amb10607820 [1,0,0,1,0,0|1,0,1]=4 3846 B10R1.21 ClCCCCC1CCCC1 Amb24480526 [1,0,0,1,0,0|1,0,1]=4 3847 B10R1.21 ClCCCCC1CCCO1 Amb25318134 [1,0,0,1,0,0|1,0,1]=4 3848 B10R1.21 N#CCCCC1CCCC1 Amb24700210 [1,0,0,1,0,0|1,0,1]=4 3849 B10R1.21 NCCCCC1CCCC1 Amb17569962 [1,0,0,1,0,0|1,0,1]=4 3850 B10R1.21 NCCCCC1CCCO1 Amb10607819 [1,0,0,1,0,0|1,0,1]=4 3851 B10R1.21 NCCCCC1CCCO1 Amb22587022 [1,0,0,1,0,0|1,0,1]=4 3852 B10R1.21 NNCCCC1CCCC1 Amb6249524 [1,0,0,1,0,0|2,0,0]=4 3853 B10R1.21 NOCCCC1CCCC1 Amb33378621 [1,0,0,1,0,0|2,0,0]=4 3854 B10R1.21 O=C=NCCC1CCCC1 Amb6267222 [1,0,0,1,0,0|1,0,1]=4 3855 B10R1.21 O=CC#CCC1CCCC1 Amb28186614 [1,0,0,1,0,0|0,0,2]=4 3856 B10R1.21 O=CCCCC1C=CCC1 Amb18643323 [1,0,0,1,0,0|0,0,2]=4 3857 B10R1.21 O=CCCCC1CCCC1 Amb25838994 [1,0,0,1,0,0|0,0,0]=2 3858 B10R1.21 O=CCCCC1CCCO1 Amb25714393 [1,0,0,1,0,0|1,0,0]=3 3859 B10R1.21 O=CCCCC1CCCS1 Amb33415400 [1,0,0,1,0,0|1,0,0]=3 3860 B10R1.21 O=CCCCC1CCOC1 Amb26996770 [1,0,0,1,0,0|1,0,0]=3 3861 B10R1.21 O=CCCCC1CCSC1 Amb33225844 [1,0,0,1,0,0|1,0,0]=3 3862 B10R1.21 O=CCCCC1OCCO1 Amb6752057 [1,0,0,1,0,0|2,0,0]=4 3863 B10R1.21 O=CCCCN1CCCC1 Amb33445897 [1,0,0,1,0,0|1,0,0]=3 3864 B10R1.21 O=CCCOC1CCCC1 Amb33540933 [1,0,0,1,0,0|1,0,0]=3 3865 B10R1.21 O=CCCOC1CCCO1 Amb28049924 [1,0,0,1,0,0|2,0,0]=4 3866 B10R1.21 O=CCCOC1CCOC1 Amb27835293 [1,0,0,1,0,0|2,0,0]=4 3867 B10R1.21 O=CCOCC1CCCO1 Amb28064332 [1,0,0,1,0,0|2,0,0]=4 3868 B10R1.21 O=CCSCC1CCCC1 Amb28197773 [1,0,0,1,0,0|1,0,0]=3 3869 B10R1.21 O=CCSCC1CCCO1 Amb27839516 [1,0,0,1,0,0|2,0,0]=4 3870 B10R1.21 O=C\C=C\CC1CCCC1 Amb33358587 [1,0,0,1,0,0|0,0,2]=4 3871 B10R1.21 OCCCCC1C=CCC1 Amb28139719 [1,0,0,1,0,0|2,0,0]=4 3872 B10R1.21 OCCCCC1CCCC1 Amb25228243 [1,0,0,1,0,0|0,0,1]=3 3873 B10R1.21 OCCCCC1CCCO1 Amb25321554 [1,0,0,1,0,0|1,0,1]=4 3874 B10R1.21 OCCCCC1CCCS1 Amb27766950 [1,0,0,1,0,0|1,0,1]=4 3875 B10R1.21 OCCCCC1CCNC1 Amb27637887 [1,0,0,1,0,0|1,0,1]=4 3876 B10R1.21 OCCCCN1CCCC1 Amb3204767 [1,0,0,1,0,0|1,0,1]=4 3877 B10R1.21 OCCCNC1CCCC1 Amb6733581 [1,0,0,1,0,0|1,0,1]=4 3878 B10R1.21 OCCCOC1CCCC1 Amb6893050 [1,0,0,1,0,0|1,0,1]=4 3879 B10R1.21 OCCOCC1CCCC1 Amb21957925 [1,0,0,1,0,0|1,0,1]=4 3880 B10R1.21 ONCCCC1CCCC1 Amb33481443 [1,0,0,1,0,0|1,0,0]=3 3881 B10R1.21 ONCCCN1CCCC1 Amb33448139 [1,0,0,1,0,0|2,0,0]=4 3882 B10R1.21 SCCCCC1CCCC1 Amb33377954 [1,0,0,1,0,0|0,1,1]=4 3883 B10R1.21 [C-]#[N+]CCCC1CCCC1 Amb24708173 [1,0,0,1,0,0|2,0,0]=4 3884 B10R1.29 C=CCCC1CCCC1=O Amb26474240 [1,0,0,1,0,0|0,0,2]=4 3885 B10R1.29 C=CCCC1CCCC1Br Amb27838998 [1,0,0,1,0,0|2,0,0]=4 3886 B10R1.29 C=CCCC1CCCC1O Amb24615229 [1,0,0,1,0,0|2,0,0]=4 3887 B10R1.29 C=CCCN1CCCC1C Amb28289636 [1,0,0,1,0,0|2,0,0]=4 3888 B10R1.29 C=CCC[C@@H]1CCC[C@H]1O Amb26913579 [1,0,0,1,0,0|2,0,0]=4 3889 B10R1.29 C=CCNC1CCCC1C Amb27883396 [1,0,0,1,0,0|2,0,0]=4 3890 B10R1.29 CC#CCC1CCCC1=O Amb28388198 [1,0,0,1,0,0|0,0,2]=4 3891 B10R1.29 CC1CCCC1CCCN Amb28455816 [1,0,0,1,0,0|1,0,1]=4 3892 B10R1.29 CC1CCCC1NCCO Amb24271129 [1,0,0,1,0,0|1,0,1]=4 3893 B10R1.29 CC1OCCC1CCC=O Amb33426817 [1,0,0,1,0,0|1,0,0]=3 3894 B10R1.29 CC1OCCC1CCCO Amb33426819 [1,0,0,1,0,0|1,0,1]=4 3895 B10R1.29 CCCCC1CCCC1=O Amb19301037 [1,0,0,1,0,0|0,0,0]=2 3896 B10R1.29 CCCCC1CCCC1N Amb18977599 [1,0,0,1,0,0|1,0,1]=4 3897 B10R1.29 CCCCC1CCCC1O Amb27188610 [1,0,0,1,0,0|0,0,1]=3 3898 B10R1.29 CCCCC1CNCC1O Amb28077183 [1,0,0,1,0,0|1,0,1]=4 3899 B10R1.29 CCCCC1COCC1=O Amb29885828 [1,0,0,1,0,0|1,0,0]=3 3900 B10R1.29 CCCCC1COCC1O Amb27981737 [1,0,0,1,0,0|1,0,1]=4 3901 B10R1.29 CCCCC1SCCC1O Amb28398994 [1,0,0,1,0,0|1,0,1]=4 3902 B10R1.29 CCCCN1CCCC1=N Amb7777898 [1,0,0,1,0,0|2,0,0]=4 3903 B10R1.29 CCCCN1CCCC1=O Amb4605894 [1,0,0,1,0,0|1,0,0]=3 3904 B10R1.29 CCCCN1CCCC1=S Amb26564122 [1,0,0,1,0,0|1,1,0]=4 3905 B10R1.29 CCCCN1CNCC1=O Amb28139296 [1,0,0,1,0,0|2,0,0]=4 3906 B10R1.29 CCCC[C@@H]1CCC[C@H]1O Amb26393355 [1,0,0,1,0,0|0,0,1]=3 3907 B10R1.29 CCCC[C@@H]1CNC[C@H]1O Amb28203928 [1,0,0,1,0,0|1,0,1]=4 3908 B10R1.29 CCCC[C@@H]1COC[C@H]1O Amb32944880 [1,0,0,1,0,0|1,0,1]=4 3909 B10R1.29 CCCC[C@@H]1OCC[C@H]1O Amb27431543 [1,0,0,1,0,0|1,0,1]=4 3910 B10R1.29 CCCC[C@H]1CNC[C@@H]1O Amb28283631 [1,0,0,1,0,0|1,0,1]=4 3911 B10R1.29 CCCNC1CCCC1O Amb18969168 [1,0,0,1,0,0|1,0,1]=4 3912 B10R1.29 CCCO[C@@H]1CCC[C@H]1O Amb27420309 [1,0,0,1,0,0|1,0,1]=4 3913 B10R1.29 CCCS[C@H]1CCC[C@@H]1O Amb27822819 [1,0,0,1,0,0|1,0,1]=4 3914 B10R1.29 CCC\C=C1/CCCC1=O Amb25936513 [1,0,0,1,0,0|0,0,2]=4 3915 B10R1.29 CCC\C=C1\CCCC1=O Amb27432602 [1,0,0,1,0,0|0,0,2]=4 3916 B10R1.29 CCNCC1CCCC1O Amb18644022 [1,0,0,1,0,0|1,0,1]=4 3917 B10R1.29 CCOCC1CCCC1=O Amb24431926 [1,0,0,1,0,0|1,0,0]=3 3918 B10R1.29 CCOCC1CCCC1O Amb27810580 [1,0,0,1,0,0|1,0,1]=4 3919 B10R1.29 CCOCC1COCC1=O Amb35639027 [1,0,0,1,0,0|2,0,0]=4 3920 B10R1.29 CCOC[C@@H]1CCC[C@H]1O Amb33213074 [1,0,0,1,0,0|1,0,1]=4 3921 B10R1.29 CN1CCCC1CCC=O Amb25305618 [1,0,0,1,0,0|1,0,0]=3 3922 B10R1.29 CN1CCCC1CCCO Amb23541272 [1,0,0,1,0,0|1,0,1]=4 3923 B10R1.29 CN1CCCC1CCNO Amb33321839 [1,0,0,1,0,0|2,0,0]=4 3924 B10R1.29 CNCCC1CCCC1C Amb27427395 [1,0,0,1,0,0|2,0,0]=4 3925 B10R1.29 CNCCN1CCCC1=O Amb18292044 [1,0,0,1,0,0|2,0,0]=4 3926 B10R1.29 CNCCN1CCCC1=O Amb19515123 [1,0,0,1,0,0|2,0,0]=4 3927 B10R1.29 COCCC1CCCC1=O Amb27665846 [1,0,0,1,0,0|1,0,0]=3 3928 B10R1.29 COCCC1CCNC1=O Amb25824666 [1,0,0,1,0,0|2,0,0]=4 3929 B10R1.29 COCCN1CCCC1=O Amb20621492 [1,0,0,1,0,0|2,0,0]=4 3930 B10R1.29 COCOC1CCCC1=O Amb25319346 [1,0,0,1,0,0|2,0,0]=4 3931 B10R1.29 CSCCC1CCCC1=O Amb27794162 [1,0,0,1,0,0|1,0,0]=3 3932 B10R1.29 CSCCC1CCCC1O Amb27857239 [1,0,0,1,0,0|1,0,1]=4 3933 B10R1.29 CSCCC1CCOC1=O Amb27467850 [1,0,0,1,0,0|2,0,0]=4 3934 B10R1.29 CSCCC1CSCC1=O Amb27166207 [1,0,0,1,0,0|2,0,0]=4 3935 B10R1.29 CSCCC1NCCC1=O Amb27192382 [1,0,0,1,0,0|2,0,0]=4 3936 B10R1.29 CSCC[C@@H]1NCCC1=O Amb18830317 [1,0,0,1,0,0|2,0,0]=4 3937 B10R1.29 CSCOC1CCCC1=O Amb25236984 [1,0,0,1,0,0|2,0,0]=4 3938 B10R1.29 C[C@@H]1CCC[C@H]1CCCBr Amb27488920 [1,0,0,1,0,0|1,0,1]=4 3939 B10R1.29 N#CCCC1CCCC1=O Amb4477198 [1,0,0,1,0,0|1,0,1]=4 3940 B10R1.29 NC1CCCC1CCCO Amb9783186 [1,0,0,1,0,0|1,0,1]=4 3941 B10R1.29 NCCCC1CCCC1O Amb9783183 [1,0,0,1,0,0|1,0,1]=4 3942 B10R1.29 NCCCC1CCNC1=O Amb27860538 [1,0,0,1,0,0|2,0,0]=4 3943 B10R1.29 NCCCC1CCOC1=O Amb32668910 [1,0,0,1,0,0|2,0,0]=4 3944 B10R1.29 NCCCC1CCOC1=O Amb32674869 [1,0,0,1,0,0|2,0,0]=4 3945 B10R1.29 NCCCN1CCCC1=O Amb534575 [1,0,0,1,0,0|2,0,0]=4 3946 B10R1.29 O=C1CCCC1CCCF Amb26876720 [1,0,0,1,0,0|1,0,0]=3 3947 B10R1.29 O=C1CCCN1CCCCl Amb1141152 [1,0,0,1,0,0|2,0,0]=4 3948 B10R1.29 O=C1CCCN1CCCO Amb3939639 [1,0,0,1,0,0|2,0,0]=4 3949 B10R1.29 O=C1CCCN1CCCS Amb27837899 [1,0,0,1,0,0|2,0,0]=4 3950 B10R1.29 O=C1CCC[C@@H]1CCCBr Amb27233151 [1,0,0,1,0,0|1,0,0]=3 3951 B10R1.29 O=C1CSCC1CCCF Amb27487070 [1,0,0,1,0,0|2,0,0]=4 3952 B10R1.29 O=C1CSCC1CCCO Amb27218665 [1,0,0,1,0,0|2,0,0]=4 3953 B10R1.29 O=C1NCCC1CCCO Amb27460992 [1,0,0,1,0,0|2,0,0]=4 3954 B10R1.29 O=C1NCCC1CCCO Amb32667562 [1,0,0,1,0,0|2,0,0]=4 3955 B10R1.29 O=C1OCCC1CCCO Amb27977861 [1,0,0,1,0,0|2,0,0]=4 3956 B10R1.29 O=C1OCC[C@H]1CCCF Amb27949209 [1,0,0,1,0,0|2,0,0]=4 3957 B10R1.29 O=CCCC1CCCC1O Amb27636929 [1,0,0,1,0,0|1,0,0]=3 3958 B10R1.29 OC1CCCC1CCCF Amb28456212 [1,0,0,1,0,0|1,0,1]=4 3959 B10R1.29 OCCC[C@@H]1CCC[C@@H]1O Amb27627473 [1,0,0,1,0,0|1,0,1]=4 3960 B10R1.29 [C-]#[N+]CCC1CCCC1C Amb28070463 [1,0,0,1,0,0|2,0,0]=4 3961 B10R1.37 C=CCCCC1CCC1O Amb33213639 [1,0,0,1,0,0|2,0,0]=4 3962 B10R1.37 CCCCCC1CCC1O Amb32945102 [1,0,0,1,0,0|0,0,1]=3 3963 B10R1.37 CCCOCC1CCC1O Amb32950463 [1,0,0,1,0,0|1,0,1]=4 3964 B10R1.37 CNCCCN1CCC1=O Amb27619422 [1,0,0,1,0,0|2,0,0]=4 3965 B10R1.37 COCCCC1CCC1O Amb33213972 [1,0,0,1,0,0|1,0,1]=4 3966 B10R1.57 C=CCCCCC1CSC1 Amb27856624 [1,0,0,1,0,0|2,0,0]=4 3967 B10R1.57 C=CCCNCC1CCC1 Amb27426711 [1,0,0,1,0,0|2,0,0]=4 3968 B10R1.57 C=CCNCCC1CCC1 Amb27450427 [1,0,0,1,0,0|2,0,0]=4 3969 B10R1.57 CCCCCCC1CCN1 Amb27617080 [1,0,0,1,0,0|1,0,1]=4 3970 B10R1.57 CCCCCCC1CNC1 Amb27589877 [1,0,0,1,0,0|2,0,0]=4 3971 B10R1.57 O=C=NCCCC1CCC1 Amb27201843 [1,0,0,1,0,0|1,0,1]=4 3972 B10R1.57 O=CNCCCC1CCN1 Amb28368901 [1,0,0,1,0,0|2,0,0]=4 3973 B10R1.57 O=CNCCCC1CNC1 Amb27462115 [1,0,0,1,0,0|2,0,0]=4 3974 B10R1.57 OCCCCCC1CCC1 Amb27432269 [1,0,0,1,0,0|0,0,1]=3 3975 B10R1.57 OCCCCNC1CCC1 Amb27482224 [1,0,0,1,0,0|1,0,1]=4 3976 B10R1.57 OCCCNCC1CCC1 Amb23580075 [1,0,0,1,0,0|1,0,1]=4 3977 B10R1.57 OCCNCCC1CCC1 Amb27880136 [1,0,0,1,0,0|1,0,1]=4 3978 B10R1.60 C=CCC1CC1CCC=O Amb27823173 [1,0,0,1,0,0|0,0,2]=4 3979 B10R1.60 C=CCC1CC1CCCO Amb27651586 [1,0,0,1,0,0|2,0,0]=4 3980 B10R1.60 C=CC[C@H]1C[C@H]1CCC=O Amb27488205 [1,0,0,1,0,0|0,0,2]=4 3981 B10R1.60 CCCC[C@@H]1C[C@H]1N=C=O Amb28285545 [1,0,0,1,0,0|1,0,1]=4 3982 B10R1.60 CCCC[C@@H]1O[C@H]1CCO Amb27457916 [1,0,0,1,0,0|1,0,1]=4 3983 B10R1.60 CCCC[C@H]1O[C@H]1CCO Amb27422277 [1,0,0,1,0,0|1,0,1]=4 3984 B10R1.60 CCC[C@@H]1O[C@H]1CCCO Amb27969140 [1,0,0,1,0,0|1,0,1]=4 3985 B10R1.60 CCC[C@H]1O[C@@H]1CCC=O Amb27235308 [1,0,0,1,0,0|1,0,0]=3 3986 B10R1.85 BrCCC1CCCCCC1 Amb25286236 [1,0,0,1,0,0|1,0,1]=4 3987 B10R1.85 Br\C=C\C1CCCCCC1 Amb33135243 [1,0,0,1,0,0|1,0,1]=4 3988 B10R1.85 C#CCC1CCCCCC1 Amb33267281 [1,0,0,1,0,0|1,0,1]=4 3989 B10R1.85 C=CCC1CCCCNC1 Amb27167243 [1,0,0,1,0,0|2,0,0]=4 3990 B10R1.85 CCCC1CCCCCN1 Amb2237241 [1,0,0,1,0,0|1,0,1]=4 3991 B10R1.85 CCCC1CCNCCO1 Amb32679920 [1,0,0,1,0,0|1,0,1]=4 3992 B10R1.85 CNCC1CCCCCC1 Amb18962588 [1,0,0,1,0,0|2,0,0]=4 3993 B10R1.85 CSCC1CCCCCC1 Amb28049613 [1,0,0,1,0,0|2,0,0]=4 3994 B10R1.85 ClCCC1CCCCCC1 Amb10807941 [1,0,0,1,0,0|1,0,1]=4 3995 B10R1.85 N#CCC1CCCCCC1 Amb25757856 [1,0,0,1,0,0|1,0,1]=4 3996 B10R1.85 NCCC1CCCCCC1 Amb10607689 [1,0,0,1,0,0|1,0,1]=4 3997 B10R1.85 NCCC1CCCCCC1 Amb21964928 [1,0,0,1,0,0|1,0,1]=4 3998 B10R1.85 NNCC1CCCCCC1 Amb24477918 [1,0,0,1,0,0|2,0,0]=4 3999 B10R1.85 NOCC1CCCCCC1 Amb33267301 [1,0,0,1,0,0|2,0,0]=4 4000 B10R1.85 O=C=NC1CCCCCC1 Amb5750732 [1,0,0,1,0,0|1,0,1]=4 4001 B10R1.85 O=CCC1CCCCCC1 Amb28315719 [1,0,0,1,0,0|0,0,0]=2 4002 B10R1.85 O=CNC1CCCOCC1 Amb27660499 [1,0,0,1,0,0|2,0,0]=4 4003 B10R1.85 O=CNC1CCCSCC1 Amb35691519 [1,0,0,1,0,0|2,0,0]=4 4004 B10R1.85 OCCC1CCCCCC1 Amb18202549 [1,0,0,1,0,0|0,0,1]=3 4005 B10R1.85 OCCC1CCCCCN1 Amb26603628 [1,0,0,1,0,0|1,0,1]=4 4006 B10R1.85 OCCC1CCCCCN1 Amb32652293 [1,0,0,1,0,0|1,0,1]=4 4007 B10R1.85 OCCC1CCCNCC1 Amb23453242 [1,0,0,1,0,0|1,0,1]=4 4008 B10R1.85 OCCC1CCCOCC1 Amb18202400 [1,0,0,1,0,0|1,0,1]=4 4009 B10R1.85 OCCC1CCCSCC1 Amb18199193 [1,0,0,1,0,0|1,0,1]=4 4010 B10R1.85 OCCN1CCCCCC1 Amb2720466 [1,0,0,1,0,0|1,0,1]=4 4011 B10R1.85 ONCC1CCCCCC1 Amb25283715 [1,0,0,1,0,0|1,0,0]=3 4012 B10R1.85 O\N=C\C1CCCCCC1 Amb27212159 [1,0,0,1,0,0|1,0,1]=4 4013 B10R1.85 SCCC1CCCCCC1 Amb24726700 [1,0,0,1,0,0|0,1,1]=4 4014 B10R1.85 [C-]#[N+]CC1CCCCCC1 Amb32877148 [1,0,0,1,0,0|2,0,0]=4 4015 B10R1.129 C=CCCC[C@@H]1C[C@@H]1C=O Amb27252225 [1,0,0,1,0,0|0,0,2]=4 4016 B10R1.129 C=CCCC[C@@H]1C[C@H]1CO Amb27446236 [1,0,0,1,0,0|2,0,0]=4 4017 B10R1.129 C=CCCNC1CC1CC Amb27839386 [1,0,0,1,0,0|2,0,0]=4 4018 B10R1.129 C=CCNCC1CC1CC Amb27781138 [1,0,0,1,0,0|2,0,0]=4 4019 B10R1.129 C=CCNC[C@@H]1C[C@H]1CC Amb28455862 [1,0,0,1,0,0|2,0,0]=4 4020 B10R1.129 CCC1OC1CCCCO Amb27661005 [1,0,0,1,0,0|1,0,1]=4 4021 B10R1.129 CCCCCC1CC1C=O Amb26343852 [1,0,0,1,0,0|0,0,0]=2 4022 B10R1.129 CCCCCC1OC1CO Amb27839244 [1,0,0,1,0,0|1,0,1]=4 4023 B10R1.129 CCCCC[C@@H]1O[C@@H]1C=O Amb27640547 [1,0,0,1,0,0|1,0,0]=3 4024 B10R1.129 CCCCC[C@@H]1O[C@@H]1CO Amb28344365 [1,0,0,1,0,0|1,0,1]=4 4025 B10R1.129 CCCOC[C@H]1C[C@H]1CO Amb27451301 [1,0,0,1,0,0|1,0,1]=4 4026 B10R1.129 CC[C@H]1O[C@H]1CCCCO Amb27970969 [1,0,0,1,0,0|1,0,1]=4 4027 B10R1.132 C=CCC1CCC1CNC Amb27807258 [1,0,0,1,0,0|2,0,0]=4 4028 B10R1.132 CCCC1CCC1CNC Amb27468157 [1,0,0,1,0,0|2,0,0]=4 4029 B10R1.161 BrCC1C=CCCCCC1 Amb27830072 [1,0,0,1,0,0|2,0,0]=4 4030 B10R1.161 BrCC1CCCCCCC1 Amb28043687 [1,0,0,1,0,0|1,0,1]=4 4031 B10R1.161 CC=C1CCCCCCC1 Amb22730433 [1,0,0,1,0,0|1,0,1]=4 4032 B10R1.161 CCC1CCCCCCN1 Amb33069617 [1,0,0,1,0,0|1,0,1]=4 4033 B10R1.161 CCC1OCCCCCO1 Amb27461108 [1,0,0,1,0,0|1,0,1]=4 4034 B10R1.161 CNC1CCCCCCC1 Amb1118420 [1,0,0,1,0,0|2,0,0]=4 4035 B10R1.161 ICC1CCCCCCC1 Amb24428840 [1,0,0,1,0,0|1,0,1]=4 4036 B10R1.161 N#CC1CCCCCCC1 Amb8950082 [1,0,0,1,0,0|1,0,1]=4 4037 B10R1.161 NCC1CCCCCCC1 Amb10610273 [1,0,0,1,0,0|1,0,1]=4 4038 B10R1.161 NCC1CCCCCCC1 Amb8950177 [1,0,0,1,0,0|1,0,1]=4 4039 B10R1.161 O=CC1=CCCCCCC1 Amb17621598 [1,0,0,1,0,0|0,0,2]=4 4040 B10R1.161 O=CC1CCC=CCCC1 Amb25766561 [1,0,0,1,0,0|0,0,2]=4 4041 B10R1.161 O=CC1CCCCCCC1 Amb31307750 [1,0,0,1,0,0|0,0,0]=2 4042 B10R1.161 O=CC1CCCCCCC1 Amb8390588 [1,0,0,1,0,0|0,0,0]=2 4043 B10R1.161 O=CN1CCCCCCC1 Amb27150999 [1,0,0,1,0,0|1,0,0]=3 4044 B10R1.161 O=CN1CCCCNCC1 Amb28126835 [1,0,0,1,0,0|2,0,0]=4 4045 B10R1.161 O=NN1CCCCCCC1 Amb22730533 [1,0,0,1,0,0|2,0,0]=4 4046 B10R1.161 OCC1CCCCCCC1 Amb10807382 [1,0,0,1,0,0|0,0,1]=3 4047 B10R1.161 ON=C1CCCCCCC1 Amb8516239 [1,0,0,1,0,0|1,0,1]=4 4048 B10R1.161 ONC1CCCCCCC1 Amb27857660 [1,0,0,1,0,0|1,0,0]=3 4049 B10R1.161 SCC1CCCCCCC1 Amb24522730 [1,0,0,1,0,0|0,1,1]=4 4050 B10R1.185 C1CCCCCCCCC1 Amb22230445 [1,0,0,1,0,0|1,0,1]=4 4051 B10R1.185 C1CCCCNCCCC1 Amb28075304 [1,0,0,1,0,0|1,0,1]=4 4052 B12R1.7 CCCC#CCC1CCC(=O)O1 Amb22172847 [0,1,0,1,0,0|0,0,1]=3 4053 B12R1.7 CCCCCCC1CCC(=O)O1 Amb569753 [0,1,0,1,0,0|0,0,0]=2 4054 B12R1.7 CCCCCCC1OCC(C)O1 Amb9787442 [0,1,0,1,0,0|1,0,1]=4 4055 B12R1.79 CCC1CCCC1(N)CC(=O)O Amb25723620 [0,1,0,1,0,0|0,0,0]=2 4056 B12R1.79 CCC1CCCC1(N)CC(N)=O Amb33254930 [0,1,0,1,0,0|1,0,0]=3 4057 B12R1.79 CCC1COCC1(N)CC(=O)O Amb33308284 [0,1,0,1,0,0|1,0,0]=3 4058 B12R1.79 CCC1COCC1(N)CC(N)=O Amb33255785 [0,1,0,1,0,0|2,0,0]=4 4059 B12R1.79 CCC1COCC1(O)CC(=O)O Amb35632279 [0,1,0,1,0,0|1,0,0]=3 4060 B12R1.79 COC1CCCC1(N)CC(=O)O Amb32787337 [0,1,0,1,0,0|1,0,0]=3 4061 B12R1.79 COC1CCCC1(N)CC(N)=O Amb33308146 [0,1,0,1,0,0|2,0,0]=4 4062 B12R1.100 C=CCC[C@@H]1C[C@@H](O)CC(=O)O1 Amb27443210 [0,1,0,1,0,0|0,0,2]=4 4063 B12R1.100 CCCC[C@@H]1CC(=O)C[C@@H](C)C1 Amb27844192 [0,1,0,1,0,0|1,0,0]=3 4064 B12R1.107 C=C(C)CC(N)C1CCCCC1 Amb28135462 [0,1,0,1,0,0|2,0,0]=4 4065 B12R1.107 C=C(C)CC(O)C1CCCCC1 Amb28188997 [0,1,0,1,0,0|2,0,0]=4 4066 B12R1.107 C=C(C)C[C@@H](O)C1CCCCC1 Amb27406791 [0,1,0,1,0,0|2,0,0]=4 4067 B12R1.107 C=C(CC(=O)O)C1CCCCC1 Amb27411597 [0,1,0,1,0,0|0,0,1]=3 4068 B12R1.107 C=C(Cl)CC(O)C1CCCCC1 Amb28244194 [0,1,0,1,0,0|2,0,0]=4 4069 B12R1.107 CC(=O)CC(=O)C1CCCCC1 Amb9775081 [0,1,0,1,0,0|1,0,1]=4 4070 B12R1.107 CC(=O)CC(O)C1CCCCC1 Amb28120564 [0,1,0,1,0,0|1,0,0]=3 4071 B12R1.107 CC(=O)CS(=O)C1CCCCC1 Amb27800713 [0,1,0,1,0,0|2,0,0]=4 4072 B12R1.107 CC(=O)OC(C)C1CCCCC1 Amb27614524 [0,1,0,1,0,0|2,0,0]=4 4073 B12R1.107 CC(CC(=N)N)C1CCCCC1 Amb28185332 [0,1,0,1,0,0|2,0,0]=4 4074 B12R1.107 CC(CC(=O)O)C1CC=CCC1 Amb25218280 [0,1,0,1,0,0|0,0,2]=4 4075 B12R1.107 CC(CC(=O)O)C1CCCCC1 Amb9672057 [0,1,0,1,0,0|0,0,0]=2 4076 B12R1.107 CC(CC(=O)O)C1CCCCO1 Amb33080211 [0,1,0,1,0,0|1,0,0]=3 4077 B12R1.107 CC(CC(=O)O)C1CCCNC1 Amb18198558 [0,1,0,1,0,0|1,0,0]=3 4078 B12R1.107 CC(CC(=O)O)C1CCCOC1 Amb28384360 [0,1,0,1,0,0|1,0,0]=3 4079 B12R1.107 CC(CC(=O)O)C1CCCSC1 Amb18191053 [0,1,0,1,0,0|1,0,0]=3 4080 B12R1.107 CC(CC(=O)O)C1CCNCC1 Amb13889036 [0,1,0,1,0,0|1,0,0]=3 4081 B12R1.107 CC(CC(=O)O)C1CCOCC1 Amb24626640 [0,1,0,1,0,0|1,0,0]=3 4082 B12R1.107 CC(CC(=O)O)C1CCSCC1 Amb18820667 [0,1,0,1,0,0|1,0,0]=3 4083 B12R1.107 CC(CC(=O)O)C1COCCO1 Amb10812774 [0,1,0,1,0,0|2,0,0]=4 4084 B12R1.107 CC(CC(=O)O)C1OCCCO1 Amb17334971 [0,1,0,1,0,0|2,0,0]=4 4085 B12R1.107 CC(CC(=O)O)N1CCCCC1 Amb17622094 [0,1,0,1,0,0|1,0,0]=3 4086 B12R1.107 CC(CC(=O)O)N1CCCCC1 Amb9399178 [0,1,0,1,0,0|1,0,0]=3 4087 B12R1.107 CC(CC(=O)O)N1CCOCC1 Amb8428158 [0,1,0,1,0,0|2,0,0]=4 4088 B12R1.107 CC(CC(=O)O)N1CCOCC1 Amb9173362 [0,1,0,1,0,0|2,0,0]=4 4089 B12R1.107 CC(CC(=O)O)N1CCSCC1 Amb9399284 [0,1,0,1,0,0|2,0,0]=4 4090 B12R1.107 CC(CC(N)=O)C1CCCCC1 Amb26651849 [0,1,0,1,0,0|1,0,0]=3 4091 B12R1.107 CC(CC(N)=O)C1CCCNC1 Amb27172537 [0,1,0,1,0,0|2,0,0]=4 4092 B12R1.107 CC(CC(N)=O)N1CCCCC1 Amb17232751 [0,1,0,1,0,0|2,0,0]=4 4093 B12R1.107 CC(NC(=O)Cl)C1CCCCC1 Amb28118445 [0,1,0,1,0,0|2,0,0]=4 4094 B12R1.107 CN(CC(=O)O)C1CCCCC1 Amb19134603 [0,1,0,1,0,0|1,0,0]=3 4095 B12R1.107 CN(CC(=O)O)C1CCCCC1 Amb5761896 [0,1,0,1,0,0|1,0,0]=3 4096 B12R1.107 CN(CC(=O)O)C1CCCNC1 Amb18825348 [0,1,0,1,0,0|2,0,0]=4 4097 B12R1.107 CN(CC(=O)O)C1CCCOC1 Amb27874550 [0,1,0,1,0,0|2,0,0]=4 4098 B12R1.107 CN(CC(=O)O)C1CCCSC1 Amb27600250 [0,1,0,1,0,0|2,0,0]=4 4099 B12R1.107 CN(CC(=O)O)C1CCNCC1 Amb21959995 [0,1,0,1,0,0|2,0,0]=4 4100 B12R1.107 CN(CC(=O)O)C1CCNCC1 Amb22587388 [0,1,0,1,0,0|2,0,0]=4 4101 B12R1.107 CN(CC(=O)O)C1CCNCC1 Amb9471657 [0,1,0,1,0,0|2,0,0]=4 4102 B12R1.107 CN(CC(N)=O)C1CCCCC1 Amb17142914 [0,1,0,1,0,0|2,0,0]=4 4103 B12R1.107 CS(=O)CC(N)C1CCCCC1 Amb27450871 [0,1,0,1,0,0|2,0,0]=4 4104 B12R1.107 C[C@@H](CC(=O)O)C1CCCCC1 Amb28142000 [0,1,0,1,0,0|0,0,0]=2 4105 B12R1.107 C[C@@H](O)C[C@@H](O)C1CCCCC1 Amb27213818 [0,1,0,1,0,0|1,0,1]=4 4106 B12R1.107 C[C@H](O)C[C@@H](O)C1CCCCC1 Amb27218531 [0,1,0,1,0,0|1,0,1]=4 4107 B12R1.107 C[C@H](O)C[C@H](O)C1CCCCC1 Amb27261706 [0,1,0,1,0,0|1,0,1]=4 4108 B12R1.107 C[C@H](OC(=O)Cl)C1CCCCC1 Amb33297336 [0,1,0,1,0,0|2,0,0]=4 4109 B12R1.107 C\C(=C/C(=O)O)C1CCCCC1 Amb33534648 [0,1,0,1,0,0|0,0,2]=4 4110 B12R1.107 NC(=O)CC(N)C1CCCCC1 Amb18988308 [0,1,0,1,0,0|1,0,0]=3 4111 B12R1.107 NC(=O)CC(N)C1CCCCC1 Amb20623698 [0,1,0,1,0,0|1,0,0]=3 4112 B12R1.107 NC(=O)CC(N)C1CCCCO1 Amb33308285 [0,1,0,1,0,0|2,0,0]=4 4113 B12R1.107 NC(=O)CC(N)C1CCCOC1 Amb27402501 [0,1,0,1,0,0|2,0,0]=4 4114 B12R1.107 NC(=O)CC(N)C1CCCSC1 Amb32787383 [0,1,0,1,0,0|2,0,0]=4 4115 B12R1.107 NC(=O)CC(N)C1CCOCC1 Amb18990343 [0,1,0,1,0,0|2,0,0]=4 4116 B12R1.107 NC(=O)CC(N)C1CCOCC1 Amb20623685 [0,1,0,1,0,0|2,0,0]=4 4117 B12R1.107 NC(=O)C[C@@H](N)C1CCCCC1 Amb24396369 [0,1,0,1,0,0|1,0,0]=3 4118 B12R1.107 NC(=O)C[C@@H](N)C1CCCCO1 Amb32787540 [0,1,0,1,0,0|2,0,0]=4 4119 B12R1.107 NC(=O)C[C@@H](N)C1CCCOC1 Amb27970310 [0,1,0,1,0,0|2,0,0]=4 4120 B12R1.107 NC(=O)C[C@@H](N)C1CCOCC1 Amb27180320 [0,1,0,1,0,0|2,0,0]=4 4121 B12R1.107 NC(=O)C[C@H](N)C1CCCCC1 Amb24537619 [0,1,0,1,0,0|1,0,0]=3 4122 B12R1.107 NC(=O)C[C@H](N)C1CCCCO1 Amb33308504 [0,1,0,1,0,0|2,0,0]=4 4123 B12R1.107 NC(=O)C[C@H](N)C1CCCOC1 Amb25079370 [0,1,0,1,0,0|2,0,0]=4 4124 B12R1.107 NC(=O)C[C@H](N)C1CCOCC1 Amb24733994 [0,1,0,1,0,0|2,0,0]=4 4125 B12R1.107 NC(CC(=O)Cl)C1CCCCC1 Amb27265805 [0,1,0,1,0,0|1,0,0]=3 4126 B12R1.107 NC(CC(=O)O)C1=CCCCC1 Amb2697637 [0,1,0,1,0,0|0,0,2]=4 4127 B12R1.107 NC(CC(=O)O)C1CC=CCC1 Amb2438878 [0,1,0,1,0,0|0,0,2]=4 4128 B12R1.107 NC(CC(=O)O)C1CCCCC1 Amb1993733 [0,1,0,1,0,0|0,0,0]=2 4129 B12R1.107 NC(CC(=O)O)C1CCCCC1 Amb32751271 [0,1,0,1,0,0|0,0,0]=2 4130 B12R1.107 NC(CC(=O)O)C1CCCCO1 Amb33253753 [0,1,0,1,0,0|1,0,0]=3 4131 B12R1.107 NC(CC(=O)O)C1CCCOC1 Amb25223168 [0,1,0,1,0,0|1,0,0]=3 4132 B12R1.107 NC(CC(=O)O)C1CCCSC1 Amb33308328 [0,1,0,1,0,0|1,0,0]=3 4133 B12R1.107 NC(CC(=O)O)C1CCOCC1 Amb2683292 [0,1,0,1,0,0|1,0,0]=3 4134 B12R1.107 NC(CC(=O)O)C1CCSCC1 Amb2683284 [0,1,0,1,0,0|1,0,0]=3 4135 B12R1.107 NC(CC(=O)O)N1CCOCC1 Amb27209494 [0,1,0,1,0,0|2,0,0]=4 4136 B12R1.107 N[C@@H](CC(=O)O)C1CCCCC1 Amb22274052 [0,1,0,1,0,0|0,0,0]=2 4137 B12R1.107 N[C@@H](CC(=O)O)C1CCCCC1 Amb33329297 [0,1,0,1,0,0|0,0,0]=2 4138 B12R1.107 N[C@@H](CC(=O)O)C1CCCCO1 Amb32787511 [0,1,0,1,0,0|1,0,0]=3 4139 B12R1.107 N[C@@H](CC(=O)O)C1CCCOC1 Amb26393198 [0,1,0,1,0,0|1,0,0]=3 4140 B12R1.107 N[C@@H](CC(=O)O)C1CCOCC1 Amb24644872 [0,1,0,1,0,0|1,0,0]=3 4141 B12R1.107 N[C@@H](CC(=O)O)[C@@H]1CC=CCC1 Amb27850002 [0,1,0,1,0,0|0,0,2]=4 4142 B12R1.107 N[C@H](CC(=O)O)C1CCCCC1 Amb26440160 [0,1,0,1,0,0|0,0,0]=2 4143 B12R1.107 N[C@H](CC(=O)O)C1CCCCC1 Amb32655979 [0,1,0,1,0,0|0,0,0]=2 4144 B12R1.107 N[C@H](CC(=O)O)C1CCCCO1 Amb33253927 [0,1,0,1,0,0|1,0,0]=3 4145 B12R1.107 N[C@H](CC(=O)O)C1CCCOC1 Amb24644873 [0,1,0,1,0,0|1,0,0]=3 4146 B12R1.107 N[C@H](CC(=O)O)C1CCOCC1 Amb28319450 [0,1,0,1,0,0|1,0,0]=3 4147 B12R1.107 N[C@H](CC(=O)O)[C@@H]1CC=CCC1 Amb28068866 [0,1,0,1,0,0|0,0,2]=4 4148 B12R1.107 O=C(O)CC(=O)N1CCCCC1 Amb17400345 [0,1,0,1,0,0|1,0,1]=4 4149 B12R1.107 O=C(O)CC(O)C1CC=CCC1 Amb18990579 [0,1,0,1,0,0|0,0,2]=4 4150 B12R1.107 O=C(O)CC(O)C1CCCCC1 Amb17232870 [0,1,0,1,0,0|0,0,0]=2 4151 B12R1.107 O=C(O)CC(O)C1CCCCO1 Amb33375651 [0,1,0,1,0,0|1,0,0]=3 4152 B12R1.107 O=C(O)CC(O)C1CCCOC1 Amb33449325 [0,1,0,1,0,0|1,0,0]=3 4153 B12R1.107 O=C(O)CC(O)C1CCCSC1 Amb33475027 [0,1,0,1,0,0|1,0,0]=3 4154 B12R1.107 O=C(O)CC(O)C1CCOCC1 Amb18990584 [0,1,0,1,0,0|1,0,0]=3 4155 B12R1.107 O=C(O)C[C@@H](O)C1CC=CCC1 Amb33226533 [0,1,0,1,0,0|0,0,2]=4 4156 B12R1.107 O=C(O)C[C@@H](O)C1CCCCC1 Amb26585299 [0,1,0,1,0,0|0,0,0]=2 4157 B12R1.107 O=C(O)C[C@@H](O)C1CCCCO1 Amb33375649 [0,1,0,1,0,0|1,0,0]=3 4158 B12R1.107 O=C(O)C[C@@H](O)C1CCCOC1 Amb33322512 [0,1,0,1,0,0|1,0,0]=3 4159 B12R1.107 O=C(O)C[C@@H](O)C1CCCSC1 Amb32726253 [0,1,0,1,0,0|1,0,0]=3 4160 B12R1.107 O=C(O)C[C@@H](O)C1CCOCC1 Amb33419079 [0,1,0,1,0,0|1,0,0]=3 4161 B12R1.107 O=C(O)C[C@H](O)C1CC=CCC1 Amb33203495 [0,1,0,1,0,0|0,0,2]=4 4162 B12R1.107 O=C(O)C[C@H](O)C1CCCCC1 Amb26517431 [0,1,0,1,0,0|0,0,0]=2 4163 B12R1.107 O=C(O)C[C@H](O)C1CCCCO1 Amb33375650 [0,1,0,1,0,0|1,0,0]=3 4164 B12R1.107 O=C(O)C[C@H](O)C1CCCOC1 Amb33322513 [0,1,0,1,0,0|1,0,0]=3 4165 B12R1.107 O=C(O)C[C@H](O)C1CCCSC1 Amb32726254 [0,1,0,1,0,0|1,0,0]=3 4166 B12R1.107 O=C(O)C[C@H](O)C1CCOCC1 Amb33419081 [0,1,0,1,0,0|1,0,0]=3 4167 B12R1.123 C=C(C)CC1(N)CCCCC1C Amb30030525 [0,1,0,1,0,0|2,0,0]=4 4168 B12R1.123 CC(O)CC1(N)CCCCC1C Amb30030897 [0,1,0,1,0,0|1,0,1]=4 4169 B12R1.123 CC1(CC(=O)O)CCCCC1=O Amb18647359 [0,1,0,1,0,0|1,0,1]=4 4170 B12R1.123 CC1CCCCC1(C)CC(=O)O Amb27457155 [0,1,0,1,0,0|0,0,0]=2 4171 B12R1.123 CC1CCCCC1(C)NC(=O)Cl Amb35633384 [0,1,0,1,0,0|2,0,0]=4 4172 B12R1.123 CC1CCCCC1(N)CC(=O)O Amb26038273 [0,1,0,1,0,0|0,0,0]=2 4173 B12R1.123 CC1CCCCC1(N)CC(N)=O Amb33255752 [0,1,0,1,0,0|1,0,0]=3 4174 B12R1.123 CC1CCCCC1(O)CC(=O)O Amb18961447 [0,1,0,1,0,0|0,0,0]=2 4175 B12R1.123 CC1CNCCC1(N)CC(=O)O Amb25054506 [0,1,0,1,0,0|1,0,0]=3 4176 B12R1.123 CC1CNCCC1(N)CC(N)=O Amb33308453 [0,1,0,1,0,0|2,0,0]=4 4177 B12R1.123 CC1COCCC1(N)CC(=O)O Amb25132674 [0,1,0,1,0,0|1,0,0]=3 4178 B12R1.123 CC1COCCC1(N)CC(N)=O Amb33254378 [0,1,0,1,0,0|2,0,0]=4 4179 B12R1.123 CC1NCCCC1(N)CC(=O)O Amb27202911 [0,1,0,1,0,0|1,0,0]=3 4180 B12R1.123 CC1NCCCC1(N)CC(N)=O Amb33254698 [0,1,0,1,0,0|2,0,0]=4 4181 B12R1.123 CC1SCCCC1(N)CC(=O)O Amb33255928 [0,1,0,1,0,0|1,0,0]=3 4182 B12R1.123 CC1SCCCC1(N)CC(N)=O Amb33254246 [0,1,0,1,0,0|2,0,0]=4 4183 B12R1.123 N[C@H]1CCCC[C@@]1(N)CC(=O)O Amb27666896 [0,1,0,1,0,0|1,0,0]=3 4184 B12R1.123 O=C(O)C[C@@]1(O)CCCC[C@@H]1Cl Amb27216481 [0,1,0,1,0,0|1,0,0]=3 4185 B12R1.141 C=C1CCCCCCCC(O)C1 Amb28345283 [0,1,0,1,0,0|2,0,0]=4 4186 B12R1.141 CC1=CC(=O)CCCCCCC1 Amb28253959 [0,1,0,1,0,0|1,0,0]=3 4187 B12R1.141 CC1CCCCCCCC(=O)N1 Amb27616243 [0,1,0,1,0,0|1,0,0]=3 4188 B12R1.141 CC1CCCCNCCC(=O)N1 Amb32657052 [0,1,0,1,0,0|1,0,0]=3 4189 B12R1.141 O=C1CCCCCCCC(=O)O1 Amb26420851 [0,1,0,1,0,0|0,0,1]=3 4190 B12R1.141 O=C1CCCCCCCC(O)C1 Amb27262870 [0,1,0,1,0,0|1,0,0]=3 4191 B12R1.141 O=C1CCCCCCOC(=O)C1 Amb27177481 [0,1,0,1,0,0|0,0,1]=3 4192 B12R1.141 OC1CCCCCCCC(O)C1 Amb27835984 [0,1,0,1,0,0|1,0,1]=4 4193 B12R1.144 CC(=O)CN(C)C1CCCC1C Amb35734066 [0,1,0,1,0,0|2,0,0]=4 4194 B12R1.144 CC(CC(=O)O)C1CCOC1C Amb33427703 [0,1,0,1,0,0|1,0,0]=3 4195 B12R1.144 CC1COCC1N(C)CC(=O)O Amb35632272 [0,1,0,1,0,0|2,0,0]=4 4196 B12R1.144 CC1CSCC1N(C)CC(=O)O Amb28364162 [0,1,0,1,0,0|2,0,0]=4 4197 B12R1.144 CC1OCCC1C(N)CC(=O)O Amb33427713 [0,1,0,1,0,0|1,0,0]=3 4198 B12R1.144 CC1OCCC1C(O)CC(=O)O Amb33427230 [0,1,0,1,0,0|1,0,0]=3 4199 B12R1.144 CC1OCCC1[C@@H](O)CC(=O)O Amb33427228 [0,1,0,1,0,0|1,0,0]=3 4200 B12R1.144 CC1OCCC1[C@H](O)CC(=O)O Amb33427227 [0,1,0,1,0,0|1,0,0]=3 4201 B12R1.144 CN(CC(=O)O)C1CCCC1O Amb18292030 [0,1,0,1,0,0|2,0,0]=4 4202 B12R1.144 CN(CC(=O)O)[C@@H]1CCC[C@H]1O Amb32684691 [0,1,0,1,0,0|2,0,0]=4 4203 B12R1.144 C[C@@H]1CCC[C@H]1C(O)CC(=O)O Amb27783830 [0,1,0,1,0,0|0,0,0]=2 4204 B12R1.144 O=C(O)C[C@H](O)[C@H]1NCC[C@H]1O Amb27660207 [0,1,0,1,0,0|2,0,0]=4 4205 B12R1.152 CC1CCC1NC(=O)CC(=O)O Amb28127754 [0,1,0,1,0,0|1,0,1]=4 4206 B12R1.181 CC1CCC(CCO)C1C(=O)O Amb27178212 [0,1,0,1,0,0|1,0,0]=3 4207 B12R1.181 CCCC1CCN(C)C1C(=O)Cl Amb28119034 [0,1,0,1,0,0|2,0,0]=4 4208 B12R1.181 CCCC1CCN(C)C1C(N)=O Amb24343198 [0,1,0,1,0,0|2,0,0]=4 4209 B12R1.181 CCCC1CNC(=O)C1C(=O)O Amb27863394 [0,1,0,1,0,0|1,0,1]=4 4210 B12R1.182 COCC1CCN(CC(=O)O)C1 Amb21860510 [0,1,0,1,0,0|2,0,0]=4 4211 B12R1.212 CC(=O)C1CCCCCCC1N Amb33447098 [0,1,0,1,0,0|1,0,0]=3 4212 B12R1.212 NC(=O)C1CCCCCCC1N Amb28292092 [0,1,0,1,0,0|1,0,0]=3 4213 B12R1.212 NC(=O)C1CCCCCCC1O Amb27178181 [0,1,0,1,0,0|1,0,0]=3 4214 B12R1.212 NC(=O)[C@@H]1CCCCCC[C@@H]1O Amb27974099 [0,1,0,1,0,0|1,0,0]=3 4215 B12R1.212 NC(=O)[C@H]1CCCCCC[C@@H]1O Amb28323009 [0,1,0,1,0,0|1,0,0]=3 4216 B12R1.212 NC1CCC=CCCC1C(=O)O Amb2694982 [0,1,0,1,0,0|0,0,2]=4 4217 B12R1.212 NC1CCCCCCC1C(=O)O Amb20667806 [0,1,0,1,0,0|0,0,0]=2 4218 B12R1.212 NC1CCCCCCC1C(=O)O Amb22059713 [0,1,0,1,0,0|0,0,0]=2 4219 B12R1.212 NS(=O)C1CCCCCCC1F Amb32720767 [0,1,0,1,0,0|2,0,0]=4 4220 B12R1.212 N[C@@H]1C=CCCCC[C@@H]1C(=O)O Amb25947645 [0,1,0,1,0,0|0,0,2]=4 4221 B12R1.212 N[C@@H]1C=CCCCC[C@@H]1C(=O)O Amb31307610 [0,1,0,1,0,0|0,0,2]=4 4222 B12R1.212 N[C@@H]1CCC=CCC[C@@H]1C(=O)O Amb1993856 [0,1,0,1,0,0|0,0,2]=4 4223 B12R1.212 N[C@@H]1CCC=CCC[C@@H]1C(=O)O Amb1994008 [0,1,0,1,0,0|0,0,2]=4 4224 B12R1.212 N[C@@H]1CCCCCC[C@@H]1C(=O)O Amb1993853 [0,1,0,1,0,0|0,0,0]=2 4225 B12R1.212 N[C@@H]1CCCCCC[C@@H]1C(=O)O Amb1994005 [0,1,0,1,0,0|0,0,0]=2 4226 B12R1.212 N[C@H]1CCC=CCC[C@H]1C(=O)O Amb1993855 [0,1,0,1,0,0|0,0,2]=4 4227 B12R1.212 N[C@H]1CCCCCC[C@H]1C(=O)O Amb1993854 [0,1,0,1,0,0|0,0,0]=2 4228 B12R1.212 O=C(O)C1CCC=CCCC1O Amb27397762 [0,1,0,1,0,0|0,0,2]=4 4229 B12R1.212 O=C(O)[C@H]1CCC=CCC[C@@H]1Cl Amb27791800 [0,1,0,1,0,0|0,0,2]=4 4230 B12R1.212 O=S(Cl)C1CCCCCCC1F Amb32720766 [0,1,0,1,0,0|2,0,0]=4 4231 B12R1.212 O=S([O-])C1CCCCCCC1F Amb32755059 [0,1,0,1,0,0|1,0,1]=4 4232 B12R1.260 CC(=O)CC(C)SC1CCCC1 Amb32670940 [0,1,0,1,0,0|2,0,0]=4 4233 B12R1.260 CC(CC(=O)O)CC1CCCC1 Amb33474814 [0,1,0,1,0,0|0,0,0]=2 4234 B12R1.260 CC(CC(=O)O)NC1CCCC1 Amb9398399 [0,1,0,1,0,0|1,0,0]=3 4235 B12R1.260 CC(CC(N)=O)NC1CCCC1 Amb17232750 [0,1,0,1,0,0|2,0,0]=4 4236 B12R1.260 CN(CC(=O)O)CC1CCCO1 Amb9301018 [0,1,0,1,0,0|2,0,0]=4 4237 B12R1.260 C\C(=C/C(=O)O)CC1CCCC1 Amb35683484 [0,1,0,1,0,0|0,0,2]=4 4238 B12R1.260 NC(=O)CC(N)CC1CCCC1 Amb32787381 [0,1,0,1,0,0|1,0,0]=3 4239 B12R1.260 NC(CC(=O)O)CC1CCCC1 Amb18825419 [0,1,0,1,0,0|0,0,0]=2 4240 B12R1.260 O=C(O)CC(=O)NC1CCCC1 Amb10608183 [0,1,0,1,0,0|1,0,1]=4 4241 B12R1.260 O=C(O)CC(O)C=C1CCCC1 Amb18647342 [0,1,0,1,0,0|0,0,2]=4 4242 B12R1.260 O=C(O)CC(O)CC1CCCC1 Amb32954885 [0,1,0,1,0,0|0,0,0]=2 4243 B12R1.260 O=C(O)C[C@@H](O)CC1CCCC1 Amb33378873 [0,1,0,1,0,0|0,0,0]=2 4244 B12R1.260 O=C(O)C[C@H](O)CC1CCCC1 Amb33378874 [0,1,0,1,0,0|0,0,0]=2 4245 B12R1.437 CC1CCCC(C=O)C1C(=O)O Amb28245773 [0,1,0,1,0,0|1,0,1]=4 4246 B12R1.437 CC1CCCC(CO)C1C(=O)O Amb28076893 [0,1,0,1,0,0|1,0,0]=3 4247 B12R1.437 CCC1NCCC(O)C1C(=O)O Amb18198051 [0,1,0,1,0,0|1,0,0]=3 4248 B12R1.437 CCN1CCOC(C)C1C(=O)O Amb18061802 [0,1,0,1,0,0|2,0,0]=4 4249 B12R1.437 CC[C@H]1CCCN(C)[C@@H]1C(=O)O Amb27810945 [0,1,0,1,0,0|1,0,0]=3 4250 B12R1.438 CC(=O)CC1CCCC(CN)C1 Amb25786547 [0,1,0,1,0,0|2,0,0]=4 4251 B12R1.438 CCC1CC(CC(=O)O)CCN1 Amb18825411 [0,1,0,1,0,0|1,0,0]=3 4252 B12R1.438 CCC1CC(CC(=O)O)CCO1 Amb28076052 [0,1,0,1,0,0|1,0,0]=3 4253 B12R1.438 CCC1CC(CC(N)=O)CCO1 Amb27833568 [0,1,0,1,0,0|2,0,0]=4 4254 B12R1.438 CCC1CCCC(CC(C)=O)C1 Amb28042751 [0,1,0,1,0,0|1,0,0]=3 4255 B12R1.438 CCC1CCCC(NC(=O)Cl)C1 Amb35633387 [0,1,0,1,0,0|2,0,0]=4 4256 B12R1.438 CCC1CCCC(NC(C)=O)C1 Amb27800438 [0,1,0,1,0,0|2,0,0]=4 4257 B12R1.438 CCC1CCCC(OC(=O)Cl)C1 Amb26597912 [0,1,0,1,0,0|2,0,0]=4 4258 B12R1.438 CCC1CCCN(CC(=O)O)C1 Amb31217534 [0,1,0,1,0,0|1,0,0]=3 4259 B12R1.438 CCC1CCCN(CC(=O)O)C1 Amb9447861 [0,1,0,1,0,0|1,0,0]=3 4260 B12R1.438 CCC1CCCN(CC(N)=O)C1 Amb18793672 [0,1,0,1,0,0|2,0,0]=4 4261 B12R1.438 CCC1CCNC(CC(=O)O)C1 Amb18825410 [0,1,0,1,0,0|1,0,0]=3 4262 B12R1.438 CCC1CCNC(CC(C)=O)C1 Amb27759570 [0,1,0,1,0,0|2,0,0]=4 4263 B12R1.438 CCN1CCCC(CC(=O)O)C1 Amb18300084 [0,1,0,1,0,0|1,0,0]=3 4264 B12R1.438 CCN1CCCC(CC(N)=O)C1 Amb28455014 [0,1,0,1,0,0|2,0,0]=4 4265 B12R1.438 CCN1CCOC(CC(=O)O)C1 Amb18061931 [0,1,0,1,0,0|2,0,0]=4 4266 B12R1.438 COC1CCCC(CC(=O)O)C1 Amb18647668 [0,1,0,1,0,0|1,0,0]=3 4267 B12R1.438 CSC1CCCC(CC(=O)O)C1 Amb27226249 [0,1,0,1,0,0|1,0,0]=3 4268 B12R1.438 N#CC1CCCC(CC(=O)O)C1 Amb18827225 [0,1,0,1,0,0|1,0,1]=4 4269 B12R1.438 NCC1CCCC(CC(=O)O)O1 Amb18197930 [0,1,0,1,0,0|1,0,0]=3 4270 B12R1.438 NCC1CCCN(CC(=O)O)C1 Amb18294011 [0,1,0,1,0,0|2,0,0]=4 4271 B12R1.438 NCC1CCCN(CC(=O)O)C1 Amb32992631 [0,1,0,1,0,0|2,0,0]=4 4272 B12R1.438 O=C(O)CN1CCCC(CO)C1 Amb29847901 [0,1,0,1,0,0|2,0,0]=4 4273 B12R1.874 CC(=O)CC1CCCCN(C)C1 Amb27445640 [0,1,0,1,0,0|2,0,0]=4 4274 B12R1.874 CC(=O)C[C@H]1CCCCC(=O)C1 Amb28144126 [0,1,0,1,0,0|1,0,1]=4 4275 B12R1.874 CC(=O)O[C@H]1CCCC[C@@H](O)C1 Amb27964523 [0,1,0,1,0,0|2,0,0]=4 4276 B12R1.874 CC(C)CC1CSCCC(=O)N1 Amb27879606 [0,1,0,1,0,0|2,0,0]=4 4277 B12R1.874 CC1CSCCN(CC(=O)O)C1 Amb27491050 [0,1,0,1,0,0|2,0,0]=4 4278 B12R1.874 O=C(O)CC1CCCCC(=O)N1 Amb26051590 [0,1,0,1,0,0|1,0,1]=4 4279 B12R1.874 O=C(O)CC1CCCNC(=O)C1 Amb25322054 [0,1,0,1,0,0|1,0,1]=4 4280 B12R1.1377 NC(=O)CC(N)CCCC1CC1 Amb33255286 [0,1,0,1,0,0|1,0,0]=3 4281 B12R1.1377 NC(CCCC1CC1)CC(=O)O Amb33253944 [0,1,0,1,0,0|0,0,0]=2 4282 B12R1.1392 CC(=O)C=C1CCCCCCC1 Amb28253982 [0,1,0,1,0,0|1,0,1]=4 4283 B12R1.1392 CC(=O)CC1CCCCCCN1 Amb27395289 [0,1,0,1,0,0|1,0,0]=3 4284 B12R1.1392 CC(=O)NC1CCCCCCC1 Amb5797421 [0,1,0,1,0,0|1,0,0]=3 4285 B12R1.1392 CC(=O)NC1CCCCCNC1 Amb32659965 [0,1,0,1,0,0|2,0,0]=4 4286 B12R1.1392 CC(=O)OC1CCCCCCC1 Amb4016350 [0,1,0,1,0,0|1,0,0]=3 4287 B12R1.1392 CC(O)CC1CCCCCCN1 Amb28041807 [0,1,0,1,0,0|1,0,1]=4 4288 B12R1.1392 N=C(N)CN1CCCCCCC1 Amb6750450 [0,1,0,1,0,0|2,0,0]=4 4289 B12R1.1392 N=C(N)NC1CCCCCCC1 Amb18801546 [0,1,0,1,0,0|2,0,0]=4 4290 B12R1.1392 O=C(Cl)NC1CCCCCCC1 Amb35637075 [0,1,0,1,0,0|1,0,0]=3 4291 B12R1.1392 O=C(Cl)OC1CCCCCCC1 Amb27480779 [0,1,0,1,0,0|1,0,0]=3 4292 B12R1.1392 O=C(O)C=C1CCCCCCC1 Amb6749166 [0,1,0,1,0,0|0,0,1]=3 4293 B12R1.1392 O=C(O)CC1CCCCCCC1 Amb6749259 [0,1,0,1,0,0|0,0,0]=2 4294 B12R1.1392 O=C(O)CC1CCCCCCO1 Amb27634953 [0,1,0,1,0,0|0,0,0]=2 4295 B12R1.1392 O=C(O)CN1CCCCCCC1 Amb6613276 [0,1,0,1,0,0|0,0,0]=2 4296 B12R1.1392 O=C(O)C[C@H]1CCCCCCN1 Amb27985858 [0,1,0,1,0,0|0,0,0]=2 4297 B12R1.1453 CCC[C@@H]1CC[C@@H](C)CC(=O)C1 Amb28052261 [0,1,0,1,0,0|1,0,0]=3 4298 B12R1.1755 CCCCCC[C@@H]1C[C@H]1C(=O)O Amb33098453 [0,1,0,1,0,0|0,0,0]=2 4299 B12R1.1755 CCCCCC[C@H]1C[C@H]1C(=O)O Amb33098421 [0,1,0,1,0,0|0,0,0]=2 4300 B12R1.1829 C=C(C)CC1(N)CCCCCC1 Amb30030516 [0,1,0,1,0,0|2,0,0]=4 4301 B12R1.1829 CC(=O)CC1(O)CCCOCC1 Amb32943795 [0,1,0,1,0,0|2,0,0]=4 4302 B12R1.1829 CC(O)CC1(N)CCCCCC1 Amb35637598 [0,1,0,1,0,0|1,0,1]=4 4303 B12R1.1829 CC1(OC(=O)Cl)CCCCCC1 Amb33297124 [0,1,0,1,0,0|2,0,0]=4 4304 B12R1.1829 CC1(OC(N)=O)CCCCCC1 Amb24724887 [0,1,0,1,0,0|2,0,0]=4 4305 B12R1.1829 NC(=O)CC1(N)CCCCCC1 Amb33254386 [0,1,0,1,0,0|1,0,0]=3 4306 B12R1.1829 NC(=O)CC1(N)CCCNCC1 Amb33254643 [0,1,0,1,0,0|2,0,0]=4 4307 B12R1.1829 NC(=O)CC1(N)CCCOCC1 Amb33255268 [0,1,0,1,0,0|2,0,0]=4 4308 B12R1.1829 NC(=O)CC1(N)CCCSCC1 Amb32787276 [0,1,0,1,0,0|2,0,0]=4 4309 B12R1.1829 NC1(CC(=O)O)CCCCCC1 Amb22641940 [0,1,0,1,0,0|0,0,0]=2 4310 B12R1.1829 NC1(CC(=O)O)CCCCCC1 Amb31307618 [0,1,0,1,0,0|0,0,0]=2 4311 B12R1.1829 NC1(CC(=O)O)CCCNCC1 Amb33255843 [0,1,0,1,0,0|1,0,0]=3 4312 B12R1.1829 NC1(CC(=O)O)CCCOCC1 Amb24462556 [0,1,0,1,0,0|1,0,0]=3 4313 B12R1.1829 NC1(CC(=O)O)CCCSCC1 Amb33254122 [0,1,0,1,0,0|1,0,0]=3 4314 B12R1.1829 NC1(CC(=O)O)COCCOC1 Amb27416915 [0,1,0,1,0,0|2,0,0]=4 4315 B12R1.1829 NS(=O)CC1(F)CCCCCC1 Amb32720725 [0,1,0,1,0,0|2,0,0]=4 4316 B12R1.1829 O=C(O)CC1(F)CCCCCC1 Amb28196214 [0,1,0,1,0,0|0,0,0]=2 4317 B12R1.1829 O=C(O)CC1(O)CCCCCC1 Amb18285918 [0,1,0,1,0,0|0,0,0]=2 4318 B12R1.1829 O=C(O)CC1(O)CCCSCC1 Amb35691450 [0,1,0,1,0,0|1,0,0]=3 4319 B12R1.1829 O=S(Cl)CC1(F)CCCCCC1 Amb32720723 [0,1,0,1,0,0|2,0,0]=4 4320 B12R1.1829 O=S([O-])CC1(F)CCCCCC1 Amb32754876 [0,1,0,1,0,0|1,0,1]=4 4321 B12R1.105 CC(C)CNCC1CCC(=O)N1 Amb33230940 [0,1,0,1,0,0|2,0,0]=4 4322 B12R1.105 C[C@@H]1CCC(CCCC(=O)O)O1 Amb33224966 [0,1,0,1,0,0|0,0,0]=2 4323 B12R1.105 O=C(O)CCCC1CCC(=O)N1 Amb18825449 [0,1,0,1,0,0|1,0,1]=4 4324 B12R1.206 CC1CCCNCCC(=O)NC1 Amb32674206 [0,1,0,1,0,0|2,0,0]=4 4325 B12R1.206 O=C1CCC(=O)OCCCCO1 Amb4036387 [0,1,0,1,0,0|1,0,1]=4 4326 B12R1.206 O=C1CCCC=CCC(O)CO1 Amb28205972 [0,1,0,1,0,0|0,0,2]=4 4327 B12R1.206 O[C@H]1CCCCCC[C@@H](O)CC1 Amb28138648 [0,1,0,1,0,0|1,0,1]=4 4328 B12R1.226 C=C(C)CCC1CCCC(=O)C1 Amb27847339 [0,1,0,1,0,0|1,0,1]=4 4329 B12R1.226 C=C(C)CCC1CCCC(O)C1 Amb28069114 [0,1,0,1,0,0|2,0,0]=4 4330 B12R1.226 CC(=O)CCC1CCCC(=O)C1 Amb28202303 [0,1,0,1,0,0|1,0,1]=4 4331 B12R1.226 CC(=O)CCC1CCCN(C)C1 Amb18825867 [0,1,0,1,0,0|2,0,0]=4 4332 B12R1.226 CC(=O)CCN1CCCC(C)C1 Amb7755710 [0,1,0,1,0,0|2,0,0]=4 4333 B12R1.226 CC(=O)CCN1CCCC(F)C1 Amb35605590 [0,1,0,1,0,0|2,0,0]=4 4334 B12R1.226 CC(=O)CCN1CCC[C@H](O)C1 Amb27187713 [0,1,0,1,0,0|2,0,0]=4 4335 B12R1.226 CC(=O)COC1CCCC(C)C1 Amb9667432 [0,1,0,1,0,0|2,0,0]=4 4336 B12R1.226 CC(=O)NCC1CCCC(C)C1 Amb27758968 [0,1,0,1,0,0|2,0,0]=4 4337 B12R1.226 CC(=O)NCC1CCCC(C)N1 Amb18960009 [0,1,0,1,0,0|2,0,0]=4 4338 B12R1.226 CC(=O)NCC1CCCC(C)O1 Amb35637305 [0,1,0,1,0,0|2,0,0]=4 4339 B12R1.226 CC(=O)OCC1CCCC(N)C1 Amb26938407 [0,1,0,1,0,0|2,0,0]=4 4340 B12R1.226 CC(=O)OCC1CCCC(N)C1 Amb32652390 [0,1,0,1,0,0|2,0,0]=4 4341 B12R1.226 CC(=O)OC[C@@H]1CCC[C@H](N)C1 Amb25095974 [0,1,0,1,0,0|2,0,0]=4 4342 B12R1.226 CC(=O)OC[C@@H]1CCC[C@H](N)C1 Amb32652550 [0,1,0,1,0,0|2,0,0]=4 4343 B12R1.226 CC(=O)OC[C@H]1CCC[C@@H](N)C1 Amb26433305 [0,1,0,1,0,0|2,0,0]=4 4344 B12R1.226 CC(C)CCC1=CC(=O)CCC1 Amb28078037 [0,1,0,1,0,0|1,0,1]=4 4345 B12R1.226 CC(C)CCN1CCCC(=O)C1 Amb28140136 [0,1,0,1,0,0|2,0,0]=4 4346 B12R1.226 CC(C)CC[C@@H]1CCC[C@@H](O)C1 Amb27432114 [0,1,0,1,0,0|1,0,1]=4 4347 B12R1.226 CC(C)CC[C@@H]1CCC[C@H](O)C1 Amb27980381 [0,1,0,1,0,0|1,0,1]=4 4348 B12R1.226 CC(C)CC[C@H]1CCCC(=O)C1 Amb28253824 [0,1,0,1,0,0|1,0,0]=3 4349 B12R1.226 CC(C)CC[C@H]1CCC[C@H](O)C1 Amb27626960 [0,1,0,1,0,0|1,0,1]=4 4350 B12R1.226 CC(C)NCC1CCCC(=O)N1 Amb27753678 [0,1,0,1,0,0|2,0,0]=4 4351 B12R1.226 CC(C)OCC1CCCC(=O)N1 Amb27221116 [0,1,0,1,0,0|2,0,0]=4 4352 B12R1.226 CC(C)SCC1CCCC(=O)C1 Amb35699381 [0,1,0,1,0,0|2,0,0]=4 4353 B12R1.226 CC1CC(NCC(=O)O)CCN1 Amb35734340 [0,1,0,1,0,0|2,0,0]=4 4354 B12R1.226 CC1CC=CC(CCC(=O)O)C1 Amb18126541 [0,1,0,1,0,0|0,0,2]=4 4355 B12R1.226 CC1CCCC(C#CC(=O)O)C1 Amb27211583 [0,1,0,1,0,0|0,0,2]=4 4356 B12R1.226 CC1CCCC(CNC(=O)Cl)C1 Amb35625852 [0,1,0,1,0,0|2,0,0]=4 4357 B12R1.226 CC1CCCC(CNC(=O)Cl)O1 Amb35648518 [0,1,0,1,0,0|2,0,0]=4 4358 B12R1.226 CC1CCCC(CNC(N)=O)O1 Amb35648803 [0,1,0,1,0,0|2,0,0]=4 4359 B12R1.226 CC1CCCC(OCC(=O)O)C1 Amb7790070 [0,1,0,1,0,0|1,0,0]=3 4360 B12R1.226 CC1CCCC(OCC(N)=O)C1 Amb18802287 [0,1,0,1,0,0|2,0,0]=4 4361 B12R1.226 CC1CCCC(\C=C\C(=O)O)C1 Amb27770062 [0,1,0,1,0,0|0,0,2]=4 4362 B12R1.226 CC1CCCN(CCC(=O)Cl)C1 Amb17143072 [0,1,0,1,0,0|2,0,0]=4 4363 B12R1.226 CC1CCCN(CCC(=O)O)C1 Amb2721890 [0,1,0,1,0,0|1,0,0]=3 4364 B12R1.226 CC1CCCN(CCC(=O)O)C1 Amb8428143 [0,1,0,1,0,0|1,0,0]=3 4365 B12R1.226 CC1CCCN(CCC(N)=O)C1 Amb17142918 [0,1,0,1,0,0|2,0,0]=4 4366 B12R1.226 CC1CN(CCC(=O)O)CCS1 Amb27394506 [0,1,0,1,0,0|2,0,0]=4 4367 B12R1.226 CC1CNCC(NCC(=O)O)C1 Amb30018298 [0,1,0,1,0,0|2,0,0]=4 4368 B12R1.226 CC1CSCC(OCC(=O)O)C1 Amb24411066 [0,1,0,1,0,0|2,0,0]=4 4369 B12R1.226 CN1CCCC(CCC(=O)O)C1 Amb10607786 [0,1,0,1,0,0|1,0,0]=3 4370 B12R1.226 CN1CCCC(CCC(=O)O)C1 Amb22587003 [0,1,0,1,0,0|1,0,0]=3 4371 B12R1.226 CN1CCCC(CCC(N)=O)C1 Amb26360399 [0,1,0,1,0,0|2,0,0]=4 4372 B12R1.226 CN1CCCC(NCC(=O)O)C1 Amb22224827 [0,1,0,1,0,0|2,0,0]=4 4373 B12R1.226 CN1CCCC(OCC(=O)O)C1 Amb6739941 [0,1,0,1,0,0|2,0,0]=4 4374 B12R1.226 CN1CCC[C@@H](NCC(=O)O)C1 Amb22224743 [0,1,0,1,0,0|2,0,0]=4 4375 B12R1.226 CN1CCC[C@@H](OCC(=O)O)C1 Amb22224744 [0,1,0,1,0,0|2,0,0]=4 4376 B12R1.226 CN1CCC[C@H](NCC(=O)O)C1 Amb22224776 [0,1,0,1,0,0|2,0,0]=4 4377 B12R1.226 CN1CCC[C@H](OCC(=O)O)C1 Amb22224777 [0,1,0,1,0,0|2,0,0]=4 4378 B12R1.226 CN1CCNC(CCC(=O)O)C1 Amb18198236 [0,1,0,1,0,0|2,0,0]=4 4379 B12R1.226 CN1CCOC(CCC(=O)O)C1 Amb18061966 [0,1,0,1,0,0|2,0,0]=4 4380 B12R1.226 CS(=O)CCC1CCCC(=O)C1 Amb28058651 [0,1,0,1,0,0|2,0,0]=4 4381 B12R1.226 CS(=O)CCC1CCCC(O)C1 Amb28073479 [0,1,0,1,0,0|2,0,0]=4 4382 B12R1.226 C[C@@H]1CCC[C@@H](OCC(=O)O)C1 Amb27791265 [0,1,0,1,0,0|1,0,0]=3 4383 B12R1.226 C[C@H]1CCC[C@@H](CCC(N)=O)C1 Amb28384086 [0,1,0,1,0,0|1,0,0]=3 4384 B12R1.226 C[C@H]1CN(CCC(=O)O)CCN1 Amb27595658 [0,1,0,1,0,0|2,0,0]=4 4385 B12R1.226 NC(=O)CCN1CCCC(F)C1 Amb28120052 [0,1,0,1,0,0|2,0,0]=4 4386 B12R1.226 NC(=O)CCN1CCC[C@@H](O)C1 Amb27235929 [0,1,0,1,0,0|2,0,0]=4 4387 B12R1.226 NC(=O)CCN1CCC[C@H](N)C1 Amb28243827 [0,1,0,1,0,0|2,0,0]=4 4388 B12R1.226 NC(=O)CCN1CCC[C@H](O)C1 Amb28073995 [0,1,0,1,0,0|2,0,0]=4 4389 B12R1.226 NC(=O)NCC1CCCC(N)C1 Amb27262343 [0,1,0,1,0,0|2,0,0]=4 4390 B12R1.226 NC(=O)NCC1CCCC(O)C1 Amb27207135 [0,1,0,1,0,0|2,0,0]=4 4391 B12R1.226 NC1CCCC(CCC(=O)O)C1 Amb9805890 [0,1,0,1,0,0|0,0,0]=2 4392 B12R1.226 NC1CCCC(NCC(=O)O)C1 Amb27262074 [0,1,0,1,0,0|1,0,0]=3 4393 B12R1.226 NC1CCCC(OCC(=O)O)C1 Amb25340337 [0,1,0,1,0,0|1,0,0]=3 4394 B12R1.226 N[C@@H]1CCCN(CCC(=O)O)C1 Amb27846936 [0,1,0,1,0,0|1,0,0]=3 4395 B12R1.226 N[C@@H]1CCC[C@@H](CCC(=O)O)C1 Amb27657525 [0,1,0,1,0,0|0,0,0]=2 4396 B12R1.226 N[C@H]1CCC[C@H](CCC(=O)O)C1 Amb27881807 [0,1,0,1,0,0|0,0,0]=2 4397 B12R1.226 O=C(O)CCC1CCCC(=O)C1 Amb18647388 [0,1,0,1,0,0|0,0,1]=3 4398 B12R1.226 O=C(O)CCC1CCCC(=O)N1 Amb18825448 [0,1,0,1,0,0|1,0,1]=4 4399 B12R1.226 O=C(O)CCC1CCCC(O)O1 Amb27845405 [0,1,0,1,0,0|1,0,0]=3 4400 B12R1.226 O=C(O)CCN1CCCC(F)C1 Amb30028430 [0,1,0,1,0,0|1,0,0]=3 4401 B12R1.261 C=C(C)C1CCCCC1C(C)=O Amb27176038 [0,1,0,1,0,0|1,0,1]=4 4402 B12R1.261 C=C(C)C1CCCNC1C(=O)O Amb18647202 [0,1,0,1,0,0|1,0,1]=4 4403 B12R1.261 C=C(C)C1OCCCC1C(=O)O Amb26852815 [0,1,0,1,0,0|1,0,1]=4 4404 B12R1.261 C=C(C)[C@@H]1OCCC[C@@H]1C(=O)O Amb25198884 [0,1,0,1,0,0|1,0,1]=4 4405 B12R1.261 C=C(C)[C@@H]1OCCC[C@H]1C(=O)O Amb33743747 [0,1,0,1,0,0|1,0,1]=4 4406 B12R1.261 C=C(C)[C@H]1OCCC[C@H]1C(=O)O Amb24648138 [0,1,0,1,0,0|1,0,1]=4 4407 B12R1.261 CC(=O)C1CCCCC1C(=O)O Amb25966565 [0,1,0,1,0,0|0,0,1]=3 4408 B12R1.261 CC(=O)C1CCCCC1C(C)=O Amb28397272 [0,1,0,1,0,0|1,0,1]=4 4409 B12R1.261 CC(=O)N1CCCCC1C(=O)O Amb9703955 [0,1,0,1,0,0|1,0,1]=4 4410 B12R1.261 CC(=O)N1CCCCC1C(C)C Amb27806330 [0,1,0,1,0,0|2,0,0]=4 4411 B12R1.261 CC(=O)N1CCCCC1C(C)O Amb27970713 [0,1,0,1,0,0|2,0,0]=4 4412 B12R1.261 CC(=O)N1CCCC[C@@H]1C(=O)O Amb25715695 [0,1,0,1,0,0|1,0,1]=4 4413 B12R1.261 CC(=O)[C@@H]1CCCC[C@@H]1C(=O)O Amb27632423 [0,1,0,1,0,0|0,0,1]=3 4414 B12R1.261 CC(=O)[C@@H]1CCCC[C@H]1C(C)C Amb27420186 [0,1,0,1,0,0|1,0,0]=3 4415 B12R1.261 CC(=O)[C@H]1CCCC[C@@H]1C(=O)O Amb27965025 [0,1,0,1,0,0|0,0,1]=3 4416 B12R1.261 CC(=O)[C@H]1CCCC[C@@H]1C(C)=O Amb27789988 [0,1,0,1,0,0|1,0,1]=4 4417 B12R1.261 CC(=O)[C@H]1CCCC[C@@H]1[C@@H](C)O Amb27253580 [0,1,0,1,0,0|1,0,0]=3 4418 B12R1.261 CC(C)C1=C(C(=O)O)CCCC1 Amb27983633 [0,1,0,1,0,0|0,0,2]=4 4419 B12R1.261 CC(C)C1CCNCC1C(=O)O Amb18198521 [0,1,0,1,0,0|1,0,0]=3 4420 B12R1.261 CC(C)C1OCCCC1C(=O)O Amb25311827 [0,1,0,1,0,0|1,0,0]=3 4421 B12R1.261 CC(C)C1OCCCC1C(N)=O Amb27485445 [0,1,0,1,0,0|2,0,0]=4 4422 B12R1.261 CC(C)N1CCCCC1C(=O)O Amb33551648 [0,1,0,1,0,0|1,0,0]=3 4423 B12R1.261 CC(C)N1CCCCC1C(=O)O Amb9299682 [0,1,0,1,0,0|1,0,0]=3 4424 B12R1.261 CC(C)N1CCCC[C@H]1C(=O)O Amb13886258 [0,1,0,1,0,0|1,0,0]=3 4425 B12R1.261 CC(C)N1CCNCC1C(=O)O Amb18198265 [0,1,0,1,0,0|2,0,0]=4 4426 B12R1.261 CC(C)N1CCSCC1C(=O)O Amb18190104 [0,1,0,1,0,0|2,0,0]=4 4427 B12R1.261 CC(C)[C@@H]1CNCC[C@@H]1C(=O)O Amb35788318 [0,1,0,1,0,0|1,0,0]=3 4428 B12R1.261 CC(C)[C@@H]1CNCC[C@@H]1C(=O)O Amb35788451 [0,1,0,1,0,0|1,0,0]=3 4429 B12R1.261 CC(C)[C@@H]1NCCC[C@H]1C(=O)O Amb18198546 [0,1,0,1,0,0|1,0,0]=3 4430 B12R1.261 CC(C)[C@@H]1OCCC[C@@H]1C(=O)O Amb25374170 [0,1,0,1,0,0|1,0,0]=3 4431 B12R1.261 CC(C)[C@@H]1OCCC[C@H]1C(=O)O Amb26945477 [0,1,0,1,0,0|1,0,0]=3 4432 B12R1.261 CC(C)[C@H]1NCCC[C@@H]1C(=O)O Amb27420236 [0,1,0,1,0,0|1,0,0]=3 4433 B12R1.261 CN(C)C1CCCCC1C(=O)O Amb18288576 [0,1,0,1,0,0|1,0,0]=3 4434 B12R1.261 CN(C)C1CCNCC1C(=O)O Amb18825354 [0,1,0,1,0,0|2,0,0]=4 4435 B12R1.261 CN(C)C1CNCCC1C(=O)O Amb27481321 [0,1,0,1,0,0|2,0,0]=4 4436 B12R1.261 CN(C)[C@H]1CCCC[C@@H]1C(=O)O Amb27459775 [0,1,0,1,0,0|1,0,0]=3 4437 B12R1.261 CN(C)[C@H]1CCCC[C@H]1C(=O)O Amb5722358 [0,1,0,1,0,0|1,0,0]=3 4438 B12R1.261 CS(=O)N1CCCC[C@H]1C(=O)O Amb27784330 [0,1,0,1,0,0|2,0,0]=4 4439 B12R1.261 NC(=O)C1CCCCC1C(=O)O Amb2732939 [0,1,0,1,0,0|1,0,1]=4 4440 B12R1.261 NC(=O)[C@@H]1CCCC[C@@H]1C(=O)O Amb25225612 [0,1,0,1,0,0|1,0,1]=4 4441 B12R1.261 NC(=O)[C@@H]1CCCC[C@H]1C(=O)O Amb22737172 [0,1,0,1,0,0|1,0,1]=4 4442 B12R1.261 NC(=O)[C@H]1CCCC[C@@H]1C(=O)O Amb22737173 [0,1,0,1,0,0|1,0,1]=4 4443 B12R1.261 NC(=O)[C@H]1CCCC[C@H]1C(=O)O Amb28052093 [0,1,0,1,0,0|1,0,1]=4 4444 B12R1.261 O=C(O)C1CCCCC1C(=O)O Amb2555292 [0,1,0,1,0,0|1,0,1]=4 4445 B12R1.261 O=C(O)C1CCCC[C@@H]1C(=O)O Amb27445486 [0,1,0,1,0,0|1,0,1]=4 4446 B12R1.261 O=C(O)C1CCCC[C@H]1C(=O)O Amb25329514 [0,1,0,1,0,0|1,0,1]=4 4447 B12R1.261 O=C(O)C1CCCOC1C(F)F Amb27948421 [0,1,0,1,0,0|2,0,0]=4 4448 B12R1.261 O=C(O)[C@@H]1CCCC[C@H]1C(=O)O Amb30628538 [0,1,0,1,0,0|1,0,1]=4 4449 B12R1.261 O=C(O)[C@@H]1CCCC[C@H]1C(=O)O Amb33523567 [0,1,0,1,0,0|1,0,1]=4 4450 B12R1.261 O=C(O)[C@H]1CCCC[C@@H]1C(=O)O Amb3941630 [0,1,0,1,0,0|1,0,1]=4 4451 B12R1.261 O=C(O)[C@H]1CCCC[C@H]1C(=O)O Amb4012860 [0,1,0,1,0,0|1,0,1]=4 4452 B12R1.390 O=C(O)CCCCOCC1CC1 Amb9207802 [0,1,0,1,0,0|0,0,0]=2 4453 B12R1.390 O=C(O)CNCCCCC1CC1 Amb32675856 [0,1,0,1,0,0|0,0,0]=2 4454 B12R1.391 C=C(C)CC1CCCCC1(C)O Amb32945578 [0,1,0,1,0,0|2,0,0]=4 4455 B12R1.391 C=C(C)C[C@@H]1CCCC[C@@]1(C)O Amb32950878 [0,1,0,1,0,0|2,0,0]=4 4456 B12R1.391 C=C(Cl)CC1CCCCC1(C)O Amb25338269 [0,1,0,1,0,0|2,0,0]=4 4457 B12R1.391 C=C(Cl)C[C@@H]1CCCC[C@@]1(C)O Amb33213976 [0,1,0,1,0,0|2,0,0]=4 4458 B12R1.391 CC(=O)CC1CCCCC1(C)O Amb35667386 [0,1,0,1,0,0|1,0,0]=3 4459 B12R1.391 CC(=O)C[C@@H]1CCCC[C@@]1(C)O Amb35669083 [0,1,0,1,0,0|1,0,0]=3 4460 B12R1.391 CC(C)CC1CCCCC1(C)O Amb32945130 [0,1,0,1,0,0|1,0,1]=4 4461 B12R1.391 CC(C)C[C@@H]1CCCC[C@@]1(C)O Amb32944748 [0,1,0,1,0,0|1,0,1]=4 4462 B12R1.391 CC(N)CC1CCCCS1(=O)=O Amb35673356 [0,1,0,1,0,0|1,0,1]=4 4463 B12R1.391 CC(O)CC1CCCCC1(C)O Amb35665920 [0,1,0,1,0,0|1,0,1]=4 4464 B12R1.391 CC(O)C[C@@H]1CCCC[C@@]1(C)O Amb35665911 [0,1,0,1,0,0|1,0,1]=4 4465 B12R1.391 CC1(C)CCCCC1CC(=O)O Amb22059703 [0,1,0,1,0,0|0,0,0]=2 4466 B12R1.391 CC1(C)CCCCC1NC(=O)Cl Amb35633306 [0,1,0,1,0,0|2,0,0]=4 4467 B12R1.391 CC1(C)CCCC\C1=C/C(=O)O Amb22059704 [0,1,0,1,0,0|0,0,2]=4 4468 B12R1.391 CC1(C)CCCNC1CC(=O)O Amb27232754 [0,1,0,1,0,0|1,0,0]=3 4469 B12R1.391 CC1(C)CCCOC1CC(=O)O Amb33299361 [0,1,0,1,0,0|1,0,0]=3 4470 B12R1.391 CC1(C)CCSCC1CC(=O)O Amb27783621 [0,1,0,1,0,0|1,0,0]=3 4471 B12R1.391 CC1(C)CNCCC1CC(=O)O Amb27603319 [0,1,0,1,0,0|1,0,0]=3 4472 B12R1.391 CC1(C)CNCCC1CC(=O)O Amb32413090 [0,1,0,1,0,0|1,0,0]=3 4473 B12R1.391 CC1(C)CNCCN1CC(=O)O Amb24645603 [0,1,0,1,0,0|2,0,0]=4 4474 B12R1.391 CC1(C)COCCC1CC(=O)O Amb33802497 [0,1,0,1,0,0|1,0,0]=3 4475 B12R1.391 CC1(C)COCCN1CC(=O)O Amb18954649 [0,1,0,1,0,0|2,0,0]=4 4476 B12R1.391 CC1(O)CCCCC1CC(=O)O Amb28385764 [0,1,0,1,0,0|0,0,0]=2 4477 B12R1.391 C[C@@]1(O)CCCC[C@H]1CC(=O)O Amb24627167 [0,1,0,1,0,0|0,0,0]=2 4478 B12R1.391 O=C(O)CC1CCCCC1(F)F Amb27187100 [0,1,0,1,0,0|1,0,0]=3 4479 B12R1.391 O=C(O)CC1CCCCS1(=O)=O Amb35732759 [0,1,0,1,0,0|2,0,0]=4 4480 B12R1.391 O=C(O)CC1CCNCC1(F)F Amb25349772 [0,1,0,1,0,0|2,0,0]=4 4481 B12R1.391 O=C(O)CC1CCNCC1(F)F Amb33482636 [0,1,0,1,0,0|2,0,0]=4 4482 B12R1.391 O=C(O)CC1CSCCC1(F)F Amb28326288 [0,1,0,1,0,0|2,0,0]=4 4483 B12R1.392 C=C(C)CC1CCCC1C(=O)O Amb28059276 [0,1,0,1,0,0|0,0,1]=3 4484 B12R1.392 C=C(C)CN1CCC[C@@H]1C(=O)O Amb27203977 [0,1,0,1,0,0|1,0,1]=4 4485 B12R1.392 C=C(C)[C@H]1CNC[C@@H]1CC(=O)O Amb27657731 [0,1,0,1,0,0|1,0,1]=4 4486 B12R1.392 CC(=O)C1CNCC1CC(=O)O Amb25674207 [0,1,0,1,0,0|1,0,1]=4 4487 B12R1.392 CC(=O)CC1CCCC1C(C)=O Amb28253734 [0,1,0,1,0,0|1,0,1]=4 4488 B12R1.392 CC(=O)C[C@@H]1CCCC1C(=O)O Amb28119794 [0,1,0,1,0,0|0,0,1]=3 4489 B12R1.392 CC(=O)C[C@@H]1COC[C@@H]1C(C)C Amb27844314 [0,1,0,1,0,0|2,0,0]=4 4490 B12R1.392 CC(=O)N[C@@H]1CCC[C@@H]1C(=O)O Amb26570377 [0,1,0,1,0,0|1,0,1]=4 4491 B12R1.392 CC(C)C1CNCC1CC(=O)O Amb27437874 [0,1,0,1,0,0|1,0,0]=3 4492 B12R1.392 CC(C)C1COCC1CC(=O)O Amb35631917 [0,1,0,1,0,0|1,0,0]=3 4493 B12R1.392 CC(C)C1SCCC1CC(=O)O Amb18820673 [0,1,0,1,0,0|1,0,0]=3 4494 B12R1.392 CC(C)CC1CNCC1C(=O)O Amb18198569 [0,1,0,1,0,0|1,0,0]=3 4495 B12R1.392 CC(C)CN1CCCC1C(=O)O Amb22585666 [0,1,0,1,0,0|1,0,0]=3 4496 B12R1.392 CC(C)CN1CCCC1C(=O)O Amb2372387 [0,1,0,1,0,0|1,0,0]=3 4497 B12R1.392 CC(C)CN1CCCC1C(N)=O Amb25159397 [0,1,0,1,0,0|2,0,0]=4 4498 B12R1.392 CC(C)CN1CCC[C@@H]1C(=O)O Amb23401416 [0,1,0,1,0,0|1,0,0]=3 4499 B12R1.392 CC(C)CN1CCC[C@@H]1C(N)=O Amb25335521 [0,1,0,1,0,0|2,0,0]=4 4500 B12R1.392 CC(C)CN1CCC[C@H]1C(=O)O Amb25281207 [0,1,0,1,0,0|1,0,0]=3 4501 B12R1.392 CC(C)CN1CCC[C@H]1C(N)=O Amb27597962 [0,1,0,1,0,0|2,0,0]=4 4502 B12R1.392 CC(C)CN1CCSC1C(=O)O Amb27215632 [0,1,0,1,0,0|2,0,0]=4 4503 B12R1.392 CC(C)C[C@@H]1CNC[C@H]1C(=O)O Amb28057737 [0,1,0,1,0,0|1,0,0]=3 4504 B12R1.392 CC(C)C[C@H]1CNC[C@@H]1C(=O)O Amb26896037 [0,1,0,1,0,0|1,0,0]=3 4505 B12R1.392 CC(C)N1CCCC1CC(=O)O Amb33550220 [0,1,0,1,0,0|1,0,0]=3 4506 B12R1.392 CC(C)NC1CCCC1C(=O)O Amb27241843 [0,1,0,1,0,0|1,0,0]=3 4507 B12R1.392 CC(C)NC1CCCC1C(N)=O Amb27652788 [0,1,0,1,0,0|2,0,0]=4 4508 B12R1.392 CC(C)N[C@@H]1CCC[C@@H]1C(=O)O Amb35659612 [0,1,0,1,0,0|1,0,0]=3 4509 B12R1.392 CC(C)SC1CCCC1C(=O)O Amb19002581 [0,1,0,1,0,0|1,0,0]=3 4510 B12R1.392 CC(C)[C@H]1CNC[C@@H]1CC(=O)O Amb27781497 [0,1,0,1,0,0|1,0,0]=3 4511 B12R1.392 CC(O)CN1CCCC1C(=O)O Amb18302659 [0,1,0,1,0,0|1,0,0]=3 4512 B12R1.392 CC(O)CN1CCC[C@@H]1C(=O)O Amb24107576 [0,1,0,1,0,0|1,0,0]=3 4513 B12R1.392 CN(C)C1CCCC1CC(=O)O Amb18198574 [0,1,0,1,0,0|1,0,0]=3 4514 B12R1.392 CN(C)C1COCC1CC(=O)O Amb27178145 [0,1,0,1,0,0|2,0,0]=4 4515 B12R1.392 CN(C)CC1CCCC1C(=O)O Amb27968542 [0,1,0,1,0,0|1,0,0]=3 4516 B12R1.392 CN(C)C[C@@H]1CCC[C@@H]1C(=O)O Amb27495360 [0,1,0,1,0,0|1,0,0]=3 4517 B12R1.392 CN(C)[C@@H]1CCC[C@H]1CC(=O)O Amb28456463 [0,1,0,1,0,0|1,0,0]=3 4518 B12R1.392 CS(=O)N[C@@H]1CCC[C@@H]1C(=O)O Amb29892765 [0,1,0,1,0,0|2,0,0]=4 4519 B12R1.392 O=C(O)C1CCCN1CC(F)F Amb9768727 [0,1,0,1,0,0|2,0,0]=4 4520 B12R1.392 O=C(O)CC1CCCC1C(=O)O Amb26371587 [0,1,0,1,0,0|1,0,1]=4 4521 B12R1.924 CC(=O)CCC1CCSC1(C)C Amb32725174 [0,1,0,1,0,0|2,0,0]=4 4522 B12R1.924 CC(=O)CCN1CCCC1(C)C Amb27656737 [0,1,0,1,0,0|2,0,0]=4 4523 B12R1.924 CC(Br)CCC1CCCS1(=O)=O Amb35723309 [0,1,0,1,0,0|1,0,1]=4 4524 B12R1.924 CC(Cl)CCC1CCCS1(=O)=O Amb35723308 [0,1,0,1,0,0|1,0,1]=4 4525 B12R1.924 CC(N)CCC1CCCS1(=O)=O Amb35723218 [0,1,0,1,0,0|1,0,1]=4 4526 B12R1.924 CC(O)CCC1CCCS1(=O)=O Amb35732592 [0,1,0,1,0,0|1,0,1]=4 4527 B12R1.924 CC1(C)CCCC1C#CC(=O)O Amb24361237 [0,1,0,1,0,0|0,0,2]=4 4528 B12R1.924 CC1(C)CCCC1CNC(=O)Cl Amb35633338 [0,1,0,1,0,0|2,0,0]=4 4529 B12R1.924 CC1(C)CCCC1NCC(N)=O Amb27601663 [0,1,0,1,0,0|2,0,0]=4 4530 B12R1.924 CC1(C)SCCC1CCC(=O)O Amb32732479 [0,1,0,1,0,0|1,0,0]=3 4531 B12R1.924 CC1(C)SCCC1OCC(=O)O Amb32725060 [0,1,0,1,0,0|2,0,0]=4 4532 B12R1.924 CC1(O)CCCC1OCC(=O)O Amb27811454 [0,1,0,1,0,0|1,0,0]=3 4533 B12R1.924 O=C(O)CCC1CCCC1(F)F Amb24737082 [0,1,0,1,0,0|1,0,0]=3 4534 B12R1.924 O=C(O)CCC1CCCS1(=O)=O Amb35736001 [0,1,0,1,0,0|2,0,0]=4 4535 B12R1.1011 CC(=O)C1CCCCCC(=O)C1 Amb27211944 [0,1,0,1,0,0|1,0,1]=4 4536 B12R1.1011 CC(=O)C1CCCCCC(C)C1 Amb27175954 [0,1,0,1,0,0|1,0,0]=3 4537 B12R1.1011 CC(N)C1CCCCCC(=O)N1 Amb27984887 [0,1,0,1,0,0|1,0,0]=3 4538 B12R1.1011 CC(O)C1CCCCCC(=O)S1 Amb27978552 [0,1,0,1,0,0|0,1,0]=3 4539 B12R1.1011 NC(=O)C1CCCCCC(=O)C1 Amb27207261 [0,1,0,1,0,0|1,0,1]=4 4540 B12R1.1011 O=C1CCCCCC(C(=O)O)C1 Amb25187509 [0,1,0,1,0,0|0,0,1]=3 4541 B12R1.3091 CC(C)C1CCCCCC1(C)O Amb35717664 [0,1,0,1,0,0|1,0,1]=4 4542 B12R1.3091 O=C(O)C1CCCCCC1(F)F Amb25978065 [0,1,0,1,0,0|1,0,0]=3 4543 B12R1.3091 O=C(O)C1CCCCCS1(=O)=O Amb33733839 [0,1,0,1,0,0|2,0,0]=4 4544 B12R1.3091 O=C(O)C1CCNCCC1(F)F Amb19374731 [0,1,0,1,0,0|2,0,0]=4 4545 B12R1.1 CCCCCC1CC=C(Br)CC1 Amb22001437 [0,1,0,1,0,0|2,0,0]=4 4546 B12R1.1 CCCCCC1CCC(=O)CC1 Amb6357562 [0,1,0,1,0,0|1,0,0]=3 4547 B12R1.1 CCCCCC1CCC(O)CC1 Amb16203683 [0,1,0,1,0,0|1,0,1]=4 4548 B12R1.1 CCCCCN1CCC(=O)CC1 Amb6262936 [0,1,0,1,0,0|2,0,0]=4 4549 B12R1.25 CCCCC1=C(C)C(=O)CCC1 Amb27177753 [0,1,0,1,0,0|1,0,1]=4 4550 B12R1.25 CCCCC1=C(O)C(=O)CCC1 Amb27954094 [0,1,0,1,0,0|0,0,1]=3 4551 B12R1.25 CCCCC1CCCC(=O)C1C Amb27177608 [0,1,0,1,0,0|1,0,0]=3 4552 B12R1.25 CCCCN1CCCC(=O)C1=O Amb27177698 [0,1,0,1,0,0|1,0,1]=4 4553 B12R1.25 CCCC[C@@H]1CCCC(=O)[C@@H]1C Amb28052225 [0,1,0,1,0,0|1,0,0]=3 4554 B12R1.25 N#CCCC1CCCC(=O)C1O Amb27175958 [0,1,0,1,0,0|1,0,1]=4 4555 B12R1.27 C#CC(=O)CCC1CCCCC1 Amb28350199 [0,1,0,1,0,0|1,0,0]=3 4556 B12R1.27 C#CC(=O)CCC1CCCCN1 Amb27881461 [0,1,0,1,0,0|2,0,0]=4 4557 B12R1.27 C#CC(=O)CSC1CCCCC1 Amb27952579 [0,1,0,1,0,0|2,0,0]=4 4558 B12R1.27 C=CC(=O)NCC1CCCCC1 Amb9280292 [0,1,0,1,0,0|2,0,0]=4 4559 B12R1.27 CC(CO)CCC1CCCCC1 Amb33727433 [0,1,0,1,0,0|1,0,1]=4 4560 B12R1.27 CCC(=O)NCC1CCCCC1 Amb8336376 [0,1,0,1,0,0|2,0,0]=4 4561 B12R1.27 CNC(=O)CCC1CCCCC1 Amb3447278 [0,1,0,1,0,0|1,0,0]=3 4562 B12R1.27 CNC(=O)CCC1CCCCN1 Amb18987510 [0,1,0,1,0,0|2,0,0]=4 4563 B12R1.27 CNC(=O)CCC1CCCCN1 Amb28963322 [0,1,0,1,0,0|2,0,0]=4 4564 B12R1.27 CNC(=O)CCC1CCCCO1 Amb27770762 [0,1,0,1,0,0|2,0,0]=4 4565 B12R1.27 CNC(=O)CCC1CCCNC1 Amb15701592 [0,1,0,1,0,0|2,0,0]=4 4566 B12R1.27 CNC(=O)CCC1CCCNC1 Amb22587385 [0,1,0,1,0,0|2,0,0]=4 4567 B12R1.27 CNC(=O)CCC1CCOCC1 Amb28078844 [0,1,0,1,0,0|2,0,0]=4 4568 B12R1.27 CNC(=O)CCN1CCCCC1 Amb24288662 [0,1,0,1,0,0|2,0,0]=4 4569 B12R1.27 CNC(=O)CCN1CCCCC1 Amb27848497 [0,1,0,1,0,0|2,0,0]=4 4570 B12R1.27 CNC(=O)OCC1CCCCC1 Amb26457506 [0,1,0,1,0,0|2,0,0]=4 4571 B12R1.27 COC(=O)C#CC1CCCCC1 Amb26433181 [0,1,0,1,0,0|0,0,2]=4 4572 B12R1.27 COC(=O)CCC1CCCCN1 Amb10607784 [0,1,0,1,0,0|1,0,0]=3 4573 B12R1.27 COC(=O)CCC1CCCCN1 Amb13949148 [0,1,0,1,0,0|1,0,0]=3 4574 B12R1.27 COC(=O)CCC1CCCCO1 Amb32661627 [0,1,0,1,0,0|1,0,0]=3 4575 B12R1.27 COC(=O)CCC1CCCNC1 Amb1102606 [0,1,0,1,0,0|1,0,0]=3 4576 B12R1.27 COC(=O)CCC1CCCNC1 Amb13949147 [0,1,0,1,0,0|1,0,0]=3 4577 B12R1.27 COC(=O)CCC1CCNCC1 Amb13889031 [0,1,0,1,0,0|1,0,0]=3 4578 B12R1.27 COC(=O)CCC1CCNCC1 Amb13889037 [0,1,0,1,0,0|1,0,0]=3 4579 B12R1.27 COC(=O)CCN1CCCCC1 Amb1016529 [0,1,0,1,0,0|1,0,0]=3 4580 B12R1.27 COC(=O)CCN1CCCCC1 Amb8470077 [0,1,0,1,0,0|1,0,0]=3 4581 B12R1.27 COC(=O)CCN1CCNCC1 Amb10609997 [0,1,0,1,0,0|2,0,0]=4 4582 B12R1.27 COC(=O)CCN1CCNCC1 Amb6739973 [0,1,0,1,0,0|2,0,0]=4 4583 B12R1.27 COC(=O)CCN1CCOCC1 Amb1152087 [0,1,0,1,0,0|2,0,0]=4 4584 B12R1.27 COC(=O)CNC1CCCCC1 Amb32666984 [0,1,0,1,0,0|1,0,0]=3 4585 B12R1.27 COC(=O)CNC1CCCCC1 Amb6687137 [0,1,0,1,0,0|1,0,0]=3 4586 B12R1.27 COC(=O)CNC1CCOCC1 Amb33546750 [0,1,0,1,0,0|2,0,0]=4 4587 B12R1.27 COC(=O)CNC1CCOCC1 Amb9472310 [0,1,0,1,0,0|2,0,0]=4 4588 B12R1.27 COC(=O)COC1CCCCC1 Amb9206351 [0,1,0,1,0,0|1,0,0]=3 4589 B12R1.27 COC(=O)COC1CCCCO1 Amb32407002 [0,1,0,1,0,0|2,0,0]=4 4590 B12R1.27 COC(=O)COC1CCNCC1 Amb22225110 [0,1,0,1,0,0|2,0,0]=4 4591 B12R1.27 COC(=O)COC1CCNCC1 Amb22752847 [0,1,0,1,0,0|2,0,0]=4 4592 B12R1.27 COC(=O)CSC1CCCCC1 Amb6760939 [0,1,0,1,0,0|1,0,0]=3 4593 B12R1.27 COC(=O)CSC1CCNCC1 Amb19072458 [0,1,0,1,0,0|2,0,0]=4 4594 B12R1.27 COC(=O)NCC1CCNCC1 Amb6668894 [0,1,0,1,0,0|2,0,0]=4 4595 B12R1.27 COC(=O)NCC1CCOCC1 Amb27840458 [0,1,0,1,0,0|2,0,0]=4 4596 B12R1.27 COC(=O)\C=C\C1CCCCC1 Amb25148638 [0,1,0,1,0,0|0,0,2]=4 4597 B12R1.27 C[C@@H](CO)CCC1CCCCC1 Amb33740970 [0,1,0,1,0,0|1,0,1]=4 4598 B12R1.27 C[C@H](CO)CCC1CCCCC1 Amb33737848 [0,1,0,1,0,0|1,0,1]=4 4599 B12R1.27 C\C(C=O)=C/CC1CCCCC1 Amb28388685 [0,1,0,1,0,0|1,0,1]=4 4600 B12R1.27 NC(CO)CCC1CCCCC1 Amb33475130 [0,1,0,1,0,0|1,0,1]=4 4601 B12R1.27 NCC(O)CCC1CCCCC1 Amb33475072 [0,1,0,1,0,0|1,0,1]=4 4602 B12R1.27 NNC(=O)CCC1CCCCC1 Amb6493562 [0,1,0,1,0,0|1,0,0]=3 4603 B12R1.27 NNC(=O)CCC1CCCOC1 Amb28350999 [0,1,0,1,0,0|2,0,0]=4 4604 B12R1.27 NNC(=O)CCC1CCOCC1 Amb27261234 [0,1,0,1,0,0|2,0,0]=4 4605 B12R1.27 NNC(=O)CCN1CCCCC1 Amb1107085 [0,1,0,1,0,0|2,0,0]=4 4606 B12R1.27 NNC(=O)CNC1CCCCC1 Amb1921804 [0,1,0,1,0,0|2,0,0]=4 4607 B12R1.27 N\C(=N/O)NCC1CCCCC1 Amb18807002 [0,1,0,1,0,0|2,0,0]=4 4608 B12R1.27 N\C(CCC1CCCCO1)=N/O Amb35638095 [0,1,0,1,0,0|2,0,0]=4 4609 B12R1.27 N\C(CCC1CCNCC1)=N/O Amb25291567 [0,1,0,1,0,0|2,0,0]=4 4610 B12R1.27 N\C(CCN1CCCCC1)=N/O Amb33532749 [0,1,0,1,0,0|2,0,0]=4 4611 B12R1.27 N\C(CCN1CCCCC1)=N\O Amb589006 [0,1,0,1,0,0|2,0,0]=4 4612 B12R1.27 N\C(CNC1CCCCC1)=N/O Amb27614553 [0,1,0,1,0,0|2,0,0]=4 4613 B12R1.27 N\C(CSC1CCCCC1)=N/O Amb19060060 [0,1,0,1,0,0|2,0,0]=4 4614 B12R1.27 O=C(CBr)CCC1CCCCO1 Amb32662543 [0,1,0,1,0,0|2,0,0]=4 4615 B12R1.27 O=C(CBr)NCC1CCCCC1 Amb17331507 [0,1,0,1,0,0|2,0,0]=4 4616 B12R1.27 O=C(CCC1CCCCC1)NO Amb6270919 [0,1,0,1,0,0|0,0,0]=2 4617 B12R1.27 O=C(CCC1CCCNC1)NO Amb27791458 [0,1,0,1,0,0|1,0,0]=3 4618 B12R1.27 O=C(CCC1CCOCC1)NO Amb27946624 [0,1,0,1,0,0|1,0,0]=3 4619 B12R1.27 O=C(CCN1CCSCC1)NO Amb28283406 [0,1,0,1,0,0|2,0,0]=4 4620 B12R1.27 O=C(CCl)NCC1CCCCC1 Amb372259 [0,1,0,1,0,0|2,0,0]=4 4621 B12R1.27 O=C(CO)NCC1CCCCC1 Amb1110661 [0,1,0,1,0,0|1,0,0]=3 4622 B12R1.27 O=C(CO)NCC1CCCCO1 Amb28061786 [0,1,0,1,0,0|2,0,0]=4 4623 B12R1.27 O=C(CO)NCC1CCCSC1 Amb27756016 [0,1,0,1,0,0|2,0,0]=4 4624 B12R1.27 O=C(CO)NCC1CCNCC1 Amb27459674 [0,1,0,1,0,0|2,0,0]=4 4625 B12R1.27 O=C(CO)NOC1CCCCC1 Amb27829208 [0,1,0,1,0,0|2,0,0]=4 4626 B12R1.27 O=C(COC1CCOCC1)NO Amb27178609 [0,1,0,1,0,0|2,0,0]=4 4627 B12R1.77 C#CC(=O)C1CCCCC1CN Amb28313608 [0,1,0,1,0,0|2,0,0]=4 4628 B12R1.77 C#CC(O)C1CCCCC1CC Amb28073652 [0,1,0,1,0,0|1,0,1]=4 4629 B12R1.77 C#CC1CCCCC1C(=O)OC Amb27795847 [0,1,0,1,0,0|0,0,2]=4 4630 B12R1.77 C=C(CO)C1CCCCC1CO Amb27764850 [0,1,0,1,0,0|2,0,0]=4 4631 B12R1.77 C=CC(=O)C1CCCCC1CN Amb27760174 [0,1,0,1,0,0|2,0,0]=4 4632 B12R1.77 CCC1CCCCC1C(O)C#N Amb27959996 [0,1,0,1,0,0|1,0,1]=4 4633 B12R1.77 CCC1CCCCN1C(=O)CBr Amb17332393 [0,1,0,1,0,0|2,0,0]=4 4634 B12R1.77 CCC1CCCCN1C(=O)CCl Amb9747353 [0,1,0,1,0,0|2,0,0]=4 4635 B12R1.77 CCC1CCCCN1C(=O)CO Amb1110412 [0,1,0,1,0,0|1,0,0]=3 4636 B12R1.77 CCC1CCCCN1C(=O)CS Amb27638567 [0,1,0,1,0,0|1,1,0]=4 4637 B12R1.77 CCC1CCCCN1C(=O)OC Amb3373232 [0,1,0,1,0,0|1,0,0]=3 4638 B12R1.77 CCC1OCCCC1C(=O)NN Amb27787344 [0,1,0,1,0,0|2,0,0]=4 4639 B12R1.77 CCC1OCCCC1C(=O)OC Amb27651384 [0,1,0,1,0,0|1,0,0]=3 4640 B12R1.77 CCN1CCCCC1C(=O)NC Amb27827175 [0,1,0,1,0,0|2,0,0]=4 4641 B12R1.77 CCN1CCCCC1C(=O)NO Amb27396751 [0,1,0,1,0,0|1,0,0]=3 4642 B12R1.77 CCN1CCCCC1\C(N)=N\O Amb27390212 [0,1,0,1,0,0|2,0,0]=4 4643 B12R1.77 CCN1CCNCC1C(=O)OC Amb27878981 [0,1,0,1,0,0|2,0,0]=4 4644 B12R1.77 CCN1CCOCC1C(=O)OC Amb23585357 [0,1,0,1,0,0|2,0,0]=4 4645 B12R1.77 CNC(=O)C1CCCCC1CN Amb27488362 [0,1,0,1,0,0|2,0,0]=4 4646 B12R1.77 CNC(=O)C1CCCCC1NC Amb27201653 [0,1,0,1,0,0|2,0,0]=4 4647 B12R1.77 CNC(=O)C1CCCCC1OC Amb27648086 [0,1,0,1,0,0|2,0,0]=4 4648 B12R1.77 CNC(=O)[C@@H]1CCCC[C@@H]1NC Amb28457418 [0,1,0,1,0,0|2,0,0]=4 4649 B12R1.77 CN[C@@H]1CCCC[C@@H]1C(=O)OC Amb27983966 [0,1,0,1,0,0|1,0,0]=3 4650 B12R1.77 COC(=O)C1CCCCC1CCl Amb27616883 [0,1,0,1,0,0|1,0,0]=3 4651 B12R1.77 COC(=O)C1CCCCC1CN Amb24638995 [0,1,0,1,0,0|1,0,0]=3 4652 B12R1.77 COC(=O)C1CCCCC1OC Amb27453897 [0,1,0,1,0,0|1,0,0]=3 4653 B12R1.77 COC(=O)C1CCNCC1OC Amb24667294 [0,1,0,1,0,0|2,0,0]=4 4654 B12R1.77 COC(=O)C1CCNCC1OC Amb33457901 [0,1,0,1,0,0|2,0,0]=4 4655 B12R1.77 COC(=O)N1CCCCC1CO Amb9287059 [0,1,0,1,0,0|2,0,0]=4 4656 B12R1.77 COC(=O)N1CCCCC1OC Amb27835373 [0,1,0,1,0,0|2,0,0]=4 4657 B12R1.77 COC(=O)[C@@H]1CCCC[C@@H]1CN Amb32993218 [0,1,0,1,0,0|1,0,0]=3 4658 B12R1.77 COC(=O)[C@@H]1CCCC[C@H]1CO Amb24436062 [0,1,0,1,0,0|1,0,0]=3 4659 B12R1.77 COC(=O)[C@H]1CCCC[C@@H]1CO Amb6300085 [0,1,0,1,0,0|1,0,0]=3 4660 B12R1.77 NCC1CCCCC1C(=O)NN Amb27770086 [0,1,0,1,0,0|2,0,0]=4 4661 B12R1.77 NNC(=O)C1CCCCC1CO Amb27650296 [0,1,0,1,0,0|2,0,0]=4 4662 B12R1.77 O=C(CO)N1CCCCC1CO Amb27632676 [0,1,0,1,0,0|2,0,0]=4 4663 B12R1.82 CCC(=O)NC1CCCC1CC Amb27652567 [0,1,0,1,0,0|2,0,0]=4 4664 B12R1.82 CCC1CCCC1NC(=O)CN Amb27187991 [0,1,0,1,0,0|2,0,0]=4 4665 B12R1.82 CCC1CCCC1NC(=O)NN Amb28399748 [0,1,0,1,0,0|2,0,0]=4 4666 B12R1.82 CCC1COCC1NC(=O)OC Amb35617116 [0,1,0,1,0,0|2,0,0]=4 4667 B12R1.82 COC(=O)N[C@H]1CCC[C@@H]1OC Amb27207630 [0,1,0,1,0,0|2,0,0]=4 4668 B12R1.150 C=C1CCCCCCCCC1O Amb27432139 [0,1,0,1,0,0|1,0,0]=3 4669 B12R1.150 C[C@@H]1CCCCCCCNC1=O Amb28047251 [0,1,0,1,0,0|1,0,0]=3 4670 B12R1.150 C[C@H]1CCCCCCCNC1=O Amb28059295 [0,1,0,1,0,0|1,0,0]=3 4671 B12R1.150 NC1CCCCCCCCC1O Amb25152507 [0,1,0,1,0,0|1,0,1]=4 4672 B12R1.150 O=C1CCCCCCCCC1=O Amb17594209 [0,1,0,1,0,0|0,0,1]=3 4673 B12R1.150 O=C1CCCCCCCCC1Br Amb28244232 [0,1,0,1,0,0|1,0,0]=3 4674 B12R1.150 O=C1CCCCCCCCC1Cl Amb27233508 [0,1,0,1,0,0|1,0,0]=3 4675 B12R1.150 O=C1CCCCCCCCC1F Amb27828822 [0,1,0,1,0,0|1,0,0]=3 4676 B12R1.150 O=C1CCCCCCCCC1O Amb4017052 [0,1,0,1,0,0|0,0,0]=2 4677 B12R1.150 O=C1NCCCCCCCC1Br Amb27410410 [0,1,0,1,0,0|1,0,0]=3 4678 B12R1.150 OC1CCCCCCCCC1Cl Amb27828119 [0,1,0,1,0,0|1,0,1]=4 4679 B12R1.150 OC1CCCCCCCCC1O Amb17594327 [0,1,0,1,0,0|0,0,2]=4 4680 B12R1.150 O[C@@H]1CCCCCCCC[C@H]1Cl Amb28132360 [0,1,0,1,0,0|1,0,1]=4 4681 B12R1.150 O[C@@H]1CCCCCCCC[C@H]1O Amb28290410 [0,1,0,1,0,0|0,0,2]=4 4682 B12R1.215 O=C1CCC#CCCCCCC1 Amb27869824 [0,1,0,1,0,0|1,0,1]=4 4683 B12R1.215 O=C1CCCC#CCCCCC1 Amb27234351 [0,1,0,1,0,0|1,0,1]=4 4684 B12R1.215 O=C1CCCCCCCCCC1 Amb2778534 [0,1,0,1,0,0|1,0,0]=3 4685 B12R1.215 O=C1CCCCCCCCCN1 Amb26068652 [0,1,0,1,0,0|1,0,0]=3 4686 B12R1.215 O=C1CCCCCOCCCC1 Amb27177976 [0,1,0,1,0,0|1,0,0]=3 4687 B12R1.215 O=C1CCNCCCCCCN1 Amb25704380 [0,1,0,1,0,0|1,0,0]=3 4688 B12R1.291 C#CC(=O)N1CCCC1CCC Amb35709153 [0,1,0,1,0,0|2,0,0]=4 4689 B12R1.291 CCCC1CCNC1C(=O)OC Amb33726850 [0,1,0,1,0,0|1,0,0]=3 4690 B12R1.291 CCC[C@@H]1CNC[C@H]1C(=O)OC Amb33038596 [0,1,0,1,0,0|1,0,0]=3 4691 B12R1.291 CCNC1CCCC1C(=O)NC Amb27804704 [0,1,0,1,0,0|2,0,0]=4 4692 B12R1.291 CCNC1COCC1C(=O)NO Amb28456740 [0,1,0,1,0,0|2,0,0]=4 4693 B12R1.291 CCOC1CNCC1C(=O)NO Amb29869555 [0,1,0,1,0,0|2,0,0]=4 4694 B12R1.291 COC(=O)[C@H]1CCCC1CC#N Amb27208998 [0,1,0,1,0,0|1,0,1]=4 4695 B12R1.291 COCC1CCOC1C(=O)OC Amb32665014 [0,1,0,1,0,0|2,0,0]=4 4696 B12R1.291 COC[C@H]1CCO[C@H]1C(=O)OC Amb32664543 [0,1,0,1,0,0|2,0,0]=4 4697 B12R1.291 NNC(=O)C1CCCC1CCO Amb27472766 [0,1,0,1,0,0|2,0,0]=4 4698 B12R1.348 CCCCC1=CCC(=O)CCC1 Amb27175982 [0,1,0,1,0,0|1,0,1]=4 4699 B12R1.348 CCCCC1CCNC(=O)CC1 Amb28129642 [0,1,0,1,0,0|2,0,0]=4 4700 B12R1.353 C#CC(=O)NCC1CCCC1C Amb27661684 [0,1,0,1,0,0|2,0,0]=4 4701 B12R1.353 CC1CCCC1CNC(=O)CCl Amb27392255 [0,1,0,1,0,0|2,0,0]=4 4702 B12R1.353 CC1CCCC1NC\C(N)=N\O Amb27760922 [0,1,0,1,0,0|2,0,0]=4 4703 B12R1.353 CN1CCCC1CCC(=O)NN Amb17594293 [0,1,0,1,0,0|2,0,0]=4 4704 B12R1.353 CNC(=O)CNC1CCCC1C Amb27240472 [0,1,0,1,0,0|2,0,0]=4 4705 B12R1.353 CNC(=O)NCC1CCCC1C Amb28127040 [0,1,0,1,0,0|2,0,0]=4 4706 B12R1.353 COC(=O)C#CC1CCCC1C Amb28044321 [0,1,0,1,0,0|0,0,2]=4 4707 B12R1.353 COC(=O)CCC1CCCC1=O Amb17400325 [0,1,0,1,0,0|1,0,1]=4 4708 B12R1.353 COC(=O)NCC1CCCC1C Amb27203590 [0,1,0,1,0,0|1,0,0]=3 4709 B12R1.353 COC(=O)NCC1CCCC1N Amb28381796 [0,1,0,1,0,0|2,0,0]=4 4710 B12R1.353 COC(=O)NCC1CCCC1O Amb27831615 [0,1,0,1,0,0|2,0,0]=4 4711 B12R1.356 COC(=O)CCCOC1CNC1 Amb32941488 [0,1,0,1,0,0|2,0,0]=4 4712 B12R1.360 COC(=O)CCCSSC1CC1 Amb33040839 [0,1,0,1,0,0|2,0,0]=4 4713 B12R1.365 C=C(CO)C1CCCCCC1O Amb28188181 [0,1,0,1,0,0|2,0,0]=4 4714 B12R1.365 C=CC(=O)C1CCCCCC1N Amb27416497 [0,1,0,1,0,0|2,0,0]=4 4715 B12R1.365 CC1CCCCCC1N(C)C=O Amb35681361 [0,1,0,1,0,0|2,0,0]=4 4716 B12R1.365 CC1CCCCCN1C(=O)CN Amb27168188 [0,1,0,1,0,0|2,0,0]=4 4717 B12R1.365 CC1CCSCCN1C(=O)CO Amb27456264 [0,1,0,1,0,0|2,0,0]=4 4718 B12R1.365 CCC(O)C1CCCCCC1C Amb35672757 [0,1,0,1,0,0|1,0,1]=4 4719 B12R1.365 COC(=O)C1CCCCCC1=O Amb4507049 [0,1,0,1,0,0|1,0,1]=4 4720 B12R1.365 COC(=O)C1CCCCCC1N Amb2695334 [0,1,0,1,0,0|1,0,0]=3 4721 B12R1.365 COC(=O)C1CCCCCC1N Amb8630108 [0,1,0,1,0,0|1,0,0]=3 4722 B12R1.365 COC(=O)C1CCCCCN1C Amb27649918 [0,1,0,1,0,0|1,0,0]=3 4723 B12R1.365 COC(=O)C1CCNCCC1N Amb33166120 [0,1,0,1,0,0|2,0,0]=4 4724 B12R1.365 COC(=O)C1CCOCCC1N Amb27623630 [0,1,0,1,0,0|2,0,0]=4 4725 B12R1.365 COC(=O)C1CCSCCC1O Amb27224372 [0,1,0,1,0,0|2,0,0]=4 4726 B12R1.365 COC(=O)C1CNCCCN1C Amb19516872 [0,1,0,1,0,0|2,0,0]=4 4727 B12R1.365 COC(=O)C1CNCCCN1C Amb22587400 [0,1,0,1,0,0|2,0,0]=4 4728 B12R1.365 COC(=O)N1CCCCCC1O Amb28321532 [0,1,0,1,0,0|2,0,0]=4 4729 B12R1.365 COC(=O)N1CCCNCC1C Amb27157989 [0,1,0,1,0,0|2,0,0]=4 4730 B12R1.365 COC(=O)N1CCNCCC1C Amb24463725 [0,1,0,1,0,0|2,0,0]=4 4731 B12R1.365 COC(=O)N1CCSCCC1C Amb27977628 [0,1,0,1,0,0|2,0,0]=4 4732 B12R1.365 COC(=O)[C@@H]1CCCCC[C@@H]1N Amb24598964 [0,1,0,1,0,0|1,0,0]=3 4733 B12R1.365 COC(=O)[C@@H]1CCCCC[C@@H]1N Amb32645900 [0,1,0,1,0,0|1,0,0]=3 4734 B12R1.365 COC(=O)[C@@H]1CCCCC[C@@H]1O Amb28256733 [0,1,0,1,0,0|1,0,0]=3 4735 B12R1.365 COC(=O)[C@@H]1CCCCC[C@H]1O Amb27451024 [0,1,0,1,0,0|1,0,0]=3 4736 B12R1.365 COC(=O)[C@H]1CCCCC[C@H]1N Amb27224034 [0,1,0,1,0,0|1,0,0]=3 4737 B12R1.371 C#CC(=O)NC1CCCCC1C Amb28078761 [0,1,0,1,0,0|2,0,0]=4 4738 B12R1.371 CC1CCCCC1CC(=O)NN Amb27757008 [0,1,0,1,0,0|1,0,0]=3 4739 B12R1.371 CC1CCCCC1CC(=O)NO Amb28282323 [0,1,0,1,0,0|0,0,0]=2 4740 B12R1.371 CC1CCCCC1NC(=O)CBr Amb17326862 [0,1,0,1,0,0|2,0,0]=4 4741 B12R1.371 CC1CCCCC1NC(=O)CCl Amb1149865 [0,1,0,1,0,0|2,0,0]=4 4742 B12R1.371 CC1CCCCC1NC(=O)CN Amb6280373 [0,1,0,1,0,0|2,0,0]=4 4743 B12R1.371 CC1CCCCC1OC(=O)C=O Amb28141351 [0,1,0,1,0,0|1,0,1]=4 4744 B12R1.371 CC1CCCCC1OC(=O)CN Amb18974496 [0,1,0,1,0,0|2,0,0]=4 4745 B12R1.371 CC1CCCCC1OC(=O)CO Amb27834792 [0,1,0,1,0,0|1,0,0]=3 4746 B12R1.371 CC1CCCCN1CC(=O)NN Amb836903 [0,1,0,1,0,0|2,0,0]=4 4747 B12R1.371 CC1CCCCN1C\C(N)=N/O Amb10609079 [0,1,0,1,0,0|2,0,0]=4 4748 B12R1.371 CC1CCCCN1C\C(N)=N\O Amb9728066 [0,1,0,1,0,0|2,0,0]=4 4749 B12R1.371 CNC(=O)CN1CCCCC1C Amb28138245 [0,1,0,1,0,0|2,0,0]=4 4750 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@@H]1C Amb35746984 [0,1,0,1,0,0|2,0,0]=4 4751 B12R1.371 COC(=O)CC1CCCCC1=O Amb8388663 [0,1,0,1,0,0|1,0,1]=4 4752 B12R1.371 COC(=O)CC1CCCCC1Br Amb22497306 [0,1,0,1,0,0|1,0,0]=3 4753 B12R1.371 COC(=O)CC1CCCCC1N Amb24419823 [0,1,0,1,0,0|1,0,0]=3 4754 B12R1.371 COC(=O)CC1CCCCC1O Amb25317529 [0,1,0,1,0,0|1,0,0]=3 4755 B12R1.371 COC(=O)CC1CCCNC1C Amb24331928 [0,1,0,1,0,0|1,0,0]=3 4756 B12R1.371 COC(=O)CC1CCNCC1C Amb26511429 [0,1,0,1,0,0|1,0,0]=3 4757 B12R1.371 COC(=O)CC1CCSCC1O Amb27186733 [0,1,0,1,0,0|2,0,0]=4 4758 B12R1.371 COC(=O)CC1CNCCC1C Amb24331936 [0,1,0,1,0,0|1,0,0]=3 4759 B12R1.371 COC(=O)CC1CNCCC1C Amb30869450 [0,1,0,1,0,0|1,0,0]=3 4760 B12R1.371 COC(=O)CC1CNCCC1F Amb27800442 [0,1,0,1,0,0|2,0,0]=4 4761 B12R1.371 COC(=O)CC1CNCCC1N Amb32861699 [0,1,0,1,0,0|2,0,0]=4 4762 B12R1.371 COC(=O)CC1CNCCN1C Amb27654022 [0,1,0,1,0,0|2,0,0]=4 4763 B12R1.371 COC(=O)CC1COCCC1N Amb33230255 [0,1,0,1,0,0|2,0,0]=4 4764 B12R1.371 COC(=O)CC1CSCCC1N Amb32863505 [0,1,0,1,0,0|2,0,0]=4 4765 B12R1.371 COC(=O)CC1CSCCC1O Amb27396897 [0,1,0,1,0,0|2,0,0]=4 4766 B12R1.371 COC(=O)CC1OCCCC1Cl Amb27635768 [0,1,0,1,0,0|2,0,0]=4 4767 B12R1.371 COC(=O)CN1CCNC[C@H]1C Amb27832334 [0,1,0,1,0,0|2,0,0]=4 4768 B12R1.371 COC(=O)CN1CCSCC1C Amb27234216 [0,1,0,1,0,0|2,0,0]=4 4769 B12R1.371 COC(=O)C[C@@H]1CCCC[C@@H]1N Amb24648079 [0,1,0,1,0,0|1,0,0]=3 4770 B12R1.371 COC(=O)C[C@@H]1CCCC[C@@H]1O Amb27197145 [0,1,0,1,0,0|1,0,0]=3 4771 B12R1.371 COC(=O)C[C@@H]1CSCC[C@@H]1O Amb28318812 [0,1,0,1,0,0|2,0,0]=4 4772 B12R1.371 COC(=O)C[C@@H]1OCCC[C@H]1Cl Amb27476234 [0,1,0,1,0,0|2,0,0]=4 4773 B12R1.371 COC(=O)C[C@H]1OCCC[C@@H]1N Amb27845601 [0,1,0,1,0,0|2,0,0]=4 4774 B12R1.371 COC(=O)NC1CCNCC1C Amb27460680 [0,1,0,1,0,0|2,0,0]=4 4775 B12R1.371 COC(=O)NC1CCOCC1C Amb27758298 [0,1,0,1,0,0|2,0,0]=4 4776 B12R1.371 COC(=O)NC1CNCCC1C Amb24661654 [0,1,0,1,0,0|2,0,0]=4 4777 B12R1.371 COC(=O)N[C@@H]1CCCC[C@H]1N Amb28323694 [0,1,0,1,0,0|2,0,0]=4 4778 B12R1.371 COC(=O)N[C@@H]1CCCC[C@H]1O Amb28370198 [0,1,0,1,0,0|2,0,0]=4 4779 B12R1.371 COC(=O)N[C@@H]1CNCC[C@@H]1C Amb17621798 [0,1,0,1,0,0|2,0,0]=4 4780 B12R1.371 COC(=O)N[C@H]1CCCC[C@H]1C Amb27261699 [0,1,0,1,0,0|1,0,0]=3 4781 B12R1.371 COC(=O)N[C@H]1CNCC[C@H]1C Amb8388559 [0,1,0,1,0,0|2,0,0]=4 4782 B12R1.371 COC(=O)OC1CCCCC1Cl Amb27985882 [0,1,0,1,0,0|2,0,0]=4 4783 B12R1.371 COC(=O)OC1CCCCC1N Amb27172419 [0,1,0,1,0,0|2,0,0]=4 4784 B12R1.371 COC(=O)OC1CCCCC1O Amb27665448 [0,1,0,1,0,0|2,0,0]=4 4785 B12R1.371 COC(=O)O[C@H]1CCCC[C@@H]1O Amb28401127 [0,1,0,1,0,0|2,0,0]=4 4786 B12R1.371 COC(=O)\C=C1/CCCCC1C Amb32667121 [0,1,0,1,0,0|0,0,2]=4 4787 B12R1.371 COC(=O)\C=C1\CCCCC1C Amb25808199 [0,1,0,1,0,0|0,0,2]=4 4788 B12R1.371 NC1CCCCC1CC(=O)NO Amb28193664 [0,1,0,1,0,0|1,0,0]=3 4789 B12R1.371 O=C(CO)CC1CCCCC1=O Amb27177763 [0,1,0,1,0,0|1,0,1]=4 4790 B12R1.371 O=C(CO)N[C@@H]1CCCC[C@H]1F Amb26060168 [0,1,0,1,0,0|2,0,0]=4 4791 B12R1.407 COC1CCCCCCC(=O)N1 Amb28184682 [0,1,0,1,0,0|1,0,0]=3 4792 B12R1.407 C[C@@H]1CCCCCC[C@@H](CO)O1 Amb27472772 [0,1,0,1,0,0|0,0,2]=4 4793 B12R1.407 C[C@@H]1CCCCCC[C@H](C=O)O1 Amb27799682 [0,1,0,1,0,0|0,0,1]=3 4794 B12R1.407 O=C1CCCC=CC[C@@H](CO)O1 Amb27833714 [0,1,0,1,0,0|0,0,2]=4 4795 B12R1.410 OCC1CCCCCCCCC1 Amb28189439 [0,1,0,1,0,0|1,0,1]=4 4796 B12R1.410 ON=C1CCCCCCCCC1 Amb17671029 [0,1,0,1,0,0|1,0,0]=3 4797 B12R1.477 COC(=O)CCCN1CCCC1 Amb8455429 [0,1,0,1,0,0|1,0,0]=3 4798 B12R1.477 COC(=O)CCNC1CCCC1 Amb8830831 [0,1,0,1,0,0|1,0,0]=3 4799 B12R1.477 COC(=O)CCOC1CCCC1 Amb9206352 [0,1,0,1,0,0|1,0,0]=3 4800 B12R1.477 COC(=O)CCSC1CCNC1 Amb19072467 [0,1,0,1,0,0|2,0,0]=4 4801 B12R1.477 COC(=O)CNCC1CCCO1 Amb6713922 [0,1,0,1,0,0|2,0,0]=4 4802 B12R1.477 COC(=O)CSCC1CCCN1 Amb19072465 [0,1,0,1,0,0|2,0,0]=4 4803 B12R1.477 COC(=O)CSCC1CCCN1 Amb35745668 [0,1,0,1,0,0|2,0,0]=4 4804 B12R1.477 NC(CO)CCCC1CCCC1 Amb33374566 [0,1,0,1,0,0|1,0,1]=4 4805 B12R1.477 NCC(O)CCCC1CCCC1 Amb33380251 [0,1,0,1,0,0|1,0,1]=4 4806 B12R1.477 NNC(=O)CCCN1CCCC1 Amb8455552 [0,1,0,1,0,0|2,0,0]=4 4807 B12R1.477 NNC(=O)CCNC1CCCC1 Amb17604769 [0,1,0,1,0,0|2,0,0]=4 4808 B12R1.477 N\C(CCCN1CCCC1)=N/O Amb9718665 [0,1,0,1,0,0|2,0,0]=4 4809 B12R1.477 N\C(CCNC1CCCC1)=N/O Amb33033612 [0,1,0,1,0,0|2,0,0]=4 4810 B12R1.477 O=C(CBr)NCCC1CCCC1 Amb17329841 [0,1,0,1,0,0|2,0,0]=4 4811 B12R1.1026 O=C1C(O)CCCCCCC1O Amb28199853 [0,1,0,1,0,0|1,0,1]=4 4812 B12R1.1442 CCOC1CCCCC(=O)C1=O Amb27177912 [0,1,0,1,0,0|1,0,1]=4 4813 B12R1.1659 C#CC(=O)C1CCCCCCC1 Amb27800753 [0,1,0,1,0,0|1,0,0]=3 4814 B12R1.1659 C#CC(=O)N1CCCCCCC1 Amb25279820 [0,1,0,1,0,0|2,0,0]=4 4815 B12R1.1659 C=C(C#N)C1CCCCCCC1 Amb32649131 [0,1,0,1,0,0|2,0,0]=4 4816 B12R1.1659 C=C(C=O)C1CCCCCCC1 Amb27841851 [0,1,0,1,0,0|1,0,0]=3 4817 B12R1.1659 C=CC(=O)N1CCCCCCC1 Amb9480595 [0,1,0,1,0,0|2,0,0]=4 4818 B12R1.1659 CCC(O)C1CCCCCCC1 Amb27652099 [0,1,0,1,0,0|1,0,1]=4 4819 B12R1.1659 CC[C@H](O)C1CCCCCCC1 Amb28366505 [0,1,0,1,0,0|1,0,1]=4 4820 B12R1.1659 CNC(=N)C1CCCCCCC1 Amb27175502 [0,1,0,1,0,0|2,0,0]=4 4821 B12R1.1659 COC(=O)C1CCCCCCC1 Amb24537636 [0,1,0,1,0,0|0,0,0]=2 4822 B12R1.1659 COC(=O)C1CCCCCCN1 Amb25246058 [0,1,0,1,0,0|1,0,0]=3 4823 B12R1.1659 COC(=O)C1CCCCNCC1 Amb27490896 [0,1,0,1,0,0|1,0,0]=3 4824 B12R1.1659 COC(=O)N1CCCCCCC1 Amb2125356 [0,1,0,1,0,0|1,0,0]=3 4825 B12R1.1659 NCC(O)C1CCCCCCC1 Amb28458412 [0,1,0,1,0,0|1,0,1]=4 4826 B12R1.1659 NNC(=O)C1CCCCCCC1 Amb28064581 [0,1,0,1,0,0|1,0,0]=3 4827 B12R1.1659 N\C(=N/O)C1CCCCCCC1 Amb26417992 [0,1,0,1,0,0|1,0,0]=3 4828 B12R1.1659 O=C(CCl)C1CCCCCCC1 Amb25294397 [0,1,0,1,0,0|1,0,0]=3 4829 B12R1.1659 O=C(CCl)N1CCCCCCC1 Amb2125573 [0,1,0,1,0,0|2,0,0]=4 4830 B12R1.1659 O=C(NO)C1CCCCCCC1 Amb27644271 [0,1,0,1,0,0|0,0,0]=2 4831 B12R1.1748 C#CC(=O)CC1CCCCCC1 Amb27459562 [0,1,0,1,0,0|1,0,0]=3 4832 B12R1.1748 C#CC(=O)CN1CCCCCC1 Amb27169042 [0,1,0,1,0,0|2,0,0]=4 4833 B12R1.1748 C#CC(=O)NC1CCCCCC1 Amb27852987 [0,1,0,1,0,0|2,0,0]=4 4834 B12R1.1748 C=CC(=O)CC1CCCCCC1 Amb28288977 [0,1,0,1,0,0|1,0,0]=3 4835 B12R1.1748 C=CC(O)CC1CCCCCC1 Amb27661457 [0,1,0,1,0,0|1,0,1]=4 4836 B12R1.1748 CC(CO)CC1CCCCCC1 Amb25323159 [0,1,0,1,0,0|1,0,1]=4 4837 B12R1.1748 CCC(=O)OC1CCCCCC1 Amb25154716 [0,1,0,1,0,0|2,0,0]=4 4838 B12R1.1748 COC(=O)C=C1CCCCCC1 Amb9826915 [0,1,0,1,0,0|0,0,2]=4 4839 B12R1.1748 COC(=O)CC1CCCCCC1 Amb26860987 [0,1,0,1,0,0|0,0,0]=2 4840 B12R1.1748 COC(=O)CC1CCCCCN1 Amb25123355 [0,1,0,1,0,0|1,0,0]=3 4841 B12R1.1748 COC(=O)CC1CCCNCC1 Amb24581304 [0,1,0,1,0,0|1,0,0]=3 4842 B12R1.1748 COC(=O)CC1CCCOCC1 Amb33068690 [0,1,0,1,0,0|1,0,0]=3 4843 B12R1.1748 COC(=O)CN1CCCNCC1 Amb1114640 [0,1,0,1,0,0|2,0,0]=4 4844 B12R1.1748 COC(=O)CN1CCCNCC1 Amb6893763 [0,1,0,1,0,0|2,0,0]=4 4845 B12R1.1748 COC(=O)NC1CCCSCC1 Amb35692780 [0,1,0,1,0,0|2,0,0]=4 4846 B12R1.1748 COC(=O)OC1CCCNCC1 Amb35723383 [0,1,0,1,0,0|2,0,0]=4 4847 B12R1.1748 CON(C)CC1CCCCCC1 Amb27766349 [0,1,0,1,0,0|2,0,0]=4 4848 B12R1.1748 C[C@@H](CO)CC1CCCCCC1 Amb33738941 [0,1,0,1,0,0|1,0,1]=4 4849 B12R1.1748 C[C@H](CO)CC1CCCCCC1 Amb33748159 [0,1,0,1,0,0|1,0,1]=4 4850 B12R1.1748 C\C(CN1CCCCCC1)=N/O Amb27468426 [0,1,0,1,0,0|2,0,0]=4 4851 B12R1.1748 N#CC(O)CC1CCCCCC1 Amb27984002 [0,1,0,1,0,0|1,0,1]=4 4852 B12R1.1748 NC(CO)CC1CCCCCC1 Amb27847857 [0,1,0,1,0,0|1,0,1]=4 4853 B12R1.1748 NCC(=O)CC1CCCCCC1 Amb28206489 [0,1,0,1,0,0|1,0,0]=3 4854 B12R1.1748 NCC(=O)NC1CCCCCC1 Amb5783139 [0,1,0,1,0,0|2,0,0]=4 4855 B12R1.1748 NCC(O)CC1CCCCCC1 Amb26570451 [0,1,0,1,0,0|1,0,1]=4 4856 B12R1.1748 NNC(=O)CN1CCCCCC1 Amb1980812 [0,1,0,1,0,0|2,0,0]=4 4857 B12R1.1748 N\C(CN1CCCCCC1)=N/O Amb1112944 [0,1,0,1,0,0|2,0,0]=4 4858 B12R1.1748 O=C(CBr)NC1CCCCCC1 Amb17324791 [0,1,0,1,0,0|2,0,0]=4 4859 B12R1.1748 O=C(CC1CCCCCC1)NO Amb28123779 [0,1,0,1,0,0|0,0,0]=2 4860 B12R1.1748 O=C(CCl)CC1CCCCCC1 Amb27662588 [0,1,0,1,0,0|1,0,0]=3 4861 B12R1.1748 O=C(CCl)NC1CCCCCC1 Amb6599838 [0,1,0,1,0,0|2,0,0]=4 4862 B12R1.1748 O=C(CF)NC1CCCCCC1 Amb28041369 [0,1,0,1,0,0|2,0,0]=4 4863 B12R1.1748 O=C(CO)NC1CCCCCC1 Amb5798095 [0,1,0,1,0,0|1,0,0]=3 4864 B12R1.1748 O=C(CO)NC1CCCOCC1 Amb27178759 [0,1,0,1,0,0|2,0,0]=4 4865 B12R1.1748 O=C(CO)OC1CCCCCC1 Amb28047956 [0,1,0,1,0,0|1,0,0]=3 4866 B12R1.1748 O=C(CS)NC1CCCCCC1 Amb27393805 [0,1,0,1,0,0|1,1,0]=4 4867 B12R1.1748 O\N=C(/Cl)CC1CCCCCC1 Amb27451494 [0,1,0,1,0,0|1,0,0]=3 4868 B12R1.1877 C#CC1(O)CCCCCC1CC Amb35721139 [0,1,0,1,0,0|1,0,1]=4 4869 B12R1.1877 C=CC1(O)CCCCCC1CC Amb35721140 [0,1,0,1,0,0|1,0,1]=4 4870 B12R1.1877 CCC1CCCCCC1(N)CO Amb35733863 [0,1,0,1,0,0|1,0,1]=4 4871 B12R1.1877 CCC1CCCCCC1(O)C#N Amb35725687 [0,1,0,1,0,0|1,0,1]=4 4872 B12R1.1877 CCC1CCCCCC1(O)CC Amb35721142 [0,1,0,1,0,0|1,0,1]=4 4873 B12R1.1877 CCC1CCCCCC1(O)CN Amb29865017 [0,1,0,1,0,0|1,0,1]=4 4874 B12R1.1877 CCC1CCCCCC1(O)CO Amb35659959 [0,1,0,1,0,0|0,0,2]=4 4875 B12R1.1880 COC1CCCCCC(=O)C1C Amb27177465 [0,1,0,1,0,0|2,0,0]=4 4876 B12R1.1880 CO[C@@H]1CCCCCC(=O)[C@H]1C Amb27854948 [0,1,0,1,0,0|2,0,0]=4 4877 B12R1.1882 CCC1CCCCCC(C=O)O1 Amb27175898 [0,1,0,1,0,0|0,0,1]=3 4878 B12R1.1882 CCC1CCCCCC(CO)O1 Amb28189493 [0,1,0,1,0,0|0,0,2]=4 4879 B12R1.1882 CCC1CCCCCC(OC)=N1 Amb33036101 [0,1,0,1,0,0|1,0,0]=3 4880 B12R1.1882 CC[C@@H]1CCCCC[C@@H](C=O)O1 Amb27799655 [0,1,0,1,0,0|0,0,1]=3 4881 B12R1.1882 CC[C@@H]1CCCCC[C@@H](CO)O1 Amb28321537 [0,1,0,1,0,0|0,0,2]=4 4882 B12R1.43 C=C(CC1CCCCC1)C(=O)O Amb27984845 [0,1,0,1,0,0|0,0,1]=3 4883 B12R1.43 C=C(CC1CCCNC1)C(=O)O Amb28322836 [0,1,0,1,0,0|1,0,1]=4 4884 B12R1.43 C=C(CN1CCCCC1)C(=O)O Amb22265884 [0,1,0,1,0,0|1,0,1]=4 4885 B12R1.43 CC(=O)C(=O)CC1CCCCC1 Amb24434603 [0,1,0,1,0,0|1,0,1]=4 4886 B12R1.43 CC(=O)C(C)CC1CCOCC1 Amb18801868 [0,1,0,1,0,0|2,0,0]=4 4887 B12R1.43 CC(=O)C(C)NC1CCCCC1 Amb27441146 [0,1,0,1,0,0|2,0,0]=4 4888 B12R1.43 CC(=O)C(C)SC1CCCCC1 Amb19076175 [0,1,0,1,0,0|2,0,0]=4 4889 B12R1.43 CC(=O)C(O)CN1CCCCC1 Amb27604482 [0,1,0,1,0,0|2,0,0]=4 4890 B12R1.43 CC(=O)[C@@H](O)CN1CCCCC1 Amb26399607 [0,1,0,1,0,0|2,0,0]=4 4891 B12R1.43 CC(CC1=CCCCC1)C(=O)O Amb27268663 [0,1,0,1,0,0|0,0,2]=4 4892 B12R1.43 CC(CC1CC=CCC1)C(=O)O Amb18647044 [0,1,0,1,0,0|0,0,2]=4 4893 B12R1.43 CC(CC1CCCCC1)C(=O)Cl Amb28066185 [0,1,0,1,0,0|1,0,0]=3 4894 B12R1.43 CC(CC1CCCCC1)C(=O)O Amb18793664 [0,1,0,1,0,0|0,0,0]=2 4895 B12R1.43 CC(CC1CCCCN1)C(=O)O Amb26058326 [0,1,0,1,0,0|1,0,0]=3 4896 B12R1.43 CC(CC1CCCCN1)C(=O)O Amb28963376 [0,1,0,1,0,0|1,0,0]=3 4897 B12R1.43 CC(CC1CCCCO1)C(=O)O Amb25677036 [0,1,0,1,0,0|1,0,0]=3 4898 B12R1.43 CC(CC1CCCNC1)C(=O)O Amb26877478 [0,1,0,1,0,0|1,0,0]=3 4899 B12R1.43 CC(CC1CCCNC1)C(=O)O Amb28963374 [0,1,0,1,0,0|1,0,0]=3 4900 B12R1.43 CC(CC1CCCOC1)C(=O)O Amb25821683 [0,1,0,1,0,0|1,0,0]=3 4901 B12R1.43 CC(CC1CCCSC1)C(=O)O Amb27776306 [0,1,0,1,0,0|1,0,0]=3 4902 B12R1.43 CC(CC1CCNCC1)C(=O)O Amb25864479 [0,1,0,1,0,0|1,0,0]=3 4903 B12R1.43 CC(CC1CCNCC1)C(=O)O Amb28963378 [0,1,0,1,0,0|1,0,0]=3 4904 B12R1.43 CC(CC1CCOCC1)C(=O)O Amb18298019 [0,1,0,1,0,0|1,0,0]=3 4905 B12R1.43 CC(CC1OCCCO1)C(=O)O Amb17334973 [0,1,0,1,0,0|2,0,0]=4 4906 B12R1.43 CC(CN1CCCCC1)C(=O)O Amb534946 [0,1,0,1,0,0|1,0,0]=3 4907 B12R1.43 CC(CN1CCCCC1)C(=O)O Amb8130502 [0,1,0,1,0,0|1,0,0]=3 4908 B12R1.43 CC(CN1CCCCC1)C(N)=O Amb17232749 [0,1,0,1,0,0|2,0,0]=4 4909 B12R1.43 CC(CN1CCOCC1)C(=O)O Amb1099388 [0,1,0,1,0,0|2,0,0]=4 4910 B12R1.43 CC(CN1CCOCC1)C(=O)O Amb1292946 [0,1,0,1,0,0|2,0,0]=4 4911 B12R1.43 CC(C[NH+]1CCOCC1)C(=O)O Amb5371892 [0,1,0,1,0,0|2,0,0]=4 4912 B12R1.43 CC(NC1CCCCC1)C(=O)O Amb840581 [0,1,0,1,0,0|1,0,0]=3 4913 B12R1.43 CC(O)C(C)CC1CCCCC1 Amb18806708 [0,1,0,1,0,0|1,0,1]=4 4914 B12R1.43 CC(O)C(N)CC1CCCCC1 Amb18198442 [0,1,0,1,0,0|1,0,1]=4 4915 B12R1.43 CC(O)[C@@H](N)CC1CCCCC1 Amb27789944 [0,1,0,1,0,0|1,0,1]=4 4916 B12R1.43 CC(OC1CCCCC1)C(=O)O Amb9281758 [0,1,0,1,0,0|1,0,0]=3 4917 B12R1.43 CC(OC1CCCNC1)C(=O)O Amb23571375 [0,1,0,1,0,0|2,0,0]=4 4918 B12R1.43 CC(OC1CCCOC1)C(=O)O Amb27861796 [0,1,0,1,0,0|2,0,0]=4 4919 B12R1.43 CC(O[C@@H]1CCCCO1)C(=O)O Amb28044310 [0,1,0,1,0,0|2,0,0]=4 4920 B12R1.43 CC(SC1CCNCC1)C(=O)O Amb17502144 [0,1,0,1,0,0|2,0,0]=4 4921 B12R1.43 CN(CC1CCCCC1)C(=O)Cl Amb25877420 [0,1,0,1,0,0|2,0,0]=4 4922 B12R1.43 C[C@@H](CC1CCCCC1)C(=O)O Amb10844011 [0,1,0,1,0,0|0,0,0]=2 4923 B12R1.43 C[C@@H](CC1CCCCO1)C(=O)O Amb33749081 [0,1,0,1,0,0|1,0,0]=3 4924 B12R1.43 C[C@@H](CC1CCOCC1)C(=O)O Amb33749082 [0,1,0,1,0,0|1,0,0]=3 4925 B12R1.43 C[C@@H](CN1CCOCC1)C(=O)O Amb27878616 [0,1,0,1,0,0|2,0,0]=4 4926 B12R1.43 C[C@@H](NC1CCCCC1)C(=O)O Amb22745317 [0,1,0,1,0,0|1,0,0]=3 4927 B12R1.43 C[C@@H](NC1CCCCC1)C(N)=O Amb28320242 [0,1,0,1,0,0|2,0,0]=4 4928 B12R1.43 C[C@@H](NC1CCCOC1)C(=O)O Amb27831106 [0,1,0,1,0,0|2,0,0]=4 4929 B12R1.43 C[C@@H](NC1CCCSC1)C(=O)O Amb27235289 [0,1,0,1,0,0|2,0,0]=4 4930 B12R1.43 C[C@@H](NC1CCNCC1)C(=O)O Amb28283516 [0,1,0,1,0,0|2,0,0]=4 4931 B12R1.43 C[C@@H](OC1CCCCO1)C(=O)O Amb24759103 [0,1,0,1,0,0|2,0,0]=4 4932 B12R1.43 C[C@H](CC1CCCCC1)C(=O)O Amb10844010 [0,1,0,1,0,0|0,0,0]=2 4933 B12R1.43 C[C@H](CC1CCCCO1)C(=O)O Amb33749391 [0,1,0,1,0,0|1,0,0]=3 4934 B12R1.43 C[C@H](CC1CCOCC1)C(=O)O Amb33749392 [0,1,0,1,0,0|1,0,0]=3 4935 B12R1.43 C[C@H](CN1CCOCC1)C(=O)O Amb27444150 [0,1,0,1,0,0|2,0,0]=4 4936 B12R1.43 C[C@H](NC1CCCCC1)C(=O)O Amb16233163 [0,1,0,1,0,0|1,0,0]=3 4937 B12R1.43 C[C@H](NC1CCCCC1)C(=O)O Amb24099402 [0,1,0,1,0,0|1,0,0]=3 4938 B12R1.43 C[C@H](NC1CCCOC1)C(=O)O Amb27669499 [0,1,0,1,0,0|2,0,0]=4 4939 B12R1.43 C[C@H](NC1CCNCC1)C(=O)O Amb27951940 [0,1,0,1,0,0|2,0,0]=4 4940 B12R1.43 C[C@H](NC1CCSCC1)C(=O)O Amb27783948 [0,1,0,1,0,0|2,0,0]=4 4941 B12R1.43 C[C@H](OC1CCCOC1)C(=O)O Amb28145435 [0,1,0,1,0,0|2,0,0]=4 4942 B12R1.43 C[C@H](OC1CCOCC1)C(=O)O Amb28281315 [0,1,0,1,0,0|2,0,0]=4 4943 B12R1.43 NC(=O)C(N)CC1CCCCC1 Amb24432460 [0,1,0,1,0,0|1,0,0]=3 4944 B12R1.43 NC(=O)C(N)CC1CCCCO1 Amb28194733 [0,1,0,1,0,0|2,0,0]=4 4945 B12R1.43 NC(=O)C(N)CC1CCCOC1 Amb33065827 [0,1,0,1,0,0|2,0,0]=4 4946 B12R1.43 NC(=O)C(N)CC1CCOCC1 Amb24763306 [0,1,0,1,0,0|2,0,0]=4 4947 B12R1.43 NC(=O)[C@@H](N)CC1CCCCC1 Amb22432473 [0,1,0,1,0,0|1,0,0]=3 4948 B12R1.43 NC(CC1=CCCCC1)C(=O)O Amb22233021 [0,1,0,1,0,0|0,0,2]=4 4949 B12R1.43 NC(CC1CC=CCC1)C(=O)O Amb26371532 [0,1,0,1,0,0|0,0,2]=4 4950 B12R1.43 NC(CC1CCCCC1)C(=O)O Amb31031227 [0,1,0,1,0,0|0,0,0]=2 4951 B12R1.43 NC(CC1CCCCC1)C(=O)O Amb33531433 [0,1,0,1,0,0|0,0,0]=2 4952 B12R1.43 NC(CC1CCCCC1)C(=O)O Amb9804055 [0,1,0,1,0,0|0,0,0]=2 4953 B12R1.43 NC(CC1CCCCC1)P(O)O Amb27597101 [0,1,0,1,0,0|1,0,1]=4 4954 B12R1.43 NC(CC1CCCCC1)[PH](=O)O Amb28458569 [0,1,0,1,0,0|1,0,0]=3 4955 B12R1.43 NC(CC1CCCCN1)C(=O)O Amb30040152 [0,1,0,1,0,0|1,0,0]=3 4956 B12R1.43 NC(CC1CCCCO1)C(=O)O Amb33550275 [0,1,0,1,0,0|1,0,0]=3 4957 B12R1.43 NC(CC1CCCCO1)C(=O)O Amb9455335 [0,1,0,1,0,0|1,0,0]=3 4958 B12R1.43 NC(CC1CCCNC1)C(=O)O Amb18825351 [0,1,0,1,0,0|1,0,0]=3 4959 B12R1.43 NC(CC1CCCOC1)C(=O)O Amb18197937 [0,1,0,1,0,0|1,0,0]=3 4960 B12R1.43 NC(CC1CCCSC1)C(=O)O Amb18819912 [0,1,0,1,0,0|1,0,0]=3 4961 B12R1.43 NC(CC1CCNCC1)C(=O)O Amb18198249 [0,1,0,1,0,0|1,0,0]=3 4962 B12R1.43 NC(CC1CCOCC1)C(=O)O Amb18995884 [0,1,0,1,0,0|1,0,0]=3 4963 B12R1.43 NC(CC1CCOCC1)C(=O)O Amb33533168 [0,1,0,1,0,0|1,0,0]=3 4964 B12R1.43 NC(CC1COCCO1)C(=O)O Amb25971838 [0,1,0,1,0,0|2,0,0]=4 4965 B12R1.43 NC(CN1CCCCC1)C(=O)O Amb18981870 [0,1,0,1,0,0|1,0,0]=3 4966 B12R1.43 NC(CN1CCCCC1)C(=O)O Amb28872382 [0,1,0,1,0,0|1,0,0]=3 4967 B12R1.43 NC(CN1CCNCC1)C(=O)O Amb18293707 [0,1,0,1,0,0|2,0,0]=4 4968 B12R1.43 NC(CN1CCOCC1)C(=O)O Amb18981865 [0,1,0,1,0,0|2,0,0]=4 4969 B12R1.43 NC(CN1CCOCC1)C(=O)O Amb24271203 [0,1,0,1,0,0|2,0,0]=4 4970 B12R1.43 N[C@@H](CC1=CCCCC1)C(=O)O Amb26874843 [0,1,0,1,0,0|0,0,2]=4 4971 B12R1.43 N[C@@H](CC1CC=CCC1)C(=O)O Amb30011954 [0,1,0,1,0,0|0,0,2]=4 4972 B12R1.43 N[C@@H](CC1CCCCC1)C(=O)O Amb22229277 [0,1,0,1,0,0|0,0,0]=2 4973 B12R1.43 N[C@@H](CC1CCCCC1)C(=O)O Amb22745313 [0,1,0,1,0,0|0,0,0]=2 4974 B12R1.43 N[C@@H](CC1CCCCC1)C(=O)O Amb2725661 [0,1,0,1,0,0|0,0,0]=2 4975 B12R1.43 N[C@@H](CC1CCCCO1)C(=O)O Amb26025666 [0,1,0,1,0,0|1,0,0]=3 4976 B12R1.43 N[C@@H](CC1CCCOC1)C(=O)O Amb26995761 [0,1,0,1,0,0|1,0,0]=3 4977 B12R1.43 N[C@@H](CC1CCOCC1)C(=O)O Amb18803355 [0,1,0,1,0,0|1,0,0]=3 4978 B12R1.43 N[C@@H](CC1CCOCC1)C(=O)O Amb30868015 [0,1,0,1,0,0|1,0,0]=3 4979 B12R1.43 N[C@@H](CC1COCCO1)C(=O)O Amb33066291 [0,1,0,1,0,0|2,0,0]=4 4980 B12R1.43 N[C@@H](CN1CCNCC1)C(=O)O Amb24548455 [0,1,0,1,0,0|2,0,0]=4 4981 B12R1.43 N[C@@H](CN1CCNCC1)C(=O)O Amb30874070 [0,1,0,1,0,0|2,0,0]=4 4982 B12R1.43 N[C@@H](CN1CCOCC1)C(=O)O Amb27590741 [0,1,0,1,0,0|2,0,0]=4 4983 B12R1.43 N[C@H](CC1CC=CCC1)C(=O)O Amb30011934 [0,1,0,1,0,0|0,0,2]=4 4984 B12R1.43 N[C@H](CC1CCCCC1)C(=O)O Amb33779608 [0,1,0,1,0,0|0,0,0]=2 4985 B12R1.43 N[C@H](CC1CCCCC1)C(=O)O Amb33872303 [0,1,0,1,0,0|0,0,0]=2 4986 B12R1.43 N[C@H](CC1CCCCC1)C(=O)O Amb8385712 [0,1,0,1,0,0|0,0,0]=2 4987 B12R1.43 N[C@H](CC1CCCCO1)C(=O)O Amb24604321 [0,1,0,1,0,0|1,0,0]=3 4988 B12R1.43 N[C@H](CC1CCCNC1)C(=O)O Amb27257985 [0,1,0,1,0,0|1,0,0]=3 4989 B12R1.43 N[C@H](CC1CCCOC1)C(=O)O Amb27807816 [0,1,0,1,0,0|1,0,0]=3 4990 B12R1.43 N[C@H](CC1CCNCC1)C(=O)O Amb28457488 [0,1,0,1,0,0|1,0,0]=3 4991 B12R1.43 N[C@H](CC1CCOCC1)C(=O)O Amb25102790 [0,1,0,1,0,0|1,0,0]=3 4992 B12R1.43 N[C@H](CC1CCOCC1)C(=O)O Amb33801097 [0,1,0,1,0,0|1,0,0]=3 4993 B12R1.43 N[C@H](CC1COCCO1)C(=O)O Amb33036539 [0,1,0,1,0,0|2,0,0]=4 4994 B12R1.43 O=C(O)C(=O)CC1CCCCC1 Amb18296282 [0,1,0,1,0,0|0,0,1]=3 4995 B12R1.43 O=C(O)C(=O)CC1CCCCO1 Amb30033845 [0,1,0,1,0,0|1,0,1]=4 4996 B12R1.43 O=C(O)C(=O)CC1CCCSC1 Amb32726310 [0,1,0,1,0,0|1,0,1]=4 4997 B12R1.43 O=C(O)C(=O)CC1CCOCC1 Amb18990342 [0,1,0,1,0,0|1,0,1]=4 4998 B12R1.43 O=C(O)C(=O)NC1CCCCC1 Amb2693954 [0,1,0,1,0,0|1,0,1]=4 4999 B12R1.43 O=C(O)C(=O)OC1CCCCC1 Amb28365635 [0,1,0,1,0,0|1,0,1]=4 5000 B12R1.43 O=C(O)C(=S)CC1CCOCC1 Amb27634825 [0,1,0,1,0,0|1,0,1]=4 5001 B12R1.43 O=C(O)C(F)CC1CCCCC1 Amb24415390 [0,1,0,1,0,0|0,0,0]=2 5002 B12R1.43 O=C(O)C(F)CC1CCCCO1 Amb35637844 [0,1,0,1,0,0|1,0,0]=3 5003 B12R1.43 O=C(O)C(F)CC1CCCSC1 Amb27653817 [0,1,0,1,0,0|1,0,0]=3 5004 B12R1.43 O=C(O)C(F)CN1CCOCC1 Amb28053140 [0,1,0,1,0,0|2,0,0]=4 5005 B12R1.43 O=C(O)C(F)OC1CCOCC1 Amb27389945 [0,1,0,1,0,0|2,0,0]=4 5006 B12R1.43 O=C(O)C(O)C=C1CCCCC1 Amb27218268 [0,1,0,1,0,0|0,0,2]=4 5007 B12R1.43 O=C(O)C(O)CC1=CCCCC1 Amb27793113 [0,1,0,1,0,0|0,0,2]=4 5008 B12R1.43 O=C(O)C(O)CC1CC=CCC1 Amb29866636 [0,1,0,1,0,0|0,0,2]=4 5009 B12R1.43 O=C(O)C(O)CC1CCCCC1 Amb18647669 [0,1,0,1,0,0|0,0,0]=2 5010 B12R1.43 O=C(O)C(O)CC1CCCCO1 Amb33353311 [0,1,0,1,0,0|1,0,0]=3 5011 B12R1.43 O=C(O)C(O)CC1CCCOC1 Amb33353296 [0,1,0,1,0,0|1,0,0]=3 5012 B12R1.43 O=C(O)C(O)CC1CCCSC1 Amb32726296 [0,1,0,1,0,0|1,0,0]=3 5013 B12R1.43 O=C(O)C(O)CC1CCNCC1 Amb27478070 [0,1,0,1,0,0|1,0,0]=3 5014 B12R1.43 O=C(O)C(O)CC1CCOCC1 Amb24488660 [0,1,0,1,0,0|1,0,0]=3 5015 B12R1.43 O=C(O)C(O)CN1CCCCC1 Amb26012171 [0,1,0,1,0,0|1,0,0]=3 5016 B12R1.43 O=C(O)C(O)CN1CCOCC1 Amb26517747 [0,1,0,1,0,0|2,0,0]=4 5017 B12R1.43 O=C(O)C(O)CN1CCOCC1 Amb32660950 [0,1,0,1,0,0|2,0,0]=4 5018 B12R1.43 O=C(O)C(S)CC1CCCCO1 Amb35738325 [0,1,0,1,0,0|1,0,0]=3 5019 B12R1.43 O=C(O)C(S)CC1CCCOC1 Amb27859098 [0,1,0,1,0,0|1,0,0]=3 5020 B12R1.43 O=C(O)C(S)CC1CCOCC1 Amb18298025 [0,1,0,1,0,0|1,0,0]=3 5021 B12R1.43 O=C(O)[C@@H](F)CC1CCCCC1 Amb27490976 [0,1,0,1,0,0|0,0,0]=2 5022 B12R1.43 O=C(O)[C@@H](O)CC1CCCCC1 Amb25355471 [0,1,0,1,0,0|0,0,0]=2 5023 B12R1.43 O=C(O)[C@H](O)CC1CCCCC1 Amb25363647 [0,1,0,1,0,0|0,0,0]=2 5024 B12R1.43 O=C(O)[C@H](O)CC1CCOCC1 Amb27406363 [0,1,0,1,0,0|1,0,0]=3 5025 B12R1.43 O=C(O)\C(F)=C/C1CCCCC1 Amb28281955 [0,1,0,1,0,0|0,0,2]=4 5026 B12R1.43 O=C(O)\C(F)=C\C1CCCCC1 Amb24597554 [0,1,0,1,0,0|0,0,2]=4 5027 B12R1.80 C=CC1CCCC1C(C)C(=O)O Amb27178214 [0,1,0,1,0,0|0,0,2]=4 5028 B12R1.80 CC(C(=O)O)C1CCCC1C#N Amb27190733 [0,1,0,1,0,0|1,0,1]=4 5029 B12R1.80 CC(C(=O)O)N1CCC[C@@H]1CO Amb27241600 [0,1,0,1,0,0|2,0,0]=4 5030 B12R1.80 CCC1CCCC1C(C)C(=O)O Amb27862198 [0,1,0,1,0,0|0,0,0]=2 5031 B12R1.80 CCC1CCCC1C(N)C(=O)O Amb29892360 [0,1,0,1,0,0|0,0,0]=2 5032 B12R1.80 CCC1CCCN1C(=O)C(=O)O Amb18950724 [0,1,0,1,0,0|1,0,1]=4 5033 B12R1.80 CCC1CCCN1C(C)C(=O)O Amb18970633 [0,1,0,1,0,0|1,0,0]=3 5034 B12R1.80 CCC1CCCN1C(C)C(C)=O Amb18793469 [0,1,0,1,0,0|2,0,0]=4 5035 B12R1.80 CCC1CCC\C1=C(\F)C(=O)O Amb27490545 [0,1,0,1,0,0|0,0,2]=4 5036 B12R1.80 CCC1COCC1C(C)C(=O)O Amb35631920 [0,1,0,1,0,0|1,0,0]=3 5037 B12R1.80 CCC1COCC1C(F)C(=O)O Amb35631921 [0,1,0,1,0,0|1,0,0]=3 5038 B12R1.80 CCC1COCC1C(N)C(=O)O Amb35663300 [0,1,0,1,0,0|1,0,0]=3 5039 B12R1.80 CCC1COCC1C(O)C(=O)O Amb35635734 [0,1,0,1,0,0|1,0,0]=3 5040 B12R1.80 COC1CCCC1C(C)C(=O)O Amb28318512 [0,1,0,1,0,0|1,0,0]=3 5041 B12R1.80 COC1CCCC1C(N)C(=O)O Amb27231132 [0,1,0,1,0,0|1,0,0]=3 5042 B12R1.80 COC1CCCC1C(N)C(N)=O Amb25278159 [0,1,0,1,0,0|2,0,0]=4 5043 B12R1.80 COC1CCCC1[C@@H](N)C(=O)O Amb27870871 [0,1,0,1,0,0|1,0,0]=3 5044 B12R1.80 COC1CCCC1[C@H](N)C(=O)O Amb25895067 [0,1,0,1,0,0|1,0,0]=3 5045 B12R1.80 N#CC1CCCC1C(N)C(=O)O Amb33036656 [0,1,0,1,0,0|1,0,1]=4 5046 B12R1.80 N#CC1CCCC1[C@@H](N)C(=O)O Amb33308986 [0,1,0,1,0,0|1,0,1]=4 5047 B12R1.80 N#CC1CCCC1[C@H](N)C(=O)O Amb33066327 [0,1,0,1,0,0|1,0,1]=4 5048 B12R1.124 C=C(C(=O)O)C1CCCCN1C Amb33322716 [0,1,0,1,0,0|1,0,1]=4 5049 B12R1.124 C=C(C(=O)O)[C@@H]1CCCC[C@H]1O Amb27878753 [0,1,0,1,0,0|1,0,1]=4 5050 B12R1.124 C=C(C)C(N)C1CCCCC1C Amb27249353 [0,1,0,1,0,0|2,0,0]=4 5051 B12R1.124 C=C1CCCCC1C(C)C(=O)O Amb18647036 [0,1,0,1,0,0|0,0,2]=4 5052 B12R1.124 C=C1CCCCC1C(O)C(=O)O Amb27641956 [0,1,0,1,0,0|0,0,2]=4 5053 B12R1.124 CC(=O)C(C)C1CCCCC1O Amb27171086 [0,1,0,1,0,0|2,0,0]=4 5054 B12R1.124 CC(C(=O)O)C1CCCCC1F Amb27481844 [0,1,0,1,0,0|1,0,0]=3 5055 B12R1.124 CC(C(=O)O)C1CCCCC1O Amb27495380 [0,1,0,1,0,0|1,0,0]=3 5056 B12R1.124 CC(C(=O)O)C1CCCCN1C Amb18198531 [0,1,0,1,0,0|1,0,0]=3 5057 B12R1.124 CC(C(=O)O)C1COCCN1C Amb18197934 [0,1,0,1,0,0|2,0,0]=4 5058 B12R1.124 CC(C(=O)O)C1CSCCN1C Amb18190133 [0,1,0,1,0,0|2,0,0]=4 5059 B12R1.124 CC1CCCCC1C(C)C(=O)O Amb25834481 [0,1,0,1,0,0|0,0,0]=2 5060 B12R1.124 CC1CCCCC1C(N)C(N)=O Amb25919349 [0,1,0,1,0,0|1,0,0]=3 5061 B12R1.124 CC1CCCCC1C(O)C(=O)O Amb27473004 [0,1,0,1,0,0|0,0,0]=2 5062 B12R1.124 CC1CCCCC1N(C)C(N)=O Amb18793712 [0,1,0,1,0,0|2,0,0]=4 5063 B12R1.124 CC1CCCCC1[C@@H](C)C(=O)O Amb33743169 [0,1,0,1,0,0|0,0,0]=2 5064 B12R1.124 CC1CCCCC1[C@@H](N)C(=O)O Amb33308841 [0,1,0,1,0,0|0,0,0]=2 5065 B12R1.124 CC1CCCCC1[C@H](C)C(=O)O Amb33744622 [0,1,0,1,0,0|0,0,0]=2 5066 B12R1.124 CC1CCCCC1[C@H](N)C(=O)O Amb33308945 [0,1,0,1,0,0|0,0,0]=2 5067 B12R1.124 CC1CCCCN1C(=O)C(=O)O Amb9303794 [0,1,0,1,0,0|1,0,1]=4 5068 B12R1.124 CC1CCCCN1C(C)C(=O)O Amb5768708 [0,1,0,1,0,0|1,0,0]=3 5069 B12R1.124 CC1COCCC1C(N)C(=O)O Amb29892286 [0,1,0,1,0,0|1,0,0]=3 5070 B12R1.124 CC1COCCN1C(C)C(=O)O Amb9404313 [0,1,0,1,0,0|2,0,0]=4 5071 B12R1.124 CC1CSCCN1C(C)C(=O)O Amb27765233 [0,1,0,1,0,0|2,0,0]=4 5072 B12R1.124 CC1SCCCC1C(N)C(=O)O Amb35660560 [0,1,0,1,0,0|1,0,0]=3 5073 B12R1.124 CN1CCCCC1C(=O)C(=O)O Amb33323472 [0,1,0,1,0,0|1,0,1]=4 5074 B12R1.124 CN1CCCCC1C(N)C(=O)O Amb28146801 [0,1,0,1,0,0|1,0,0]=3 5075 B12R1.124 CN1CCCCC1C(O)C(=O)O Amb33323471 [0,1,0,1,0,0|1,0,0]=3 5076 B12R1.124 CN1CCOCC1C(N)C(=O)O Amb18197779 [0,1,0,1,0,0|2,0,0]=4 5077 B12R1.124 CN1CCSCC1C(N)C(=O)O Amb18819108 [0,1,0,1,0,0|2,0,0]=4 5078 B12R1.124 C\C(C(=O)O)=C1\CCCCC1C Amb27599516 [0,1,0,1,0,0|0,0,2]=4 5079 B12R1.124 NC(=O)C(N)C1CCCCC1O Amb33309185 [0,1,0,1,0,0|2,0,0]=4 5080 B12R1.124 NC(C(=O)O)C1CCCCC1=O Amb28121115 [0,1,0,1,0,0|1,0,1]=4 5081 B12R1.124 NC(C(=O)O)C1CCCCC1O Amb26951441 [0,1,0,1,0,0|1,0,0]=3 5082 B12R1.124 N[C@@H](C(=O)O)C1CCCCC1O Amb27650561 [0,1,0,1,0,0|1,0,0]=3 5083 B12R1.124 N[C@@H](C(=O)O)[C@@H]1CCCC[C@H]1O Amb27233591 [0,1,0,1,0,0|1,0,0]=3 5084 B12R1.124 N[C@@H](C(=O)O)[C@H]1CCCCC1=O Amb28291534 [0,1,0,1,0,0|1,0,1]=4 5085 B12R1.124 N[C@H](C(=O)O)C1CCCCC1O Amb26405888 [0,1,0,1,0,0|1,0,0]=3 5086 B12R1.124 N[C@H](C(=O)O)[C@@H]1CCCC[C@H]1O Amb27657632 [0,1,0,1,0,0|1,0,0]=3 5087 B12R1.124 N[C@H](C(=O)O)[C@H]1CCCC[C@@H]1O Amb28384492 [0,1,0,1,0,0|1,0,0]=3 5088 B12R1.145 C=C(CC1CCCN1C)C(=O)O Amb33320709 [0,1,0,1,0,0|1,0,1]=4 5089 B12R1.145 C=C(CN1CCCC1C)C(=O)O Amb27475431 [0,1,0,1,0,0|1,0,1]=4 5090 B12R1.145 CC(CC1CCCN1C)C(=O)O Amb33322233 [0,1,0,1,0,0|1,0,0]=3 5091 B12R1.145 CC(CC1CCOC1C)C(=O)O Amb33427699 [0,1,0,1,0,0|1,0,0]=3 5092 B12R1.145 CC(NC1COCC1C)C(=O)O Amb29878777 [0,1,0,1,0,0|2,0,0]=4 5093 B12R1.145 CC(NC1CSCC1C)C(=O)O Amb27868220 [0,1,0,1,0,0|2,0,0]=4 5094 B12R1.145 CC(SC1CCCC1O)C(=O)O Amb19061030 [0,1,0,1,0,0|2,0,0]=4 5095 B12R1.145 CC(SC1CCOC1C)C(=O)O Amb27211327 [0,1,0,1,0,0|2,0,0]=4 5096 B12R1.145 CC1CCCC1N[C@@H](C)C(=O)O Amb28145321 [0,1,0,1,0,0|1,0,0]=3 5097 B12R1.145 CC1COCC1N[C@@H](C)C(=O)O Amb29878776 [0,1,0,1,0,0|2,0,0]=4 5098 B12R1.145 CC1COCC1N[C@H](C)C(=O)O Amb29878775 [0,1,0,1,0,0|2,0,0]=4 5099 B12R1.145 CC1OCCC1CC(=O)C(=O)O Amb33427687 [0,1,0,1,0,0|1,0,1]=4 5100 B12R1.145 CC1OCCC1CC(N)C(=O)O Amb33427950 [0,1,0,1,0,0|1,0,0]=3 5101 B12R1.145 CC1OCCC1CC(O)C(=O)O Amb33427675 [0,1,0,1,0,0|1,0,0]=3 5102 B12R1.145 CC1OCCC1SC(F)C(=O)O Amb27752476 [0,1,0,1,0,0|2,0,0]=4 5103 B12R1.145 CN1CCCC1CC(=O)C(=O)O Amb33321407 [0,1,0,1,0,0|1,0,1]=4 5104 B12R1.145 CN1CCCC1CC(N)C(=O)O Amb25943956 [0,1,0,1,0,0|1,0,0]=3 5105 B12R1.145 CN1CCCC1CC(N)C(N)=O Amb26573699 [0,1,0,1,0,0|2,0,0]=4 5106 B12R1.145 CN1CCCC1CC(O)C(=O)O Amb33321406 [0,1,0,1,0,0|1,0,0]=3 5107 B12R1.145 CN1CCCC1C[C@@H](N)C(=O)O Amb24571359 [0,1,0,1,0,0|1,0,0]=3 5108 B12R1.145 CN1CCCC1C[C@H](N)C(=O)O Amb27266253 [0,1,0,1,0,0|1,0,0]=3 5109 B12R1.145 N[C@@H](CC1CCCC1=O)C(=O)O Amb27484073 [0,1,0,1,0,0|1,0,1]=4 5110 B12R1.264 C=C(CCC1CCCC1)C(=O)O Amb33374531 [0,1,0,1,0,0|0,0,1]=3 5111 B12R1.264 C=C(CCN1CCCC1)C(=O)O Amb33275174 [0,1,0,1,0,0|1,0,1]=4 5112 B12R1.264 CC(CCC1CCCC1)C(=O)O Amb33359509 [0,1,0,1,0,0|0,0,0]=2 5113 B12R1.264 CC(CCC1CCCO1)C(=O)O Amb33359077 [0,1,0,1,0,0|1,0,0]=3 5114 B12R1.264 CC(CCC1CCCS1)C(=O)O Amb33416797 [0,1,0,1,0,0|1,0,0]=3 5115 B12R1.264 CC(CCC1CCOC1)C(=O)O Amb33422764 [0,1,0,1,0,0|1,0,0]=3 5116 B12R1.264 CC(CCC1CCSC1)C(=O)O Amb33225845 [0,1,0,1,0,0|1,0,0]=3 5117 B12R1.264 CC(CCN1CCCC1)C(=O)O Amb32685799 [0,1,0,1,0,0|1,0,0]=3 5118 B12R1.264 CC(CNC1CCCC1)C(=O)O Amb9400308 [0,1,0,1,0,0|1,0,0]=3 5119 B12R1.264 CC(CNC1CCCC1)C(N)=O Amb8944561 [0,1,0,1,0,0|2,0,0]=4 5120 B12R1.264 CC(O)C(C)CCC1CCCC1 Amb32944295 [0,1,0,1,0,0|1,0,1]=4 5121 B12R1.264 CC(OCC1CCCO1)C(=O)O Amb9719323 [0,1,0,1,0,0|2,0,0]=4 5122 B12R1.264 CC(SCC1CCCO1)C(=O)O Amb9718797 [0,1,0,1,0,0|2,0,0]=4 5123 B12R1.264 C[C@@H](CCC1CCCC1)C(=O)O Amb33744918 [0,1,0,1,0,0|0,0,0]=2 5124 B12R1.264 C[C@H](CCC1CCCC1)C(=O)O Amb33738125 [0,1,0,1,0,0|0,0,0]=2 5125 B12R1.264 C\C(=C/CC1CCCC1)C(=O)O Amb27866687 [0,1,0,1,0,0|0,0,2]=4 5126 B12R1.264 NC(=O)C(N)CCC1CCCC1 Amb33308940 [0,1,0,1,0,0|1,0,0]=3 5127 B12R1.264 NC(=O)C(N)CCC1CCCO1 Amb33065507 [0,1,0,1,0,0|2,0,0]=4 5128 B12R1.264 NC(=O)C(N)CCC1CCOC1 Amb33065446 [0,1,0,1,0,0|2,0,0]=4 5129 B12R1.264 NC(=O)C(N)CCN1CCCC1 Amb18316155 [0,1,0,1,0,0|2,0,0]=4 5130 B12R1.264 NC(=O)C(N)COC1CCCC1 Amb18789721 [0,1,0,1,0,0|2,0,0]=4 5131 B12R1.264 NC(CCC1CCCC1)C(=O)O Amb23598234 [0,1,0,1,0,0|0,0,0]=2 5132 B12R1.264 NC(CCC1CCCO1)C(=O)O Amb33249594 [0,1,0,1,0,0|1,0,0]=3 5133 B12R1.264 NC(CCC1CCOC1)C(=O)O Amb33066200 [0,1,0,1,0,0|1,0,0]=3 5134 B12R1.264 NC(CCC1OCCO1)C(=O)O Amb27451005 [0,1,0,1,0,0|2,0,0]=4 5135 B12R1.264 NC(CCN1CCCC1)C(=O)O Amb19036758 [0,1,0,1,0,0|1,0,0]=3 5136 B12R1.264 NC(COC1CCCC1)C(=O)O Amb18789984 [0,1,0,1,0,0|1,0,0]=3 5137 B12R1.264 NC(COC1CCOC1)C(=O)O Amb33036537 [0,1,0,1,0,0|2,0,0]=4 5138 B12R1.264 N[C@@H](CCC1CCCC1)C(=O)O Amb33308916 [0,1,0,1,0,0|0,0,0]=2 5139 B12R1.264 N[C@@H](CCC1CCCO1)C(=O)O Amb33309238 [0,1,0,1,0,0|1,0,0]=3 5140 B12R1.264 N[C@@H](CCC1CCOC1)C(=O)O Amb33035305 [0,1,0,1,0,0|1,0,0]=3 5141 B12R1.264 N[C@@H](CCN1CCCC1)C(=O)O Amb32787856 [0,1,0,1,0,0|1,0,0]=3 5142 B12R1.264 N[C@@H](COC1CCCC1)C(=O)O Amb33308576 [0,1,0,1,0,0|1,0,0]=3 5143 B12R1.264 N[C@@H](COC1CCCC1)C(=O)O Amb33743688 [0,1,0,1,0,0|1,0,0]=3 5144 B12R1.264 N[C@@H](COC1CCOC1)C(=O)O Amb33065609 [0,1,0,1,0,0|2,0,0]=4 5145 B12R1.264 N[C@H](CCC1CCCC1)C(=O)O Amb33309122 [0,1,0,1,0,0|0,0,0]=2 5146 B12R1.264 N[C@H](CCC1CCCO1)C(=O)O Amb33035296 [0,1,0,1,0,0|1,0,0]=3 5147 B12R1.264 N[C@H](CCC1CCOC1)C(=O)O Amb33036694 [0,1,0,1,0,0|1,0,0]=3 5148 B12R1.264 N[C@H](CCN1CCCC1)C(=O)O Amb32698148 [0,1,0,1,0,0|1,0,0]=3 5149 B12R1.264 N[C@H](COC1CCCC1)C(=O)O Amb33309230 [0,1,0,1,0,0|1,0,0]=3 5150 B12R1.264 N[C@H](COC1CCOC1)C(=O)O Amb33065699 [0,1,0,1,0,0|2,0,0]=4 5151 B12R1.264 O=C(O)C(=O)CCC1CCCC1 Amb33378682 [0,1,0,1,0,0|0,0,1]=3 5152 B12R1.264 O=C(O)C(=O)CCN1CCCC1 Amb33448118 [0,1,0,1,0,0|1,0,1]=4 5153 B12R1.264 O=C(O)C(O)CCC1CCCC1 Amb33448612 [0,1,0,1,0,0|0,0,0]=2 5154 B12R1.264 O=C(O)C(O)CCN1CCCC1 Amb33474949 [0,1,0,1,0,0|1,0,0]=3 5155 B12R1.279 CCCC1CC(C(=O)O)CCO1 Amb539060 [0,1,0,1,0,0|1,0,0]=3 5156 B12R1.279 CCCC1CCCC(C(=O)O)O1 Amb27805706 [0,1,0,1,0,0|0,0,0]=2 5157 B12R1.279 CCCC1CCNC(C(=O)O)O1 Amb33193999 [0,1,0,1,0,0|1,0,0]=3 5158 B12R1.279 CCCC1CCOC(C(=O)O)N1 Amb33193669 [0,1,0,1,0,0|1,0,0]=3 5159 B12R1.279 CCCC1CSCC(C(=O)O)N1 Amb27167439 [0,1,0,1,0,0|1,0,0]=3 5160 B12R1.279 CCCC1NC(C(=O)O)CCS1 Amb18969825 [0,1,0,1,0,0|1,0,0]=3 5161 B12R1.279 CCCN1CCCC(C(=O)O)C1 Amb2372122 [0,1,0,1,0,0|1,0,0]=3 5162 B12R1.279 CCCN1CCCC(C(=O)O)C1 Amb32758735 [0,1,0,1,0,0|1,0,0]=3 5163 B12R1.279 CCCN1CCSC(C(=O)O)C1 Amb29891950 [0,1,0,1,0,0|2,0,0]=4 5164 B12R1.279 CCOC1CCCC(C(=O)O)C1 Amb27421514 [0,1,0,1,0,0|1,0,0]=3 5165 B12R1.279 COCC1CCOC(C(=O)O)N1 Amb33194355 [0,1,0,1,0,0|2,0,0]=4 5166 B12R1.279 COCN1CCCC(C(=O)O)C1 Amb27603524 [0,1,0,1,0,0|2,0,0]=4 5167 B12R1.279 NCCC1CCCC(C(N)=O)C1 Amb4304388 [0,1,0,1,0,0|2,0,0]=4 5168 B12R1.279 O=C(O)C1CCCN(CCO)C1 Amb9238855 [0,1,0,1,0,0|2,0,0]=4 5169 B12R1.337 C#CCCC1CCC(C(=O)O)N1 Amb27808991 [0,1,0,1,0,0|0,0,2]=4 5170 B12R1.337 CCCCC1NC(C(=O)O)CS1 Amb2719321 [0,1,0,1,0,0|1,0,0]=3 5171 B12R1.337 CCCCN1CCC(C(=O)O)C1 Amb19036403 [0,1,0,1,0,0|1,0,0]=3 5172 B12R1.337 COCCN1CCC(C(=O)O)C1 Amb10607745 [0,1,0,1,0,0|2,0,0]=4 5173 B12R1.337 COCCN1CCC(C(=O)O)C1 Amb22586979 [0,1,0,1,0,0|2,0,0]=4 5174 B12R1.337 CSCCC1NC(C(=O)O)CS1 Amb19003936 [0,1,0,1,0,0|2,0,0]=4 5175 B12R1.385 COCCC1CCC(C)C(=O)C1 Amb28122462 [0,1,0,1,0,0|2,0,0]=4 5176 B12R1.457 CCC\C=C\C1CC(Cl)C(=O)O1 Amb27964526 [0,1,0,1,0,0|0,0,2]=4 5177 B12R1.457 CCC\C=C\[C@@H]1C[C@@H](O)C(=O)O1 Amb28455684 [0,1,0,1,0,0|0,0,2]=4 5178 B12R1.626 CCC1CCCCC(C(=O)O)N1 Amb27206644 [0,1,0,1,0,0|0,0,0]=2 5179 B12R1.626 CC[C@@H]1CCCC[C@@H](C(=O)O)N1 Amb27197940 [0,1,0,1,0,0|0,0,0]=2 5180 B12R1.626 CC[C@H]1CCCC[C@@H](C(=O)O)N1 Amb27969148 [0,1,0,1,0,0|0,0,0]=2 5181 B12R1.661 CCC1CCCCC1(Br)[N+](=O)[O-] Amb33299001 [0,1,0,1,0,0|1,0,1]=4 5182 B12R1.661 CCC1CCCCC1(N)C(N)=O Amb27814003 [0,1,0,1,0,0|1,0,0]=3 5183 B12R1.661 CCC1CCCCC1(O)C(N)=O Amb27212329 [0,1,0,1,0,0|1,0,0]=3 5184 B12R1.661 CCC1CNCCC1(N)C(=O)O Amb28351736 [0,1,0,1,0,0|1,0,0]=3 5185 B12R1.661 CCC1CNCCC1(O)C(=O)O Amb28422251 [0,1,0,1,0,0|1,0,0]=3 5186 B12R1.661 COC1CCCCC1(C)C(=O)O Amb28127179 [0,1,0,1,0,0|1,0,0]=3 5187 B12R1.661 COC1CCCCC1(N)C(N)=O Amb27488405 [0,1,0,1,0,0|2,0,0]=4 5188 B12R1.661 COC1COCCC1(O)C(=O)O Amb27250283 [0,1,0,1,0,0|2,0,0]=4 5189 B12R1.661 CO[C@@H]1CCCC[C@]1(N)C(N)=O Amb27435453 [0,1,0,1,0,0|2,0,0]=4 5190 B12R1.1028 C[C@@H]1CCCCCC(=O)C(=O)C1 Amb28202301 [0,1,0,1,0,0|1,0,1]=4 5191 B12R1.1035 C=C(C)C1(O)CCCCCC1C Amb35721270 [0,1,0,1,0,0|2,0,0]=4 5192 B12R1.1035 CC1CCCCCC1(N)C(=O)O Amb35681268 [0,1,0,1,0,0|0,0,0]=2 5193 B12R1.1035 CC1CCCCCC1(N)C(N)=O Amb29865027 [0,1,0,1,0,0|1,0,0]=3 5194 B12R1.1035 CC1CCCCCC1(O)C(=O)O Amb29865277 [0,1,0,1,0,0|0,0,0]=2 5195 B12R1.1035 CC1CCCCCC1(O)C(N)=O Amb29865262 [0,1,0,1,0,0|1,0,0]=3 5196 B12R1.1035 CN1CCCCCC1(C)C(=O)O Amb28423380 [0,1,0,1,0,0|1,0,0]=3 5197 B12R1.1035 NC1(C(=O)O)CCCCCC1O Amb27793425 [0,1,0,1,0,0|1,0,0]=3 5198 B12R1.1035 N[C@]1(C(=O)O)CCCCC[C@@H]1O Amb27637722 [0,1,0,1,0,0|1,0,0]=3 5199 B12R1.1035 N[C@]1(C(=O)O)CCCCC[C@H]1O Amb27791761 [0,1,0,1,0,0|1,0,0]=3 5200 B12R1.1335 CC(=N)N1CCCCCCCC1 Amb27607308 [0,1,0,1,0,0|2,0,0]=4 5201 B12R1.1335 CC(=O)N1CCCCCCCC1 Amb25169087 [0,1,0,1,0,0|1,0,0]=3 5202 B12R1.1335 NC(=S)N1CCCCCCCC1 Amb28282880 [0,1,0,1,0,0|1,1,0]=4 5203 B12R1.1335 O=C(Cl)N1CCCCCCCC1 Amb27802970 [0,1,0,1,0,0|1,0,0]=3 5204 B12R1.1335 O=C(O)C1=CCCCCCCC1 Amb28325718 [0,1,0,1,0,0|0,0,1]=3 5205 B12R1.1335 O=C(O)C1CCCCCCCN1 Amb27171757 [0,1,0,1,0,0|0,0,0]=2 5206 B12R1.1385 CC(=O)C1(C)CCCCCCC1 Amb28199847 [0,1,0,1,0,0|1,0,0]=3 5207 B12R1.1385 CC1(C(=O)O)CCCCCCC1 Amb28118951 [0,1,0,1,0,0|0,0,0]=2 5208 B12R1.1385 NC(=S)C1(N)CCCCCCC1 Amb27448066 [0,1,0,1,0,0|1,1,0]=4 5209 B12R1.1385 NC1(C(=O)O)CCCCCCC1 Amb2694926 [0,1,0,1,0,0|0,0,0]=2 5210 B12R1.1385 O=C(Cl)C1(Cl)CCCCCCC1 Amb33127989 [0,1,0,1,0,0|1,0,0]=3 5211 B12R1.1385 O=C(O)C1(Cl)CCCCCCC1 Amb32716557 [0,1,0,1,0,0|0,0,0]=2 5212 B12R1.1385 O=C(O)C1(F)C#CCCCCC1 Amb26539508 [0,1,0,1,0,0|0,0,2]=4 5213 B12R1.1385 O=[N+]([O-])C1(Br)CCCCCCC1 Amb33298984 [0,1,0,1,0,0|1,0,1]=4 5214 B12R1.1396 NC(=O)C(N)CCCC1CCC1 Amb33127506 [0,1,0,1,0,0|1,0,0]=3 5215 B12R1.1396 NC(=O)C(N)CCOC1CCC1 Amb18789748 [0,1,0,1,0,0|2,0,0]=4 5216 B12R1.1396 NC(CCCC1CCC1)C(=O)O Amb33065574 [0,1,0,1,0,0|0,0,0]=2 5217 B12R1.1396 NC(CCOC1CCC1)C(=O)O Amb18790003 [0,1,0,1,0,0|1,0,0]=3 5218 B12R1.1396 N[C@@H](CCCC1CCC1)C(=O)O Amb32789403 [0,1,0,1,0,0|0,0,0]=2 5219 B12R1.1396 N[C@@H](CCOC1CCC1)C(=O)O Amb33065908 [0,1,0,1,0,0|1,0,0]=3 5220 B12R1.1396 N[C@H](CCCC1CCC1)C(=O)O Amb33309112 [0,1,0,1,0,0|0,0,0]=2 5221 B12R1.1396 N[C@H](CCOC1CCC1)C(=O)O Amb33065755 [0,1,0,1,0,0|1,0,0]=3 5222 B12R1.1397 NC(=O)C(N)CCOCC1CC1 Amb18789746 [0,1,0,1,0,0|2,0,0]=4 5223 B12R1.1397 NC(CCOCC1CC1)C(=O)O Amb18790001 [0,1,0,1,0,0|1,0,0]=3 5224 B12R1.1397 N[C@@H](CCOCC1CC1)C(=O)O Amb33309120 [0,1,0,1,0,0|1,0,0]=3 5225 B12R1.1397 N[C@H](CCOCC1CC1)C(=O)O Amb33066001 [0,1,0,1,0,0|1,0,0]=3 5226 B12R1.1416 CCCCNC1CC(C(=O)O)C1 Amb33070089 [0,1,0,1,0,0|1,0,0]=3 5227 B12R1.1416 CCCCOC1CC(C(=O)O)C1 Amb23449185 [0,1,0,1,0,0|1,0,0]=3 5228 B12R1.1416 COCCNC1CC(C(=O)O)C1 Amb33070083 [0,1,0,1,0,0|2,0,0]=4 5229 B12R1.1416 COCCOC1CC(C(=O)O)C1 Amb23449179 [0,1,0,1,0,0|2,0,0]=4 5230 B12R1.1445 CCC[C@H]1CCC[C@H](N)C(=O)N1 Amb27419860 [0,1,0,1,0,0|1,0,0]=3 5231 B12R1.1500 CCCC1CNCC1(F)C(=O)O Amb29859849 [0,1,0,1,0,0|1,0,0]=3 5232 B12R1.1500 CCCC1COCC1(N)C(=O)O Amb35616341 [0,1,0,1,0,0|1,0,0]=3 5233 B12R1.1500 CCCC1COCC1(N)C(N)=O Amb35639249 [0,1,0,1,0,0|2,0,0]=4 5234 B12R1.1500 CCCC1COCC1(O)C(=O)O Amb35632030 [0,1,0,1,0,0|1,0,0]=3 5235 B12R1.1500 CCCC1COCC1(O)C(N)=O Amb35632029 [0,1,0,1,0,0|2,0,0]=4 5236 B12R1.1500 NC(=O)C1(N)CCCC1CCO Amb29867580 [0,1,0,1,0,0|2,0,0]=4 5237 B12R1.1500 NC1(C(=O)O)CCCC1CCO Amb29867581 [0,1,0,1,0,0|1,0,0]=3 5238 B12R1.2197 C=C(C(=O)O)C1CCCCCC1 Amb33267274 [0,1,0,1,0,0|0,0,1]=3 5239 B12R1.2197 C=C(C)C(N)C1CCCCCC1 Amb27950832 [0,1,0,1,0,0|2,0,0]=4 5240 B12R1.2197 C=C(C)C(O)C1CCCCCC1 Amb27758885 [0,1,0,1,0,0|2,0,0]=4 5241 B12R1.2197 CC(=O)C(C)C1CCCCCC1 Amb27771010 [0,1,0,1,0,0|1,0,0]=3 5242 B12R1.2197 CC(=O)N(C)C1CCCCCC1 Amb8326259 [0,1,0,1,0,0|2,0,0]=4 5243 B12R1.2197 CC(C(=O)O)=C1CCCCCC1 Amb27171923 [0,1,0,1,0,0|0,0,2]=4 5244 B12R1.2197 CC(C(=O)O)C1CCCCCC1 Amb17107142 [0,1,0,1,0,0|0,0,0]=2 5245 B12R1.2197 CC(C(=O)O)C1CCCCCN1 Amb18198526 [0,1,0,1,0,0|1,0,0]=3 5246 B12R1.2197 CC(C(=O)O)C1CCCOCC1 Amb27973292 [0,1,0,1,0,0|1,0,0]=3 5247 B12R1.2197 CC(C(=O)O)C1CCCSCC1 Amb35691481 [0,1,0,1,0,0|1,0,0]=3 5248 B12R1.2197 CC(C(=O)O)C1COCCOC1 Amb28127872 [0,1,0,1,0,0|2,0,0]=4 5249 B12R1.2197 CC(C(=O)O)N1CCCCCC1 Amb33551921 [0,1,0,1,0,0|1,0,0]=3 5250 B12R1.2197 CC(C(=O)O)N1CCCCCC1 Amb4011048 [0,1,0,1,0,0|1,0,0]=3 5251 B12R1.2197 CC(C(=O)O)N1CCCNCC1 Amb17479019 [0,1,0,1,0,0|2,0,0]=4 5252 B12R1.2197 CC(C(=O)O)N1CCCSCC1 Amb18955443 [0,1,0,1,0,0|2,0,0]=4 5253 B12R1.2197 CC(O)C(C)C1CCCCCC1 Amb28248522 [0,1,0,1,0,0|1,0,1]=4 5254 B12R1.2197 CC(O)C(O)C1CCCCCC1 Amb27756574 [0,1,0,1,0,0|1,0,1]=4 5255 B12R1.2197 C[C@@H](C(=O)O)C1CCCCCC1 Amb33729548 [0,1,0,1,0,0|0,0,0]=2 5256 B12R1.2197 C[C@@H](C(=O)O)C1CCCOCC1 Amb33729189 [0,1,0,1,0,0|1,0,0]=3 5257 B12R1.2197 C[C@H](C(=O)O)C1CCCCCC1 Amb33747704 [0,1,0,1,0,0|0,0,0]=2 5258 B12R1.2197 C[C@H](C(=O)O)C1CCCOCC1 Amb33728387 [0,1,0,1,0,0|1,0,0]=3 5259 B12R1.2197 NC(=O)C(Cl)C1CCCCCC1 Amb28042780 [0,1,0,1,0,0|1,0,0]=3 5260 B12R1.2197 NC(=O)C(N)C1CCCCCC1 Amb27493019 [0,1,0,1,0,0|1,0,0]=3 5261 B12R1.2197 NC(=O)C(O)C1CCCCCC1 Amb27963400 [0,1,0,1,0,0|1,0,0]=3 5262 B12R1.2197 NC(C(=O)O)C1CCCCCC1 Amb22233741 [0,1,0,1,0,0|0,0,0]=2 5263 B12R1.2197 NC(C(=O)O)C1CCCCCC1 Amb22490983 [0,1,0,1,0,0|0,0,0]=2 5264 B12R1.2197 NC(C(=O)O)C1CCCOCC1 Amb29892109 [0,1,0,1,0,0|1,0,0]=3 5265 B12R1.2197 NC(C(=O)O)C1CCCSCC1 Amb35663286 [0,1,0,1,0,0|1,0,0]=3 5266 B12R1.2197 NC(C(=O)O)C1COCCOC1 Amb29892392 [0,1,0,1,0,0|2,0,0]=4 5267 B12R1.2197 N[C@@H](C(=O)O)C1CCCCCC1 Amb24669969 [0,1,0,1,0,0|0,0,0]=2 5268 B12R1.2197 N[C@H](C(=O)O)C1CCCCCC1 Amb20241945 [0,1,0,1,0,0|0,0,0]=2 5269 B12R1.2197 O=C(O)C(=O)C1CCCCCC1 Amb26371674 [0,1,0,1,0,0|0,0,1]=3 5270 B12R1.2197 O=C(O)C(=O)N1CCCCCC1 Amb2693952 [0,1,0,1,0,0|1,0,1]=4 5271 B12R1.2197 O=C(O)C(F)C1CCCCCC1 Amb25898911 [0,1,0,1,0,0|0,0,0]=2 5272 B12R1.2197 O=C(O)C(F)C1CCCSCC1 Amb35691484 [0,1,0,1,0,0|1,0,0]=3 5273 B12R1.2197 O=C(O)C(F)C1COCCOC1 Amb28062236 [0,1,0,1,0,0|2,0,0]=4 5274 B12R1.2197 O=C(O)C(O)C1CCCCCC1 Amb26075154 [0,1,0,1,0,0|0,0,0]=2 5275 B12R1.2197 O=C(O)C(O)C1CCCSCC1 Amb35615822 [0,1,0,1,0,0|1,0,0]=3 5276 B12R1.46 CCC1CCC(=O)CC1C(=O)O Amb28068765 [0,1,0,1,0,0|0,0,1]=3 5277 B12R1.46 CCC1CCC(=O)CC1C(N)=O Amb32865508 [0,1,0,1,0,0|1,0,1]=4 5278 B12R1.46 CCC1CCC(C)NC1C(=O)O Amb33072388 [0,1,0,1,0,0|1,0,0]=3 5279 B12R1.46 CCC1CCC(N)CC1C(=O)O Amb32866426 [0,1,0,1,0,0|0,0,0]=2 5280 B12R1.46 CCC1CCC(O)CC1C(=O)O Amb32867808 [0,1,0,1,0,0|0,0,0]=2 5281 B12R1.46 CCC1CNC(=O)CC1C(=O)O Amb33070800 [0,1,0,1,0,0|1,0,1]=4 5282 B12R1.46 CCC1NCC(C)CC1C(=O)O Amb27218515 [0,1,0,1,0,0|1,0,0]=3 5283 B12R1.46 CCN1CCC(C)CC1C(N)=O Amb27650103 [0,1,0,1,0,0|2,0,0]=4 5284 B12R1.54 CC(=O)CCC(=O)C1CCCC1 Amb18799103 [0,1,0,1,0,0|1,0,1]=4 5285 B12R1.54 CC(=O)NCC(O)C1CCCC1 Amb27810072 [0,1,0,1,0,0|2,0,0]=4 5286 B12R1.54 CC(C#CC(=O)O)C1CCCC1 Amb33169063 [0,1,0,1,0,0|0,0,2]=4 5287 B12R1.54 CC(CCC(=O)O)N1CCCC1 Amb13949052 [0,1,0,1,0,0|1,0,0]=3 5288 B12R1.54 CC(CCC(=O)O)N1CCCC1 Amb2785204 [0,1,0,1,0,0|1,0,0]=3 5289 B12R1.54 CN(CCC(=O)O)C1CCCC1 Amb8873298 [0,1,0,1,0,0|1,0,0]=3 5290 B12R1.54 C\C(=C/CC(=O)O)C1CCCC1 Amb31161627 [0,1,0,1,0,0|0,0,2]=4 5291 B12R1.54 NC(=O)NCC(O)C1CCCC1 Amb27190649 [0,1,0,1,0,0|2,0,0]=4 5292 B12R1.54 NC(CCC(=O)O)C1CCCC1 Amb33429958 [0,1,0,1,0,0|0,0,0]=2 5293 B12R1.54 NC(CCC(=O)O)C1CCCO1 Amb33318767 [0,1,0,1,0,0|1,0,0]=3 5294 B12R1.54 NC(CCC(=O)O)C1CCCS1 Amb33416244 [0,1,0,1,0,0|1,0,0]=3 5295 B12R1.54 NC(CCC(=O)O)C1CCOC1 Amb33420782 [0,1,0,1,0,0|1,0,0]=3 5296 B12R1.54 NC(CCC(=O)O)C1CCSC1 Amb33141659 [0,1,0,1,0,0|1,0,0]=3 5297 B12R1.54 O=C(O)CCC(=O)C1CCCC1 Amb2699517 [0,1,0,1,0,0|0,0,1]=3 5298 B12R1.54 O=C(O)CCC(=O)C1CCNC1 Amb18198662 [0,1,0,1,0,0|1,0,1]=4 5299 B12R1.54 O=C(O)CCC(=O)C1CCSC1 Amb18820774 [0,1,0,1,0,0|1,0,1]=4 5300 B12R1.54 O=C(O)CCC(=O)N1CCCC1 Amb6360547 [0,1,0,1,0,0|1,0,1]=4 5301 B12R1.54 O=C(O)CNC(=O)C1CCCC1 Amb1116958 [0,1,0,1,0,0|1,0,1]=4 5302 B12R1.59 CCC1CCC(C#CC(=O)O)N1 Amb33169071 [0,1,0,1,0,0|0,0,2]=4 5303 B12R1.131 C=C(C)CCC1(N)CCCC1C Amb35657815 [0,1,0,1,0,0|2,0,0]=4 5304 B12R1.131 CC(O)CCC1(N)CCCC1C Amb35606503 [0,1,0,1,0,0|1,0,1]=4 5305 B12R1.131 CC1COCC1(O)CCC(=O)O Amb35632041 [0,1,0,1,0,0|1,0,0]=3 5306 B12R1.210 C=C(C)CC1CCCCCC1O Amb18805991 [0,1,0,1,0,0|2,0,0]=4 5307 B12R1.210 C=C(C)C[C@@H]1CCCCC[C@H]1O Amb32950057 [0,1,0,1,0,0|2,0,0]=4 5308 B12R1.210 C=C(Cl)CC1CCCCCC1O Amb33213689 [0,1,0,1,0,0|2,0,0]=4 5309 B12R1.210 C=C(Cl)C[C@@H]1CCCCC[C@H]1O Amb32945011 [0,1,0,1,0,0|2,0,0]=4 5310 B12R1.210 CC(=O)CC1CCCCCC1Cl Amb28047319 [0,1,0,1,0,0|1,0,0]=3 5311 B12R1.210 CC(=O)CC1CCCCCN1C Amb27458157 [0,1,0,1,0,0|1,0,0]=3 5312 B12R1.210 CC(=O)C[C@H]1CCCC=C[C@H]1C Amb27781987 [0,1,0,1,0,0|1,0,1]=4 5313 B12R1.210 CC(=O)C[C@H]1CCCCC[C@@H]1Cl Amb27844358 [0,1,0,1,0,0|1,0,0]=3 5314 B12R1.210 CC(=O)NC1CCCCCC1Br Amb28370391 [0,1,0,1,0,0|2,0,0]=4 5315 B12R1.210 CC(=O)NC1CCCCCC1C Amb27489458 [0,1,0,1,0,0|1,0,0]=3 5316 B12R1.210 CC(=O)NC1CCCCCC1N Amb27266098 [0,1,0,1,0,0|2,0,0]=4 5317 B12R1.210 CC(=O)\C=C1/CCCCCC1C Amb35734060 [0,1,0,1,0,0|1,0,1]=4 5318 B12R1.210 CC(O)CC1CCCCCN1C Amb27213956 [0,1,0,1,0,0|1,0,1]=4 5319 B12R1.210 CC1=C(CC(=O)O)CCCCC1 Amb27614696 [0,1,0,1,0,0|0,0,1]=3 5320 B12R1.210 CC1CCCCCC1CC(=O)O Amb29865063 [0,1,0,1,0,0|0,0,0]=2 5321 B12R1.210 CC1CCCCCC1NC(=O)Cl Amb35633242 [0,1,0,1,0,0|1,0,0]=3 5322 B12R1.210 CC1CCCCCN1CC(N)=S Amb27433559 [0,1,0,1,0,0|1,1,0]=4 5323 B12R1.210 CC1CCCCCN1C[C@H](C)O Amb28320579 [0,1,0,1,0,0|1,0,1]=4 5324 B12R1.210 CC1CCCCC\C1=C/C(=O)O Amb35721698 [0,1,0,1,0,0|0,0,1]=3 5325 B12R1.210 CC1CCOCCN1CC(N)=O Amb27649926 [0,1,0,1,0,0|2,0,0]=4 5326 B12R1.210 CC1COCCCN1CC(=O)O Amb27968934 [0,1,0,1,0,0|1,0,0]=3 5327 B12R1.210 CC1COCCCN1CC(N)=O Amb28382015 [0,1,0,1,0,0|2,0,0]=4 5328 B12R1.210 CC1NCCCCC1CC(=O)O Amb27792876 [0,1,0,1,0,0|0,0,0]=2 5329 B12R1.210 CN1CCCCCC1CC(=O)O Amb28250660 [0,1,0,1,0,0|0,0,0]=2 5330 B12R1.210 CS(=O)CC1CCCCCC1O Amb27978240 [0,1,0,1,0,0|2,0,0]=4 5331 B12R1.210 C[C@@H]1NCCCC[C@H]1CC(=O)O Amb18198536 [0,1,0,1,0,0|0,0,0]=2 5332 B12R1.210 C[C@H]1NCCCC[C@@H]1CC(=O)O Amb27420235 [0,1,0,1,0,0|0,0,0]=2 5333 B12R1.210 NC(=O)NC1CCCCCC1N Amb27249850 [0,1,0,1,0,0|2,0,0]=4 5334 B12R1.210 NC(=O)NC1CCCCCC1O Amb27770817 [0,1,0,1,0,0|2,0,0]=4 5335 B12R1.210 NC1CCCCCC1CC(=O)O Amb27178104 [0,1,0,1,0,0|0,0,0]=2 5336 B12R1.210 N[C@@H]1CCCCC[C@@H]1CC(=O)O Amb27816143 [0,1,0,1,0,0|0,0,0]=2 5337 B12R1.210 O=C(O)CC1CCCCCC1=O Amb18825694 [0,1,0,1,0,0|0,0,1]=3 5338 B12R1.210 O=C(O)CC1CCCCCC1O Amb18198284 [0,1,0,1,0,0|0,0,0]=2 5339 B12R1.210 O=C(O)CC1CCCCNC1=O Amb27161233 [0,1,0,1,0,0|1,0,1]=4 5340 B12R1.210 O=C(O)CC1CCNCCC1=O Amb24667785 [0,1,0,1,0,0|1,0,1]=4 5341 B12R1.210 O=C(O)CC1CCOCCC1F Amb27620258 [0,1,0,1,0,0|1,0,0]=3 5342 B12R1.210 O=C(O)CC1CCSCCC1F Amb28133029 [0,1,0,1,0,0|1,0,0]=3 5343 B12R1.210 O=C(O)CN1CCCCCC1=O Amb415920 [0,1,0,1,0,0|1,0,1]=4 5344 B12R1.210 O=C(O)C[C@@H]1CCCCOC1=O Amb27389145 [0,1,0,1,0,0|1,0,1]=4 5345 B12R1.276 C=C1C[C@H](NCC)[C@H](C(=O)O)C1 Amb27632439 [0,1,0,1,0,0|1,0,1]=4 5346 B12R1.276 CCCN1CC(=O)CC1C(=O)O Amb25851504 [0,1,0,1,0,0|1,0,1]=4 5347 B12R1.276 CCCN1C[C@H](F)C[C@H]1C(N)=O Amb27233981 [0,1,0,1,0,0|2,0,0]=4 5348 B12R1.276 CCCN1C[C@H](O)C[C@H]1C(=O)O Amb27238026 [0,1,0,1,0,0|1,0,0]=3 5349 B12R1.276 CCC[C@@H]1CC(=O)N[C@H]1C(=O)O Amb28384100 [0,1,0,1,0,0|1,0,1]=4 5350 B12R1.276 CCC[C@@H]1CC(=O)OC1C(=O)O Amb27233499 [0,1,0,1,0,0|1,0,1]=4 5351 B12R1.276 CCC[C@@H]1CN(C)C[C@H]1C(=O)O Amb32946188 [0,1,0,1,0,0|1,0,0]=3 5352 B12R1.276 CCOC1CN(C)CC1C(=O)O Amb29869690 [0,1,0,1,0,0|2,0,0]=4 5353 B12R1.276 O=C(O)C1CC(O)CN1CCO Amb27971600 [0,1,0,1,0,0|2,0,0]=4 5354 B12R1.374 CC1CCC(=O)CC1CCCN Amb32865380 [0,1,0,1,0,0|2,0,0]=4 5355 B12R1.374 CC1CCC(=O)CC1CCCO Amb32865379 [0,1,0,1,0,0|2,0,0]=4 5356 B12R1.374 CCCCC1=CC(=O)CCC1C Amb27486087 [0,1,0,1,0,0|1,0,1]=4 5357 B12R1.374 CCCCC1CC(=O)CCC1C Amb25735768 [0,1,0,1,0,0|1,0,0]=3 5358 B12R1.374 CCCOC1CC(=O)CCC1C Amb32867559 [0,1,0,1,0,0|2,0,0]=4 5359 B12R1.374 CCCSC1CC(=O)CCC1C Amb32867514 [0,1,0,1,0,0|2,0,0]=4 5360 B12R1.374 CCOCC1CC(=O)CCC1C Amb32865288 [0,1,0,1,0,0|2,0,0]=4 5361 B12R1.374 COCCC1CC(=O)CCC1C Amb32865392 [0,1,0,1,0,0|2,0,0]=4 5362 B12R1.552 O=C(O)CCC(=O)NCC1CC1 Amb9390804 [0,1,0,1,0,0|1,0,1]=4 5363 B12R1.620 CCC1CCC(C)N1CC(=O)O Amb28142663 [0,1,0,1,0,0|1,0,0]=3 5364 B12R1.1009 CC(=O)NC1C(C)CCCC1C Amb25704120 [0,1,0,1,0,0|2,0,0]=4 5365 B12R1.1009 CC(=O)NC1[C@H](C)CCC[C@H]1C Amb28247113 [0,1,0,1,0,0|2,0,0]=4 5366 B12R1.1009 CC(=O)N[C@H]1[C@@H](C)CCC[C@H]1C Amb27622130 [0,1,0,1,0,0|2,0,0]=4 5367 B12R1.1009 CC(=O)OC1C(C)CCCC1C Amb27954461 [0,1,0,1,0,0|2,0,0]=4 5368 B12R1.1009 CC1CCCC(C)N1CC(=O)Cl Amb17143066 [0,1,0,1,0,0|2,0,0]=4 5369 B12R1.1009 CC1CCCC(C)N1CC(=O)O Amb6356154 [0,1,0,1,0,0|1,0,0]=3 5370 B12R1.1009 CC1CCCC(C)N1CC(N)=O Amb17142915 [0,1,0,1,0,0|2,0,0]=4 5371 B12R1.1009 CC1CCCC(O)\C1=C/C(=O)O Amb28118936 [0,1,0,1,0,0|0,0,2]=4 5372 B12R1.1009 CC1CCCC(O)\C1=C\C(=O)O Amb27788509 [0,1,0,1,0,0|0,0,2]=4 5373 B12R1.1009 CC1CNCC(C)C1CC(=O)O Amb27872649 [0,1,0,1,0,0|1,0,0]=3 5374 B12R1.1009 CC1NCCN(C)C1CC(=O)O Amb18825349 [0,1,0,1,0,0|2,0,0]=4 5375 B12R1.1009 CN1CCCC(O)C1CC(=O)O Amb18197951 [0,1,0,1,0,0|1,0,0]=3 5376 B12R1.1009 C[C@H]1CCC[C@@H](C)N1CC(=O)O Amb8503432 [0,1,0,1,0,0|1,0,0]=3 5377 B12R1.1157 CCC[C@@H]1CC(=O)CC[C@H](C)C1 Amb28074675 [0,1,0,1,0,0|1,0,0]=3 5378 B12R1.1343 C=C(Br)CNC1CCCCCC1 Amb27478131 [0,1,0,1,0,0|2,0,0]=4 5379 B12R1.1343 C=C(Br)COC1CCCCCC1 Amb28206874 [0,1,0,1,0,0|2,0,0]=4 5380 B12R1.1343 C=C(C)CCN1CCCCCC1 Amb27955088 [0,1,0,1,0,0|2,0,0]=4 5381 B12R1.1343 C=C(Cl)CNC1CCCCCC1 Amb19077092 [0,1,0,1,0,0|2,0,0]=4 5382 B12R1.1343 CC(=N)NCC1CCCCCC1 Amb28193193 [0,1,0,1,0,0|2,0,0]=4 5383 B12R1.1343 CC(=O)CCC1CCCCCC1 Amb27468725 [0,1,0,1,0,0|1,0,0]=3 5384 B12R1.1343 CC(=O)CCN1CCCCCC1 Amb1136685 [0,1,0,1,0,0|1,0,0]=3 5385 B12R1.1343 CC(=O)CCN1CCCOCC1 Amb18806959 [0,1,0,1,0,0|2,0,0]=4 5386 B12R1.1343 CC(=O)NCC1CCCCCC1 Amb27208386 [0,1,0,1,0,0|1,0,0]=3 5387 B12R1.1343 CC(=O)NCC1CCCCCN1 Amb33038736 [0,1,0,1,0,0|2,0,0]=4 5388 B12R1.1343 CC(=O)NCC1CCCCNC1 Amb26605896 [0,1,0,1,0,0|2,0,0]=4 5389 B12R1.1343 CC(=O)NCC1CCCSCC1 Amb29883281 [0,1,0,1,0,0|2,0,0]=4 5390 B12R1.1343 CC(=O)\C=C\C1CCCCCC1 Amb27968526 [0,1,0,1,0,0|1,0,1]=4 5391 B12R1.1343 CC(O)CCC1CCCCCC1 Amb26370751 [0,1,0,1,0,0|1,0,1]=4 5392 B12R1.1343 CC(O)CCC1CCCCNC1 Amb27654832 [0,1,0,1,0,0|1,0,1]=4 5393 B12R1.1343 CC(O)CCC1CCCNCC1 Amb27842230 [0,1,0,1,0,0|1,0,1]=4 5394 B12R1.1343 CC(O)CNC1CCCCCC1 Amb9245998 [0,1,0,1,0,0|1,0,1]=4 5395 B12R1.1343 C[C@@H](O)CCC1CCCCCC1 Amb33267286 [0,1,0,1,0,0|1,0,1]=4 5396 B12R1.1343 C[C@@H](O)COC1CCCCCC1 Amb27451447 [0,1,0,1,0,0|1,0,1]=4 5397 B12R1.1343 C[C@H](O)CCC1CCCCCC1 Amb33267288 [0,1,0,1,0,0|1,0,1]=4 5398 B12R1.1343 C[C@H](O)COC1CCCCCC1 Amb28256210 [0,1,0,1,0,0|1,0,1]=4 5399 B12R1.1343 N=C(N)CCN1CCCCCC1 Amb6256920 [0,1,0,1,0,0|2,0,0]=4 5400 B12R1.1343 N=C(N)NCC1CCCCCC1 Amb27983875 [0,1,0,1,0,0|2,0,0]=4 5401 B12R1.1343 NC(=O)CCN1CCCCCC1 Amb17142920 [0,1,0,1,0,0|1,0,0]=3 5402 B12R1.1343 NC(=O)CNC1CCCCCC1 Amb1114001 [0,1,0,1,0,0|1,0,0]=3 5403 B12R1.1343 NC(=O)CNC1CCCSCC1 Amb29860743 [0,1,0,1,0,0|2,0,0]=4 5404 B12R1.1343 NC(=O)COC1CCCNCC1 Amb35723364 [0,1,0,1,0,0|2,0,0]=4 5405 B12R1.1343 NC(=O)CSC1CCCNCC1 Amb35672460 [0,1,0,1,0,0|2,0,0]=4 5406 B12R1.1343 NC(=O)NCC1CCCSCC1 Amb30030704 [0,1,0,1,0,0|2,0,0]=4 5407 B12R1.1343 NC(=O)OCC1CCCCNC1 Amb35647544 [0,1,0,1,0,0|2,0,0]=4 5408 B12R1.1343 NC(=S)CCN1CCCCCC1 Amb6266789 [0,1,0,1,0,0|1,1,0]=4 5409 B12R1.1343 NC(=S)COC1CCCCCC1 Amb19059515 [0,1,0,1,0,0|1,1,0]=4 5410 B12R1.1343 NC(=S)NCC1CCCCCC1 Amb28193224 [0,1,0,1,0,0|1,1,0]=4 5411 B12R1.1343 O=C(Cl)NCC1CCCCCC1 Amb35625593 [0,1,0,1,0,0|1,0,0]=3 5412 B12R1.1343 O=C(Cl)NCC1CCCSCC1 Amb35627018 [0,1,0,1,0,0|2,0,0]=4 5413 B12R1.1343 O=C(O)C#CC1CCCCCC1 Amb24556561 [0,1,0,1,0,0|0,0,1]=3 5414 B12R1.1343 O=C(O)C#CC1CCCCCN1 Amb33168987 [0,1,0,1,0,0|0,0,2]=4 5415 B12R1.1343 O=C(O)CCC1CCCCCC1 Amb18825578 [0,1,0,1,0,0|0,0,0]=2 5416 B12R1.1343 O=C(O)CCC1CCCCCN1 Amb18198528 [0,1,0,1,0,0|0,0,0]=2 5417 B12R1.1343 O=C(O)CCC1CCCNCC1 Amb18198557 [0,1,0,1,0,0|0,0,0]=2 5418 B12R1.1343 O=C(O)CCC1CCCOCC1 Amb18825358 [0,1,0,1,0,0|0,0,0]=2 5419 B12R1.1343 O=C(O)CCC1CCCSCC1 Amb18820668 [0,1,0,1,0,0|0,0,0]=2 5420 B12R1.1343 O=C(O)CCN1CCCCCC1 Amb2721891 [0,1,0,1,0,0|0,0,0]=2 5421 B12R1.1343 O=C(O)CCN1CCCCCC1 Amb33552757 [0,1,0,1,0,0|0,0,0]=2 5422 B12R1.1343 O=C(O)CCN1CCCNCC1 Amb2699587 [0,1,0,1,0,0|1,0,0]=3 5423 B12R1.1343 O=C(O)CCN1CCCSCC1 Amb18977928 [0,1,0,1,0,0|1,0,0]=3 5424 B12R1.1343 O=C(O)CCN1CSCCSC1 Amb28904253 [0,1,0,1,0,0|2,0,0]=4 5425 B12R1.1343 O=C(O)CNC1=NCCCCC1 Amb1083417 [0,1,0,1,0,0|1,0,1]=4 5426 B12R1.1343 O=C(O)CNC1CCCCCC1 Amb8428138 [0,1,0,1,0,0|0,0,0]=2 5427 B12R1.1343 O=C(O)CNC1CCCNCC1 Amb27449632 [0,1,0,1,0,0|1,0,0]=3 5428 B12R1.1343 O=C(O)CNC1CCCSCC1 Amb35700457 [0,1,0,1,0,0|1,0,0]=3 5429 B12R1.1343 O=C(O)COC1CCCCCC1 Amb18972071 [0,1,0,1,0,0|0,0,0]=2 5430 B12R1.1343 O=C(O)C\N=C1/CCCCCN1 Amb22081473 [0,1,0,1,0,0|1,0,1]=4 5431 B12R1.1343 O=C(O)\C=C\C1CCCCCC1 Amb24715822 [0,1,0,1,0,0|0,0,1]=3 5432 B12R1.1343 O=C(O)\C=C\N1CCCCCC1 Amb27272954 [0,1,0,1,0,0|0,0,2]=4 5433 B12R1.1343 O=[N+]([O-])CCC1CCCCCC1 Amb33268613 [0,1,0,1,0,0|1,0,1]=4 5434 B12R1.3110 C=C(C)CCC1(N)CCCCC1 Amb35649476 [0,1,0,1,0,0|2,0,0]=4 5435 B12R1.3110 CC(=O)CCC1(C)CCCCC1 Amb28381165 [0,1,0,1,0,0|1,0,0]=3 5436 B12R1.3110 CC(=O)CCC1(C)CCOCC1 Amb33415596 [0,1,0,1,0,0|2,0,0]=4 5437 B12R1.3110 CC(=O)CCC1(O)CCCCC1 Amb27495367 [0,1,0,1,0,0|1,0,0]=3 5438 B12R1.3110 CC(=O)NCC1(C)CCCCC1 Amb28056742 [0,1,0,1,0,0|2,0,0]=4 5439 B12R1.3110 CC(=O)NCC1(F)CCCCC1 Amb27661965 [0,1,0,1,0,0|2,0,0]=4 5440 B12R1.3110 CC(=O)NCC1(N)CCCCC1 Amb28990857 [0,1,0,1,0,0|2,0,0]=4 5441 B12R1.3110 CC(=O)OCC1(C)CCCCC1 Amb27867457 [0,1,0,1,0,0|2,0,0]=4 5442 B12R1.3110 CC(O)CCC1(C)CCCCC1 Amb27444395 [0,1,0,1,0,0|1,0,1]=4 5443 B12R1.3110 CC(O)CCC1(N)CCCCC1 Amb35643082 [0,1,0,1,0,0|1,0,1]=4 5444 B12R1.3110 CC1(CCC(=O)O)CCCCC1 Amb24365922 [0,1,0,1,0,0|0,0,0]=2 5445 B12R1.3110 CC1(CCC(=O)O)CCOCC1 Amb33416866 [0,1,0,1,0,0|1,0,0]=3 5446 B12R1.3110 CC1(CCC(=O)O)OCCCO1 Amb17334969 [0,1,0,1,0,0|2,0,0]=4 5447 B12R1.3110 CC1(CCC(=O)O)SCCCS1 Amb27592894 [0,1,0,1,0,0|2,0,0]=4 5448 B12R1.3110 CC1(CC[N+](=O)[O-])CCCCC1 Amb33226718 [0,1,0,1,0,0|1,0,1]=4 5449 B12R1.3110 CC1(CNC(=O)Cl)CCCCC1 Amb35633528 [0,1,0,1,0,0|2,0,0]=4 5450 B12R1.3110 CC1(NCC(=O)O)CCCOC1 Amb27477449 [0,1,0,1,0,0|2,0,0]=4 5451 B12R1.3110 CC1(NCC(=O)O)CCOCC1 Amb27207957 [0,1,0,1,0,0|2,0,0]=4 5452 B12R1.3110 CC1(OCC(=O)O)CCOCC1 Amb33042674 [0,1,0,1,0,0|2,0,0]=4 5453 B12R1.3110 CC1(\C=C\C(=O)O)CCCCC1 Amb33358910 [0,1,0,1,0,0|0,0,2]=4 5454 B12R1.3110 C[C@@H](O)CCC1(C)CCCCC1 Amb33417985 [0,1,0,1,0,0|1,0,1]=4 5455 B12R1.3110 C[C@H](O)CCC1(C)CCCCC1 Amb33417986 [0,1,0,1,0,0|1,0,1]=4 5456 B12R1.3110 NC(=O)NCC1(N)CCCCC1 Amb18952985 [0,1,0,1,0,0|2,0,0]=4 5457 B12R1.3110 NC1(CCC(=O)O)CCCCC1 Amb18198525 [0,1,0,1,0,0|0,0,0]=2 5458 B12R1.3110 NC1(CCC(=O)O)CCCCC1 Amb30584951 [0,1,0,1,0,0|0,0,0]=2 5459 B12R1.3110 NC1(CCC(=O)O)CCNCC1 Amb28201335 [0,1,0,1,0,0|1,0,0]=3 5460 B12R1.3110 NC1(CCC(=O)O)CCOCC1 Amb18825300 [0,1,0,1,0,0|1,0,0]=3 5461 B12R1.3110 NC1(CCC(=O)O)CCOCC1 Amb31157035 [0,1,0,1,0,0|1,0,0]=3 5462 B12R1.3110 O=C(O)C#CC1(O)CCCCC1 Amb1085906 [0,1,0,1,0,0|0,0,2]=4 5463 B12R1.21 C=C1CCN(CCC(=O)O)CC1 Amb28241800 [0,1,0,1,0,0|1,0,1]=4 5464 B12R1.21 CC(=O)CCC1CCC(C)CC1 Amb25262982 [0,1,0,1,0,0|1,0,0]=3 5465 B12R1.21 CC(=O)CCC1CCN(C)CC1 Amb33271359 [0,1,0,1,0,0|2,0,0]=4 5466 B12R1.21 CC(=O)CCN1CCC(C)CC1 Amb7755742 [0,1,0,1,0,0|2,0,0]=4 5467 B12R1.21 CC(=O)CCN1CCC(F)CC1 Amb29879500 [0,1,0,1,0,0|2,0,0]=4 5468 B12R1.21 CC(=O)CCN1CCC(N)CC1 Amb18984829 [0,1,0,1,0,0|2,0,0]=4 5469 B12R1.21 CC(=O)NCC1CCC(O)CC1 Amb27409703 [0,1,0,1,0,0|2,0,0]=4 5470 B12R1.21 CC(=O)OCC1CCC(C)CC1 Amb27640208 [0,1,0,1,0,0|2,0,0]=4 5471 B12R1.21 CC(=O)OCC1CCC(N)CC1 Amb27880617 [0,1,0,1,0,0|2,0,0]=4 5472 B12R1.21 CC(=O)SC[C@H]1CC[C@H](N)CC1 Amb32413279 [0,1,0,1,0,0|2,0,0]=4 5473 B12R1.21 CC(O)CCC1CCC(C)CC1 Amb25751204 [0,1,0,1,0,0|1,0,1]=4 5474 B12R1.21 CC1CCC(CCC(=O)O)CC1 Amb26075332 [0,1,0,1,0,0|0,0,0]=2 5475 B12R1.21 CC1CCC(CC[C@@H](C)O)CC1 Amb32732088 [0,1,0,1,0,0|1,0,1]=4 5476 B12R1.21 CC1CCC(CC[C@H](C)O)CC1 Amb32732239 [0,1,0,1,0,0|1,0,1]=4 5477 B12R1.21 CC1CCC(CC[N+](=O)[O-])CC1 Amb32732073 [0,1,0,1,0,0|1,0,1]=4 5478 B12R1.21 CC1CCC(CNC(=O)Cl)CC1 Amb35625853 [0,1,0,1,0,0|2,0,0]=4 5479 B12R1.21 CC1CCC(CNC(N)=O)CC1 Amb28325093 [0,1,0,1,0,0|2,0,0]=4 5480 B12R1.21 CC1CCC(NCC(=O)O)CN1 Amb27786731 [0,1,0,1,0,0|2,0,0]=4 5481 B12R1.21 CC1CCC(NCC(=O)O)CO1 Amb35728710 [0,1,0,1,0,0|2,0,0]=4 5482 B12R1.21 CC1CCC(NCC(=O)O)CS1 Amb35720931 [0,1,0,1,0,0|2,0,0]=4 5483 B12R1.21 CC1CCC(OCC(=O)O)CC1 Amb6261219 [0,1,0,1,0,0|1,0,0]=3 5484 B12R1.21 CC1CCC(OCC(=O)O)CS1 Amb27770611 [0,1,0,1,0,0|2,0,0]=4 5485 B12R1.21 CC1CCC(OCC(N)=O)CC1 Amb18802285 [0,1,0,1,0,0|2,0,0]=4 5486 B12R1.21 CC1CCC(\C=C\C(=O)O)CC1 Amb33225597 [0,1,0,1,0,0|0,0,2]=4 5487 B12R1.21 CC1CCN(CCC(=O)Cl)CC1 Amb17143074 [0,1,0,1,0,0|2,0,0]=4 5488 B12R1.21 CC1CCN(CCC(=O)O)CC1 Amb1098975 [0,1,0,1,0,0|1,0,0]=3 5489 B12R1.21 CC1CCN(CCC(=O)O)CC1 Amb5606224 [0,1,0,1,0,0|1,0,0]=3 5490 B12R1.21 CN1CCC(CCC(=O)O)CC1 Amb10607787 [0,1,0,1,0,0|1,0,0]=3 5491 B12R1.21 CN1CCC(CCC(=O)O)CC1 Amb13889038 [0,1,0,1,0,0|1,0,0]=3 5492 B12R1.21 CN1CCC(CCC(=O)O)CC1 Amb22587004 [0,1,0,1,0,0|1,0,0]=3 5493 B12R1.21 CN1CCC(NCC(=O)O)CC1 Amb22586792 [0,1,0,1,0,0|2,0,0]=4 5494 B12R1.21 CN1CCC(NCC(=O)O)CC1 Amb2721900 [0,1,0,1,0,0|2,0,0]=4 5495 B12R1.21 CN1CCC(OCC(=O)O)CC1 Amb13783514 [0,1,0,1,0,0|2,0,0]=4 5496 B12R1.21 CN1CCC(OCC(=O)O)CC1 Amb30584897 [0,1,0,1,0,0|2,0,0]=4 5497 B12R1.21 CN1CCC(SCC(=O)O)CC1 Amb30039035 [0,1,0,1,0,0|2,0,0]=4 5498 B12R1.21 CN1CCN(CCC(=O)O)CC1 Amb1099018 [0,1,0,1,0,0|2,0,0]=4 5499 B12R1.21 CN1CCN(CCC(=O)O)CC1 Amb3319044 [0,1,0,1,0,0|2,0,0]=4 5500 B12R1.21 CN1CCN(CCC(=O)O)CC1 Amb6307200 [0,1,0,1,0,0|2,0,0]=4 5501 B12R1.21 C[C@H]1CC[C@H](NCC(=O)O)CC1 Amb28369192 [0,1,0,1,0,0|1,0,0]=3 5502 B12R1.21 C[C@H]1CC[C@H](NCC(N)=O)CC1 Amb28140048 [0,1,0,1,0,0|2,0,0]=4 5503 B12R1.21 C[NH+]1CC[NH+](CCC(=O)O)CC1 Amb4250909 [0,1,0,1,0,0|2,0,0]=4 5504 B12R1.21 NC(=O)CCN1CCC(F)CC1 Amb27391707 [0,1,0,1,0,0|2,0,0]=4 5505 B12R1.21 NC(=O)CNC1CCC(N)CC1 Amb24116866 [0,1,0,1,0,0|2,0,0]=4 5506 B12R1.21 NC(=O)CSC1CCC(N)CC1 Amb27594858 [0,1,0,1,0,0|2,0,0]=4 5507 B12R1.21 NC1CCC(NCC(=O)O)CC1 Amb24116865 [0,1,0,1,0,0|1,0,0]=3 5508 B12R1.21 NC1CCC(OCC(=O)O)CC1 Amb25840871 [0,1,0,1,0,0|1,0,0]=3 5509 B12R1.21 NC1CCN(CCC(=O)O)CC1 Amb33164116 [0,1,0,1,0,0|1,0,0]=3 5510 B12R1.21 NC1CCN(CCC(=O)O)CC1 Amb9418986 [0,1,0,1,0,0|1,0,0]=3 5511 B12R1.21 N[C@H]1CC[C@H](CCC(=O)O)CC1 Amb27478082 [0,1,0,1,0,0|0,0,0]=2 5512 B12R1.21 N[C@H]1CC[C@H](OCC(=O)O)CC1 Amb25047681 [0,1,0,1,0,0|1,0,0]=3 5513 B12R1.21 O=C(O)CCC1CCC(=O)CC1 Amb23453163 [0,1,0,1,0,0|0,0,1]=3 5514 B12R1.21 O=C(O)CCC1CCC(=O)NC1 Amb16233457 [0,1,0,1,0,0|1,0,1]=4 5515 B12R1.21 O=C(O)CCN1CCC(F)CC1 Amb35592107 [0,1,0,1,0,0|1,0,0]=3 5516 B12R1.21 O=C(O)CCN1CCC(O)CC1 Amb33552422 [0,1,0,1,0,0|1,0,0]=3 5517 B12R1.21 O=C(O)CCN1CCC(O)CC1 Amb6656572 [0,1,0,1,0,0|1,0,0]=3 5518 B12R1.21 O=C(O)CCN1CCN(O)CC1 Amb27875403 [0,1,0,1,0,0|2,0,0]=4 5519 B12R1.21 O=C(O)CNC1CCC(O)CC1 Amb22225028 [0,1,0,1,0,0|1,0,0]=3 5520 B12R1.21 O=C(O)COC1CCC(=O)CC1 Amb26371567 [0,1,0,1,0,0|1,0,1]=4 5521 B12R1.21 O=C(O)COC1CCC(F)CC1 Amb27209104 [0,1,0,1,0,0|1,0,0]=3 5522 B12R1.50 CCC(C)CC1=CC(=O)CCC1 Amb27759127 [0,1,0,1,0,0|1,0,1]=4 5523 B12R1.50 CCC(N)CC1CCCC(O)C1 Amb35654243 [0,1,0,1,0,0|1,0,1]=4 5524 B12R1.50 CCC(O)CN1CCCC(=O)C1 Amb28048452 [0,1,0,1,0,0|2,0,0]=4 5525 B12R1.50 CCN(C)CC1CCCC(=O)C1 Amb30013873 [0,1,0,1,0,0|2,0,0]=4 5526 B12R1.50 CCS(=O)CC1CCCC(=O)C1 Amb30013483 [0,1,0,1,0,0|2,0,0]=4 5527 B12R1.154 CC1CCNCCC(=O)NCC1 Amb32674208 [0,1,0,1,0,0|2,0,0]=4 5528 B12R1.154 O=C1CCCC(O)CCCCO1 Amb27853898 [0,1,0,1,0,0|0,0,0]=2 5529 B12R1.154 O=C1CCOC(=O)CCCCN1 Amb28186602 [0,1,0,1,0,0|1,0,1]=4 5530 B12R1.154 OC1CCCCCC(O)CCC1 Amb27260254 [0,1,0,1,0,0|1,0,1]=4 5531 B12R1.224 CC(=O)OC1CCCC(C)C1C Amb27660600 [0,1,0,1,0,0|2,0,0]=4 5532 B12R1.224 CC(=O)OC1CCCC(O)C1C Amb27665428 [0,1,0,1,0,0|2,0,0]=4 5533 B12R1.224 CC1=C(CC(=O)O)CCCC1C Amb27392227 [0,1,0,1,0,0|0,0,2]=4 5534 B12R1.224 CC1C(CC(=O)O)NCCN1C Amb18198246 [0,1,0,1,0,0|2,0,0]=4 5535 B12R1.224 CC1CCCC(NC(=O)Cl)C1C Amb35637109 [0,1,0,1,0,0|2,0,0]=4 5536 B12R1.224 CC1CCCC(NC(N)=O)C1C Amb1105316 [0,1,0,1,0,0|2,0,0]=4 5537 B12R1.224 CC1CCCC(OC(=O)Cl)C1C Amb33297324 [0,1,0,1,0,0|2,0,0]=4 5538 B12R1.224 CC1CCC\C(=C/C(=O)O)C1C Amb27954478 [0,1,0,1,0,0|0,0,2]=4 5539 B12R1.224 CC1NCCN(CC(=O)O)C1C Amb27860754 [0,1,0,1,0,0|2,0,0]=4 5540 B12R1.224 CC1OCCN(CC(=O)O)C1C Amb28078647 [0,1,0,1,0,0|2,0,0]=4 5541 B12R1.224 NC1CCCC(CC(=O)O)C1O Amb27605801 [0,1,0,1,0,0|1,0,0]=3 5542 B12R1.257 NC(=O)CCCCOC1CNC1 Amb32941487 [0,1,0,1,0,0|2,0,0]=4 5543 B12R1.366 CCC(C)C1CCCCC1(C)O Amb32944279 [0,1,0,1,0,0|1,0,1]=4 5544 B12R1.366 CCC(C)[C@@H]1CCCC[C@@]1(C)O Amb32944638 [0,1,0,1,0,0|1,0,1]=4 5545 B12R1.366 CCC(N)C1CCCCC1(C)O Amb35665772 [0,1,0,1,0,0|1,0,1]=4 5546 B12R1.366 CCC(N)[C@@H]1CCCC[C@@]1(C)O Amb35665929 [0,1,0,1,0,0|1,0,1]=4 5547 B12R1.368 C=CC(O)C1CCCC1C(=O)O Amb28384999 [0,1,0,1,0,0|0,0,2]=4 5548 B12R1.368 CC(CO)N1CCC[C@@H]1C(=O)O Amb27640220 [0,1,0,1,0,0|2,0,0]=4 5549 B12R1.368 CCC(=O)N1CCCC1C(=O)O Amb9706298 [0,1,0,1,0,0|1,0,1]=4 5550 B12R1.368 CCC(=O)N1CCC[C@@H]1C(=O)O Amb18789438 [0,1,0,1,0,0|1,0,1]=4 5551 B12R1.368 CCC(=O)N1CCC[C@H]1C(=O)O Amb3999526 [0,1,0,1,0,0|1,0,1]=4 5552 B12R1.368 CCC(=O)[C@H]1CCC[C@H]1C(=O)O Amb28052142 [0,1,0,1,0,0|0,0,1]=3 5553 B12R1.368 CCC(C)C1CCNC1C(=O)O Amb27399080 [0,1,0,1,0,0|1,0,0]=3 5554 B12R1.368 CCC(C)C1CNCC1C(=O)O Amb28253047 [0,1,0,1,0,0|1,0,0]=3 5555 B12R1.368 CCC(C)N1CCCC1C(=O)O Amb9300938 [0,1,0,1,0,0|1,0,0]=3 5556 B12R1.368 CCS(=O)N1CCC[C@H]1C(=O)O Amb27613504 [0,1,0,1,0,0|2,0,0]=4 5557 B12R1.368 CNC(=O)C1CCCC1C(=O)O Amb27853307 [0,1,0,1,0,0|1,0,1]=4 5558 B12R1.368 CNC(=O)[C@@H]1CCC[C@@H]1C(=O)O Amb27951176 [0,1,0,1,0,0|1,0,1]=4 5559 B12R1.368 COC(=O)C1CCCC1C(=O)O Amb18647593 [0,1,0,1,0,0|1,0,1]=4 5560 B12R1.368 COC(=O)[C@@H]1CCC[C@@H]1C(=O)O Amb33524017 [0,1,0,1,0,0|1,0,1]=4 5561 B12R1.368 COC(=O)[C@@H]1CCC[C@H]1C(=O)O Amb6299715 [0,1,0,1,0,0|1,0,1]=4 5562 B12R1.368 COC(=O)[C@H]1CCC[C@@H]1C(=O)O Amb26397442 [0,1,0,1,0,0|1,0,1]=4 5563 B12R1.368 COC(C)C1CCNC1C(=O)O Amb27817707 [0,1,0,1,0,0|2,0,0]=4 5564 B12R1.368 C[C@@H](CO)[C@H]1CCCC1C(=O)O Amb27645418 [0,1,0,1,0,0|1,0,0]=3 5565 B12R1.534 CCC(N)CC1CCCS1(=O)=O Amb35673538 [0,1,0,1,0,0|1,0,1]=4 5566 B12R1.669 CC1(CCl)CCCCC1C(N)=O Amb28385634 [0,1,0,1,0,0|2,0,0]=4 5567 B12R1.669 CC1(CF)CCCCC1C(=O)O Amb27791269 [0,1,0,1,0,0|1,0,0]=3 5568 B12R1.669 CCC1(C)CCCCC1C(C)=O Amb27948589 [0,1,0,1,0,0|1,0,0]=3 5569 B12R1.669 N#CC1(O)CCCCC1C(=O)O Amb27471066 [0,1,0,1,0,0|1,0,1]=4 5570 B12R1.679 CCC1(C)CCCC1CC(=O)O Amb33494108 [0,1,0,1,0,0|0,0,0]=2 5571 B12R1.870 C=C(C)CCC1CCC(N)C1C Amb27859632 [0,1,0,1,0,0|2,0,0]=4 5572 B12R1.870 CC(=O)CCN1CCC(C)C1C Amb28126266 [0,1,0,1,0,0|2,0,0]=4 5573 B12R1.870 CC1C(Br)CCC1CCS(C)=O Amb28060346 [0,1,0,1,0,0|2,0,0]=4 5574 B12R1.870 CC1C(N)CCC1CCS(C)=O Amb27785319 [0,1,0,1,0,0|2,0,0]=4 5575 B12R1.870 CC1OCC(NCC(=O)O)C1C Amb35730806 [0,1,0,1,0,0|2,0,0]=4 5576 B12R1.870 CN1C(=O)CCC1CCC(=O)O Amb8010014 [0,1,0,1,0,0|1,0,1]=4 5577 B12R1.870 NC1CSC(CCC(=O)O)C1N Amb27411797 [0,1,0,1,0,0|2,0,0]=4 5578 B12R1.876 CN1C(=O)CCCCC1C(=O)O Amb23590304 [0,1,0,1,0,0|1,0,1]=4 5579 B12R1.876 N[C@H]1CCCC[C@H](C(=O)O)[C@@H]1O Amb27634835 [0,1,0,1,0,0|1,0,0]=3 5580 B12R1.1020 CC1CCCC(CC(=O)O)CC1 Amb25150903 [0,1,0,1,0,0|0,0,0]=2 5581 B12R1.1020 CC1CCCC(NC(=O)Cl)CC1 Amb35633331 [0,1,0,1,0,0|2,0,0]=4 5582 B12R1.1020 CC1CCCN(CC(N)=O)CC1 Amb27637564 [0,1,0,1,0,0|2,0,0]=4 5583 B12R1.1020 CC1CCC\C(=C\C(=O)O)CC1 Amb33468165 [0,1,0,1,0,0|0,0,2]=4 5584 B12R1.1020 CC1CCN(CC(=O)O)CCS1 Amb27434656 [0,1,0,1,0,0|2,0,0]=4 5585 B12R1.1020 CN1CCCC(CC(=O)O)CC1 Amb18198562 [0,1,0,1,0,0|1,0,0]=3 5586 B12R1.1020 CN1CCCC(CC(=O)O)CC1 Amb33483549 [0,1,0,1,0,0|1,0,0]=3 5587 B12R1.1020 CN1CCCN(CC(=O)O)CC1 Amb22586956 [0,1,0,1,0,0|2,0,0]=4 5588 B12R1.1020 CN1CCCN(CC(=O)O)CC1 Amb6653265 [0,1,0,1,0,0|2,0,0]=4 5589 B12R1.1020 NC(=O)CN1CCCC(O)CC1 Amb27953950 [0,1,0,1,0,0|2,0,0]=4 5590 B12R1.2352 CCC1(C)CCCCCC(=O)C1 Amb27177879 [0,1,0,1,0,0|1,0,0]=3 5591 B12R1.2352 CCC1(O)CCCCCC(O)C1 Amb28207363 [0,1,0,1,0,0|1,0,1]=4 5592 B12R1.2352 CC[C@@]1(C)CCCCCC(=O)C1 Amb27954062 [0,1,0,1,0,0|1,0,0]=3 5593 B12R1.29 CCCNC(=O)C1CCC(=O)O1 Amb27833343 [0,1,0,1,0,0|1,0,1]=4 5594 B12R1.57 CCC1CC(=O)CCC1C(=O)O Amb28127177 [0,1,0,1,0,0|0,0,1]=3 5595 B12R1.57 CCN1CC(=O)CCC1C(=O)O Amb26539907 [0,1,0,1,0,0|1,0,1]=4 5596 B12R1.65 CCC1CC(C)CN1CC(=O)O Amb28453870 [0,1,0,1,0,0|1,0,0]=3 5597 B12R1.65 CCC1CC(C)CN1CC(N)=O Amb28064830 [0,1,0,1,0,0|2,0,0]=4 5598 B12R1.65 CC[C@@H]1NC(=O)C[C@H]1CC(=O)O Amb18198651 [0,1,0,1,0,0|1,0,1]=4 5599 B12R1.65 O=C(O)CN1CC(O)CC1CO Amb30040305 [0,1,0,1,0,0|2,0,0]=4 5600 B12R1.125 C=C(C)CCC1CCCCC1N Amb27979472 [0,1,0,1,0,0|2,0,0]=4 5601 B12R1.125 C=C(C)CCC1CCCCC1O Amb28062579 [0,1,0,1,0,0|2,0,0]=4 5602 B12R1.125 C=C(C)CC[C@@H]1CCCC[C@H]1O Amb32950339 [0,1,0,1,0,0|2,0,0]=4 5603 B12R1.125 C=C(C)CNC1CCCCC1C Amb17309025 [0,1,0,1,0,0|2,0,0]=4 5604 B12R1.125 C=C1CCCCC1CCC(C)=O Amb27861159 [0,1,0,1,0,0|1,0,1]=4 5605 B12R1.125 C=C1CCCCC1CCC(N)=O Amb28054855 [0,1,0,1,0,0|1,0,1]=4 5606 B12R1.125 CC(=O)CCC1CCCCN1C Amb25034626 [0,1,0,1,0,0|1,0,0]=3 5607 B12R1.125 CC(=O)CCC1OCCCC1O Amb28322044 [0,1,0,1,0,0|2,0,0]=4 5608 B12R1.125 CC(=O)CCN1CCCCC1C Amb7755660 [0,1,0,1,0,0|1,0,0]=3 5609 B12R1.125 CC(=O)CC[C@@H]1CCCCC1=O Amb28202304 [0,1,0,1,0,0|1,0,1]=4 5610 B12R1.125 CC(=O)NCC1CCCCC1N Amb27190710 [0,1,0,1,0,0|2,0,0]=4 5611 B12R1.125 CC(=O)NCC1CCCCC1O Amb27760777 [0,1,0,1,0,0|2,0,0]=4 5612 B12R1.125 CC(=O)NCC1CCCCN1C Amb28201206 [0,1,0,1,0,0|2,0,0]=4 5613 B12R1.125 CC(=O)NCC1CCNCC1C Amb26626243 [0,1,0,1,0,0|2,0,0]=4 5614 B12R1.125 CC(=O)NC[C@H]1CCCC[C@@H]1O Amb27790347 [0,1,0,1,0,0|2,0,0]=4 5615 B12R1.125 CC(=O)NC[C@H]1CCCC[C@H]1O Amb27208254 [0,1,0,1,0,0|2,0,0]=4 5616 B12R1.125 CC(O)CCC1CCCCC1C Amb27874287 [0,1,0,1,0,0|1,0,1]=4 5617 B12R1.125 CC(O)CCC1CCCCN1C Amb33323191 [0,1,0,1,0,0|1,0,1]=4 5618 B12R1.125 CC(O)COC1CCCCC1C Amb18807458 [0,1,0,1,0,0|1,0,1]=4 5619 B12R1.125 CC1CCCCC1CNC(=O)Cl Amb35625849 [0,1,0,1,0,0|1,0,0]=3 5620 B12R1.125 CC1CCCCC1OCC(=O)O Amb9726703 [0,1,0,1,0,0|0,0,0]=2 5621 B12R1.125 CC1CCCCC1OCC(N)=O Amb18802286 [0,1,0,1,0,0|1,0,0]=3 5622 B12R1.125 CC1CCCCC1OC[C@@H](C)O Amb27177949 [0,1,0,1,0,0|1,0,1]=4 5623 B12R1.125 CC1CCCCC1OC[C@H](C)O Amb27198617 [0,1,0,1,0,0|1,0,1]=4 5624 B12R1.125 CC1CCCCN1CCC(=N)N Amb6275610 [0,1,0,1,0,0|2,0,0]=4 5625 B12R1.125 CC1CCCCN1CCC(=O)Cl Amb17143073 [0,1,0,1,0,0|1,0,0]=3 5626 B12R1.125 CC1CCCCN1CCC(=O)O Amb21953915 [0,1,0,1,0,0|0,0,0]=2 5627 B12R1.125 CC1CCCCN1CCC(=O)O Amb2693037 [0,1,0,1,0,0|0,0,0]=2 5628 B12R1.125 CC1CCCCN1CCC(N)=O Amb17142919 [0,1,0,1,0,0|1,0,0]=3 5629 B12R1.125 CC1CCCCN1CCC(N)=S Amb6279739 [0,1,0,1,0,0|1,1,0]=4 5630 B12R1.125 CC1CCCCN1\C=C\C(=O)O Amb28071417 [0,1,0,1,0,0|0,0,2]=4 5631 B12R1.125 CC1CCCC\C1=N/CC(=O)O Amb27400353 [0,1,0,1,0,0|0,0,1]=3 5632 B12R1.125 CC1CCCNC1CCS(C)=O Amb35677548 [0,1,0,1,0,0|2,0,0]=4 5633 B12R1.125 CC1CCNCC1CNC(N)=O Amb27175423 [0,1,0,1,0,0|2,0,0]=4 5634 B12R1.125 CC1CNCCC1C#CC(=O)O Amb33169019 [0,1,0,1,0,0|0,0,2]=4 5635 B12R1.125 CC1CNCCC1CCC(=O)O Amb27858642 [0,1,0,1,0,0|0,0,0]=2 5636 B12R1.125 CC1CNCCC1NCC(=O)O Amb27597159 [0,1,0,1,0,0|1,0,0]=3 5637 B12R1.125 CC1SCCCC1OCC(=O)O Amb25117392 [0,1,0,1,0,0|1,0,0]=3 5638 B12R1.125 CN1CCCCC1C#CC(=O)O Amb33169009 [0,1,0,1,0,0|0,0,2]=4 5639 B12R1.125 CN1CCCCC1CCC(=O)O Amb10607785 [0,1,0,1,0,0|0,0,0]=2 5640 B12R1.125 CN1CCCCC1CCC(=O)O Amb13949149 [0,1,0,1,0,0|0,0,0]=2 5641 B12R1.125 CN1CCCCC1CCC(=O)O Amb28555723 [0,1,0,1,0,0|0,0,0]=2 5642 B12R1.125 CN1CCCCC1CC[N+](=O)[O-] Amb33322709 [0,1,0,1,0,0|1,0,1]=4 5643 B12R1.125 CN1CCCCC1CNC(=O)Cl Amb35625872 [0,1,0,1,0,0|2,0,0]=4 5644 B12R1.125 CN1CCCCC1COC(=O)Cl Amb33297321 [0,1,0,1,0,0|2,0,0]=4 5645 B12R1.125 CN1CCCCC1\C=C\C(=O)O Amb33323102 [0,1,0,1,0,0|0,0,2]=4 5646 B12R1.125 CN1CCCN=C1CCC(=O)O Amb18825637 [0,1,0,1,0,0|1,0,1]=4 5647 B12R1.125 CS(=O)CCC1CCCCC1N Amb27855611 [0,1,0,1,0,0|2,0,0]=4 5648 B12R1.125 CS(=O)CCC1CCCCC1O Amb27628181 [0,1,0,1,0,0|2,0,0]=4 5649 B12R1.125 C[C@@H](O)CCC1CCCCN1C Amb33322732 [0,1,0,1,0,0|1,0,1]=4 5650 B12R1.125 C[C@@H]1COCCN1CCC(=O)O Amb27863121 [0,1,0,1,0,0|1,0,0]=3 5651 B12R1.125 C[C@@H]1COCCN1CCC(N)=O Amb27806762 [0,1,0,1,0,0|2,0,0]=4 5652 B12R1.125 C[C@H](O)CCC1CCCCN1C Amb33223884 [0,1,0,1,0,0|1,0,1]=4 5653 B12R1.125 C[C@H](O)CCN1CCCC[C@H]1C Amb27261625 [0,1,0,1,0,0|1,0,1]=4 5654 B12R1.125 C[C@H]1CNCCN1CCC(=O)O Amb27217264 [0,1,0,1,0,0|1,0,0]=3 5655 B12R1.125 NC(=O)CN[C@@H]1CCCC[C@H]1O Amb26864539 [0,1,0,1,0,0|2,0,0]=4 5656 B12R1.125 NC1CCCCC1CCC(=O)O Amb28872362 [0,1,0,1,0,0|0,0,0]=2 5657 B12R1.125 NC1CCCCC1CCC(=O)O Amb6739962 [0,1,0,1,0,0|0,0,0]=2 5658 B12R1.125 NC1CCCCC1OCC(=O)O Amb24488516 [0,1,0,1,0,0|1,0,0]=3 5659 B12R1.125 O=C(O)CCC1CCCCC1=O Amb2721886 [0,1,0,1,0,0|0,0,1]=3 5660 B12R1.125 O=C(O)CCC1CCCCC1F Amb27636457 [0,1,0,1,0,0|0,0,0]=2 5661 B12R1.125 O=C(O)CCC1CCCCC1O Amb27426758 [0,1,0,1,0,0|0,0,0]=2 5662 B12R1.125 O=C(O)CCC1CCNCC1F Amb27247564 [0,1,0,1,0,0|1,0,0]=3 5663 B12R1.125 O=C(O)CCC1CCOCC1=O Amb18198355 [0,1,0,1,0,0|1,0,1]=4 5664 B12R1.125 O=C(O)CCC1CCSCC1=O Amb18820771 [0,1,0,1,0,0|1,0,1]=4 5665 B12R1.125 O=C(O)CCC1COCCC1=O Amb18198354 [0,1,0,1,0,0|1,0,1]=4 5666 B12R1.125 O=C(O)CCC1CSCCC1=O Amb18820772 [0,1,0,1,0,0|1,0,1]=4 5667 B12R1.125 O=C(O)CCN1CCCCC1=O Amb6739919 [0,1,0,1,0,0|1,0,1]=4 5668 B12R1.125 O=C(O)CCN1CCCCC1=S Amb27392329 [0,1,0,1,0,0|1,0,1]=4 5669 B12R1.125 O=C(O)CC[C@@H]1CCCC[C@@H]1O Amb27210572 [0,1,0,1,0,0|0,0,0]=2 5670 B12R1.125 O=C(O)CC[C@@H]1CCCSC1=O Amb27252135 [0,1,0,1,0,0|1,0,1]=4 5671 B12R1.125 O=C(O)CC[C@H]1CCCC[C@H]1O Amb27444151 [0,1,0,1,0,0|0,0,0]=2 5672 B12R1.125 O=C(O)CC[C@H]1NCCC[C@@H]1O Amb28244797 [0,1,0,1,0,0|1,0,0]=3 5673 B12R1.125 O=C(O)CSC1CCCCC1O Amb10808762 [0,1,0,1,0,0|1,0,0]=3 5674 B12R1.127 C=C(C)CC1CC(N)CCC1C Amb32866259 [0,1,0,1,0,0|2,0,0]=4 5675 B12R1.127 C=C(Cl)CC1CC(Cl)CCC1C Amb32865859 [0,1,0,1,0,0|2,0,0]=4 5676 B12R1.127 C=C(Cl)CC1CC(N)CCC1C Amb32866351 [0,1,0,1,0,0|2,0,0]=4 5677 B12R1.127 CC(=O)CN1CC(O)CCC1C Amb27787155 [0,1,0,1,0,0|2,0,0]=4 5678 B12R1.127 CC(=O)CN1C[C@H](O)CC[C@H]1C Amb30011468 [0,1,0,1,0,0|2,0,0]=4 5679 B12R1.127 CC(=O)NC1CC(Cl)CCC1C Amb4010861 [0,1,0,1,0,0|2,0,0]=4 5680 B12R1.127 CC1CCC(=O)C(CC(=O)O)C1 Amb18647358 [0,1,0,1,0,0|1,0,1]=4 5681 B12R1.127 CC1CCC(=O)CC1CC(=O)O Amb26841119 [0,1,0,1,0,0|0,0,1]=3 5682 B12R1.127 CC1CCC(C)C(CC(=O)O)C1 Amb25793973 [0,1,0,1,0,0|0,0,0]=2 5683 B12R1.127 CC1CCC(C)C(OC(=O)Cl)C1 Amb33297337 [0,1,0,1,0,0|2,0,0]=4 5684 B12R1.127 CC1CCC(C)\C(=C\C(=O)O)C1 Amb27616902 [0,1,0,1,0,0|0,0,2]=4 5685 B12R1.127 CC1CCC(N)C(CC(=O)O)C1 Amb25210909 [0,1,0,1,0,0|1,0,0]=3 5686 B12R1.127 CC1CCC(N)CN1CC(=O)O Amb35643289 [0,1,0,1,0,0|1,0,0]=3 5687 B12R1.127 CC1CCC(N)CN1CC(N)=O Amb27779810 [0,1,0,1,0,0|2,0,0]=4 5688 B12R1.127 CC1CCC(O)C(CC(=O)O)C1 Amb18198283 [0,1,0,1,0,0|1,0,0]=3 5689 B12R1.127 CC1CN(CC(=O)O)C(C)CN1 Amb27175599 [0,1,0,1,0,0|2,0,0]=4 5690 B12R1.127 CN1CCC(F)C(CC(=O)O)C1 Amb27624603 [0,1,0,1,0,0|2,0,0]=4 5691 B12R1.127 CN1CCC(N)C(CC(=O)O)C1 Amb32863474 [0,1,0,1,0,0|2,0,0]=4 5692 B12R1.127 CN1CCC(O)C(CC(=O)O)C1 Amb18197942 [0,1,0,1,0,0|2,0,0]=4 5693 B12R1.127 CN1CCN(C)C(CC(=O)O)C1 Amb21953967 [0,1,0,1,0,0|2,0,0]=4 5694 B12R1.127 CN1CCN(C)C(CC(=O)O)C1 Amb9695690 [0,1,0,1,0,0|2,0,0]=4 5695 B12R1.127 C[C@@H]1CC[C@@H](O)CN1CC(=O)O Amb29866109 [0,1,0,1,0,0|1,0,0]=3 5696 B12R1.127 C[C@@H]1CC[C@@H](O)CN1CC(N)=O Amb25369273 [0,1,0,1,0,0|2,0,0]=4 5697 B12R1.127 O=C(O)CC1CC(=O)CCC1O Amb28343109 [0,1,0,1,0,0|1,0,1]=4 5698 B12R1.252 CC(=O)CCC=C1CCCCC1 Amb2610904 [0,1,0,1,0,0|1,0,1]=4 5699 B12R1.252 CC(=O)CCCC1CCCCC1 Amb33359306 [0,1,0,1,0,0|1,0,0]=3 5700 B12R1.252 CC(=O)CCNC1CCCCC1 Amb18647221 [0,1,0,1,0,0|1,0,0]=3 5701 B12R1.252 CC(=O)NCCC1CCCCN1 Amb9725754 [0,1,0,1,0,0|2,0,0]=4 5702 B12R1.252 CC(=O)NCCC1CCCNC1 Amb18982294 [0,1,0,1,0,0|2,0,0]=4 5703 B12R1.252 CC(=O)NCCC1CCCNC1 Amb21960598 [0,1,0,1,0,0|2,0,0]=4 5704 B12R1.252 CC(=O)NCCC1CCNCC1 Amb1080251 [0,1,0,1,0,0|2,0,0]=4 5705 B12R1.252 CC(=O)NCNC1CCCCC1 Amb27770101 [0,1,0,1,0,0|2,0,0]=4 5706 B12R1.252 CC(=O)\C=C\CC1CCCCC1 Amb32953373 [0,1,0,1,0,0|1,0,1]=4 5707 B12R1.252 CC(C)=CCCC1CCCCC1 Amb35582921 [0,1,0,1,0,0|2,0,0]=4 5708 B12R1.252 CC(O)CCCC1CCCCC1 Amb33449617 [0,1,0,1,0,0|1,0,1]=4 5709 B12R1.252 CC(O)CCNC1CCCCC1 Amb33455954 [0,1,0,1,0,0|1,0,1]=4 5710 B12R1.252 CC(O)CNCC1CCCCC1 Amb9246018 [0,1,0,1,0,0|1,0,1]=4 5711 B12R1.252 C[C@@H](O)CCCC1CCCCC1 Amb33422430 [0,1,0,1,0,0|1,0,1]=4 5712 B12R1.252 C[C@H](O)CCCC1CCCCC1 Amb33422431 [0,1,0,1,0,0|1,0,1]=4 5713 B12R1.252 N=C(N)CCCN1CCCCC1 Amb13951455 [0,1,0,1,0,0|2,0,0]=4 5714 B12R1.252 N=C(N)CCOC1CCCCC1 Amb10610331 [0,1,0,1,0,0|2,0,0]=4 5715 B12R1.252 NC(=O)CCCN1CCCCC1 Amb17142921 [0,1,0,1,0,0|1,0,0]=3 5716 B12R1.252 NC(=O)CCNC1CCCCC1 Amb8437701 [0,1,0,1,0,0|1,0,0]=3 5717 B12R1.252 NC(=O)CNCC1CCCCC1 Amb1113547 [0,1,0,1,0,0|1,0,0]=3 5718 B12R1.252 NC(=O)COCC1CCNCC1 Amb17083678 [0,1,0,1,0,0|2,0,0]=4 5719 B12R1.252 NC(=O)NOCC1CCCCC1 Amb28193569 [0,1,0,1,0,0|2,0,0]=4 5720 B12R1.252 NC(=S)CCOC1CCCCC1 Amb6262051 [0,1,0,1,0,0|1,1,0]=4 5721 B12R1.252 NC(=S)NCCC1CCCCC1 Amb19058785 [0,1,0,1,0,0|1,1,0]=4 5722 B12R1.252 NS(=O)CCCC1CCOCC1 Amb32720878 [0,1,0,1,0,0|2,0,0]=4 5723 B12R1.252 O=C(Cl)NCCC1CCCCC1 Amb35625747 [0,1,0,1,0,0|1,0,0]=3 5724 B12R1.252 O=C(Cl)NCCC1CCCCO1 Amb35633405 [0,1,0,1,0,0|2,0,0]=4 5725 B12R1.252 O=C(Cl)NCCC1CCOCC1 Amb35625737 [0,1,0,1,0,0|2,0,0]=4 5726 B12R1.252 O=C(Cl)OCCC1CCCCC1 Amb33297326 [0,1,0,1,0,0|1,0,0]=3 5727 B12R1.252 O=C(Cl)OCCC1CCCCO1 Amb33297112 [0,1,0,1,0,0|2,0,0]=4 5728 B12R1.252 O=C(O)C#CCC1CCCCC1 Amb27170004 [0,1,0,1,0,0|0,0,1]=3 5729 B12R1.252 O=C(O)C#CCN1CCCCC1 Amb27974141 [0,1,0,1,0,0|0,0,2]=4 5730 B12R1.252 O=C(O)CC#CC1CCCCC1 Amb26861627 [0,1,0,1,0,0|0,0,1]=3 5731 B12R1.252 O=C(O)CCCC1=COCCC1 Amb33424245 [0,1,0,1,0,0|0,0,2]=4 5732 B12R1.252 O=C(O)CCCC1CC=CCC1 Amb33358970 [0,1,0,1,0,0|0,0,1]=3 5733 B12R1.252 O=C(O)CCCC1CCCCC1 Amb4007236 [0,1,0,1,0,0|0,0,0]=2 5734 B12R1.252 O=C(O)CCCC1CCCCN1 Amb1101084 [0,1,0,1,0,0|0,0,0]=2 5735 B12R1.252 O=C(O)CCCC1CCCCN1 Amb22284114 [0,1,0,1,0,0|0,0,0]=2 5736 B12R1.252 O=C(O)CCCC1CCCCO1 Amb33377395 [0,1,0,1,0,0|0,0,0]=2 5737 B12R1.252 O=C(O)CCCC1CCCOC1 Amb33358265 [0,1,0,1,0,0|0,0,0]=2 5738 B12R1.252 O=C(O)CCCC1CCCSC1 Amb33079061 [0,1,0,1,0,0|0,0,0]=2 5739 B12R1.252 O=C(O)CCCC1CCNCC1 Amb1101085 [0,1,0,1,0,0|0,0,0]=2 5740 B12R1.252 O=C(O)CCCC1CCNCC1 Amb2720095 [0,1,0,1,0,0|0,0,0]=2 5741 B12R1.252 O=C(O)CCCC1CCOCC1 Amb28555790 [0,1,0,1,0,0|0,0,0]=2 5742 B12R1.252 O=C(O)CCCN1CCCCC1 Amb5718374 [0,1,0,1,0,0|0,0,0]=2 5743 B12R1.252 O=C(O)CCCN1CCCCC1 Amb5762298 [0,1,0,1,0,0|0,0,0]=2 5744 B12R1.252 O=C(O)CCCN1CCNCC1 Amb17479003 [0,1,0,1,0,0|1,0,0]=3 5745 B12R1.252 O=C(O)CCCN1CCOCC1 Amb21954071 [0,1,0,1,0,0|1,0,0]=3 5746 B12R1.252 O=C(O)CCCN1CCOCC1 Amb5846623 [0,1,0,1,0,0|1,0,0]=3 5747 B12R1.252 O=C(O)CCNC1=NCCCC1 Amb10976585 [0,1,0,1,0,0|1,0,1]=4 5748 B12R1.252 O=C(O)CCNC1CCCCC1 Amb33484265 [0,1,0,1,0,0|0,0,0]=2 5749 B12R1.252 O=C(O)CCNC1CCCCC1 Amb3940614 [0,1,0,1,0,0|0,0,0]=2 5750 B12R1.252 O=C(O)CCNC1CCNCC1 Amb19008333 [0,1,0,1,0,0|1,0,0]=3 5751 B12R1.252 O=C(O)CCNC1CCNCC1 Amb33552933 [0,1,0,1,0,0|1,0,0]=3 5752 B12R1.252 O=C(O)CCOC1CCCCO1 Amb24120644 [0,1,0,1,0,0|1,0,0]=3 5753 B12R1.252 O=C(O)CCOC1CCOCC1 Amb18790274 [0,1,0,1,0,0|1,0,0]=3 5754 B12R1.252 O=C(O)CCSC1CCCCC1 Amb3318888 [0,1,0,1,0,0|0,0,0]=2 5755 B12R1.252 O=C(O)COCC1CC=CCC1 Amb32946018 [0,1,0,1,0,0|0,0,2]=4 5756 B12R1.252 O=C(O)COCC1CCCCC1 Amb19032022 [0,1,0,1,0,0|0,0,0]=2 5757 B12R1.252 O=C(O)COCC1CCCCO1 Amb9716871 [0,1,0,1,0,0|1,0,0]=3 5758 B12R1.252 O=C(O)COCC1CCCNC1 Amb33038178 [0,1,0,1,0,0|1,0,0]=3 5759 B12R1.252 O=C(O)COCC1CCCNC1 Amb33329459 [0,1,0,1,0,0|1,0,0]=3 5760 B12R1.252 O=C(O)COCC1CCNCC1 Amb35751378 [0,1,0,1,0,0|1,0,0]=3 5761 B12R1.252 O=C(O)COCC1CCNCC1 Amb35752582 [0,1,0,1,0,0|1,0,0]=3 5762 B12R1.252 O=C(O)COCC1CCOCC1 Amb18312456 [0,1,0,1,0,0|1,0,0]=3 5763 B12R1.252 O=C(O)CSCC1CCCCO1 Amb9008344 [0,1,0,1,0,0|1,0,0]=3 5764 B12R1.252 O=C(O)C\C=C\C1CCCCC1 Amb26861470 [0,1,0,1,0,0|0,0,1]=3 5765 B12R1.252 O=C(O)C\C=C\C1CCOCC1 Amb26883733 [0,1,0,1,0,0|0,0,2]=4 5766 B12R1.252 O=C(O)\C=C\CC1CCCCC1 Amb26527903 [0,1,0,1,0,0|0,0,1]=3 5767 B12R1.252 O=C(O)\C=C\CN1CCCCC1 Amb18988789 [0,1,0,1,0,0|0,0,2]=4 5768 B12R1.252 O=C(O)\C=C\CN1CCCCC1 Amb30634362 [0,1,0,1,0,0|0,0,2]=4 5769 B12R1.252 O=C([O-])CCCC1CCCCC1 Amb8516780 [0,1,0,1,0,0|0,0,1]=3 5770 B12R1.252 O=S(Cl)CCCC1CCOCC1 Amb32720877 [0,1,0,1,0,0|2,0,0]=4 5771 B12R1.252 O=S([O-])CCCC1CCOCC1 Amb32755565 [0,1,0,1,0,0|1,0,1]=4 5772 B12R1.252 O=[N+]([O-])CCCC1CCCCC1 Amb33422420 [0,1,0,1,0,0|1,0,1]=4 5773 B12R1.489 CCCC1C(=O)CCC1C(=O)O Amb27770158 [0,1,0,1,0,0|0,0,1]=3 5774 B12R1.489 CCCN1C(=O)CCC1C(=O)O Amb19001515 [0,1,0,1,0,0|1,0,1]=4 5775 B12R1.489 COC[C@@H]1C(=O)CC[C@H]1C(=O)O Amb27632433 [0,1,0,1,0,0|1,0,1]=4 5776 B12R1.895 CC1CCC(C)C1NCC(N)=O Amb28184861 [0,1,0,1,0,0|2,0,0]=4 5777 B12R1.1238 CC1CC1C(=O)NCCC(=O)O Amb1119322 [0,1,0,1,0,0|1,0,1]=4 5778 B12R1.1357 O=C(O)CCCC(=O)C1CCC1 Amb6305212 [0,1,0,1,0,0|0,0,1]=3 5779 B12R1.1357 O=C(O)CCNC(=O)C1CCC1 Amb1121549 [0,1,0,1,0,0|1,0,1]=4 5780 B12R1.1359 CN(CCCC(=O)O)CC1CC1 Amb19373696 [0,1,0,1,0,0|1,0,0]=3 5781 B12R1.1809 CC(=O)NCCC1(O)CCCC1 Amb35704642 [0,1,0,1,0,0|2,0,0]=4 5782 B12R1.1809 CC1(CCCC(=O)O)OCCO1 Amb18862902 [0,1,0,1,0,0|2,0,0]=4 5783 B12R1.1809 CC1(CCNC(=O)Cl)CCCC1 Amb35636895 [0,1,0,1,0,0|2,0,0]=4 5784 B12R1.1809 NC(=O)NCCC1(O)CCCC1 Amb35704837 [0,1,0,1,0,0|2,0,0]=4 5785 B12R1.2019 CCCNC(=O)C1CC1C(=O)O Amb17606126 [0,1,0,1,0,0|1,0,1]=4 5786 B12R1.2266 CCCCC1(C)CCCC1(C)O Amb24760592 [0,1,0,1,0,0|1,0,1]=4 5787 B12R1.2277 CCCCC1(C)COCC(=O)N1 Amb28384296 [0,1,0,1,0,0|2,0,0]=4 5788 B12R1.2277 CCCCC1(O)CCOC(=O)C1 Amb27495709 [0,1,0,1,0,0|2,0,0]=4 5789 B12R1.2277 CCCC[C@]1(C)CCCC(=O)C1 Amb27954111 [0,1,0,1,0,0|1,0,0]=3 5790 B12R1.28 C#CCCCC1CCCC(=O)C1 Amb28126616 [0,1,0,1,0,0|1,0,1]=4 5791 B12R1.28 CCCCCC1CCCC(=O)O1 Amb4493671 [0,1,0,1,0,0|0,0,0]=2 5792 B12R1.28 CCCCNC1=CC(=O)CCC1 Amb25258387 [0,1,0,1,0,0|1,0,1]=4 5793 B12R1.28 CCCNCC1CCCC(=O)N1 Amb32721825 [0,1,0,1,0,0|1,0,0]=3 5794 B12R1.28 CCCOCC1CCNC(=O)C1 Amb32654949 [0,1,0,1,0,0|2,0,0]=4 5795 B12R1.28 CC\C=C\CC1CCCC(=O)O1 Amb25227687 [0,1,0,1,0,0|0,0,1]=3 5796 B12R1.75 C=C(C)CC1CCCCC1CN Amb27468140 [0,1,0,1,0,0|2,0,0]=4 5797 B12R1.75 CC(=O)CN1CCCCC1CO Amb18806940 [0,1,0,1,0,0|2,0,0]=4 5798 B12R1.75 CC(=O)C[C@H]1CCCC[C@H]1C=O Amb28429561 [0,1,0,1,0,0|1,0,1]=4 5799 B12R1.75 CC(=O)NC1CCCCC1CN Amb27257787 [0,1,0,1,0,0|2,0,0]=4 5800 B12R1.75 CC(=O)NC1CCCCC1CO Amb27868462 [0,1,0,1,0,0|2,0,0]=4 5801 B12R1.75 CC(=O)N[C@H]1CCCC[C@H]1CO Amb28428478 [0,1,0,1,0,0|2,0,0]=4 5802 B12R1.75 CC(=O)O[C@H]1CCCC[C@@H]1CO Amb27420620 [0,1,0,1,0,0|2,0,0]=4 5803 B12R1.75 CCC1CCCCC1CC(=O)O Amb25152261 [0,1,0,1,0,0|0,0,0]=2 5804 B12R1.75 CCC1CCCCC1CC(C)=O Amb27495385 [0,1,0,1,0,0|1,0,0]=3 5805 B12R1.75 CCC1CCCCC1NC(=O)Cl Amb35625776 [0,1,0,1,0,0|1,0,0]=3 5806 B12R1.75 CCC1CCCCC1NC(N)=S Amb19058801 [0,1,0,1,0,0|1,1,0]=4 5807 B12R1.75 CCC1CCCCC1OC(=O)Cl Amb27181224 [0,1,0,1,0,0|1,0,0]=3 5808 B12R1.75 CCC1CCCCC1OC(C)=O Amb27766398 [0,1,0,1,0,0|1,0,0]=3 5809 B12R1.75 CCC1CCCCN1CC(=O)Cl Amb17143064 [0,1,0,1,0,0|1,0,0]=3 5810 B12R1.75 CCC1CCCCN1CC(=O)O Amb5380767 [0,1,0,1,0,0|0,0,0]=2 5811 B12R1.75 CCC1CCCCN1CC(C)O Amb18794118 [0,1,0,1,0,0|1,0,1]=4 5812 B12R1.75 CCC1CCCCN1CC(N)=O Amb17142913 [0,1,0,1,0,0|1,0,0]=3 5813 B12R1.75 CCC1CCCCN1CC(N)=S Amb8894001 [0,1,0,1,0,0|1,1,0]=4 5814 B12R1.75 CCC1CCCCN1C[N+](=O)[O-] Amb28138233 [0,1,0,1,0,0|1,0,1]=4 5815 B12R1.75 CCC1CCCC\C1=C\C(=O)O Amb33468654 [0,1,0,1,0,0|0,0,1]=3 5816 B12R1.75 CCC1CCNCC1NC(C)=O Amb32677496 [0,1,0,1,0,0|2,0,0]=4 5817 B12R1.75 CCC1COCCN1CC(N)=O Amb18802914 [0,1,0,1,0,0|2,0,0]=4 5818 B12R1.75 CCN1CCOCC1CC(=O)O Amb27814474 [0,1,0,1,0,0|1,0,0]=3 5819 B12R1.75 CCN1CCOCC1CC(=O)O Amb33330660 [0,1,0,1,0,0|1,0,0]=3 5820 B12R1.75 CCN1CCSCC1CC(=O)O Amb27952352 [0,1,0,1,0,0|1,0,0]=3 5821 B12R1.75 CC[C@@H]1NCCC[C@H]1CC(=O)O Amb18198537 [0,1,0,1,0,0|0,0,0]=2 5822 B12R1.75 CC[C@H]1CNCC[C@H]1CC(=O)Cl Amb28291338 [0,1,0,1,0,0|1,0,0]=3 5823 B12R1.75 CC[C@H]1NCCC[C@@H]1CC(=O)O Amb27654051 [0,1,0,1,0,0|0,0,0]=2 5824 B12R1.75 COC1CCCCC1NC(N)=O Amb27211770 [0,1,0,1,0,0|2,0,0]=4 5825 B12R1.75 COC1CCCNC1CC(C)=O Amb18647523 [0,1,0,1,0,0|2,0,0]=4 5826 B12R1.75 COC1CCOCC1CC(=O)O Amb18197607 [0,1,0,1,0,0|1,0,0]=3 5827 B12R1.75 COC1CCSCC1CC(=O)O Amb18190928 [0,1,0,1,0,0|1,0,0]=3 5828 B12R1.75 COC1COCCC1CC(=O)O Amb18197629 [0,1,0,1,0,0|1,0,0]=3 5829 B12R1.75 COC1CSCCC1CC(=O)O Amb18189240 [0,1,0,1,0,0|1,0,0]=3 5830 B12R1.75 COC1OCCCC1CC(=O)O Amb18197635 [0,1,0,1,0,0|1,0,0]=3 5831 B12R1.75 CO[C@@H]1CCCC[C@@H]1NC(C)=O Amb28074111 [0,1,0,1,0,0|2,0,0]=4 5832 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(C)=O Amb27956180 [0,1,0,1,0,0|2,0,0]=4 5833 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(N)=O Amb28349618 [0,1,0,1,0,0|2,0,0]=4 5834 B12R1.75 CSC1CCCCC1NC(=O)Cl Amb35633414 [0,1,0,1,0,0|2,0,0]=4 5835 B12R1.75 CSC1CCCCC1NC(C)=O Amb28067814 [0,1,0,1,0,0|2,0,0]=4 5836 B12R1.75 N#CC1CCCCC1CC(=O)O Amb18827227 [0,1,0,1,0,0|0,0,1]=3 5837 B12R1.75 N#CN1CCCCC1CC(=O)O Amb35593361 [0,1,0,1,0,0|1,0,1]=4 5838 B12R1.75 NC(=O)N[C@@H]1CCCC[C@H]1CO Amb27163786 [0,1,0,1,0,0|2,0,0]=4 5839 B12R1.75 NCC1=C(CC(=O)O)CCCC1 Amb27645397 [0,1,0,1,0,0|0,0,2]=4 5840 B12R1.75 NCC1CCCCC1CC(=O)O Amb10843836 [0,1,0,1,0,0|0,0,0]=2 5841 B12R1.75 NCC1CCCCC1NC(N)=O Amb27208284 [0,1,0,1,0,0|2,0,0]=4 5842 B12R1.75 NCC1CCCCC1OC(N)=O Amb28195875 [0,1,0,1,0,0|2,0,0]=4 5843 B12R1.75 NCC1CCCCN1CC(=O)O Amb18982971 [0,1,0,1,0,0|1,0,0]=3 5844 B12R1.75 NCC1CCCCN1CC(N)=O Amb6673910 [0,1,0,1,0,0|2,0,0]=4 5845 B12R1.75 NNC1CCCCC1CC(=O)O Amb27960868 [0,1,0,1,0,0|1,0,0]=3 5846 B12R1.75 NN[C@H]1CCCC[C@H]1CC(=O)O Amb27789570 [0,1,0,1,0,0|1,0,0]=3 5847 B12R1.75 O=C(O)CC1CCCCC1CO Amb27392264 [0,1,0,1,0,0|0,0,0]=2 5848 B12R1.75 O=C(O)CC1CCCC\C1=N/O Amb27974144 [0,1,0,1,0,0|1,0,1]=4 5849 B12R1.75 O=C(O)CN1CCCCC1CO Amb18294605 [0,1,0,1,0,0|1,0,0]=3 5850 B12R1.75 O=C(O)CN1CCOCC1CO Amb27254701 [0,1,0,1,0,0|2,0,0]=4 5851 B12R1.81 CC(=O)NCC1CCCC1CBr Amb27178312 [0,1,0,1,0,0|2,0,0]=4 5852 B12R1.81 CCC1NCCC1C#CC(=O)O Amb33169069 [0,1,0,1,0,0|0,0,2]=4 5853 B12R1.81 CCC1OCCC1CNC(=O)Cl Amb35633570 [0,1,0,1,0,0|2,0,0]=4 5854 B12R1.81 CCN1CCCC1CNC(=O)Cl Amb35614612 [0,1,0,1,0,0|2,0,0]=4 5855 B12R1.81 CCN1CCCC1CNC(N)=O Amb9708648 [0,1,0,1,0,0|2,0,0]=4 5856 B12R1.81 COC1CCCC1NCC(=O)O Amb18807777 [0,1,0,1,0,0|1,0,0]=3 5857 B12R1.81 COC1CCCC1NCC(N)=O Amb18807414 [0,1,0,1,0,0|2,0,0]=4 5858 B12R1.81 N#CC1CCCC1OCC(=O)O Amb33468830 [0,1,0,1,0,0|1,0,1]=4 5859 B12R1.81 N#CN1CCCC1CCC(=O)O Amb29870342 [0,1,0,1,0,0|1,0,1]=4 5860 B12R1.81 NC[C@@H]1CCCN1CCC(=O)O Amb33218395 [0,1,0,1,0,0|1,0,0]=3 5861 B12R1.81 NC[C@H]1CCCN1CCC(=O)O Amb33218388 [0,1,0,1,0,0|1,0,0]=3 5862 B12R1.81 O=C(O)CCC1CCC\C1=N/O Amb27233661 [0,1,0,1,0,0|1,0,1]=4 5863 B12R1.130 CC(=O)CCCC1CCCN1C Amb33320329 [0,1,0,1,0,0|1,0,0]=3 5864 B12R1.130 CC(=O)NCCC1CCCN1C Amb35682238 [0,1,0,1,0,0|2,0,0]=4 5865 B12R1.130 CC(=O)NCC[C@@H]1CNC[C@H]1C Amb32696178 [0,1,0,1,0,0|2,0,0]=4 5866 B12R1.130 CC(O)CCCC1CCCN1C Amb33320729 [0,1,0,1,0,0|1,0,1]=4 5867 B12R1.130 CC(O)CCNC1CCCC1C Amb33440572 [0,1,0,1,0,0|1,0,1]=4 5868 B12R1.130 CC1CCCC1N\C=C\C(=O)O Amb27172585 [0,1,0,1,0,0|0,0,2]=4 5869 B12R1.130 CC1CCC\C1=N/NCC(=O)O Amb27261410 [0,1,0,1,0,0|1,0,1]=4 5870 B12R1.130 CC1OCCC1CCCC(=O)O Amb33429902 [0,1,0,1,0,0|0,0,0]=2 5871 B12R1.130 CN1CCCC1CCCC(=O)O Amb33322235 [0,1,0,1,0,0|0,0,0]=2 5872 B12R1.130 CN1CCCC1CCC[N+](=O)[O-] Amb33320770 [0,1,0,1,0,0|1,0,1]=4 5873 B12R1.130 CN1CCCC1CCNC(=O)Cl Amb35625606 [0,1,0,1,0,0|2,0,0]=4 5874 B12R1.130 CN1CCCC1CCNC(N)=O Amb35691980 [0,1,0,1,0,0|2,0,0]=4 5875 B12R1.130 CN1CCCC1COCC(=O)O Amb21861056 [0,1,0,1,0,0|1,0,0]=3 5876 B12R1.130 CN1CCCC1COCC(=O)O Amb32409791 [0,1,0,1,0,0|1,0,0]=3 5877 B12R1.130 CN1CCCC1C\C=C\C(=O)O Amb33320769 [0,1,0,1,0,0|0,0,2]=4 5878 B12R1.130 CN1CCC[C@H]1COCC(=O)O Amb22224778 [0,1,0,1,0,0|1,0,0]=3 5879 B12R1.130 C[C@@H](O)CCCC1CCCN1C Amb33320726 [0,1,0,1,0,0|1,0,1]=4 5880 B12R1.130 C[C@H](O)CCCC1CCCN1C Amb33320727 [0,1,0,1,0,0|1,0,1]=4 5881 B12R1.130 O=C(O)CCCN1CCCC1=O Amb1130787 [0,1,0,1,0,0|1,0,1]=4 5882 B12R1.130 O=C(O)CCSC1CCCC1=O Amb16230793 [0,1,0,1,0,0|1,0,1]=4 5883 B12R1.170 C=CCC1CCCCCC(=O)C1 Amb28253648 [0,1,0,1,0,0|1,0,1]=4 5884 B12R1.170 CCOC1CCCCCC(=O)C1 Amb27177931 [0,1,0,1,0,0|1,0,0]=3 5885 B12R1.255 CC(=O)CCCCC1CCCC1 Amb33448571 [0,1,0,1,0,0|1,0,0]=3 5886 B12R1.255 CC(=O)CCCCN1CCCC1 Amb9659031 [0,1,0,1,0,0|1,0,0]=3 5887 B12R1.255 CC(=O)\C=C\CCC1CCCC1 Amb33379446 [0,1,0,1,0,0|1,0,1]=4 5888 B12R1.255 CC(O)CCCCC1CCCC1 Amb33359674 [0,1,0,1,0,0|1,0,1]=4 5889 B12R1.255 CC(O)CCCCN1CCCC1 Amb18789599 [0,1,0,1,0,0|1,0,1]=4 5890 B12R1.255 C[C@@H](O)CCCCC1CCCC1 Amb33375589 [0,1,0,1,0,0|1,0,1]=4 5891 B12R1.255 C[C@@H](O)CCCCN1CCCC1 Amb33275213 [0,1,0,1,0,0|1,0,1]=4 5892 B12R1.255 C[C@H](O)CCCCC1CCCC1 Amb33375619 [0,1,0,1,0,0|1,0,1]=4 5893 B12R1.255 C[C@H](O)CCCCN1CCCC1 Amb33275214 [0,1,0,1,0,0|1,0,1]=4 5894 B12R1.255 NC(=O)CCCCC1CCSS1 Amb2747279 [0,1,0,1,0,0|2,0,0]=4 5895 B12R1.255 NS(=O)CCOCC1CCCC1 Amb32720585 [0,1,0,1,0,0|2,0,0]=4 5896 B12R1.255 O=C(O)C#CCCC1CCCO1 Amb28322969 [0,1,0,1,0,0|0,0,2]=4 5897 B12R1.255 O=C(O)C#CCCC1CCOC1 Amb27960018 [0,1,0,1,0,0|0,0,2]=4 5898 B12R1.255 O=C(O)CCCCC1CCCC1 Amb33229242 [0,1,0,1,0,0|0,0,0]=2 5899 B12R1.255 O=C(O)CCCCC1CCOC1 Amb33229236 [0,1,0,1,0,0|0,0,0]=2 5900 B12R1.255 O=C(O)CCCCC1CCSS1 Amb1152511 [0,1,0,1,0,0|1,0,0]=3 5901 B12R1.255 O=C(O)CCCCC1CSSC1 Amb33551319 [0,1,0,1,0,0|1,0,0]=3 5902 B12R1.255 O=C(O)CCCCC1OCCO1 Amb28079380 [0,1,0,1,0,0|1,0,0]=3 5903 B12R1.255 O=C(O)CCCCN1CCCC1 Amb33552798 [0,1,0,1,0,0|0,0,0]=2 5904 B12R1.255 O=C(O)CCCCN1CCCC1 Amb7783148 [0,1,0,1,0,0|0,0,0]=2 5905 B12R1.255 O=C(O)CCCC[C@@H]1CCSS1 Amb553489 [0,1,0,1,0,0|1,0,0]=3 5906 B12R1.255 O=C(O)CCCC[C@H]1CCSS1 Amb17616537 [0,1,0,1,0,0|1,0,0]=3 5907 B12R1.255 O=C(O)CCCNC1=NCCC1 Amb8559049 [0,1,0,1,0,0|1,0,1]=4 5908 B12R1.255 O=C(O)CCNCC1CCCO1 Amb7755703 [0,1,0,1,0,0|1,0,0]=3 5909 B12R1.255 O=C(O)CCOCC1CCCO1 Amb6274081 [0,1,0,1,0,0|1,0,0]=3 5910 B12R1.255 O=C(O)CCSCC1CCCO1 Amb9723634 [0,1,0,1,0,0|1,0,0]=3 5911 B12R1.255 O=C(O)CNCCN1CCCC1 Amb9325920 [0,1,0,1,0,0|1,0,0]=3 5912 B12R1.255 O=C(O)COCCC1CCCC1 Amb32954482 [0,1,0,1,0,0|0,0,0]=2 5913 B12R1.255 O=C(O)COCCN1CCCC1 Amb33474001 [0,1,0,1,0,0|1,0,0]=3 5914 B12R1.255 O=C(O)CSCCN1CCCC1 Amb13949167 [0,1,0,1,0,0|1,0,0]=3 5915 B12R1.255 O=C(O)CSCCN1CCCC1 Amb6745649 [0,1,0,1,0,0|1,0,0]=3 5916 B12R1.255 O=C(O)\C=C\CCC1CCCC1 Amb33374577 [0,1,0,1,0,0|0,0,1]=3 5917 B12R1.255 O=C(O)\C=C\CCN1CCCC1 Amb33275245 [0,1,0,1,0,0|0,0,2]=4 5918 B12R1.255 O=C([O-])CCCCC1CCSS1 Amb22168392 [0,1,0,1,0,0|1,0,1]=4 5919 B12R1.255 O=S(Cl)CCOCC1CCCC1 Amb32720584 [0,1,0,1,0,0|2,0,0]=4 5920 B12R1.255 O=S([O-])CCOCC1CCCC1 Amb32755438 [0,1,0,1,0,0|1,0,1]=4 5921 B12R1.255 O=[N+]([O-])CCCCC1CCCC1 Amb33380265 [0,1,0,1,0,0|1,0,1]=4 5922 B12R1.255 O=[N+]([O-])CCCCN1CCCC1 Amb33275167 [0,1,0,1,0,0|1,0,1]=4 5923 B12R1.283 C#CCC1CCCCC1C(C)=O Amb25996388 [0,1,0,1,0,0|1,0,1]=4 5924 B12R1.283 C#CCN1CCCCC1C(=O)O Amb2372169 [0,1,0,1,0,0|0,0,2]=4 5925 B12R1.283 C#CCN1CCCC[C@@H]1C(=O)O Amb32672115 [0,1,0,1,0,0|0,0,2]=4 5926 B12R1.283 C#CCN1CCCC[C@H]1C(=O)O Amb32679669 [0,1,0,1,0,0|0,0,2]=4 5927 B12R1.283 C#CC[C@@H]1CCCC[C@H]1C(C)=O Amb25273888 [0,1,0,1,0,0|1,0,1]=4 5928 B12R1.283 C#CC[C@H]1CCCC[C@H]1C(C)=O Amb26554032 [0,1,0,1,0,0|1,0,1]=4 5929 B12R1.283 C=C=CC1CCCCC1C(=O)O Amb28119826 [0,1,0,1,0,0|0,0,2]=4 5930 B12R1.283 C=CCC1CCCCC1C(=O)O Amb18646999 [0,1,0,1,0,0|0,0,1]=3 5931 B12R1.283 C=CCN1CCCCC1C(=O)O Amb2382768 [0,1,0,1,0,0|0,0,2]=4 5932 B12R1.283 CC(=O)N1CCCCC1CCBr Amb17103917 [0,1,0,1,0,0|2,0,0]=4 5933 B12R1.283 CC(=O)N1CCCCC1CCCl Amb17103644 [0,1,0,1,0,0|2,0,0]=4 5934 B12R1.283 CC(=O)N1CCCCC1CCN Amb17046292 [0,1,0,1,0,0|2,0,0]=4 5935 B12R1.283 CC(=O)N1CCCCC1CCO Amb5797426 [0,1,0,1,0,0|2,0,0]=4 5936 B12R1.283 CC(=O)N1CCCC[C@@H]1CCO Amb25295318 [0,1,0,1,0,0|2,0,0]=4 5937 B12R1.283 CC(=O)N1CCCC[C@H]1CCO Amb25700843 [0,1,0,1,0,0|2,0,0]=4 5938 B12R1.283 CC(=O)[C@@H]1CCCC[C@H]1CC#N Amb26427085 [0,1,0,1,0,0|1,0,1]=4 5939 B12R1.283 CC(=O)[C@@H]1CCCC[C@H]1CC=O Amb27195918 [0,1,0,1,0,0|1,0,1]=4 5940 B12R1.283 CCCC1=C(C(C)=O)CCCC1 Amb27614636 [0,1,0,1,0,0|1,0,1]=4 5941 B12R1.283 CCCC1CCCCC1C(C)=O Amb27762565 [0,1,0,1,0,0|1,0,0]=3 5942 B12R1.283 CCCC1CCCNC1C(=O)O Amb27178215 [0,1,0,1,0,0|0,0,0]=2 5943 B12R1.283 CCCC1CNCCN1C(C)=O Amb28285684 [0,1,0,1,0,0|2,0,0]=4 5944 B12R1.283 CCCC1OCCCC1C(=O)O Amb10609660 [0,1,0,1,0,0|0,0,0]=2 5945 B12R1.283 CCCN1CCCCC1C(=N)N Amb35666161 [0,1,0,1,0,0|2,0,0]=4 5946 B12R1.283 CCCN1CCCCC1C(=O)O Amb1110568 [0,1,0,1,0,0|0,0,0]=2 5947 B12R1.283 CCCN1CCCCC1C(=O)O Amb33552437 [0,1,0,1,0,0|0,0,0]=2 5948 B12R1.283 CCCN1CCCCC1C(N)=O Amb26003555 [0,1,0,1,0,0|1,0,0]=3 5949 B12R1.283 CCCN1CCCCC1C(N)=S Amb27412417 [0,1,0,1,0,0|1,1,0]=4 5950 B12R1.283 CCCN1CCCC[C@H]1C(N)=O Amb28291427 [0,1,0,1,0,0|1,0,0]=3 5951 B12R1.283 CCCN1CCNCC1C(=O)O Amb18825347 [0,1,0,1,0,0|1,0,0]=3 5952 B12R1.283 CCCN1CCOCC1C(N)=O Amb27178873 [0,1,0,1,0,0|2,0,0]=4 5953 B12R1.283 CCNC1CCCCC1S(C)=O Amb28291089 [0,1,0,1,0,0|2,0,0]=4 5954 B12R1.283 CCO[C@@H]1CCCC[C@H]1C(C)=O Amb28248007 [0,1,0,1,0,0|1,0,0]=3 5955 B12R1.283 COCC1CC=CCC1C(=O)O Amb27408514 [0,1,0,1,0,0|0,0,2]=4 5956 B12R1.283 COCC1CCCCN1C(=O)Cl Amb32863950 [0,1,0,1,0,0|2,0,0]=4 5957 B12R1.283 COCC1NCCCC1C(N)=O Amb27458399 [0,1,0,1,0,0|2,0,0]=4 5958 B12R1.283 COCC1OCCCC1C(=O)O Amb27647224 [0,1,0,1,0,0|1,0,0]=3 5959 B12R1.283 C\C=C\C1CCCCC1C(C)=O Amb25282802 [0,1,0,1,0,0|1,0,1]=4 5960 B12R1.283 N#CNC1CCCCC1C(=O)O Amb30031688 [0,1,0,1,0,0|1,0,1]=4 5961 B12R1.283 NC(=O)C1CCCCN1CCO Amb27207263 [0,1,0,1,0,0|2,0,0]=4 5962 B12R1.283 NC(=O)N1CCCCC1CCO Amb28281163 [0,1,0,1,0,0|2,0,0]=4 5963 B12R1.283 NCCC1CCCCN1C(N)=O Amb28381340 [0,1,0,1,0,0|2,0,0]=4 5964 B12R1.283 O=C(O)C1CCCCC1\C=C\Cl Amb27190721 [0,1,0,1,0,0|0,0,2]=4 5965 B12R1.283 O=C(O)C1COCCN1CCF Amb27949845 [0,1,0,1,0,0|2,0,0]=4 5966 B12R1.283 O=C(O)C1CSCCN1CCF Amb28063061 [0,1,0,1,0,0|2,0,0]=4 5967 B12R1.283 O=C(O)C1CSCCN1CCO Amb27243166 [0,1,0,1,0,0|2,0,0]=4 5968 B12R1.283 O=C(O)[C@@H]1CCCCN1CCF Amb27757723 [0,1,0,1,0,0|1,0,0]=3 5969 B12R1.283 O=C(O)[C@@H]1CCCC[C@H]1N=C=S Amb27467769 [0,1,0,1,0,0|1,0,1]=4 5970 B12R1.289 CC(=O)CC1CCCC1CC#N Amb27164722 [0,1,0,1,0,0|1,0,1]=4 5971 B12R1.289 CC(=O)C[C@@H]1CCC[C@H]1CC#N Amb27620440 [0,1,0,1,0,0|1,0,1]=4 5972 B12R1.289 CCCC1COCC1NC(=O)Cl Amb35636915 [0,1,0,1,0,0|2,0,0]=4 5973 B12R1.289 CCCC1COCC1NC(C)=O Amb35617217 [0,1,0,1,0,0|2,0,0]=4 5974 B12R1.289 CCCC1COCC1NC(N)=O Amb35613744 [0,1,0,1,0,0|2,0,0]=4 5975 B12R1.289 CCCC1COC\C1=C/C(=O)O Amb35631892 [0,1,0,1,0,0|0,0,2]=4 5976 B12R1.289 CCSC1CCCC1NC(=O)Cl Amb35633550 [0,1,0,1,0,0|2,0,0]=4 5977 B12R1.289 COCC1CCCN1CC(=O)O Amb21860507 [0,1,0,1,0,0|1,0,0]=3 5978 B12R1.289 N#CNC1CCCC1CC(=O)O Amb35593377 [0,1,0,1,0,0|1,0,1]=4 5979 B12R1.289 N#CN[C@@H]1CCC[C@H]1CC(=O)O Amb35593379 [0,1,0,1,0,0|1,0,1]=4 5980 B12R1.289 O=CNC1CCCC1CC(=O)O Amb29863705 [0,1,0,1,0,0|1,0,1]=4 5981 B12R1.289 O=CN[C@@H]1CCC[C@H]1CC(=O)O Amb35603999 [0,1,0,1,0,0|1,0,1]=4 5982 B12R1.321 C=CCCC1CCCCC(=O)C1 Amb27951458 [0,1,0,1,0,0|1,0,1]=4 5983 B12R1.321 CCCCC1CC(=O)NCCN1 Amb27950409 [0,1,0,1,0,0|2,0,0]=4 5984 B12R1.321 CCCCC1CCCCC(=O)N1 Amb4011804 [0,1,0,1,0,0|1,0,0]=3 5985 B12R1.321 CCCCC1CCCCC(=O)O1 Amb22230135 [0,1,0,1,0,0|0,0,0]=2 5986 B12R1.321 CCCCC1CCNCC(C)O1 Amb32679925 [0,1,0,1,0,0|1,0,1]=4 5987 B12R1.321 CCCCC1CSCCC(=N)N1 Amb27233027 [0,1,0,1,0,0|2,0,0]=4 5988 B12R1.321 CCCCN1CCCNC(=O)C1 Amb25938139 [0,1,0,1,0,0|2,0,0]=4 5989 B12R1.321 CCOCC1=CC(=O)CCCC1 Amb27840683 [0,1,0,1,0,0|1,0,1]=4 5990 B12R1.321 CC\C=C\C1CCCCC(=O)N1 Amb27248259 [0,1,0,1,0,0|1,0,1]=4 5991 B12R1.321 CSCCC1CCCCC(O)C1 Amb27621857 [0,1,0,1,0,0|1,0,1]=4 5992 B12R1.321 N#CCCC1CCCCC(=O)C1 Amb28202067 [0,1,0,1,0,0|1,0,1]=4 5993 B12R1.321 NCCCC1CCCCC(=O)N1 Amb18825523 [0,1,0,1,0,0|1,0,0]=3 5994 B12R1.321 O=C1CCCCC(CCCCl)O1 Amb27974145 [0,1,0,1,0,0|0,0,0]=2 5995 B12R1.321 O=C1CCCCC(CCCO)N1 Amb18825414 [0,1,0,1,0,0|1,0,0]=3 5996 B12R1.321 O=C1CCCCC(CCCO)O1 Amb27206114 [0,1,0,1,0,0|0,0,0]=2 5997 B12R1.384 CC1(O)CCCCC1CCCO Amb28189528 [0,1,0,1,0,0|1,0,1]=4 5998 B12R1.384 CCCCC1CCCCC1(C)O Amb32945487 [0,1,0,1,0,0|1,0,1]=4 5999 B12R1.384 CCCC[C@@H]1CCCC[C@@]1(C)O Amb33213620 [0,1,0,1,0,0|1,0,1]=4 6000 B12R1.384 CCCNC1CCCCC1(C)O Amb35664258 [0,1,0,1,0,0|1,0,1]=4 6001 B12R1.384 CCCN[C@@H]1CCCC[C@@]1(C)O Amb35665714 [0,1,0,1,0,0|1,0,1]=4 6002 B12R1.384 CCCSC1CCCCC1(C)O Amb35667561 [0,1,0,1,0,0|1,0,1]=4 6003 B12R1.384 CCCS[C@@H]1CCCC[C@@]1(C)O Amb35667466 [0,1,0,1,0,0|1,0,1]=4 6004 B12R1.384 CCNCC1CCCCS1(=O)=O Amb27985584 [0,1,0,1,0,0|1,0,1]=4 6005 B12R1.384 CCOCC1CCCCC1(C)O Amb33213611 [0,1,0,1,0,0|1,0,1]=4 6006 B12R1.384 CCOC[C@@H]1CCCC[C@@]1(C)O Amb33213610 [0,1,0,1,0,0|1,0,1]=4 6007 B12R1.384 CNCCC1CCCCS1(=O)=O Amb35673546 [0,1,0,1,0,0|1,0,1]=4 6008 B12R1.384 C[C@@]1(O)CCCC[C@H]1CCCO Amb27422386 [0,1,0,1,0,0|1,0,1]=4 6009 B12R1.384 NCCCC1CCCCS1(=O)=O Amb35723223 [0,1,0,1,0,0|1,0,1]=4 6010 B12R1.384 O=S1(=O)CCCCC1CCCBr Amb32690551 [0,1,0,1,0,0|1,0,1]=4 6011 B12R1.384 O=S1(=O)CCCCC1CCCCl Amb32690550 [0,1,0,1,0,0|1,0,1]=4 6012 B12R1.384 O=S1(=O)CCCCC1CCCO Amb35723304 [0,1,0,1,0,0|1,0,1]=4 6013 B12R1.386 CC(=O)N1CCCC1CCCN Amb31161636 [0,1,0,1,0,0|2,0,0]=4 6014 B12R1.386 CCNCC1CCCN1C(C)=O Amb21861191 [0,1,0,1,0,0|2,0,0]=4 6015 B12R1.386 CC\C=C\N1CCC[C@H]1C(=O)O Amb27616899 [0,1,0,1,0,0|0,0,2]=4 6016 B12R1.386 COCCN1CSCC1C(=O)O Amb21965045 [0,1,0,1,0,0|2,0,0]=4 6017 B12R1.386 C\C=C\CN1CCC[C@@H]1C(=O)O Amb27391152 [0,1,0,1,0,0|0,0,2]=4 6018 B12R1.386 N#CCCN1CCCC1C(=O)O Amb19001546 [0,1,0,1,0,0|1,0,1]=4 6019 B12R1.386 N#CCCN1CCC[C@@H]1C(=O)O Amb28127284 [0,1,0,1,0,0|1,0,1]=4 6020 B12R1.386 N#CCCN1CCC[C@H]1C(=O)O Amb25774338 [0,1,0,1,0,0|1,0,1]=4 6021 B12R1.386 N#CNCC1CCCC1C(=O)O Amb30031676 [0,1,0,1,0,0|1,0,1]=4 6022 B12R1.386 N#CNC[C@H]1CCC[C@H]1C(=O)O Amb30031486 [0,1,0,1,0,0|1,0,1]=4 6023 B12R1.386 NCCCN1CCCC1C(N)=O Amb6750987 [0,1,0,1,0,0|2,0,0]=4 6024 B12R1.386 NCCCN1CCC[C@@H]1C(N)=O Amb34915539 [0,1,0,1,0,0|2,0,0]=4 6025 B12R1.386 NCCCN1CCC[C@H]1C(N)=O Amb32668534 [0,1,0,1,0,0|2,0,0]=4 6026 B12R1.405 CC(=O)C1CCCCCC1C#N Amb25918242 [0,1,0,1,0,0|1,0,1]=4 6027 B12R1.405 CC(=O)N1CCCCCC1CN Amb24671055 [0,1,0,1,0,0|2,0,0]=4 6028 B12R1.405 CCC1CCCCCC1C(C)O Amb35672751 [0,1,0,1,0,0|1,0,1]=4 6029 B12R1.405 CC[C@@H]1NCCCC[C@H]1C(=O)O Amb18198539 [0,1,0,1,0,0|0,0,0]=2 6030 B12R1.405 CC[C@H]1NCCCC[C@@H]1C(=O)O Amb28247202 [0,1,0,1,0,0|0,0,0]=2 6031 B12R1.405 CNC1CCCCCC1C(N)=O Amb27833351 [0,1,0,1,0,0|1,0,0]=3 6032 B12R1.405 CO[C@H]1CCCCC[C@H]1C(=O)O Amb27489023 [0,1,0,1,0,0|0,0,0]=2 6033 B12R1.405 CS(=O)C1CCCCCC1CN Amb27181216 [0,1,0,1,0,0|2,0,0]=4 6034 B12R1.405 CSC1CCCCCC1C(=O)O Amb18967402 [0,1,0,1,0,0|0,0,0]=2 6035 B12R1.405 N#CN1CCCCCC1C(=O)O Amb30031677 [0,1,0,1,0,0|1,0,1]=4 6036 B12R1.405 O=C(O)C1=C(CO)CCCCC1 Amb27955255 [0,1,0,1,0,0|0,0,2]=4 6037 B12R1.522 CCNCCN1CCC1C(N)=O Amb33252130 [0,1,0,1,0,0|2,0,0]=4 6038 B12R1.522 CNCCCN1CCC1C(N)=O Amb33252131 [0,1,0,1,0,0|2,0,0]=4 6039 B12R1.522 NCCCCN1CCC1C(N)=O Amb33195366 [0,1,0,1,0,0|2,0,0]=4 6040 B12R1.76 CCC1CCCCC1C(C)(C)O Amb27812947 [0,1,0,1,0,0|1,0,1]=4 6041 B12R1.76 CCC1CCCCC1S(=O)(=O)Cl Amb26346385 [0,1,0,1,0,0|1,0,1]=4 6042 B12R1.76 CCC1CCCCC1S(=O)(=O)F Amb33352213 [0,1,0,1,0,0|1,0,1]=4 6043 B12R1.76 CCC1CCCCC1S(N)(=O)=O Amb25246011 [0,1,0,1,0,0|1,0,1]=4 6044 B12R1.151 CC1CCCCC1CS(=O)(=O)Cl Amb27635506 [0,1,0,1,0,0|1,0,1]=4 6045 B12R1.151 CC1CCCCC1CS(=O)(=O)F Amb33352697 [0,1,0,1,0,0|1,0,1]=4 6046 B12R1.151 CC1CCCCC1CS(N)(=O)=O Amb26537450 [0,1,0,1,0,0|1,0,1]=4 6047 B12R1.211 CC1CCCCCC1S(=O)(=O)Cl Amb32692912 [0,1,0,1,0,0|1,0,1]=4 6048 B12R1.211 CC1CCCCCC1S(=O)(=O)F Amb33352467 [0,1,0,1,0,0|1,0,1]=4 6049 B12R1.211 CC1CCCCCC1S(N)(=O)=O Amb32691838 [0,1,0,1,0,0|1,0,1]=4 6050 B12R1.890 CC(C)(O)CCCC1CCCC1 Amb33481436 [0,1,0,1,0,0|1,0,1]=4 6051 B12R1.890 NS(=O)(=O)CCCC1CCCC1 Amb33056122 [0,1,0,1,0,0|1,0,1]=4 6052 B12R1.890 O=S(=O)(Cl)CCCC1CCCC1 Amb33055703 [0,1,0,1,0,0|1,0,1]=4 6053 B12R1.890 O=S(=O)(F)CCCC1CCCC1 Amb33056155 [0,1,0,1,0,0|1,0,1]=4 6054 B12R1.891 CC(C)(O)CCC1CCCCC1 Amb27792222 [0,1,0,1,0,0|1,0,1]=4 6055 B12R1.891 NS(=O)(=O)CCC1CCCCC1 Amb25841057 [0,1,0,1,0,0|1,0,1]=4 6056 B12R1.891 O=S(=O)(Cl)CCC1CCCCC1 Amb33544723 [0,1,0,1,0,0|1,0,1]=4 6057 B12R1.891 O=S(=O)(F)CCC1CCCCC1 Amb32718351 [0,1,0,1,0,0|1,0,1]=4 6058 B12R1.891 O=S(=O)(O)CCC1CCCCN1 Amb27160643 [0,1,0,1,0,0|2,0,0]=4 6059 B12R1.891 O=S(=O)(O)CCC1CCNCC1 Amb10573545 [0,1,0,1,0,0|2,0,0]=4 6060 B12R1.2230 NS(=O)(=O)C1CCCCCCC1 Amb19078669 [0,1,0,1,0,0|1,0,1]=4 6061 B12R1.2230 O=S(=O)(Cl)C1CCCCCCC1 Amb26493537 [0,1,0,1,0,0|1,0,1]=4 6062 B12R1.2230 O=S(=O)(F)C1CCCCCCC1 Amb33352583 [0,1,0,1,0,0|1,0,1]=4 6063 B12R1.2240 CP(=O)(O)CN1CCCCCC1 Amb4300776 [0,1,0,1,0,0|2,0,0]=4 6064 B12R1.2240 NS(=O)(=O)CC1CCCCCC1 Amb28186895 [0,1,0,1,0,0|1,0,1]=4 6065 B12R1.2240 O=S(=O)(Cl)CC1CCCCCC1 Amb25068459 [0,1,0,1,0,0|1,0,1]=4 6066 B12R1.2240 O=S(=O)(F)CC1CCCCCC1 Amb33352632 [0,1,0,1,0,0|1,0,1]=4 6067 B12R1.2240 O=S(=O)(O)CC1CCCCCN1 Amb28436658 [0,1,0,1,0,0|2,0,0]=4 6068 B12R1.17 CCCC(=O)C1CCCC(=O)C1 Amb27264763 [0,1,0,1,0,0|1,0,1]=4 6069 B12R1.17 CCCC(C)C1CC(=O)CCO1 Amb28145719 [0,1,0,1,0,0|2,0,0]=4 6070 B12R1.17 CCCC(C)C1CCCC(=O)C1 Amb27434180 [0,1,0,1,0,0|1,0,0]=3 6071 B12R1.17 CCCC(C)[C@H]1CCC[C@H](O)C1 Amb27184256 [0,1,0,1,0,0|1,0,1]=4 6072 B12R1.17 CCCN(C)C1CCCC(=O)C1 Amb27799381 [0,1,0,1,0,0|2,0,0]=4 6073 B12R1.17 CCCS(=O)C1CCCC(=O)C1 Amb27622604 [0,1,0,1,0,0|2,0,0]=4 6074 B12R1.87 CCC1C(O)CCNC1C(=O)O Amb27178053 [0,1,0,1,0,0|1,0,0]=3 6075 B12R1.87 CCN1C(=O)CCCC1C(=O)O Amb27791736 [0,1,0,1,0,0|1,0,1]=4 6076 B12R1.87 CO[C@@H]1C(=O)CCC[C@@H]1C(=O)O Amb27881779 [0,1,0,1,0,0|1,0,1]=4 6077 B12R1.89 CC1CCC(CC(=O)O)C1CO Amb27178054 [0,1,0,1,0,0|1,0,0]=3 6078 B12R1.89 CC1CCN(CC(=O)O)C1CO Amb27750434 [0,1,0,1,0,0|2,0,0]=4 6079 B12R1.89 CCC1C(=O)OCC1CC(=O)O Amb25258337 [0,1,0,1,0,0|1,0,1]=4 6080 B12R1.89 CCC1C(C)CCN1CC(N)=O Amb27457210 [0,1,0,1,0,0|2,0,0]=4 6081 B12R1.89 CCN1C(=O)CCC1CC(=O)O Amb31289898 [0,1,0,1,0,0|1,0,1]=4 6082 B12R1.89 CC[C@@H]1C(=O)OC[C@@H]1CC(=O)O Amb27192122 [0,1,0,1,0,0|1,0,1]=4 6083 B12R1.233 CC(=O)CN1CCC(C)CC1C Amb18801420 [0,1,0,1,0,0|2,0,0]=4 6084 B12R1.233 CC(=O)N[C@H]1CC[C@@H](C)C[C@@H]1C Amb28325855 [0,1,0,1,0,0|2,0,0]=4 6085 B12R1.233 CC1CCC(CC(=O)O)C(O)C1 Amb18198275 [0,1,0,1,0,0|1,0,0]=3 6086 B12R1.233 CC1CCC(NC(=O)Cl)C(C)C1 Amb35633239 [0,1,0,1,0,0|2,0,0]=4 6087 B12R1.233 CC1CCC(NC(N)=O)C(C)C1 Amb27622103 [0,1,0,1,0,0|2,0,0]=4 6088 B12R1.233 CC1CCC(OC(=O)Cl)C(C)C1 Amb33297293 [0,1,0,1,0,0|2,0,0]=4 6089 B12R1.233 CC1CN(C)CCC1CC(=O)O Amb24570830 [0,1,0,1,0,0|1,0,0]=3 6090 B12R1.233 CN1CCC(CC(=O)O)C(O)C1 Amb18197972 [0,1,0,1,0,0|2,0,0]=4 6091 B12R1.233 C[C@@H]1NC(=O)CC[C@H]1CC(=O)O Amb18198652 [0,1,0,1,0,0|1,0,1]=4 6092 B12R1.233 C[C@H]1CCN(CC(N)=O)[C@@H](C)C1 Amb27261247 [0,1,0,1,0,0|2,0,0]=4 6093 B12R1.317 CCCC(N)C1CCCC1(C)O Amb35592891 [0,1,0,1,0,0|1,0,1]=4 6094 B12R1.317 CCCC(N)C1CCCS1(=O)=O Amb35639632 [0,1,0,1,0,0|1,0,1]=4 6095 B12R1.317 CCCC(O)C1CCCS1(=O)=O Amb35650003 [0,1,0,1,0,0|1,0,1]=4 6096 B12R1.861 CC(=O)CC[C@@H]1CC(=O)C[C@H]1C Amb27854615 [0,1,0,1,0,0|1,0,1]=4 6097 B12R1.861 CC(=O)CC[C@H]1CC(=O)C[C@H]1C Amb28247980 [0,1,0,1,0,0|1,0,1]=4 6098 B12R1.861 CC1CC(N)CN1CCC(N)=O Amb27803203 [0,1,0,1,0,0|2,0,0]=4 6099 B12R1.1007 CC1CCCCC(=O)CCCC1 Amb27177486 [0,1,0,1,0,0|1,0,0]=3 6100 B12R1.1007 O=C1CCCCC(=O)OCCC1 Amb17594258 [0,1,0,1,0,0|0,0,1]=3 6101 B12R1.1007 O=C1CCCCC(=O)OCCO1 Amb25892017 [0,1,0,1,0,0|1,0,1]=4 6102 B12R1.1007 O=C1CCCCC(O)CCCC1 Amb4020519 [0,1,0,1,0,0|1,0,0]=3 6103 B12R1.1007 O=C1CCCCC(O)CCCO1 Amb27443581 [0,1,0,1,0,0|0,0,0]=2 6104 B12R1.1007 O[C@H]1CCCC[C@@H](O)CCCC1 Amb28322085 [0,1,0,1,0,0|1,0,1]=4 6105 B12R1.1015 CC1=CCCC(C(=O)O)CCC1 Amb27841410 [0,1,0,1,0,0|0,0,2]=4 6106 B12R1.1015 NC1CCCC(C(=O)O)CCC1 Amb33347307 [0,1,0,1,0,0|0,0,0]=2 6107 B12R1.1015 O=C(O)C1CCCC(O)CCC1 Amb27487862 [0,1,0,1,0,0|0,0,0]=2 6108 B12R1.1356 CC(CCCCC(=O)O)C1CC1 Amb33227087 [0,1,0,1,0,0|0,0,0]=2 6109 B12R1.1356 O=C(O)CCCNC(=O)C1CC1 Amb1120072 [0,1,0,1,0,0|1,0,1]=4 6110 B12R1.1584 CCNC(=O)C1CCC1C(=O)O Amb27220035 [0,1,0,1,0,0|1,0,1]=4 6111 B12R1.1584 CCNC(=O)[C@@H]1CC[C@@H]1C(=O)O Amb27811129 [0,1,0,1,0,0|1,0,1]=4 6112 B12R1.1584 CCOC(=O)C1CCC1C(=O)O Amb32753545 [0,1,0,1,0,0|1,0,1]=4 6113 B12R1.1584 CCOC(=O)[C@@H]1CC[C@@H]1C(=O)O Amb32683495 [0,1,0,1,0,0|1,0,1]=4 6114 B12R1.1584 CCOC(=O)[C@@H]1CC[C@H]1C(=O)O Amb34151641 [0,1,0,1,0,0|1,0,1]=4 6115 B12R2.24 N=C1CC[C@@H]2CCCC[C@@H]2N1 Amb28060881 [0,0,0,2,0,0|2,0,0]=4 6116 B12R2.24 N=C1NC[C@@H]2CCCC[C@@H]2O1 Amb27788365 [0,0,0,2,0,0|2,0,0]=4 6117 B12R2.24 NC1=NC2CCCCC2CO1 Amb26003579 [0,0,0,2,0,0|2,0,0]=4 6118 B12R2.24 O=C1C=C2CCCCC2CC1 Amb17593740 [0,0,0,2,0,0|1,0,1]=4 6119 B12R2.24 O=C1C=C2CCCC[C@@H]2CC1 Amb28074789 [0,0,0,2,0,0|1,0,1]=4 6120 B12R2.24 O=C1CC2CCCCC2CN1 Amb27600042 [0,0,0,2,0,0|1,0,0]=3 6121 B12R2.24 O=C1CC2CCCCC2NN1 Amb28460723 [0,0,0,2,0,0|2,0,0]=4 6122 B12R2.24 O=C1CC2NCCCC2CN1 Amb27470207 [0,0,0,2,0,0|2,0,0]=4 6123 B12R2.24 O=C1CCC2=C(CCCC2)O1 Amb26013850 [0,0,0,2,0,0|0,0,2]=4 6124 B12R2.24 O=C1CCC2CCCCC2C1 Amb2782888 [0,0,0,2,0,0|1,0,0]=3 6125 B12R2.24 O=C1CCC2CCCCC2O1 Amb3361282 [0,0,0,2,0,0|0,0,0]=2 6126 B12R2.24 O=C1CCC2CCCCN2C1 Amb27950553 [0,0,0,2,0,0|2,0,0]=4 6127 B12R2.24 O=C1CCC2CCCC[C@H]2C1 Amb28122431 [0,0,0,2,0,0|1,0,0]=3 6128 B12R2.24 O=C1CCC2CCCNC2C1 Amb18644586 [0,0,0,2,0,0|2,0,0]=4 6129 B12R2.24 O=C1CCC2CCCOC2C1 Amb27599499 [0,0,0,2,0,0|2,0,0]=4 6130 B12R2.24 O=C1CCC2CCNCC2N1 Amb27839692 [0,0,0,2,0,0|2,0,0]=4 6131 B12R2.24 O=C1CCC2CCSCC2N1 Amb28318107 [0,0,0,2,0,0|2,0,0]=4 6132 B12R2.24 O=C1CCC2CNCCC2N1 Amb13888807 [0,0,0,2,0,0|2,0,0]=4 6133 B12R2.24 O=C1CCC2CNCCC2N1 Amb33549631 [0,0,0,2,0,0|2,0,0]=4 6134 B12R2.24 O=C1CCC2COCCC2C1 Amb26423658 [0,0,0,2,0,0|2,0,0]=4 6135 B12R2.24 O=C1CCC2COCCC2N1 Amb27639153 [0,0,0,2,0,0|2,0,0]=4 6136 B12R2.24 O=C1CCC2CSCCC2N1 Amb28041501 [0,0,0,2,0,0|2,0,0]=4 6137 B12R2.24 O=C1CCC2NCCCC2C1 Amb27232951 [0,0,0,2,0,0|2,0,0]=4 6138 B12R2.24 O=C1CCN2CCCCC2C1 Amb17778369 [0,0,0,2,0,0|2,0,0]=4 6139 B12R2.24 O=C1CC[C@@H]2CCCC[C@@H]2C1 Amb28246539 [0,0,0,2,0,0|1,0,0]=3 6140 B12R2.24 O=C1CC[C@@H]2CCCC[C@H]2C1 Amb17674190 [0,0,0,2,0,0|1,0,0]=3 6141 B12R2.24 O=C1CC[C@@H]2CCNC[C@H]2N1 Amb18200727 [0,0,0,2,0,0|2,0,0]=4 6142 B12R2.24 O=C1CC[C@@H]2CNCC[C@H]2N1 Amb18200730 [0,0,0,2,0,0|2,0,0]=4 6143 B12R2.24 O=C1CC[C@@H]2NCCC[C@H]2C1 Amb28457417 [0,0,0,2,0,0|2,0,0]=4 6144 B12R2.24 O=C1CC[C@H]2CCCC[C@H]2O1 Amb24590114 [0,0,0,2,0,0|0,0,0]=2 6145 B12R2.24 O=C1CC[C@H]2CNCC[C@@H]2C1 Amb27881809 [0,0,0,2,0,0|2,0,0]=4 6146 B12R2.24 O=C1CC[C@H]2CNCC[C@H]2N1 Amb27492957 [0,0,0,2,0,0|2,0,0]=4 6147 B12R2.24 O=C1CC[C@H]2COCC[C@@H]2C1 Amb27434232 [0,0,0,2,0,0|2,0,0]=4 6148 B12R2.24 O=C1CN2CCCCC2CN1 Amb32708548 [0,0,0,2,0,0|2,0,0]=4 6149 B12R2.24 O=C1CN2CCCC[C@H]2CN1 Amb25336412 [0,0,0,2,0,0|2,0,0]=4 6150 B12R2.24 O=C1CNC2CCCCC2N1 Amb9277175 [0,0,0,2,0,0|2,0,0]=4 6151 B12R2.24 O=C1CN[C@@H]2CCCC[C@@H]2N1 Amb25175818 [0,0,0,2,0,0|2,0,0]=4 6152 B12R2.24 O=C1CN[C@@H]2CCCC[C@H]2N1 Amb27851403 [0,0,0,2,0,0|2,0,0]=4 6153 B12R2.24 O=C1CN[C@H]2CCCC[C@@H]2C1 Amb27794443 [0,0,0,2,0,0|2,0,0]=4 6154 B12R2.24 O=C1CN[C@H]2CCCC[C@@H]2N1 Amb28246439 [0,0,0,2,0,0|2,0,0]=4 6155 B12R2.24 O=C1NC2CCNCC2CO1 Amb24360302 [0,0,0,2,0,0|2,0,0]=4 6156 B12R2.24 O=C1NC2CCNCC2CO1 Amb33473571 [0,0,0,2,0,0|2,0,0]=4 6157 B12R2.24 O=C1NC2CNCCC2CO1 Amb27478904 [0,0,0,2,0,0|2,0,0]=4 6158 B12R2.24 O=C1NCC2CCCCC2O1 Amb27176513 [0,0,0,2,0,0|1,0,0]=3 6159 B12R2.24 O=C1NCC2CCNCC2O1 Amb28428386 [0,0,0,2,0,0|2,0,0]=4 6160 B12R2.24 O=C1NC[C@@H]2CCCC[C@@H]2O1 Amb27877099 [0,0,0,2,0,0|1,0,0]=3 6161 B12R2.24 O=C1N[C@@H]2CCCC[C@H]2CO1 Amb27431413 [0,0,0,2,0,0|1,0,0]=3 6162 B12R2.24 O=C1N[C@@H]2CCNC[C@H]2CO1 Amb27804129 [0,0,0,2,0,0|2,0,0]=4 6163 B12R2.24 O=C1N[C@@H]2CCNC[C@H]2CO1 Amb33172737 [0,0,0,2,0,0|2,0,0]=4 6164 B12R2.24 O=C1N[C@@H]2CNCC[C@H]2CO1 Amb32664523 [0,0,0,2,0,0|2,0,0]=4 6165 B12R2.24 O=C1N[C@H]2CCCCC2CO1 Amb28251134 [0,0,0,2,0,0|1,0,0]=3 6166 B12R2.24 O=C1N[C@H]2CCNC[C@@H]2CO1 Amb28572082 [0,0,0,2,0,0|2,0,0]=4 6167 B12R2.24 O=C1N[C@H]2CNCC[C@@H]2CO1 Amb26551670 [0,0,0,2,0,0|2,0,0]=4 6168 B12R2.24 OC1CC2CCCCC2CO1 Amb28065116 [0,0,0,2,0,0|0,0,2]=4 6169 B12R2.24 OC1CCC2CCCCC2C1 Amb765625 [0,0,0,2,0,0|1,0,1]=4 6170 B12R2.24 OC1CCC2CCCCC2N1 Amb27225788 [0,0,0,2,0,0|1,0,1]=4 6171 B12R2.24 OC1CC[C@@H]2CCCC[C@H]2C1 Amb27781953 [0,0,0,2,0,0|1,0,1]=4 6172 B12R2.24 OC1CC[C@H]2CCCC[C@@H]2C1 Amb27422295 [0,0,0,2,0,0|1,0,1]=4 6173 B12R2.24 OC1CC[C@H]2CCCC[C@@H]2O1 Amb27849666 [0,0,0,2,0,0|0,0,2]=4 6174 B12R2.24 OC1CC[C@H]2CCCC[C@H]2C1 Amb26565110 [0,0,0,2,0,0|1,0,1]=4 6175 B12R2.24 OC1C[C@@H]2CCCC[C@@H]2CO1 Amb27978457 [0,0,0,2,0,0|0,0,2]=4 6176 B12R2.24 OC1C[C@H]2CCCC[C@H]2CO1 Amb27484688 [0,0,0,2,0,0|0,0,2]=4 6177 B12R2.24 O[C@@H]1CC[C@@H]2CCCC[C@H]2C1 Amb27198537 [0,0,0,2,0,0|1,0,1]=4 6178 B12R2.24 O[C@@H]1CC[C@H]2CCCC[C@H]2C1 Amb28205912 [0,0,0,2,0,0|1,0,1]=4 6179 B12R2.24 O[C@H]1CC[C@H]2CCCC[C@@H]2C1 Amb24556449 [0,0,0,2,0,0|1,0,1]=4 6180 B12R2.24 S=C1C[C@H]2CCCC[C@@H]2CN1 Amb27845473 [0,0,0,2,0,0|1,1,0]=4 6181 B12R2.24 S=C1NC2CCCCC2CO1 Amb28047334 [0,0,0,2,0,0|1,1,0]=4 6182 B12R2.26 CCC1CC12CCCC(=O)N2 Amb28367717 [0,0,0,2,0,0|1,0,0]=3 6183 B12R2.162 CCC[C@@H]1[C@H]2CC[C@@H]1C(=O)C2 Amb27432605 [0,0,0,2,0,0|1,0,0]=3 6184 B12R2.203 CC1CC[C@@H]2CCCC(=O)[C@H]12 Amb27204873 [0,0,0,2,0,0|1,0,0]=3 6185 B12R2.203 C[C@@H]1CCC[C@H]2CCC(=O)[C@H]21 Amb27802554 [0,0,0,2,0,0|1,0,0]=3 6186 B12R2.203 C[C@@H]1CC[C@@H]2CCCC(=O)[C@@H]21 Amb27844188 [0,0,0,2,0,0|1,0,0]=3 6187 B12R2.203 C[C@H]1CCC2=C1C(=O)CCC2 Amb27823659 [0,0,0,2,0,0|1,0,1]=4 6188 B12R2.203 C[C@H]1CCC[C@@H]2CCC(=O)[C@@H]12 Amb28052428 [0,0,0,2,0,0|1,0,0]=3 6189 B12R2.203 C[C@H]1CC[C@H]2CCCC(=O)[C@@H]12 Amb27216476 [0,0,0,2,0,0|1,0,0]=3 6190 B12R2.203 O=C1CCC2CCCC(O)N12 Amb28365589 [0,0,0,2,0,0|2,0,0]=4 6191 B12R2.203 O=C1CCC[C@@H]2CC[C@@H](O)[C@@H]12 Amb27440480 [0,0,0,2,0,0|2,0,0]=4 6192 B12R2.203 O=C1CC[C@H]2CCCC(O)N12 Amb28294266 [0,0,0,2,0,0|2,0,0]=4 6193 B12R2.203 O=C1CC[C@H]2CCC[C@@H](O)[C@H]12 Amb28411294 [0,0,0,2,0,0|2,0,0]=4 6194 B12R2.212 CC1CCC2CC1OC(=O)N2 Amb28074144 [0,0,0,2,0,0|2,0,0]=4 6195 B12R2.212 CN1CCC2CC(=O)CC1C2 Amb27234465 [0,0,0,2,0,0|2,0,0]=4 6196 B12R2.212 O=C1C[C@@H]2C[C@@H](CC[C@@H]2O)C1 Amb28052587 [0,0,0,2,0,0|2,0,0]=4 6197 B12R2.215 O=C1CC2CCCCC1CC2 Amb27256513 [0,0,0,2,0,0|1,0,0]=3 6198 B12R2.276 CCCC[C@H]1CC(=O)[C@@H]2C[C@H]12 Amb27427777 [0,0,0,2,0,0|1,0,0]=3 6199 B12R2.330 CC[C@@H]1C[C@H]2CN[C@@H]1C(=O)C2 Amb27782333 [0,0,0,2,0,0|2,0,0]=4 6200 B12R2.594 O=C1CC2CCCC(CN1)C2 Amb27224733 [0,0,0,2,0,0|2,0,0]=4 6201 B12R2.594 O=C1CCN2CCCC(C2)N1 Amb28129334 [0,0,0,2,0,0|2,0,0]=4 6202 B12R2.594 O=C1CNC2CCCC(C2)N1 Amb25202232 [0,0,0,2,0,0|2,0,0]=4 6203 B12R2.594 O=C1C[C@H]2CCC[C@@H](CN1)C2 Amb28052667 [0,0,0,2,0,0|2,0,0]=4 6204 B12R2.612 CC1CCC2CC(=O)NCC12 Amb28118427 [0,0,0,2,0,0|2,0,0]=4 6205 B12R2.612 C[C@@H]1CO[C@H]2CC(=O)CC[C@@H]12 Amb28074743 [0,0,0,2,0,0|2,0,0]=4 6206 B12R2.612 C[C@H]1CC[C@@H]2CC(=O)NC[C@H]12 Amb27841094 [0,0,0,2,0,0|2,0,0]=4 6207 B12R2.1020 O=C1C=C2CCCCC(C1)C2 Amb27164653 [0,0,0,2,0,0|1,0,1]=4 6208 B12R2.1020 OC1CC2CCCCC(C1)C2 Amb28069391 [0,0,0,2,0,0|1,0,1]=4 6209 B12R2.1081 O=C1CCCC2CCCCC12 Amb3941631 [0,0,0,2,0,0|1,0,0]=3 6210 B12R2.1081 O=C1CCCC2CNCCC12 Amb18125580 [0,0,0,2,0,0|2,0,0]=4 6211 B12R2.1081 O=C1CCCN2CCCCC12 Amb25337490 [0,0,0,2,0,0|2,0,0]=4 6212 B12R2.1081 O=C1CCC[C@@H]2CCCC[C@@H]12 Amb22800177 [0,0,0,2,0,0|1,0,0]=3 6213 B12R2.1081 O=C1CCC[C@@H]2CNCCN12 Amb25084217 [0,0,0,2,0,0|2,0,0]=4 6214 B12R2.1081 O=C1CCC[C@H]2CNCCN12 Amb25869368 [0,0,0,2,0,0|2,0,0]=4 6215 B12R2.1081 O=C1CCC[C@H]2NCCC[C@H]12 Amb27461786 [0,0,0,2,0,0|2,0,0]=4 6216 B12R2.1081 O=C1CCNC2CCCCC12 Amb1948705 [0,0,0,2,0,0|2,0,0]=4 6217 B12R2.1081 O=C1CCNC2CCCCN12 Amb26372843 [0,0,0,2,0,0|2,0,0]=4 6218 B12R2.1081 O=C1CCN[C@@H]2CCCC[C@@H]12 Amb1048126 [0,0,0,2,0,0|2,0,0]=4 6219 B12R2.1081 O=C1CCOC2CCCCC12 Amb18831001 [0,0,0,2,0,0|2,0,0]=4 6220 B12R2.1081 O=C1CCS[C@H]2CCCC[C@H]12 Amb27227098 [0,0,0,2,0,0|2,0,0]=4 6221 B12R2.1081 O=C1CNCC2CCCCN12 Amb10604047 [0,0,0,2,0,0|2,0,0]=4 6222 B12R2.1081 O=C1CNCC2CCCCN12 Amb22728017 [0,0,0,2,0,0|2,0,0]=4 6223 B12R2.1081 O=C1CNC[C@@H]2CCCCN12 Amb22751890 [0,0,0,2,0,0|2,0,0]=4 6224 B12R2.1081 O=C1CNC[C@H]2CCCCN12 Amb26480693 [0,0,0,2,0,0|2,0,0]=4 6225 B12R2.1081 O=C1NCCC2CCCNC12 Amb23455297 [0,0,0,2,0,0|2,0,0]=4 6226 B12R2.1081 O=C1NCCC2CCNCC12 Amb23455307 [0,0,0,2,0,0|2,0,0]=4 6227 B12R2.1081 O=C1NCCC2NCCCC12 Amb23455312 [0,0,0,2,0,0|2,0,0]=4 6228 B12R2.1081 O=C1NCCN2CCCCC12 Amb2692469 [0,0,0,2,0,0|2,0,0]=4 6229 B12R2.1081 O=C1NCC[C@@H]2CCNC[C@H]12 Amb31251634 [0,0,0,2,0,0|2,0,0]=4 6230 B12R2.1081 O=C1NCC[C@@H]2CCNC[C@H]12 Amb33457745 [0,0,0,2,0,0|2,0,0]=4 6231 B12R2.1081 O=C1NCO[C@H]2CCCC[C@H]12 Amb27464384 [0,0,0,2,0,0|2,0,0]=4 6232 B12R2.1081 O=C1OCCC2CNCCN12 Amb24404151 [0,0,0,2,0,0|2,0,0]=4 6233 B12R2.1081 O=C1OCCC2CNCCN12 Amb26371286 [0,0,0,2,0,0|2,0,0]=4 6234 B12R2.1081 O=C1OCCN2CCNCC12 Amb24095698 [0,0,0,2,0,0|2,0,0]=4 6235 B12R2.1081 O=C1OCC[C@@H]2CCCCN12 Amb27954932 [0,0,0,2,0,0|1,0,0]=3 6236 B12R2.1081 OC1CCCC2CCCCC12 Amb25701854 [0,0,0,2,0,0|1,0,1]=4 6237 B12R2.1081 OC1CCC[C@@H]2CCCC[C@H]12 Amb26443989 [0,0,0,2,0,0|1,0,1]=4 6238 B12R2.1081 OC1CCC[C@H]2CCCC[C@@H]12 Amb24763685 [0,0,0,2,0,0|1,0,1]=4 6239 B12R2.1081 O[C@@H]1CCC[C@@H]2CCCC[C@@H]21 Amb27427919 [0,0,0,2,0,0|1,0,1]=4 6240 B12R2.1081 O[C@@H]1CCC[C@H]2CCCC[C@H]12 Amb27646612 [0,0,0,2,0,0|1,0,1]=4 6241 B12R2.1081 O[C@H]1CCC[C@@H]2CCCCC12 Amb22504288 [0,0,0,2,0,0|1,0,1]=4 6242 B12R2.1824 O=C1CC2CC(CC2CO)O1 Amb27456594 [0,0,0,2,0,0|1,0,0]=3 6243 B12R2.1824 O=C1C[C@H]2C[C@H](C[C@@H]2CO)O1 Amb27422521 [0,0,0,2,0,0|1,0,0]=3 6244 B12R2.2092 CCCCC1[C@@H]2CCC(O)[C@H]12 Amb27653138 [0,0,0,2,0,0|1,0,1]=4 6245 B12R2.2092 CCCC[C@@H]1[C@@H]2CCC(=O)[C@@H]21 Amb27434195 [0,0,0,2,0,0|1,0,0]=3 6246 B12R2.2092 CCCC[C@@H]1[C@@H]2CC[C@@H](O)[C@@H]21 Amb27422532 [0,0,0,2,0,0|1,0,1]=4 6247 B12R2.2092 CCOCC1C2CCC(=O)C21 Amb28201173 [0,0,0,2,0,0|2,0,0]=4 6248 B12R2.2313 O=C1C=C(C2CCC2)CCC1 Amb28045365 [0,0,0,2,0,0|1,0,1]=4 6249 B12R2.2313 O=C1CCCC(C2CCC2)N1 Amb28460661 [0,0,0,2,0,0|1,0,0]=3 6250 B12R2.2313 O=C1CCCC(N2CCC2)C1 Amb27454622 [0,0,0,2,0,0|2,0,0]=4 6251 B12R2.2313 OC1CCCC(C2CCC2)C1 Amb27464184 [0,0,0,2,0,0|1,0,1]=4 6252 B12R2.5121 O=C1CC2(CCCC2)CCN1 Amb26926734 [0,0,0,2,0,0|2,0,0]=4 6253 B12R2.5121 O=C1CCCC2(CCCC2)N1 Amb24486123 [0,0,0,2,0,0|1,0,0]=3 6254 B12R2.5121 O=C1CCCC2(CCCO2)C1 Amb27640796 [0,0,0,2,0,0|2,0,0]=4 6255 B12R2.5121 O=C1CCCC2(CCNC2)N1 Amb28051714 [0,0,0,2,0,0|2,0,0]=4 6256 B12R2.5121 O=C1CCNC2(CCCC2)C1 Amb19374419 [0,0,0,2,0,0|2,0,0]=4 6257 B12R2.5121 O=C1CCNC2(CCCC2)C1 Amb9776203 [0,0,0,2,0,0|2,0,0]=4 6258 B12R2.5121 O=C1CCOC2(CCCC2)C1 Amb18200740 [0,0,0,2,0,0|2,0,0]=4 6259 B12R2.5121 O=C1CCSC2(CCCC2)C1 Amb18825509 [0,0,0,2,0,0|2,0,0]=4 6260 B12R2.5121 O=C1CNCC2(CCCC2)N1 Amb27434470 [0,0,0,2,0,0|2,0,0]=4 6261 B12R2.5121 O=C1NC2(CCCC2)CCO1 Amb27454592 [0,0,0,2,0,0|2,0,0]=4 6262 B12R2.5121 O=C1NCCC2(CCCC2)O1 Amb26446659 [0,0,0,2,0,0|1,0,0]=3 6263 B12R2.5121 O=C1NCCC2(CCOC2)O1 Amb26987846 [0,0,0,2,0,0|2,0,0]=4 6264 B12R2.5121 OC1CCCC2(CCCC2)C1 Amb27806595 [0,0,0,2,0,0|1,0,1]=4 6265 B12R2.6 ClC1=NCC(C2CCCC2)O1 Amb27625223 [0,0,0,2,0,0|2,0,0]=4 6266 B12R2.6 NC1=NCC(C2CCCC2)O1 Amb27752425 [0,0,0,2,0,0|2,0,0]=4 6267 B12R2.6 O=C1CC(C2CCCC2)CN1 Amb26641863 [0,0,0,2,0,0|2,0,0]=4 6268 B12R2.6 O=C1CCC(C2CCCC2)C1 Amb8503561 [0,0,0,2,0,0|1,0,0]=3 6269 B12R2.6 O=C1CCC(C2CCCC2)N1 Amb27846011 [0,0,0,2,0,0|1,0,0]=3 6270 B12R2.6 O=C1CCC(C2CCCO2)N1 Amb31188230 [0,0,0,2,0,0|2,0,0]=4 6271 B12R2.6 O=C1CCC(N2CCCC2)C1 Amb28058950 [0,0,0,2,0,0|2,0,0]=4 6272 B12R2.6 O=C1CCC(N2CCCC2)N1 Amb25339947 [0,0,0,2,0,0|2,0,0]=4 6273 B12R2.6 O=C1CC[C@@H](C2CCNC2)N1 Amb27817641 [0,0,0,2,0,0|2,0,0]=4 6274 B12R2.6 O=C1CC[C@H](C2CCCC2)C1 Amb28182520 [0,0,0,2,0,0|1,0,0]=3 6275 B12R2.6 O=C1COC(C2CCCC2)C1 Amb35734216 [0,0,0,2,0,0|2,0,0]=4 6276 B12R2.6 O=C1NC(C2CCCC2)CO1 Amb25147927 [0,0,0,2,0,0|2,0,0]=4 6277 B12R2.6 O=C1NCC(C2CCCC2)O1 Amb25046805 [0,0,0,2,0,0|1,0,0]=3 6278 B12R2.6 O=C1NCC(C2CCCO2)O1 Amb24407876 [0,0,0,2,0,0|2,0,0]=4 6279 B12R2.6 O=C1NCC(C2CCCS2)O1 Amb33415379 [0,0,0,2,0,0|2,0,0]=4 6280 B12R2.6 O=C1NCC(C2CCOC2)O1 Amb26372636 [0,0,0,2,0,0|2,0,0]=4 6281 B12R2.6 O=C1NCC(C2CCSC2)O1 Amb33345501 [0,0,0,2,0,0|2,0,0]=4 6282 B12R2.6 OC1=NC(C2CCCC2)CN1 Amb27264279 [0,0,0,2,0,0|2,0,0]=4 6283 B12R2.17 O=C1CC[C@]2(C[C@@H]2CCO)N1 Amb28345338 [0,0,0,2,0,0|2,0,0]=4 6284 B12R2.36 COC1CCC12CCC(=O)O2 Amb33036229 [0,0,0,2,0,0|1,0,0]=3 6285 B12R2.73 CCC1CC1N2CCC(=O)C2 Amb27778419 [0,0,0,2,0,0|2,0,0]=4 6286 B12R2.202 C[C@H]1CCC[C@@H]2CC(=O)CN12 Amb27802509 [0,0,0,2,0,0|2,0,0]=4 6287 B12R2.202 O=C1C[C@@H]2[C@@H](O)CCC[C@H]2O1 Amb27253623 [0,0,0,2,0,0|1,0,0]=3 6288 B12R2.202 O=C1C[C@@H]2[C@H](Br)CCC[C@@H]2C1 Amb27427924 [0,0,0,2,0,0|2,0,0]=4 6289 B12R2.375 COC1OCC2OC(=O)CC21 Amb22499994 [0,0,0,2,0,0|2,0,0]=4 6290 B12R2.375 CO[C@@H]1OC[C@@H]2OC(=O)C[C@@H]21 Amb24527808 [0,0,0,2,0,0|2,0,0]=4 6291 B12R2.375 CO[C@H]1OC[C@@H]2OC(=O)C[C@H]12 Amb26397440 [0,0,0,2,0,0|2,0,0]=4 6292 B12R2.375 CO[C@H]1OC[C@H]2OC(=O)C[C@H]21 Amb28250914 [0,0,0,2,0,0|2,0,0]=4 6293 B12R2.375 O=C1CC2C(CO)CCC2O1 Amb27621490 [0,0,0,2,0,0|1,0,0]=3 6294 B12R2.375 O=C1CC2C(CSC2CO)O1 Amb27768483 [0,0,0,2,0,0|2,0,0]=4 6295 B12R2.375 O=C1C[C@@H]2[C@@H](CO)CC[C@@H]2O1 Amb28069429 [0,0,0,2,0,0|1,0,0]=3 6296 B12R2.375 O=C1C[C@@H]2[C@@H](CO)SC[C@@H]2O1 Amb27198015 [0,0,0,2,0,0|2,0,0]=4 6297 B12R2.375 O=CC1CCC2OC(=O)CC12 Amb22342421 [0,0,0,2,0,0|1,0,1]=4 6298 B12R2.375 O=CC1CC[C@@H]2OC(=O)C[C@H]12 Amb27463356 [0,0,0,2,0,0|1,0,1]=4 6299 B12R2.459 O=C1C[C@@H]2CCC[C@@H](O)[C@H]1C2 Amb27195761 [0,0,0,2,0,0|2,0,0]=4 6300 B12R2.586 O=C1CCC2CCNCCN12 Amb24728512 [0,0,0,2,0,0|2,0,0]=4 6301 B12R2.586 O=C1CCC2CNCCCN12 Amb27962737 [0,0,0,2,0,0|2,0,0]=4 6302 B12R2.586 O=C1CC[C@@H]2CCCCC[C@H]12 Amb28351654 [0,0,0,2,0,0|1,0,0]=3 6303 B12R2.586 O=C1NC[C@@H]2CCCCC[C@H]12 Amb27853850 [0,0,0,2,0,0|1,0,0]=3 6304 B12R2.586 O=C1OCC2=C1CCCCC2 Amb27668945 [0,0,0,2,0,0|0,0,2]=4 6305 B12R2.586 OC1OCC2CCCCCC21 Amb27407454 [0,0,0,2,0,0|0,0,2]=4 6306 B12R2.586 OC1OC[C@@H]2CCCCC[C@H]12 Amb25346318 [0,0,0,2,0,0|0,0,2]=4 6307 B12R2.586 O[C@@H]1CC[C@@H]2CCCCC[C@@H]21 Amb27651831 [0,0,0,2,0,0|1,0,1]=4 6308 B12R2.586 O[C@H]1CC[C@@H]2CCCCC[C@H]12 Amb27478671 [0,0,0,2,0,0|1,0,1]=4 6309 B12R2.1041 O=C1C=C2CCCCCC2C1 Amb26053092 [0,0,0,2,0,0|1,0,1]=4 6310 B12R2.1041 O=C1C=C2CCCCCC2O1 Amb27848525 [0,0,0,2,0,0|0,0,2]=4 6311 B12R2.1041 O=C1CC2CCCCCC2C1 Amb24486177 [0,0,0,2,0,0|1,0,0]=3 6312 B12R2.1041 O=C1CC2CCCCCN2C1 Amb27851753 [0,0,0,2,0,0|2,0,0]=4 6313 B12R2.1041 O=C1CC2NCCCCC2N1 Amb27839666 [0,0,0,2,0,0|2,0,0]=4 6314 B12R2.1041 O=C1C[C@@H]2CCCCC[C@@H]2N1 Amb28455139 [0,0,0,2,0,0|1,0,0]=3 6315 B12R2.1041 O=C1C[C@@H]2CCCNC[C@H]2N1 Amb18200726 [0,0,0,2,0,0|2,0,0]=4 6316 B12R2.1041 O=C1C[C@@H]2CCNCC[C@H]2N1 Amb18200725 [0,0,0,2,0,0|2,0,0]=4 6317 B12R2.1041 O=C1C[C@@H]2CCNCC[C@H]2O1 Amb30527443 [0,0,0,2,0,0|1,0,0]=3 6318 B12R2.1041 O=C1C[C@@H]2CNCCC[C@H]2N1 Amb18200729 [0,0,0,2,0,0|2,0,0]=4 6319 B12R2.1041 O=C1C[C@H]2CCCCC[C@@H]2N1 Amb27446186 [0,0,0,2,0,0|1,0,0]=3 6320 B12R2.1041 O=C1C[C@H]2OCCCC[C@H]2N1 Amb27459725 [0,0,0,2,0,0|2,0,0]=4 6321 B12R2.1041 O=C1NC2CCCCCC2S1 Amb28068684 [0,0,0,2,0,0|1,1,0]=4 6322 B12R2.1041 OC1CC2CCCCCC2C1 Amb27649351 [0,0,0,2,0,0|1,0,1]=4 6323 B12R2.2298 NC1=NCC(CCC2CC2)O1 Amb27427482 [0,0,0,2,0,0|2,0,0]=4 6324 B12R2.2298 O=C1CCN(CCC2CC2)C1 Amb27455898 [0,0,0,2,0,0|2,0,0]=4 6325 B12R2.2298 O=C1COC(CCC2CC2)C1 Amb35717184 [0,0,0,2,0,0|2,0,0]=4 6326 B12R2.2298 O=C1NCC(CCC2CC2)O1 Amb27472173 [0,0,0,2,0,0|1,0,0]=3 6327 B12R2.2298 O=C1NCC(CNC2CC2)O1 Amb27660543 [0,0,0,2,0,0|2,0,0]=4 6328 B12R2.2301 O=C1CCC(CC2CCC2)O1 Amb33036268 [0,0,0,2,0,0|0,0,0]=2 6329 B12R2.2314 CC1CCCC12CC(=O)CO2 Amb35726697 [0,0,0,2,0,0|2,0,0]=4 6330 B12R2.2314 CC1CCCC12CN=C(N)O2 Amb27804446 [0,0,0,2,0,0|2,0,0]=4 6331 B12R2.2314 CC1CCCC12CNC(=O)C2 Amb27399849 [0,0,0,2,0,0|2,0,0]=4 6332 B12R2.2314 CC1COCC12CCC(=O)O2 Amb33036238 [0,0,0,2,0,0|1,0,0]=3 6333 B12R2.2314 CC1COCC12CNC(=O)O2 Amb35616380 [0,0,0,2,0,0|2,0,0]=4 6334 B12R2.2314 O=C1CCC2(CCCC2=O)O1 Amb25709581 [0,0,0,2,0,0|1,0,1]=4 6335 B12R2.2314 O=C1CCC2(CCCC2Br)O1 Amb27830083 [0,0,0,2,0,0|1,0,0]=3 6336 B12R2.2314 O=C1CC[C@@]2(CCC[C@@H]2O)N1 Amb27620489 [0,0,0,2,0,0|2,0,0]=4 6337 B12R2.2918 C=C1COC2(CCCCC2)O1 Amb25198632 [0,0,0,2,0,0|2,0,0]=4 6338 B12R2.2918 NC1=NCC2(CCCCC2)O1 Amb28119006 [0,0,0,2,0,0|2,0,0]=4 6339 B12R2.2918 O=C1CC2(CCCCC2)CN1 Amb7990390 [0,0,0,2,0,0|2,0,0]=4 6340 B12R2.2918 O=C1CC2(CCCCC2)CO1 Amb25697017 [0,0,0,2,0,0|2,0,0]=4 6341 B12R2.2918 O=C1CCC2(CCCCC2)C1 Amb28253675 [0,0,0,2,0,0|1,0,0]=3 6342 B12R2.2918 O=C1CCC2(CCCCC2)N1 Amb25984890 [0,0,0,2,0,0|1,0,0]=3 6343 B12R2.2918 O=C1CCC2(CCCCC2)O1 Amb574708 [0,0,0,2,0,0|0,0,0]=2 6344 B12R2.2918 O=C1CCC2(CCCNC2)O1 Amb22234691 [0,0,0,2,0,0|1,0,0]=3 6345 B12R2.2918 O=C1CCC2(CCCNC2)O1 Amb27202704 [0,0,0,2,0,0|1,0,0]=3 6346 B12R2.2918 O=C1CCC2(CCCOC2)N1 Amb28133157 [0,0,0,2,0,0|2,0,0]=4 6347 B12R2.2918 O=C1CCC2(CCCSC2)O1 Amb33036271 [0,0,0,2,0,0|1,0,0]=3 6348 B12R2.2918 O=C1CCC2(CCNCC2)N1 Amb19516953 [0,0,0,2,0,0|2,0,0]=4 6349 B12R2.2918 O=C1CCC2(CCNCC2)N1 Amb22587448 [0,0,0,2,0,0|2,0,0]=4 6350 B12R2.2918 O=C1CCC2(CCNCC2)N1 Amb22737011 [0,0,0,2,0,0|2,0,0]=4 6351 B12R2.2918 O=C1CCC2(CCNCC2)O1 Amb10070442 [0,0,0,2,0,0|1,0,0]=3 6352 B12R2.2918 O=C1CCC2(CCOCC2)C1 Amb33743523 [0,0,0,2,0,0|2,0,0]=4 6353 B12R2.2918 O=C1CCC2(CCOCC2)N1 Amb27262450 [0,0,0,2,0,0|2,0,0]=4 6354 B12R2.2918 O=C1CNC2(CCCCC2)N1 Amb15695109 [0,0,0,2,0,0|2,0,0]=4 6355 B12R2.2918 O=C1COC2(CCCCC2)N1 Amb27647406 [0,0,0,2,0,0|2,0,0]=4 6356 B12R2.2918 O=C1COC2(CCCCC2)O1 Amb9804079 [0,0,0,2,0,0|1,0,0]=3 6357 B12R2.2918 O=C1COC2(CCNCC2)O1 Amb28313977 [0,0,0,2,0,0|2,0,0]=4 6358 B12R2.2918 O=C1CSC2(CCCCC2)N1 Amb1086854 [0,0,0,2,0,0|2,0,0]=4 6359 B12R2.2918 O=C1NCC2(CCCCC2)O1 Amb17506327 [0,0,0,2,0,0|1,0,0]=3 6360 B12R2.2918 O=C1NCC2(CCCNC2)O1 Amb19516811 [0,0,0,2,0,0|2,0,0]=4 6361 B12R2.2918 O=C1NCC2(CCCNC2)O1 Amb22587308 [0,0,0,2,0,0|2,0,0]=4 6362 B12R2.2918 O=C1NCC2(CCCOC2)O1 Amb28070175 [0,0,0,2,0,0|2,0,0]=4 6363 B12R2.2918 O=C1NCC2(CCNCC2)O1 Amb15701361 [0,0,0,2,0,0|2,0,0]=4 6364 B12R2.2918 O=C1NCC2(CCNCC2)O1 Amb33096659 [0,0,0,2,0,0|2,0,0]=4 6365 B12R2.2918 O=C1NCC2(CCNCC2)O1 Amb33551124 [0,0,0,2,0,0|2,0,0]=4 6366 B12R2.2918 O=C1NCC2(CCOCC2)O1 Amb26977152 [0,0,0,2,0,0|2,0,0]=4 6367 B12R2.2918 O=C1OCC2(CCNCC2)O1 Amb15701375 [0,0,0,2,0,0|2,0,0]=4 6368 B12R2.2918 O=C1OCC2(CCNCC2)O1 Amb22587312 [0,0,0,2,0,0|2,0,0]=4 6369 B12R2.2918 OC1CCC2(CCCCC2)C1 Amb27760981 [0,0,0,2,0,0|1,0,1]=4 6370 B12R2.2918 OC1CCC2(CCCCC2)O1 Amb28068972 [0,0,0,2,0,0|0,0,2]=4 6371 B12R2.2918 S=C1NCC2(CCCCC2)O1 Amb28281543 [0,0,0,2,0,0|1,1,0]=4 6372 B12R2.549 CC1[C@@H]2CCCCC[C@@H](O)[C@H]12 Amb27472770 [0,0,0,2,0,0|1,0,1]=4 6373 B12R2.549 C[C@@H]1[C@@H]2[C@@H](O)CCCCC[C@H]12 Amb28064110 [0,0,0,2,0,0|1,0,1]=4 6374 B12R2.549 C[C@@H]1[C@@H]2[C@H](O)CCCCC[C@H]12 Amb27844225 [0,0,0,2,0,0|1,0,1]=4 6375 B12R2.550 O=C1CCCCCC2CC2C1 Amb28122424 [0,0,0,2,0,0|1,0,0]=3 6376 B12R2.2016 C1CCCCC2OC2CCC1 Amb6358048 [0,0,0,2,0,0|1,0,1]=4 6377 B12R2.255 N=C(N)C1CCCCC12CC2 Amb32658621 [0,0,0,2,0,0|2,0,0]=4 6378 B12R2.255 NC(=O)C1CCCCC12CC2 Amb32658617 [0,0,0,2,0,0|1,0,0]=3 6379 B12R2.255 NC(=O)C1CCOCC12CC2 Amb32658626 [0,0,0,2,0,0|2,0,0]=4 6380 B12R2.255 NC(=O)C1CNCCC12CC2 Amb27230051 [0,0,0,2,0,0|2,0,0]=4 6381 B12R2.255 NC(=S)C1CCCCC12CC2 Amb32658620 [0,0,0,2,0,0|1,1,0]=4 6382 B12R2.255 O=C(O)C1CCCCC12CC2 Amb18200739 [0,0,0,2,0,0|0,0,0]=2 6383 B12R2.255 O=C(O)C1NCCCC12CC2 Amb34912699 [0,0,0,2,0,0|1,0,0]=3 6384 B12R2.1365 CC(=O)N1C2CCCC1CC2 Amb28285665 [0,0,0,2,0,0|2,0,0]=4 6385 B12R2.1365 NC(=O)N1C2CCCC1CC2 Amb27804543 [0,0,0,2,0,0|2,0,0]=4 6386 B12R2.1365 O=C(O)C1C2CCC1CNC2 Amb13953127 [0,0,0,2,0,0|1,0,0]=3 6387 B12R2.1365 O=C(O)C1C2CCC1CNC2 Amb24612771 [0,0,0,2,0,0|1,0,0]=3 6388 B12R2.1365 O=C(O)C1[C@@H]2CC[C@H]1CNC2 Amb27787192 [0,0,0,2,0,0|1,0,0]=3 6389 B12R2.1365 O=C(O)[C@@H]1[C@@H]2CC[C@H]1CNC2 Amb19515673 [0,0,0,2,0,0|1,0,0]=3 6390 B12R2.1365 O=C(O)[C@H]1[C@@H]2CC[C@H]1CNC2 Amb19515674 [0,0,0,2,0,0|1,0,0]=3 6391 B12R2.1387 O=C(O)C1CCC2CC1CO2 Amb32645648 [0,0,0,2,0,0|1,0,0]=3 6392 B12R2.1387 O=C(O)C1CCC2CCC1N2 Amb25354424 [0,0,0,2,0,0|1,0,0]=3 6393 B12R2.1387 O=C(O)[C@@H]1CC[C@@H]2CC[C@H]1N2 Amb27637623 [0,0,0,2,0,0|1,0,0]=3 6394 B12R2.1387 O=C(O)[C@@H]1CC[C@@H]2CC[C@H]1N2 Amb33716329 [0,0,0,2,0,0|1,0,0]=3 6395 B12R2.1387 O=C(O)[C@@H]1CC[C@H]2CC[C@@H]1N2 Amb23440217 [0,0,0,2,0,0|1,0,0]=3 6396 B12R2.1387 O=C(O)[C@@H]1CC[C@H]2CC[C@@H]1O2 Amb27444125 [0,0,0,2,0,0|1,0,0]=3 6397 B12R2.1387 O=C(O)[C@@H]1CC[C@H]2CC[C@H]1C2 Amb27484139 [0,0,0,2,0,0|0,0,0]=2 6398 B12R2.1387 O=C(O)[C@@H]1CC[C@H]2CC[C@H]1O2 Amb33017537 [0,0,0,2,0,0|1,0,0]=3 6399 B12R2.1387 O=C(O)[C@@H]1CC[C@H]2C[C@@H]1CO2 Amb33189310 [0,0,0,2,0,0|1,0,0]=3 6400 B12R2.1387 O=C(O)[C@H]1CCC2CCC1C2 Amb28245248 [0,0,0,2,0,0|0,0,0]=2 6401 B12R2.1387 O=C(O)[C@H]1CC[C@@H]2CC[C@H]1N2 Amb26532205 [0,0,0,2,0,0|1,0,0]=3 6402 B12R2.1387 O=C(O)[C@H]1CC[C@@H]2CC[C@H]1N2 Amb32643941 [0,0,0,2,0,0|1,0,0]=3 6403 B12R2.1387 O=C(O)[C@H]1CC[C@H]2CC[C@@H]1C2 Amb28051873 [0,0,0,2,0,0|0,0,0]=2 6404 B12R2.1392 CC(=O)C1CC2CCC1CC2 Amb22728930 [0,0,0,2,0,0|1,0,0]=3 6405 B12R2.1392 CC(=O)C1CC2CCC1NC2 Amb27245359 [0,0,0,2,0,0|2,0,0]=4 6406 B12R2.1392 CC(=O)C1CC2CCN1CC2 Amb26979846 [0,0,0,2,0,0|2,0,0]=4 6407 B12R2.1392 CC(=O)N1CC2CCC1CC2 Amb27832910 [0,0,0,2,0,0|2,0,0]=4 6408 B12R2.1392 CC(O)C1CC2CCC1CC2 Amb28284293 [0,0,0,2,0,0|1,0,1]=4 6409 B12R2.1392 N=C(N)C1CC2CCC1CC2 Amb35627470 [0,0,0,2,0,0|2,0,0]=4 6410 B12R2.1392 NC(=O)C1CC2CCC1CC2 Amb2732953 [0,0,0,2,0,0|1,0,0]=3 6411 B12R2.1392 NC(=O)C1CC2CCC1CN2 Amb27793576 [0,0,0,2,0,0|2,0,0]=4 6412 B12R2.1392 NC(=O)C1NC2CCC1CC2 Amb26351986 [0,0,0,2,0,0|2,0,0]=4 6413 B12R2.1392 NC(=O)[C@H]1NC2CCC1CC2 Amb27949126 [0,0,0,2,0,0|2,0,0]=4 6414 B12R2.1392 NC(=S)C1CC2CCC1CC2 Amb30031017 [0,0,0,2,0,0|1,1,0]=4 6415 B12R2.1392 O=C(Cl)C1CC2CCN1CC2 Amb27849894 [0,0,0,2,0,0|2,0,0]=4 6416 B12R2.1392 O=C(O)C1CC2C=CC1CC2 Amb2732162 [0,0,0,2,0,0|0,0,2]=4 6417 B12R2.1392 O=C(O)C1CC2CCC1CC2 Amb27974531 [0,0,0,2,0,0|0,0,0]=2 6418 B12R2.1392 O=C(O)C1CC2CCC1NC2 Amb27956011 [0,0,0,2,0,0|1,0,0]=3 6419 B12R2.1392 O=C(O)C1CC2CCC1NC2 Amb28652994 [0,0,0,2,0,0|1,0,0]=3 6420 B12R2.1392 O=C(O)C1CC2CCN1CC2 Amb24074716 [0,0,0,2,0,0|1,0,0]=3 6421 B12R2.1392 O=C(O)C1CC2CCN1CC2 Amb8630244 [0,0,0,2,0,0|1,0,0]=3 6422 B12R2.1392 O=C(O)C1CN2CCC1CC2 Amb6316115 [0,0,0,2,0,0|1,0,0]=3 6423 B12R2.1392 O=C(O)C1CN2CCC1CC2 Amb6869690 [0,0,0,2,0,0|1,0,0]=3 6424 B12R2.1392 O=C(O)C1CN2CCN1CC2 Amb18200193 [0,0,0,2,0,0|2,0,0]=4 6425 B12R2.1392 O=C(O)C1CN2CCN1CC2 Amb33620703 [0,0,0,2,0,0|2,0,0]=4 6426 B12R2.1392 O=C(O)C1NC2CCC1CC2 Amb32665841 [0,0,0,2,0,0|1,0,0]=3 6427 B12R2.1392 O=C(O)C1NC2CCC1CC2 Amb8630240 [0,0,0,2,0,0|1,0,0]=3 6428 B12R2.1392 O=C(O)[C@@H]1CC2C=CC1CC2 Amb27409101 [0,0,0,2,0,0|0,0,2]=4 6429 B12R2.1392 O=C(O)[C@@H]1CC2CCC1CC2 Amb27444540 [0,0,0,2,0,0|0,0,0]=2 6430 B12R2.1392 O=C(O)[C@@H]1CC2CCN1CC2 Amb22262935 [0,0,0,2,0,0|1,0,0]=3 6431 B12R2.1392 O=C(O)[C@@H]1CC2CCN1CC2 Amb24074715 [0,0,0,2,0,0|1,0,0]=3 6432 B12R2.1392 O=C(O)[C@@H]1CN2CCC1CC2 Amb26651821 [0,0,0,2,0,0|1,0,0]=3 6433 B12R2.1392 O=C(O)[C@@H]1C[C@@H]2C=C[C@H]1CC2 Amb26570327 [0,0,0,2,0,0|0,0,2]=4 6434 B12R2.1392 O=C(O)[C@@H]1NC2CCC1CC2 Amb28076094 [0,0,0,2,0,0|1,0,0]=3 6435 B12R2.1392 O=C(O)[C@H]1CC2CCC1CC2 Amb27253575 [0,0,0,2,0,0|0,0,0]=2 6436 B12R2.1392 O=C(O)[C@H]1CC2CCN1CC2 Amb24074714 [0,0,0,2,0,0|1,0,0]=3 6437 B12R2.1392 O=C(O)[C@H]1CC2CCN1CC2 Amb24074717 [0,0,0,2,0,0|1,0,0]=3 6438 B12R2.1392 O=C(O)[C@H]1CN2CCC1CC2 Amb26053600 [0,0,0,2,0,0|1,0,0]=3 6439 B12R2.1392 O=C(O)[C@H]1C[C@@H]2C=C[C@H]1CC2 Amb27234648 [0,0,0,2,0,0|0,0,2]=4 6440 B12R2.1392 O=C(O)[C@H]1C[C@H]2CC[C@@H]1CO2 Amb27974249 [0,0,0,2,0,0|1,0,0]=3 6441 B12R2.1392 O=C(O)[C@H]1NC2CCC1CC2 Amb2372641 [0,0,0,2,0,0|1,0,0]=3 6442 B12R2.1392 O=S([O-])C1CC2CCC1CC2 Amb32755225 [0,0,0,2,0,0|1,0,1]=4 6443 B12R2.2028 CC1=CC(=O)[C@H]2CCCC[C@@H]12 Amb27861313 [0,0,0,2,0,0|1,0,1]=4 6444 B12R2.2028 CC1OC(=O)C2=C1CCCC2 Amb25921458 [0,0,0,2,0,0|0,0,2]=4 6445 B12R2.2028 CC1OC(=O)C2NCCCC12 Amb28365385 [0,0,0,2,0,0|1,0,0]=3 6446 B12R2.2028 CC1OC(=O)[C@@H]2NCCC[C@H]12 Amb27231641 [0,0,0,2,0,0|1,0,0]=3 6447 B12R2.2028 O=C1OC(=O)C2CCCCC12 Amb1156678 [0,0,0,2,0,0|1,0,1]=4 6448 B12R2.2028 O=C1OC(=O)[C@@H]2CCCC[C@@H]12 Amb20242491 [0,0,0,2,0,0|1,0,1]=4 6449 B12R2.2028 O=C1OC(=O)[C@@H]2CCCC[C@H]12 Amb8513495 [0,0,0,2,0,0|1,0,1]=4 6450 B12R2.2028 O=C1OC(=O)[C@H]2CCCC[C@H]12 Amb20242492 [0,0,0,2,0,0|1,0,1]=4 6451 B12R2.2028 O=C1OC(O)[C@H]2CCCC[C@@H]12 Amb28053672 [0,0,0,2,0,0|1,0,0]=3 6452 B12R2.2597 CC(=O)[C@@]12CCCC[C@@H]1[C@H]2C Amb28253707 [0,0,0,2,0,0|1,0,0]=3 6453 B12R2.2597 O=C(O)[C@@]12CCCC[C@@H]1[C@H]2Br Amb32680303 [0,0,0,2,0,0|1,0,0]=3 6454 B12R2.3852 NC1C2CCC1C(C(=O)O)C2 Amb24642247 [0,0,0,2,0,0|1,0,0]=3 6455 B12R2.3852 O=C(O)C1CC2CCC1C2=O Amb25095207 [0,0,0,2,0,0|1,0,1]=4 6456 B12R2.3852 O=C(O)C1CC2CCC1C2F Amb25197957 [0,0,0,2,0,0|1,0,0]=3 6457 B12R2.3852 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1[C@H]2O Amb27657730 [0,0,0,2,0,0|1,0,0]=3 6458 B12R2.3852 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2=O Amb25200972 [0,0,0,2,0,0|1,0,1]=4 6459 B12R2.3959 COC12CCCC1C2C(=O)O Amb28282832 [0,0,0,2,0,0|1,0,0]=3 6460 B12R2.7773 CCC1C2CCCC12C(C)=O Amb27599500 [0,0,0,2,0,0|1,0,0]=3 6461 B12R2.53 CCC1COCC12CC(=O)N2 Amb35616391 [0,0,0,2,0,0|2,0,0]=4 6462 B12R2.114 O=C1C=CC[C@@H]2CCC[C@@H]2C1 Amb28411254 [0,0,0,2,0,0|1,0,1]=4 6463 B12R2.114 O=C1CC2CCNC2CCN1 Amb27175292 [0,0,0,2,0,0|2,0,0]=4 6464 B12R2.114 O=C1CCCC2CNCC2N1 Amb28366921 [0,0,0,2,0,0|2,0,0]=4 6465 B12R2.114 O=C1CCC[C@@H]2CNC[C@@H]2N1 Amb33521821 [0,0,0,2,0,0|2,0,0]=4 6466 B12R2.114 O=C1CCC[C@@H]2CNC[C@H]2N1 Amb18200733 [0,0,0,2,0,0|2,0,0]=4 6467 B12R2.114 O=C1CCC[C@H]2CCC[C@@H]2C1 Amb27434256 [0,0,0,2,0,0|1,0,0]=3 6468 B12R2.114 O=C1COCC2CCCC2N1 Amb26394403 [0,0,0,2,0,0|2,0,0]=4 6469 B12R2.246 CC1=CC(=O)[C@@H]2CCC[C@@H]2C1 Amb28199875 [0,0,0,2,0,0|1,0,1]=4 6470 B12R2.246 CC1=CC(=O)[C@H]2CCC[C@@H]2C1 Amb27855002 [0,0,0,2,0,0|1,0,1]=4 6471 B12R2.246 CC1CC(=O)C2CCCC2O1 Amb18830998 [0,0,0,2,0,0|2,0,0]=4 6472 B12R2.246 CC1CC2CCNC2C(=O)N1 Amb27787252 [0,0,0,2,0,0|2,0,0]=4 6473 B12R2.246 C[C@@H]1CC(=O)N[C@@H]2CCC[C@H]12 Amb24547017 [0,0,0,2,0,0|2,0,0]=4 6474 B12R2.246 C[C@@H]1CC(=O)[C@@H]2CCC[C@@H]2N1 Amb27482637 [0,0,0,2,0,0|2,0,0]=4 6475 B12R2.246 C[C@@H]1C[C@H]2CCN[C@H]2C(=O)N1 Amb27213340 [0,0,0,2,0,0|2,0,0]=4 6476 B12R2.246 C[C@H]1CC(=O)N[C@H]2CCC[C@@H]12 Amb27879486 [0,0,0,2,0,0|2,0,0]=4 6477 B12R2.298 O=C(O)CC1CCCC12CC2 Amb18200738 [0,0,0,2,0,0|0,0,0]=2 6478 B12R2.298 O=C(O)CC1CNCC12CC2 Amb31028932 [0,0,0,2,0,0|1,0,0]=3 6479 B12R2.1362 CC(=O)C1CCN2CCCC12 Amb25723255 [0,0,0,2,0,0|2,0,0]=4 6480 B12R2.1362 CC(=O)N1CCC2CCCC21 Amb26033416 [0,0,0,2,0,0|2,0,0]=4 6481 B12R2.1362 NC(=O)C1NCC2CCCC21 Amb23585283 [0,0,0,2,0,0|2,0,0]=4 6482 B12R2.1362 NC(=O)C1OCC2CCCC21 Amb27836582 [0,0,0,2,0,0|2,0,0]=4 6483 B12R2.1362 NC(=O)[C@@H]1CC[C@H]2CCC[C@H]21 Amb27650691 [0,0,0,2,0,0|1,0,0]=3 6484 B12R2.1362 NC(=O)[C@@H]1NC[C@@H]2CCC[C@@H]21 Amb33495967 [0,0,0,2,0,0|2,0,0]=4 6485 B12R2.1362 NC(=O)[C@@H]1NC[C@H]2CCC[C@H]21 Amb35789885 [0,0,0,2,0,0|2,0,0]=4 6486 B12R2.1362 NC(=O)[C@H]1CC[C@@H]2CCC[C@@H]21 Amb28291613 [0,0,0,2,0,0|1,0,0]=3 6487 B12R2.1362 NC(=O)[C@H]1CC[C@@H]2CCC[C@H]21 Amb27210405 [0,0,0,2,0,0|1,0,0]=3 6488 B12R2.1362 O=C(Cl)C1CCC2CCCC21 Amb27165069 [0,0,0,2,0,0|1,0,0]=3 6489 B12R2.1362 O=C(O)C1=C2CCCC2CC1 Amb27961330 [0,0,0,2,0,0|0,0,2]=4 6490 B12R2.1362 O=C(O)C1CCC2CC=CC21 Amb27176583 [0,0,0,2,0,0|0,0,2]=4 6491 B12R2.1362 O=C(O)C1CCC2CCCN21 Amb28239751 [0,0,0,2,0,0|1,0,0]=3 6492 B12R2.1362 O=C(O)C1CCC2CNCC21 Amb19515676 [0,0,0,2,0,0|1,0,0]=3 6493 B12R2.1362 O=C(O)C1CC[C@H]2CCC[C@@H]12 Amb27419964 [0,0,0,2,0,0|0,0,0]=2 6494 B12R2.1362 O=C(O)C1CNC2COCC21 Amb28435371 [0,0,0,2,0,0|2,0,0]=4 6495 B12R2.1362 O=C(O)C1COC2COCC21 Amb33742478 [0,0,0,2,0,0|2,0,0]=4 6496 B12R2.1362 O=C(O)C1NCC2CCCC21 Amb10604049 [0,0,0,2,0,0|1,0,0]=3 6497 B12R2.1362 O=C(O)C1NCC2CCCC21 Amb23585510 [0,0,0,2,0,0|1,0,0]=3 6498 B12R2.1362 O=C(O)C1NC[C@@H]2CCC[C@H]12 Amb28056189 [0,0,0,2,0,0|1,0,0]=3 6499 B12R2.1362 O=C(O)C1NOC2CCCC21 Amb26423696 [0,0,0,2,0,0|2,0,0]=4 6500 B12R2.1362 O=C(O)C1NOC2CCCC21 Amb33496182 [0,0,0,2,0,0|2,0,0]=4 6501 B12R2.1362 O=C(O)C1OCC2CCCC21 Amb26872385 [0,0,0,2,0,0|1,0,0]=3 6502 B12R2.1362 O=C(O)C1OCC2NCCC21 Amb18200015 [0,0,0,2,0,0|2,0,0]=4 6503 B12R2.1362 O=C(O)[C@@H]1C=C[C@H]2CCC[C@H]21 Amb27433928 [0,0,0,2,0,0|0,0,2]=4 6504 B12R2.1362 O=C(O)[C@@H]1CCN2CCC[C@H]12 Amb27439856 [0,0,0,2,0,0|1,0,0]=3 6505 B12R2.1362 O=C(O)[C@@H]1CC[C@@H]2CCC[C@@H]21 Amb27253193 [0,0,0,2,0,0|0,0,0]=2 6506 B12R2.1362 O=C(O)[C@@H]1CC[C@H]2CCC[C@H]21 Amb24578118 [0,0,0,2,0,0|0,0,0]=2 6507 B12R2.1362 O=C(O)[C@@H]1CO[C@@H]2CNC[C@@H]21 Amb35749753 [0,0,0,2,0,0|2,0,0]=4 6508 B12R2.1362 O=C(O)[C@@H]1CO[C@@H]2CNC[C@@H]21 Amb35753146 [0,0,0,2,0,0|2,0,0]=4 6509 B12R2.1362 O=C(O)[C@@H]1CO[C@@H]2OCC[C@@H]21 Amb33715559 [0,0,0,2,0,0|2,0,0]=4 6510 B12R2.1362 O=C(O)[C@@H]1NC[C@@H]2CCC[C@@H]21 Amb27421988 [0,0,0,2,0,0|1,0,0]=3 6511 B12R2.1362 O=C(O)[C@@H]1NC[C@@H]2CCC[C@@H]21 Amb31158274 [0,0,0,2,0,0|1,0,0]=3 6512 B12R2.1362 O=C(O)[C@@H]1NC[C@H]2CCC[C@H]21 Amb22745648 [0,0,0,2,0,0|1,0,0]=3 6513 B12R2.1362 O=C(O)[C@@H]1NO[C@H]2CCC[C@H]21 Amb28385555 [0,0,0,2,0,0|2,0,0]=4 6514 B12R2.1362 O=C(O)[C@@H]1OC[C@@H]2CCC[C@@H]21 Amb32675029 [0,0,0,2,0,0|1,0,0]=3 6515 B12R2.1362 O=C(O)[C@H]1CCN2CCCC12 Amb27602806 [0,0,0,2,0,0|1,0,0]=3 6516 B12R2.1362 O=C(O)[C@H]1CCN2CCC[C@@H]12 Amb27459026 [0,0,0,2,0,0|1,0,0]=3 6517 B12R2.1362 O=C(O)[C@H]1CCN2CCC[C@H]12 Amb27654429 [0,0,0,2,0,0|1,0,0]=3 6518 B12R2.1362 O=C(O)[C@H]1CC[C@H]2CCC[C@@H]12 Amb28144821 [0,0,0,2,0,0|0,0,0]=2 6519 B12R2.1362 O=C(O)[C@H]1NC[C@@H]2CCC[C@H]12 Amb22585304 [0,0,0,2,0,0|1,0,0]=3 6520 B12R2.1362 O=C(O)[C@H]1NC[C@@H]2CCC[C@H]12 Amb2382895 [0,0,0,2,0,0|1,0,0]=3 6521 B12R2.1362 O=C(O)[C@H]1NO[C@@H]2CCC[C@H]12 Amb27966808 [0,0,0,2,0,0|2,0,0]=4 6522 B12R2.1367 NC(=O)CC1C2CCC1CC2 Amb28368421 [0,0,0,2,0,0|1,0,0]=3 6523 B12R2.1367 NC(=O)CN1C2CCC1CC2 Amb27649788 [0,0,0,2,0,0|2,0,0]=4 6524 B12R2.1367 O=C(O)CC1C2C=CC1CC2 Amb27176432 [0,0,0,2,0,0|0,0,2]=4 6525 B12R2.1367 O=C(O)CC1C2CCC1CC2 Amb25765697 [0,0,0,2,0,0|0,0,0]=2 6526 B12R2.1661 CC(=O)CC1CC2CCC1C2 Amb26854646 [0,0,0,2,0,0|1,0,0]=3 6527 B12R2.1661 CC(=O)CC1CC2CCC1O2 Amb32876101 [0,0,0,2,0,0|2,0,0]=4 6528 B12R2.1661 CC(=O)CC1C[C@H]2CC[C@@H]1C2 Amb27844149 [0,0,0,2,0,0|1,0,0]=3 6529 B12R2.1661 CC(=O)N[C@H]1CC2CCC1C2 Amb25225741 [0,0,0,2,0,0|2,0,0]=4 6530 B12R2.1661 CC(=O)OC1CC2CCC1C2 Amb4014580 [0,0,0,2,0,0|2,0,0]=4 6531 B12R2.1661 CC(=O)OC1C[C@H]2CC[C@@H]1C2 Amb28254572 [0,0,0,2,0,0|2,0,0]=4 6532 B12R2.1661 CC(O)CC1CC2CCC1C2 Amb24434345 [0,0,0,2,0,0|1,0,1]=4 6533 B12R2.1661 CN(O)CC1CC2CCC1C2 Amb33143697 [0,0,0,2,0,0|2,0,0]=4 6534 B12R2.1661 C[C@@H](O)CC1CC2CCC1C2 Amb33143333 [0,0,0,2,0,0|1,0,1]=4 6535 B12R2.1661 C[C@H](O)CC1CC2CCC1C2 Amb33143334 [0,0,0,2,0,0|1,0,1]=4 6536 B12R2.1661 N=C(N)CC1CC2CCC1C2 Amb24700123 [0,0,0,2,0,0|2,0,0]=4 6537 B12R2.1661 N=C(N)CC1CC2CCC1C2 Amb33620538 [0,0,0,2,0,0|2,0,0]=4 6538 B12R2.1661 NC(=O)CC1CC2CCC1C2 Amb8333628 [0,0,0,2,0,0|1,0,0]=3 6539 B12R2.1661 NC(=O)CC1C[C@@H]2CC[C@H]1C2 Amb24550040 [0,0,0,2,0,0|1,0,0]=3 6540 B12R2.1661 NC(=O)NC1CC2CCC1C2 Amb28061165 [0,0,0,2,0,0|2,0,0]=4 6541 B12R2.1661 NC(=O)O[C@H]1C[C@H]2CC[C@H]1C2 Amb28436659 [0,0,0,2,0,0|2,0,0]=4 6542 B12R2.1661 NC(=S)CC1CC2CCC1C2 Amb25110806 [0,0,0,2,0,0|1,1,0]=4 6543 B12R2.1661 NS(=O)CC1CC2CCC1C2 Amb32720588 [0,0,0,2,0,0|2,0,0]=4 6544 B12R2.1661 O=C(Cl)CC1CC2CCC1C2 Amb6743376 [0,0,0,2,0,0|1,0,0]=3 6545 B12R2.1661 O=C(Cl)NC1CC2CCC1C2 Amb35625926 [0,0,0,2,0,0|2,0,0]=4 6546 B12R2.1661 O=C(O)CC1CC2C=CC1C2 Amb26360464 [0,0,0,2,0,0|0,0,2]=4 6547 B12R2.1661 O=C(O)CC1CC2CCC1C2 Amb9703154 [0,0,0,2,0,0|0,0,0]=2 6548 B12R2.1661 O=C(O)CC1CC2CCC1O2 Amb18200227 [0,0,0,2,0,0|1,0,0]=3 6549 B12R2.1661 O=C(O)CC1C[C@@H]2CC[C@H]1C2 Amb3940184 [0,0,0,2,0,0|0,0,0]=2 6550 B12R2.1661 O=C(O)CC1C[C@H]2C=C[C@@H]1C2 Amb24706706 [0,0,0,2,0,0|0,0,2]=4 6551 B12R2.1661 O=C(O)CC1C[C@H]2CC[C@@H]1C2 Amb27449302 [0,0,0,2,0,0|0,0,0]=2 6552 B12R2.1661 O=C(O)CN1CC2CCC1C2 Amb35752647 [0,0,0,2,0,0|1,0,0]=3 6553 B12R2.1661 O=C(O)CN1CC2CCC1C2 Amb3941222 [0,0,0,2,0,0|1,0,0]=3 6554 B12R2.1661 O=C(O)CN1C[C@@H]2CC[C@H]1C2 Amb10844645 [0,0,0,2,0,0|1,0,0]=3 6555 B12R2.1661 O=C(O)C[C@@H]1C[C@@H]2C=C[C@H]1C2 Amb10607426 [0,0,0,2,0,0|0,0,2]=4 6556 B12R2.1661 O=C(O)C[C@H]1C[C@H]2CC[C@@H]1C2 Amb27419930 [0,0,0,2,0,0|0,0,0]=2 6557 B12R2.1661 O=C(O)\C=C1\CC2CCC1C2 Amb24509294 [0,0,0,2,0,0|0,0,2]=4 6558 B12R2.1661 O=S(Cl)CC1CC2CCC1C2 Amb32720587 [0,0,0,2,0,0|2,0,0]=4 6559 B12R2.1661 O=S([O-])CC1CC2CCC1C2 Amb32755255 [0,0,0,2,0,0|1,0,1]=4 6560 B12R2.1661 O=[N+]([O-])CC1CC2CCC1C2 Amb33143315 [0,0,0,2,0,0|1,0,1]=4 6561 B12R2.1661 OB(O)C[C@@H]1C[C@H]2CC[C@@H]1C2 Amb27448788 [0,0,0,2,0,0|1,0,1]=4 6562 B12R2.1954 CCC1NCC2C(C(=O)O)C12 Amb18200473 [0,0,0,2,0,0|1,0,0]=3 6563 B12R2.2025 N[C@@H]1[C@@H](C(=O)O)[C@H]2CCC[C@@H]12 Amb35789448 [0,0,0,2,0,0|1,0,0]=3 6564 B12R2.2025 N[C@@H]1[C@@H](C(=O)O)[C@H]2CCC[C@@H]12 Amb35789751 [0,0,0,2,0,0|1,0,0]=3 6565 B12R2.2043 O=C1CC2CCCC2(CO)C1 Amb28285020 [0,0,0,2,0,0|2,0,0]=4 6566 B12R2.2043 O=C1C[C@@H]2CCC[C@]2(CO)C1 Amb28285828 [0,0,0,2,0,0|2,0,0]=4 6567 B12R2.2257 CCN1C2CCC1CC(=O)C2 Amb8056522 [0,0,0,2,0,0|2,0,0]=4 6568 B12R2.2257 CCN1[C@H]2CC[C@@H]1CC(=O)C2 Amb28342808 [0,0,0,2,0,0|2,0,0]=4 6569 B12R2.2257 CO[C@@H]1[C@H]2CC[C@@H]1NC(=O)C2 Amb27867341 [0,0,0,2,0,0|2,0,0]=4 6570 B12R2.2257 O=C[C@H]1[C@@H]2CC[C@H]1OC(=O)C2 Amb27440395 [0,0,0,2,0,0|1,0,1]=4 6571 B12R2.22 O=C1CC(C2CCCCC2)C1 Amb26984732 [0,0,0,2,0,0|1,0,0]=3 6572 B12R2.22 O=C1CC(C2CCCCC2)O1 Amb27445110 [0,0,0,2,0,0|0,0,0]=2 6573 B12R2.22 O=C1CC(C2CCCCO2)N1 Amb35742186 [0,0,0,2,0,0|2,0,0]=4 6574 B12R2.22 O=C1CC(C2CCCOC2)N1 Amb27647813 [0,0,0,2,0,0|2,0,0]=4 6575 B12R2.22 O=C1CC(C2CCOCC2)C1 Amb26627119 [0,0,0,2,0,0|2,0,0]=4 6576 B12R2.87 CC1NCCCC12CC(=O)N2 Amb28130874 [0,0,0,2,0,0|2,0,0]=4 6577 B12R2.1058 O=C1CC2(CCCCCC2)C1 Amb28314770 [0,0,0,2,0,0|1,0,0]=3 6578 B12R2.1058 O=C1CC2(CCCCCC2)N1 Amb26363368 [0,0,0,2,0,0|1,0,0]=3 6579 B12R2.1058 O=C1CC2(CCCSCC2)N1 Amb35610981 [0,0,0,2,0,0|2,0,0]=4 6580 B12R2.1058 OC1CC2(CCCCCC2)C1 Amb28290182 [0,0,0,2,0,0|1,0,1]=4 6581 B12R2.1067 O=C1CC2=C1CCCCCC2 Amb28144214 [0,0,0,2,0,0|1,0,1]=4 6582 B12R2.1067 O=C1CC2CCCCCCC12 Amb27666446 [0,0,0,2,0,0|1,0,0]=3 6583 B12R2.1067 O=C1C[C@@H]2CCCCCC[C@H]12 Amb28429638 [0,0,0,2,0,0|1,0,0]=3 6584 B12R2.1067 O=C1NC2CCCCCCC12 Amb20667702 [0,0,0,2,0,0|1,0,0]=3 6585 B12R2.1067 O=C1N[C@@H]2CCCCCC[C@H]12 Amb26891895 [0,0,0,2,0,0|1,0,0]=3 6586 B12R2.1067 O=C1N[C@H]2CCCCCC[C@@H]12 Amb27207647 [0,0,0,2,0,0|1,0,0]=3 6587 B12R2.19 C[C@@]12CCCC[C@@H]1CC(=O)C2 Amb27844101 [0,0,0,2,0,0|1,0,0]=3 6588 B12R2.19 C[C@@]12CCCC[C@H]1CC(=O)C2 Amb27818183 [0,0,0,2,0,0|1,0,0]=3 6589 B12R2.19 C[C@]12CCCC[C@H]1CC(=O)C2 Amb25179810 [0,0,0,2,0,0|1,0,0]=3 6590 B12R2.19 C[C@]12CCCC[C@H]1CC(O)C2 Amb27844224 [0,0,0,2,0,0|1,0,1]=4 6591 B12R2.19 C[C@]12CCCC[C@H]1NC(=O)O2 Amb27841050 [0,0,0,2,0,0|1,0,0]=3 6592 B12R2.19 C[C@]12CCCC[C@H]1OC(=O)N2 Amb26425025 [0,0,0,2,0,0|2,0,0]=4 6593 B12R2.1085 CC(=O)C1C2CCCN(C)C21 Amb28411273 [0,0,0,2,0,0|2,0,0]=4 6594 B12R2.1085 CN1CCCC2C(C(=O)O)C21 Amb18200454 [0,0,0,2,0,0|1,0,0]=3 6595 B12R2.1085 NC1CCCC2C(C(=O)O)C12 Amb26930592 [0,0,0,2,0,0|1,0,0]=3 6596 B12R2.1085 NC1CCC[C@H]2[C@H](C(=O)O)[C@@H]12 Amb27403148 [0,0,0,2,0,0|1,0,0]=3 6597 B12R2.1085 O=C(O)C1C2CCCC(=O)C21 Amb27816456 [0,0,0,2,0,0|1,0,1]=4 6598 B12R2.1085 O=C(O)C1C2CCCC(O)C21 Amb28411208 [0,0,0,2,0,0|1,0,0]=3 6599 B12R2.1085 O=C(O)[C@@H]1[C@H]2C(=O)CCC[C@@H]12 Amb26907624 [0,0,0,2,0,0|1,0,1]=4 6600 B12R2.1085 O=C(O)[C@@H]1[C@H]2CCCC(=O)[C@H]21 Amb35745886 [0,0,0,2,0,0|1,0,1]=4 6601 B12R2.1129 NC1CC2CCC1C2C(=O)O Amb23454093 [0,0,0,2,0,0|1,0,0]=3 6602 B12R2.1129 O=C(O)C1C2CC[C@@H]1C(=O)C2 Amb27407063 [0,0,0,2,0,0|1,0,1]=4 6603 B12R2.1129 O=C(O)C1[C@@H]2CC[C@@H]1C[C@H]2O Amb27781553 [0,0,0,2,0,0|1,0,0]=3 6604 B12R2.1129 O=C(O)C1[C@H]2CC[C@@H]1[C@@H](O)C2 Amb28291538 [0,0,0,2,0,0|1,0,0]=3 6605 B12R2.1129 O=C(O)[C@H]1[C@@H]2CC[C@H]1C(=O)C2 Amb27433899 [0,0,0,2,0,0|1,0,1]=4 6606 B12R2.1129 O=C(O)[C@H]1[C@@H]2CN[C@H]1[C@H](O)C2 Amb35750412 [0,0,0,2,0,0|2,0,0]=4 6607 B12R2.1129 O=C(O)[C@H]1[C@@H]2CN[C@H]1[C@H](O)C2 Amb35752038 [0,0,0,2,0,0|2,0,0]=4 6608 B12R2.1154 CC1[C@H]2CCC[C@@H]1CC(O)C2 Amb28120703 [0,0,0,2,0,0|1,0,1]=4 6609 B12R2.1154 CN1C2CCCC1CC(=O)C2 Amb2690009 [0,0,0,2,0,0|2,0,0]=4 6610 B12R2.1154 CN1[C@H]2CCC[C@@H]1CC(=O)C2 Amb28314591 [0,0,0,2,0,0|2,0,0]=4 6611 B12R2.1412 CC(=O)NC12CCCCC1C2 Amb35724139 [0,0,0,2,0,0|2,0,0]=4 6612 B12R2.1412 NC(=O)NC12CCCCC1C2 Amb35723901 [0,0,0,2,0,0|2,0,0]=4 6613 B12R2.1412 O=C(Cl)NC12CCCCC1C2 Amb35633602 [0,0,0,2,0,0|2,0,0]=4 6614 B12R2.1412 O=C(O)CC12CCCCC1C2 Amb25362080 [0,0,0,2,0,0|0,0,0]=2 6615 B12R2.1420 O=C(O)CC1CCC2CC1C2 Amb27657859 [0,0,0,2,0,0|0,0,0]=2 6616 B12R2.3126 CC12CCCCC1C2C(=O)O Amb27490809 [0,0,0,2,0,0|0,0,0]=2 6617 B12R2.3126 CC12CCCCC1C2C(N)=O Amb25097167 [0,0,0,2,0,0|1,0,0]=3 6618 B12R2.3126 C[C@]12CCCC[C@H]1[C@@H]2C(=O)O Amb27865448 [0,0,0,2,0,0|0,0,0]=2 6619 B12R2.3190 CC(=O)[C@H]1C[C@@H]2CCCC[C@@H]21 Amb27227096 [0,0,0,2,0,0|1,0,0]=3 6620 B12R2.3190 CC(=O)[C@H]1C[C@H]2CCCC[C@@H]12 Amb27199096 [0,0,0,2,0,0|1,0,0]=3 6621 B12R2.3190 NC(=O)C1CC2CCCCC21 Amb26039410 [0,0,0,2,0,0|1,0,0]=3 6622 B12R2.3190 NC(=O)N1CC2CCCCC21 Amb28281399 [0,0,0,2,0,0|2,0,0]=4 6623 B12R2.3190 NC(=O)[C@@H]1C[C@H]2CCCC[C@H]21 Amb27238705 [0,0,0,2,0,0|1,0,0]=3 6624 B12R2.3190 O=C(O)C1=C[C@@H]2CCCC[C@H]12 Amb33620433 [0,0,0,2,0,0|0,0,2]=4 6625 B12R2.3190 O=C(O)C1CC2CCCCC21 Amb24711579 [0,0,0,2,0,0|0,0,0]=2 6626 B12R2.3190 O=C(O)C1CC2CCNCC21 Amb28365366 [0,0,0,2,0,0|1,0,0]=3 6627 B12R2.3190 O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]21 Amb32992742 [0,0,0,2,0,0|0,0,0]=2 6628 B12R2.3190 O=C(O)[C@@H]1C[C@H]2CCNC[C@H]21 Amb22757902 [0,0,0,2,0,0|1,0,0]=3 6629 B12R2.3190 O=C(O)[C@@H]1C[C@H]2CCNC[C@H]21 Amb24603821 [0,0,0,2,0,0|1,0,0]=3 6630 B12R2.3190 O=C(O)[C@H]1C[C@H]2CCCC[C@@H]12 Amb27635595 [0,0,0,2,0,0|0,0,0]=2 6631 B12R2.3255 CC(=O)CC1CCCC2OC12 Amb27802639 [0,0,0,2,0,0|2,0,0]=4 6632 B12R2.3255 CC(=O)NC1CCCC2CC21 Amb28077688 [0,0,0,2,0,0|2,0,0]=4 6633 B12R2.3255 NC(=O)CN1CCCC2CC21 Amb27632685 [0,0,0,2,0,0|2,0,0]=4 6634 B12R2.3255 NC(=O)NC1CCCC2CC21 Amb35682100 [0,0,0,2,0,0|2,0,0]=4 6635 B12R2.3255 O=C(Cl)NC1CCCC2CC21 Amb35633355 [0,0,0,2,0,0|2,0,0]=4 6636 B12R2.83 O=C1CCC2CCCC2CC1 Amb17593806 [0,0,0,2,0,0|1,0,0]=3 6637 B12R2.83 O=C1CCC2CCCC2CN1 Amb24689525 [0,0,0,2,0,0|1,0,0]=3 6638 B12R2.83 O=C1CCN2CCCC2CN1 Amb26559296 [0,0,0,2,0,0|2,0,0]=4 6639 B12R2.83 O=C1CC[C@@H]2CCC[C@@H]2CN1 Amb27207694 [0,0,0,2,0,0|1,0,0]=3 6640 B12R2.84 CC12CCCC1CCC(=O)C2 Amb27261978 [0,0,0,2,0,0|1,0,0]=3 6641 B12R2.84 CC12CCCC1CCC(O)C2 Amb27661062 [0,0,0,2,0,0|1,0,1]=4 6642 B12R2.84 C[C@]12CCC[C@H]1CCC(O)C2 Amb28350274 [0,0,0,2,0,0|1,0,1]=4 6643 B12R2.252 CC(=O)N1C[C@H]2CCC[C@H]2C1 Amb28072858 [0,0,0,2,0,0|2,0,0]=4 6644 B12R2.252 NC(=O)C1CC2CCCC2C1 Amb27403111 [0,0,0,2,0,0|1,0,0]=3 6645 B12R2.252 NC(=O)C1C[C@@H]2CCC[C@@H]2C1 Amb27974623 [0,0,0,2,0,0|1,0,0]=3 6646 B12R2.252 NC(=O)C1C[C@@H]2CNC[C@@H]2C1 Amb28119928 [0,0,0,2,0,0|2,0,0]=4 6647 B12R2.252 NC(=O)C1C[C@H]2CCC[C@@H]2C1 Amb27632438 [0,0,0,2,0,0|1,0,0]=3 6648 B12R2.252 NC(=O)[C@@H]1C[C@@H]2CCC[C@@H]2C1 Amb27228002 [0,0,0,2,0,0|1,0,0]=3 6649 B12R2.252 NC(=O)[C@H]1C[C@H]2CCC[C@H]2N1 Amb26896054 [0,0,0,2,0,0|2,0,0]=4 6650 B12R2.252 O=C(Cl)C1CC2CCCC2C1 Amb27632292 [0,0,0,2,0,0|1,0,0]=3 6651 B12R2.252 O=C(Cl)N1CC2CCCC2C1 Amb27839707 [0,0,0,2,0,0|2,0,0]=4 6652 B12R2.252 O=C(Cl)N1C[C@H]2CCC[C@H]2C1 Amb32651683 [0,0,0,2,0,0|2,0,0]=4 6653 B12R2.252 O=C(O)C1=CC2CCCC2C1 Amb26994706 [0,0,0,2,0,0|0,0,2]=4 6654 B12R2.252 O=C(O)C1CC2=C(CCC2)C1 Amb27865670 [0,0,0,2,0,0|0,0,2]=4 6655 B12R2.252 O=C(O)C1CC2CCCC2C1 Amb27794757 [0,0,0,2,0,0|0,0,0]=2 6656 B12R2.252 O=C(O)C1CC2CCCC2N1 Amb24117841 [0,0,0,2,0,0|1,0,0]=3 6657 B12R2.252 O=C(O)C1CC2CCCC2N1 Amb6306680 [0,0,0,2,0,0|1,0,0]=3 6658 B12R2.252 O=C(O)C1CC2CNCC2C1 Amb25891052 [0,0,0,2,0,0|1,0,0]=3 6659 B12R2.252 O=C(O)C1CC2CNCC2C1 Amb32412043 [0,0,0,2,0,0|1,0,0]=3 6660 B12R2.252 O=C(O)C1CC2OCCC2N1 Amb26011999 [0,0,0,2,0,0|2,0,0]=4 6661 B12R2.252 O=C(O)C1CC2OCCC2N1 Amb32684553 [0,0,0,2,0,0|2,0,0]=4 6662 B12R2.252 O=C(O)C1C[C@@H]2COC[C@H]2C1 Amb35752193 [0,0,0,2,0,0|1,0,0]=3 6663 B12R2.252 O=C(O)C1C[C@@H]2OCC[C@@H]2N1 Amb32685558 [0,0,0,2,0,0|2,0,0]=4 6664 B12R2.252 O=C(O)C1C[C@@H]2OCC[C@@H]2N1 Amb32685559 [0,0,0,2,0,0|2,0,0]=4 6665 B12R2.252 O=C(O)[C@@H]1CC2CCCC2=N1 Amb27984762 [0,0,0,2,0,0|1,0,1]=4 6666 B12R2.252 O=C(O)[C@@H]1CC2CCCC2N1 Amb27972615 [0,0,0,2,0,0|1,0,0]=3 6667 B12R2.252 O=C(O)[C@@H]1C[C@@H]2CCC[C@@H]2N1 Amb2613747 [0,0,0,2,0,0|1,0,0]=3 6668 B12R2.252 O=C(O)[C@@H]1C[C@@H]2CNC[C@@H]2C1 Amb33803483 [0,0,0,2,0,0|1,0,0]=3 6669 B12R2.252 O=C(O)[C@@H]1C[C@@H]2CNC[C@@H]2C1 Amb33803925 [0,0,0,2,0,0|1,0,0]=3 6670 B12R2.252 O=C(O)[C@@H]1C[C@H]2CCC[C@H]2N1 Amb17608587 [0,0,0,2,0,0|1,0,0]=3 6671 B12R2.252 O=C(O)[C@H]1C[C@H]2CCC[C@H]2N1 Amb8627881 [0,0,0,2,0,0|1,0,0]=3 6672 B12R2.589 CN1CC[C@@H]2C(CC(=O)O)[C@@H]21 Amb27229372 [0,0,0,2,0,0|1,0,0]=3 6673 B12R2.630 CN1C2CCC(=O)CC1CC2 Amb25860159 [0,0,0,2,0,0|2,0,0]=4 6674 B12R2.630 CN1[C@H]2CC[C@@H]1CCC(=O)C2 Amb28052265 [0,0,0,2,0,0|2,0,0]=4 6675 B12R2.1017 CC1=CC2CC1CC2C(=O)O Amb27777170 [0,0,0,2,0,0|0,0,2]=4 6676 B12R2.1017 NC1CC2CC1CC2C(=O)O Amb27445070 [0,0,0,2,0,0|1,0,0]=3 6677 B12R2.1017 NC1C[C@@H]2C[C@H]1CC2C(=O)O Amb18200452 [0,0,0,2,0,0|1,0,0]=3 6678 B12R2.1017 NC1C[C@H]2C[C@@H]1CC2C(=O)O Amb27420246 [0,0,0,2,0,0|1,0,0]=3 6679 B12R2.1017 N[C@@H]1C[C@H]2C[C@@H]1C[C@H]2C(=O)O Amb24595495 [0,0,0,2,0,0|1,0,0]=3 6680 B12R2.1017 N[C@@H]1C[C@H]2C[C@@H]1C[C@H]2C(=O)O Amb33620543 [0,0,0,2,0,0|1,0,0]=3 6681 B12R2.1017 O=C(O)C1CC2CC1CC2O Amb22498844 [0,0,0,2,0,0|1,0,0]=3 6682 B12R2.1017 O=C(O)[C@@H]1C[C@H]2C[C@@H]1C[C@H]2O Amb35752483 [0,0,0,2,0,0|1,0,0]=3 6683 B12R2.1017 O=C(O)[C@H]1C[C@@H]2O[C@H]1C[C@H]2O Amb30526961 [0,0,0,2,0,0|2,0,0]=4 6684 B12R2.1017 O=C1CC2CC1CC2C(=O)O Amb27176431 [0,0,0,2,0,0|1,0,1]=4 6685 B12R2.1017 O=C1C[C@@H]2C[C@@H]1C[C@H]2C(=O)O Amb27232840 [0,0,0,2,0,0|1,0,1]=4 6686 B12R2.1017 O=C1C[C@H]2C[C@@H]1C[C@H]2C(=O)O Amb33484207 [0,0,0,2,0,0|1,0,1]=4 6687 B12R2.1370 CC(=O)NCC12CCCC1C2 Amb35692004 [0,0,0,2,0,0|2,0,0]=4 6688 B12R2.1370 NC(=O)CNC12CCCC1C2 Amb35724517 [0,0,0,2,0,0|2,0,0]=4 6689 B12R2.1370 NC(=O)NCC12CCCC1C2 Amb30010178 [0,0,0,2,0,0|2,0,0]=4 6690 B12R2.1370 O=C(Cl)NCC12CCCC1C2 Amb35636896 [0,0,0,2,0,0|2,0,0]=4 6691 B12R2.1370 O=C(O)C#CC12CCCC1C2 Amb35735661 [0,0,0,2,0,0|0,0,2]=4 6692 B12R2.1370 O=C(O)CNC12CCCC1C2 Amb35727873 [0,0,0,2,0,0|1,0,0]=3 6693 B12R2.1413 NC(=S)CC1CC2CCCC21 Amb32648853 [0,0,0,2,0,0|1,1,0]=4 6694 B12R2.1413 O=C(O)CC1CC2CCCC21 Amb25217122 [0,0,0,2,0,0|0,0,0]=2 6695 B12R2.1413 O=C(O)CC1CC2CCOC21 Amb28325743 [0,0,0,2,0,0|1,0,0]=3 6696 B12R2.1413 O=C(O)CC1C[C@@H]2COC[C@H]12 Amb33330509 [0,0,0,2,0,0|1,0,0]=3 6697 B12R2.1413 O=C(O)C[C@@H]1C[C@@H]2COC[C@@H]21 Amb27787755 [0,0,0,2,0,0|1,0,0]=3 6698 B12R2.1413 O=C(O)\C=C1/CC2CCCC12 Amb23512877 [0,0,0,2,0,0|0,0,2]=4 6699 B12R2.1413 O=C(O)\C=C1\C[C@@H]2CCC[C@H]12 Amb27451007 [0,0,0,2,0,0|0,0,2]=4 6700 B12R2.2376 CC1CCCC12CC2C(=O)O Amb27757709 [0,0,0,2,0,0|0,0,0]=2 6701 B12R2.2376 CC1COCC12CC2C(=O)O Amb35635718 [0,0,0,2,0,0|1,0,0]=3 6702 B12R2.2376 CC1CSCC12CC2C(=O)O Amb27207483 [0,0,0,2,0,0|1,0,0]=3 6703 B12R2.5266 O=C(O)CNC1CCC2CC21 Amb28145667 [0,0,0,2,0,0|1,0,0]=3 6704 B12R2.5266 O=C(O)CNC1CC[C@@H]2C[C@H]12 Amb27843092 [0,0,0,2,0,0|1,0,0]=3 6705 B12R2.93 CC1(O)CCC12CCCCC2 Amb30025878 [0,0,0,2,0,0|1,0,1]=4 6706 B12R2.250 CC(=O)C1CC12CCCCC2 Amb27215552 [0,0,0,2,0,0|1,0,0]=3 6707 B12R2.250 CC(=O)C1CC12CCCNC2 Amb27782525 [0,0,0,2,0,0|2,0,0]=4 6708 B12R2.250 CC(=O)C1CC12CCNCC2 Amb27866581 [0,0,0,2,0,0|2,0,0]=4 6709 B12R2.250 CC(=O)C1OC12CCCCC2 Amb28351539 [0,0,0,2,0,0|2,0,0]=4 6710 B12R2.250 CC(=O)N1CC12CCCCC2 Amb24078312 [0,0,0,2,0,0|2,0,0]=4 6711 B12R2.250 NC(=O)C1CC12CCNCC2 Amb27766779 [0,0,0,2,0,0|2,0,0]=4 6712 B12R2.250 NC(=O)C1OC12CCCCC2 Amb24634187 [0,0,0,2,0,0|2,0,0]=4 6713 B12R2.250 NC(=O)[C@@H]1CC12CCCCC2 Amb25065202 [0,0,0,2,0,0|1,0,0]=3 6714 B12R2.250 NC(=O)[C@H]1CC12CCOCC2 Amb28365478 [0,0,0,2,0,0|2,0,0]=4 6715 B12R2.250 O=C(Cl)C1CC12CCOCC2 Amb35717347 [0,0,0,2,0,0|2,0,0]=4 6716 B12R2.250 O=C(O)C1CC12CCCCC2 Amb10607313 [0,0,0,2,0,0|0,0,0]=2 6717 B12R2.250 O=C(O)C1CC12CCCCN2 Amb27827705 [0,0,0,2,0,0|1,0,0]=3 6718 B12R2.250 O=C(O)C1CC12CCCNC2 Amb23590870 [0,0,0,2,0,0|1,0,0]=3 6719 B12R2.250 O=C(O)C1CC12CCCNC2 Amb30584813 [0,0,0,2,0,0|1,0,0]=3 6720 B12R2.250 O=C(O)C1CC12CCCOC2 Amb26026760 [0,0,0,2,0,0|1,0,0]=3 6721 B12R2.250 O=C(O)C1CC12CCNCC2 Amb16187123 [0,0,0,2,0,0|1,0,0]=3 6722 B12R2.250 O=C(O)C1CC12CCNCC2 Amb21959838 [0,0,0,2,0,0|1,0,0]=3 6723 B12R2.250 O=C(O)C1CC12CCOCC2 Amb17605508 [0,0,0,2,0,0|1,0,0]=3 6724 B12R2.250 O=C(O)C1CC12CCSCC2 Amb18948988 [0,0,0,2,0,0|1,0,0]=3 6725 B12R2.250 O=C(O)C1CC12COCCN2 Amb28246853 [0,0,0,2,0,0|2,0,0]=4 6726 B12R2.250 O=C(O)C1OC12CCCCC2 Amb16230757 [0,0,0,2,0,0|1,0,0]=3 6727 B12R2.250 O=C(O)C1OC12CCCOC2 Amb28074831 [0,0,0,2,0,0|2,0,0]=4 6728 B12R2.250 O=C(O)[C@@H]1CC12CCCCC2 Amb26880141 [0,0,0,2,0,0|0,0,0]=2 6729 B12R2.250 O=C(O)[C@@H]1CC12CCOCC2 Amb25279532 [0,0,0,2,0,0|1,0,0]=3 6730 B12R2.250 O=C(O)[C@@H]1OC12CCCCC2 Amb25933481 [0,0,0,2,0,0|1,0,0]=3 6731 B12R2.250 O=C(O)[C@H]1CC12CCOCC2 Amb25916297 [0,0,0,2,0,0|1,0,0]=3 6732 B12R2.1381 CC(=O)CCC1CC2CC2C1 Amb35624457 [0,0,0,2,0,0|1,0,0]=3 6733 B12R2.1381 CC(=O)NCC1CC2CC2C1 Amb35622780 [0,0,0,2,0,0|2,0,0]=4 6734 B12R2.1381 CC(O)CCC1CC2CC2C1 Amb29873013 [0,0,0,2,0,0|1,0,1]=4 6735 B12R2.1381 NC(=O)CCN1CC2CC2C1 Amb27426161 [0,0,0,2,0,0|2,0,0]=4 6736 B12R2.1381 NC(=O)NCC1CC2CC2C1 Amb35599157 [0,0,0,2,0,0|2,0,0]=4 6737 B12R2.1381 O=C(Cl)NCC1CC2CC2C1 Amb35601212 [0,0,0,2,0,0|2,0,0]=4 6738 B12R2.1381 O=C(O)C#CC1CC2CC2C1 Amb25890973 [0,0,0,2,0,0|0,0,2]=4 6739 B12R2.1381 O=C(O)C#C[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35624934 [0,0,0,2,0,0|0,0,2]=4 6740 B12R2.1381 O=C(O)CCC1CC2CC2C1 Amb29873028 [0,0,0,2,0,0|0,0,0]=2 6741 B12R2.1381 O=C(O)\C=C\C1CC2CC2C1 Amb33470056 [0,0,0,2,0,0|0,0,2]=4 6742 B12R2.1391 O=C(O)C1CC2CCCC1N2 Amb28251192 [0,0,0,2,0,0|1,0,0]=3 6743 B12R2.1391 O=C(O)C1CC2CNCC1C2 Amb33802654 [0,0,0,2,0,0|1,0,0]=3 6744 B12R2.1391 O=C(O)C1CC2CNCC1C2 Amb33804032 [0,0,0,2,0,0|1,0,0]=3 6745 B12R2.1391 O=C(O)C1CN2CCCC1C2 Amb24381374 [0,0,0,2,0,0|1,0,0]=3 6746 B12R2.2057 C1CCC(CCC2CO2)CC1 Amb28397107 [0,0,0,2,0,0|1,0,1]=4 6747 B12R2.3148 NC(=O)N[C@H]1[C@H]2CCCC[C@H]21 Amb28396521 [0,0,0,2,0,0|2,0,0]=4 6748 B12R2.3148 O=C(O)CC1C2C=CCCC21 Amb28076961 [0,0,0,2,0,0|0,0,2]=4 6749 B12R2.3148 O=C(O)CC1C2CCCOC21 Amb27195433 [0,0,0,2,0,0|1,0,0]=3 6750 B12R2.3148 O=C(O)CC1C2CCNCC21 Amb27193232 [0,0,0,2,0,0|1,0,0]=3 6751 B12R2.3148 O=C(O)CC1C2CCOCC21 Amb27791112 [0,0,0,2,0,0|1,0,0]=3 6752 B12R2.3148 O=C(O)CC1[C@H]2CCCC[C@@H]12 Amb27200086 [0,0,0,2,0,0|0,0,0]=2 6753 B12R2.3148 O=C(O)CC1[C@H]2CCCN[C@@H]12 Amb27864513 [0,0,0,2,0,0|1,0,0]=3 6754 B12R2.3148 O=C(O)C[C@@H]1[C@H]2CCCC[C@H]21 Amb27634887 [0,0,0,2,0,0|0,0,0]=2 6755 B12R2.259 CCCC1CCCCC12CO2 Amb33745413 [0,0,0,2,0,0|1,0,1]=4 6756 B12R2.1809 CCC1CCCCCC12CO2 Amb33736260 [0,0,0,2,0,0|1,0,1]=4 6757 B12R2.2383 C1CCC(CCCC2CO2)C1 Amb26992711 [0,0,0,2,0,0|1,0,1]=4 6758 B12R2.2474 O=C1CCCCCC[C@@H]2C[C@H]12 Amb28429558 [0,0,0,2,0,0|1,0,0]=3 6759 B12R2.2474 O=C1CCCCCC[C@H]2C[C@@H]12 Amb27435391 [0,0,0,2,0,0|1,0,0]=3 6760 B12R2.2474 O[C@@H]1CCCCCC[C@@H]2C[C@H]12 Amb28321536 [0,0,0,2,0,0|1,0,1]=4 6761 B12R2.2474 O[C@H]1CCCCCC[C@H]2C[C@@H]12 Amb27428279 [0,0,0,2,0,0|1,0,1]=4 6762 B12R2.3808 C1CCCC(CC2CO2)CC1 Amb24670704 [0,0,0,2,0,0|1,0,1]=4 6763 B12R2.229 O=C1C=CCC[C@@H]2CCCC12 Amb27227133 [0,0,0,2,0,0|1,0,1]=4 6764 B12R2.229 O=C1CCCCC2NCCC12 Amb27206471 [0,0,0,2,0,0|2,0,0]=4 6765 B12R2.229 O=C1CCCCN2CCCC12 Amb26853749 [0,0,0,2,0,0|2,0,0]=4 6766 B12R2.229 O=C1CCNCC2CCCN12 Amb24438731 [0,0,0,2,0,0|2,0,0]=4 6767 B12R2.229 O=C1NCCCC2CCCC12 Amb25046678 [0,0,0,2,0,0|1,0,0]=3 6768 B12R2.229 O=C1NCCCC2CNCC12 Amb32410414 [0,0,0,2,0,0|2,0,0]=4 6769 B12R2.229 O=C1NCCCC2NCCC12 Amb33041082 [0,0,0,2,0,0|2,0,0]=4 6770 B12R2.229 O=C1NCCCC2OCCC12 Amb33041076 [0,0,0,2,0,0|2,0,0]=4 6771 B12R2.229 O=C1NCCCN2CCCC12 Amb13951606 [0,0,0,2,0,0|2,0,0]=4 6772 B12R2.229 O=C1NCCC[C@@H]2CCC[C@H]12 Amb27767881 [0,0,0,2,0,0|1,0,0]=3 6773 B12R2.229 O=C1NCCC[C@H]2CCC[C@@H]12 Amb25248002 [0,0,0,2,0,0|1,0,0]=3 6774 B12R2.229 O[C@@H]1CCCC[C@@H]2CCC[C@H]12 Amb28350092 [0,0,0,2,0,0|1,0,1]=4 6775 B12R2.2017 C1=C2CCCCC(CCC1)N2 Amb27798332 [0,0,0,2,0,0|2,0,0]=4 6776 B12R2.2412 OC12CCCCC1CCCC2 Amb17593870 [0,0,0,2,0,0|1,0,1]=4 6777 B12R2.2412 O[C@]12CCCC[C@@H]1CCCN2 Amb28254521 [0,0,0,2,0,0|1,0,1]=4 6778 B12R2.1655 CC(=O)CC1CCC2CC2C1 Amb35704914 [0,0,0,2,0,0|1,0,0]=3 6779 B12R2.1655 CC(=O)CN1CCC2CC2C1 Amb35631231 [0,0,0,2,0,0|2,0,0]=4 6780 B12R2.1655 CC(O)CC1CCC2CC2C1 Amb30019128 [0,0,0,2,0,0|1,0,1]=4 6781 B12R2.1655 N=C(N)CC1CCC2CC2C1 Amb35598428 [0,0,0,2,0,0|2,0,0]=4 6782 B12R2.1655 NC(=O)CN1CCC2CC2C1 Amb29855648 [0,0,0,2,0,0|2,0,0]=4 6783 B12R2.1655 NC(=O)NC1CCC2CC2C1 Amb35682102 [0,0,0,2,0,0|2,0,0]=4 6784 B12R2.1655 NC(=S)CC1CCC2CC2C1 Amb35704117 [0,0,0,2,0,0|1,1,0]=4 6785 B12R2.1655 O=C(Cl)NC1CCC2CC2C1 Amb35633354 [0,0,0,2,0,0|2,0,0]=4 6786 B12R2.1655 O=C(O)CC1CCC2CC2C1 Amb27239974 [0,0,0,2,0,0|0,0,0]=2 6787 B12R2.1655 O=C(O)CN1CCC2CC2C1 Amb30006736 [0,0,0,2,0,0|1,0,0]=3 6788 B12R2.467 OC1CCCCC(C2CC2)C1 Amb27412089 [0,0,0,2,0,0|1,0,1]=4 6789 B12R2.959 CCC[C@@H]1CC(=O)[C@H]2O[C@H]2C1 Amb27252296 [0,0,0,2,0,0|2,0,0]=4 6790 B12R2.1019 O=C1NC2CCCC1CCC2 Amb22364869 [0,0,0,2,0,0|1,0,0]=3 6791 B12R2.1019 O=C1NC2CCCC1CNC2 Amb6893904 [0,0,0,2,0,0|2,0,0]=4 6792 B12R2.1019 O=C1N[C@@H]2CCC[C@@H]1CNC2 Amb25139620 [0,0,0,2,0,0|2,0,0]=4 6793 B12R2.1019 O=C1N[C@H]2CCC[C@@H]1CNC2 Amb22757908 [0,0,0,2,0,0|2,0,0]=4 6794 B12R2.1019 O=C1N[C@H]2CCC[C@H]1CNC2 Amb23385287 [0,0,0,2,0,0|2,0,0]=4 6795 B12R2.1019 OC1CC2CCCC1CCC2 Amb27494930 [0,0,0,2,0,0|1,0,1]=4 6796 B12R2.5478 O=C1CCCCC2(CCC2)N1 Amb27469731 [0,0,0,2,0,0|1,0,0]=3 6797 B12R2.1659 NC(=O)NC1CCC1C2CC2 Amb27826943 [0,0,0,2,0,0|2,0,0]=4 6798 B12R2.3151 O=C(O)CC1CCC12CCC2 Amb35749961 [0,0,0,2,0,0|0,0,0]=2 6799 B12R2.1123 CC1CC2CC2CC1C(=O)O Amb32988612 [0,0,0,2,0,0|0,0,0]=2 6800 B12R2.1123 CC1CC2CC2CC1C(N)=O Amb33230234 [0,0,0,2,0,0|1,0,0]=3 6801 B12R2.1642 NS(=O)CC[C@@H]1C[C@H]1C2CC2 Amb32720985 [0,0,0,2,0,0|2,0,0]=4 6802 B12R2.1642 O=C(Cl)NCC1CC1C2CC2 Amb35601818 [0,0,0,2,0,0|2,0,0]=4 6803 B12R2.1642 O=C(O)C#CC1CC1C2CC2 Amb35598304 [0,0,0,2,0,0|0,0,2]=4 6804 B12R2.1642 O=S(Cl)CC[C@@H]1C[C@H]1C2CC2 Amb32720984 [0,0,0,2,0,0|2,0,0]=4 6805 B12R2.1642 O=S([O-])CC[C@@H]1C[C@H]1C2CC2 Amb32755813 [0,0,0,2,0,0|1,0,1]=4 6806 B12R2.3161 CC(=O)CCC1CC12CCC2 Amb28052749 [0,0,0,2,0,0|1,0,0]=3 6807 B12R2.3161 O=C(O)C#CC1CC12CCC2 Amb33168971 [0,0,0,2,0,0|0,0,2]=4 6808 B12R2.3161 O=C(O)CCC1CC12COC2 Amb27872488 [0,0,0,2,0,0|1,0,0]=3 6809 B12R2.635 CN1CCC2CC2C1C(=O)O Amb28435419 [0,0,0,2,0,0|1,0,0]=3 6810 B12R2.1357 CC(=O)C12CCCCCC1C2 Amb28199934 [0,0,0,2,0,0|1,0,0]=3 6811 B12R2.1357 NC(=O)C12CNCCCC1C2 Amb28052738 [0,0,0,2,0,0|2,0,0]=4 6812 B12R2.1357 O=C(Cl)C12CCCCCC1O2 Amb27176495 [0,0,0,2,0,0|2,0,0]=4 6813 B12R2.5335 CC(=O)[C@H]1CC[C@@H]2C[C@@H]2[C@H]1O Amb28198614 [0,0,0,2,0,0|2,0,0]=4 6814 B12R2.1658 CC(=O)CN1CC2CCC2C1 Amb35626494 [0,0,0,2,0,0|2,0,0]=4 6815 B12R2.1658 NC(=O)CN1CC2CCC2C1 Amb29872142 [0,0,0,2,0,0|2,0,0]=4 6816 B12R2.1658 O=C(O)CN1CC2CCC2C1 Amb35613845 [0,0,0,2,0,0|1,0,0]=3 6817 B12R2.254 CC(=O)C1CCC12CCCC2 Amb29874091 [0,0,0,2,0,0|1,0,0]=3 6818 B12R2.254 CC(O)C1CCC12CCCC2 Amb35619203 [0,0,0,2,0,0|1,0,1]=4 6819 B12R2.254 O=C(O)C1CCC12CCCO2 Amb35752933 [0,0,0,2,0,0|1,0,0]=3 6820 B12R2.254 O=C(O)C1NCC12CCCC2 Amb28921048 [0,0,0,2,0,0|1,0,0]=3 6821 B12R2.254 O=C(O)C1NCC12CCCC2 Amb32667313 [0,0,0,2,0,0|1,0,0]=3 6822 B12R2.257 CC(=O)CC1CC12CCNC2 Amb28202698 [0,0,0,2,0,0|2,0,0]=4 6823 B12R2.257 CC(=O)CC1CC12CCOC2 Amb27462350 [0,0,0,2,0,0|2,0,0]=4 6824 B12R2.257 O=C(Cl)NC1CC12CCCC2 Amb35633476 [0,0,0,2,0,0|2,0,0]=4 6825 B12R2.257 O=C(O)CC1CC12CCOC2 Amb27968188 [0,0,0,2,0,0|1,0,0]=3 6826 B12R2.1354 CC(=O)C1CC1C2CCCO2 Amb27657047 [0,0,0,2,0,0|2,0,0]=4 6827 B12R2.1354 CC(=O)C1CC1C2CCOC2 Amb18796762 [0,0,0,2,0,0|2,0,0]=4 6828 B12R2.1354 O=C(O)C1CC1C2CCCC2 Amb18285138 [0,0,0,2,0,0|0,0,0]=2 6829 B12R2.1354 O=C(O)C1CC1C2CCCO2 Amb24334826 [0,0,0,2,0,0|1,0,0]=3 6830 B12R2.1354 O=C(O)C1CC1C2CCCS2 Amb33416221 [0,0,0,2,0,0|1,0,0]=3 6831 B12R2.1354 O=C(O)C1CC1C2CCOC2 Amb18182076 [0,0,0,2,0,0|1,0,0]=3 6832 B12R2.1354 O=C(O)C1CC1C2CCSC2 Amb33141516 [0,0,0,2,0,0|1,0,0]=3 6833 B12R2.1354 O=C(O)C1OC1C2CCCC2 Amb27176482 [0,0,0,2,0,0|1,0,0]=3 6834 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2CCCC2 Amb33226763 [0,0,0,2,0,0|0,0,0]=2 6835 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2CCCO2 Amb33038083 [0,0,0,2,0,0|1,0,0]=3 6836 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2CCCS2 Amb33416206 [0,0,0,2,0,0|1,0,0]=3 6837 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2CCOC2 Amb33420776 [0,0,0,2,0,0|1,0,0]=3 6838 B12R2.1354 O=C(O)[C@@H]1C[C@H]1C2CCSC2 Amb33141331 [0,0,0,2,0,0|1,0,0]=3 6839 B12R2.1410 O=C(Cl)N1CCCC12CCC2 Amb33296976 [0,0,0,2,0,0|2,0,0]=4 6840 B12R2.1410 O=C(O)C1CCCC12CCC2 Amb27800010 [0,0,0,2,0,0|0,0,0]=2 6841 B12R2.1410 O=C(O)C1CCNC12CCC2 Amb35789038 [0,0,0,2,0,0|1,0,0]=3 6842 B12R2.1410 O=C(O)C1CCNC12CCC2 Amb35789349 [0,0,0,2,0,0|1,0,0]=3 6843 B12R2.1410 O=C(O)C1CCOC12CCC2 Amb32990690 [0,0,0,2,0,0|1,0,0]=3 6844 B12R2.1410 O=C(O)C1CCOC12COC2 Amb32990701 [0,0,0,2,0,0|2,0,0]=4 6845 B12R2.1410 O=C(O)C1CCSC12CNC2 Amb33804143 [0,0,0,2,0,0|2,0,0]=4 6846 B12R2.1410 O=C(O)C1CNCC12CCC2 Amb26371321 [0,0,0,2,0,0|1,0,0]=3 6847 B12R2.1410 O=C(O)C1CNCC12CCC2 Amb32664556 [0,0,0,2,0,0|1,0,0]=3 6848 B12R2.1410 O=C(O)C1CNCC12CNC2 Amb33468782 [0,0,0,2,0,0|2,0,0]=4 6849 B12R2.1410 O=C(O)C1CNCC12COC2 Amb24647271 [0,0,0,2,0,0|2,0,0]=4 6850 B12R2.1410 O=C(O)C1COCC12CCC2 Amb28365333 [0,0,0,2,0,0|1,0,0]=3 6851 B12R2.3150 O=C(O)CC1CC1C2CCC2 Amb27209775 [0,0,0,2,0,0|0,0,0]=2 6852 B12R2.3193 O=C(O)C1CCC1C2CCC2 Amb28455591 [0,0,0,2,0,0|0,0,0]=2 6853 B12R2.3193 O=C(O)C1CCC1C2CNC2 Amb27413523 [0,0,0,2,0,0|1,0,0]=3 6854 B12R2.3193 O=C(O)C1CCN1C2CCC2 Amb27839933 [0,0,0,2,0,0|1,0,0]=3 6855 B12R2.3193 O=C(O)C1CCN1C2COC2 Amb27963192 [0,0,0,2,0,0|2,0,0]=4 6856 B12R2.553 CC1(O)CCCCC1C2CC2 Amb32950183 [0,0,0,2,0,0|1,0,1]=4 6857 B12R2.553 C[C@@]1(O)CCCC[C@H]1C2CC2 Amb33212804 [0,0,0,2,0,0|1,0,1]=4 6858 B12R2.1356 CC(=O)N1CCCC1C2CC2 Amb27840385 [0,0,0,2,0,0|2,0,0]=4 6859 B12R2.1356 NC(=O)C1CNCC1C2CC2 Amb28285066 [0,0,0,2,0,0|2,0,0]=4 6860 B12R2.1356 NC(=O)N1CCCC1C2CC2 Amb27979932 [0,0,0,2,0,0|2,0,0]=4 6861 B12R2.1356 O=C(O)C1CCCN1C2CC2 Amb24452052 [0,0,0,2,0,0|1,0,0]=3 6862 B12R2.1356 O=C(O)C1CCCN1C2CC2 Amb28653024 [0,0,0,2,0,0|1,0,0]=3 6863 B12R2.1356 O=C(O)C1CCOC1C2CC2 Amb24390691 [0,0,0,2,0,0|1,0,0]=3 6864 B12R2.1356 O=C(O)C1CNCC1C2CC2 Amb18830899 [0,0,0,2,0,0|1,0,0]=3 6865 B12R2.1356 O=C(O)C1COCC1C2CC2 Amb27842339 [0,0,0,2,0,0|1,0,0]=3 6866 B12R2.1356 O=C(O)C1NCCC1C2CC2 Amb24105425 [0,0,0,2,0,0|1,0,0]=3 6867 B12R2.1356 O=C(O)C1NCCC1C2CC2 Amb33804047 [0,0,0,2,0,0|1,0,0]=3 6868 B12R2.1356 O=C(O)[C@@H]1CCC[C@H]1C2CC2 Amb32651662 [0,0,0,2,0,0|0,0,0]=2 6869 B12R2.1356 O=C(O)[C@@H]1CCO[C@H]1C2CC2 Amb32682495 [0,0,0,2,0,0|1,0,0]=3 6870 B12R2.1356 O=C(O)[C@@H]1CNC[C@H]1C2CC2 Amb33803946 [0,0,0,2,0,0|1,0,0]=3 6871 B12R2.1356 O=C(O)[C@H]1OCC[C@H]1C2CC2 Amb27249861 [0,0,0,2,0,0|1,0,0]=3 6872 B12R2.2404 O=S1(=O)C2CCCC1CCC2 Amb6359455 [0,0,0,2,0,0|1,0,1]=4 6873 B12R2.3066 CC(=O)C12CCC[C@H]1OCC2 Amb33447511 [0,0,0,2,0,0|2,0,0]=4 6874 B12R2.3066 NC(=O)[C@]12CCC[C@H]1CNC2 Amb32753700 [0,0,0,2,0,0|2,0,0]=4 6875 B12R2.3066 O=C(O)C12CCCC1CCC2 Amb18125731 [0,0,0,2,0,0|0,0,0]=2 6876 B12R2.3066 O=C(O)C12CCCC1CCN2 Amb27872846 [0,0,0,2,0,0|1,0,0]=3 6877 B12R2.3066 O=C(O)C12CCCC1CNC2 Amb2696579 [0,0,0,2,0,0|1,0,0]=3 6878 B12R2.3066 O=C(O)C12CCCC1NCC2 Amb32671262 [0,0,0,2,0,0|1,0,0]=3 6879 B12R2.3066 O=C(O)C12CCCC1NCC2 Amb32674921 [0,0,0,2,0,0|1,0,0]=3 6880 B12R2.3066 O=C(O)C12CCCC1OCC2 Amb32670869 [0,0,0,2,0,0|1,0,0]=3 6881 B12R2.3066 O=C(O)C12CCCN1CCC2 Amb10068390 [0,0,0,2,0,0|1,0,0]=3 6882 B12R2.3066 O=C(O)C12CCCN1CCC2 Amb20622032 [0,0,0,2,0,0|1,0,0]=3 6883 B12R2.3066 O=C(O)C12CCC[C@H]1OCC2 Amb33447515 [0,0,0,2,0,0|1,0,0]=3 6884 B12R2.3066 O=C(O)C12CNCC1CNC2 Amb28060246 [0,0,0,2,0,0|2,0,0]=4 6885 B12R2.3066 O=C(O)[C@@]12CCC[C@@H]1CNC2 Amb10067048 [0,0,0,2,0,0|1,0,0]=3 6886 B12R2.3066 O=C(O)[C@@]12CCC[C@@H]1NCC2 Amb32675445 [0,0,0,2,0,0|1,0,0]=3 6887 B12R2.3066 O=C(O)[C@@]12CCC[C@@H]1OCC2 Amb32660504 [0,0,0,2,0,0|1,0,0]=3 6888 B12R2.3066 O=C(O)[C@]12CCC[C@@H]1OCC2 Amb34915747 [0,0,0,2,0,0|1,0,0]=3 6889 B12R2.3066 O=C(O)[C@]12CCC[C@H]1CNC2 Amb10067049 [0,0,0,2,0,0|1,0,0]=3 6890 B12R2.3066 O=C(O)[C@]12CCC[C@H]1NCC2 Amb35745803 [0,0,0,2,0,0|1,0,0]=3 6891 B12R2.1385 O=C(O)C1CCC2CC2CC1 Amb24729624 [0,0,0,2,0,0|0,0,0]=2 6892 B12R2.1385 O=C(O)C1CC[C@@H]2C[C@H]2CC1 Amb28199038 [0,0,0,2,0,0|0,0,0]=2 6893 B12R2.1385 O=C(O)C1CC[C@H]2C[C@H]2CC1 Amb33098568 [0,0,0,2,0,0|0,0,0]=2 6894 B12R2.3125 NC(=O)C1C2CCCCCC21 Amb27658809 [0,0,0,2,0,0|1,0,0]=3 6895 B12R2.3125 O=C(O)C1C2C=CCCCC21 Amb28342248 [0,0,0,2,0,0|0,0,2]=4 6896 B12R2.3125 O=C(O)C1C2CCCCCC21 Amb27955294 [0,0,0,2,0,0|0,0,0]=2 6897 B12R2.3125 O=C(O)C1C2CCCCNC21 Amb18830901 [0,0,0,2,0,0|1,0,0]=3 6898 B12R2.3125 O=C(O)C1C2CCCNCC21 Amb18830900 [0,0,0,2,0,0|1,0,0]=3 6899 B12R2.3125 O=C(O)C1C2CCNCCC21 Amb18200477 [0,0,0,2,0,0|1,0,0]=3 6900 B12R2.3125 O=C(O)[C@@H]1[C@H]2CCCCC[C@H]21 Amb25098730 [0,0,0,2,0,0|0,0,0]=2