0 B10R0.4 C#CCCCN\C=C\C(=O)O Amb28387111 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.4 C=C(Br)CCCCCCCC Amb6298935 [0,0,0,0,0,0|1,0,3]=4 2 B10R0.4 C=C(C)CCCCCCCC Amb6298941 [0,0,0,0,0,0|1,0,2]=3 3 B10R0.4 C=C(C)CNCCCCCC Amb17308745 [0,0,0,0,0,0|2,0,1]=3 4 B10R0.4 C=C(C)\C=C\CCCCCC Amb22546604 [0,0,0,0,0,0|1,0,0]=1 5 B10R0.4 C=C(Cl)CCCCCCCC Amb6298929 [0,0,0,0,0,0|1,0,3]=4 6 B10R0.4 CC#CCOC\C=C\C(C)=O Amb27673812 [0,0,0,0,0,0|1,0,2]=3 7 B10R0.4 CC(=O)NCCCCCC=O Amb24113371 [0,0,0,0,0,0|2,0,2]=4 8 B10R0.4 CC(=O)NCCCCCCN Amb5786933 [0,0,0,0,0,0|2,0,1]=3 9 B10R0.4 CC(=O)NCCCCCCO Amb24113372 [0,0,0,0,0,0|2,0,1]=3 10 B10R0.4 CC(=O)OCCCCCCBr Amb24063174 [0,0,0,0,0,0|2,0,1]=3 11 B10R0.4 CC(=O)OCCCCC[Zn]Br Amb22000479 [0,0,0,0,0,0|3,0,1]=4 12 B10R0.4 CC(=O)SCCCCCCN Amb31031026 [0,0,0,0,0,0|2,0,1]=3 13 B10R0.4 CC(=O)SCCCCCCN Amb33276211 [0,0,0,0,0,0|2,0,1]=3 14 B10R0.4 CC(=O)\C=C\C#CCCCCl Amb26421747 [0,0,0,0,0,0|1,0,2]=3 15 B10R0.4 CCCC#CC\C=C\C(=O)O Amb25991326 [0,0,0,0,0,0|1,0,2]=3 16 B10R0.4 CCCCC#CCCC(C)=O Amb27269937 [0,0,0,0,0,0|0,0,4]=4 17 B10R0.4 CCCCC#C\C=C\C(C)O Amb27757913 [0,0,0,0,0,0|0,0,4]=4 18 B10R0.4 CCCCC#C\C=C\[C@@H](C)O Amb27980597 [0,0,0,0,0,0|0,0,4]=4 19 B10R0.4 CCCCCC#CCC(=O)Cl Amb27672073 [0,0,0,0,0,0|1,0,3]=4 20 B10R0.4 CCCCCCC#CC(=O)O Amb2780028 [0,0,0,0,0,0|1,0,2]=3 21 B10R0.4 CCCCCCC#CC(C)=O Amb27672631 [0,0,0,0,0,0|0,0,2]=2 22 B10R0.4 CCCCCCC#C[C@@H](C)Br Amb27818537 [0,0,0,0,0,0|1,0,3]=4 23 B10R0.4 CCCCCCC#C[C@H](C)O Amb27989910 [0,0,0,0,0,0|0,0,4]=4 24 B10R0.4 CCCCCCCCC(=O)Cl Amb3941485 [0,0,0,0,0,0|1,0,2]=3 25 B10R0.4 CCCCCCCCC(=O)O Amb3940373 [0,0,0,0,0,0|1,0,2]=3 26 B10R0.4 CCCCCCCCC(=O)[O-] Amb22729912 [0,0,0,0,0,0|1,0,2]=3 27 B10R0.4 CCCCCCCCC(C)=O Amb8513861 [0,0,0,0,0,0|0,0,2]=2 28 B10R0.4 CCCCCCCCC(C)Br Amb22731670 [0,0,0,0,0,0|1,0,3]=4 29 B10R0.4 CCCCCCCCC(C)C Amb20241015 [0,0,0,0,0,0|1,0,3]=4 30 B10R0.4 CCCCCCCCC(N)=O Amb8999041 [0,0,0,0,0,0|1,0,2]=3 31 B10R0.4 CCCCCCCCN(C)C Amb2778778 [0,0,0,0,0,0|2,0,2]=4 32 B10R0.4 CCCCCCCC[C@@H](C)O Amb19929333 [0,0,0,0,0,0|0,0,4]=4 33 B10R0.4 CCCCCCCC[S@@+](C)[O-] Amb17779184 [0,0,0,0,0,0|1,0,3]=4 34 B10R0.4 CCCCCCCNC(N)=S Amb2688655 [0,0,0,0,0,0|2,1,1]=4 35 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [0,0,0,0,0,0|2,0,1]=3 36 B10R0.4 CCCCCCCOC(C)=O Amb6366320 [0,0,0,0,0,0|1,0,1]=2 37 B10R0.4 CCCCCCCOC(C)Cl Amb32715989 [0,0,0,0,0,0|2,0,2]=4 38 B10R0.4 CCCCCCCOC(N)=O Amb32668733 [0,0,0,0,0,0|2,0,1]=3 39 B10R0.4 CCCCCCCSC(=N)N Amb22487432 [0,0,0,0,0,0|3,0,1]=4 40 B10R0.4 CCCCCCNCC(=O)O Amb8827565 [0,0,0,0,0,0|2,0,1]=3 41 B10R0.4 CCCCCCNCC(C)C Amb6730526 [0,0,0,0,0,0|2,0,2]=4 42 B10R0.4 CCCCCCNCC(C)O Amb9247474 [0,0,0,0,0,0|1,0,3]=4 43 B10R0.4 CCCCCCOCC(=O)O Amb7790032 [0,0,0,0,0,0|2,0,1]=3 44 B10R0.4 CCCCCC\C=C\B(O)O Amb2456043 [0,0,0,0,0,0|2,0,1]=3 45 B10R0.4 CCCCCC\C=C\C(=O)O Amb3940553 [0,0,0,0,0,0|1,0,0]=1 46 B10R0.4 CCCCCC\C=C\C(C)=O Amb22052629 [0,0,0,0,0,0|0,0,0]=0 47 B10R0.4 CCCCCC\C=C\C(C)O Amb22641689 [0,0,0,0,0,0|0,0,2]=2 48 B10R0.4 CCCCCNCCC(=O)O Amb7755694 [0,0,0,0,0,0|2,0,2]=4 49 B10R0.4 CCCCC\C=C\C=C(C)C Amb22546758 [0,0,0,0,0,0|1,0,1]=2 50 B10R0.4 CCCCC\C=C\NC(C)=O Amb28080162 [0,0,0,0,0,0|1,0,1]=2 51 B10R0.4 CCCCSCCCC(=O)O Amb9280591 [0,0,0,0,0,0|2,0,2]=4 52 B10R0.4 CCCNCCCOC(C)=O Amb18924647 [0,0,0,0,0,0|2,0,1]=3 53 B10R0.4 CCC\C=C\C=C/C=C(C)C Amb22546608 [0,0,0,0,0,0|1,0,3]=4 54 B10R0.4 CCNCCOCCC(C)=O Amb18630736 [0,0,0,0,0,0|2,0,2]=4 55 B10R0.4 CCOCCCCCC(=O)O Amb22234334 [0,0,0,0,0,0|2,0,2]=4 56 B10R0.4 CC\C=C\CN\C=C\C(=O)O Amb28387904 [0,0,0,0,0,0|2,0,2]=4 57 B10R0.4 COCCCNCCC(C)=O Amb32675820 [0,0,0,0,0,0|2,0,2]=4 58 B10R0.4 COCCNCCNC(C)=O Amb9256125 [0,0,0,0,0,0|3,0,1]=4 59 B10R0.4 COCCOC\C=C\C(=O)O Amb18182499 [0,0,0,0,0,0|3,0,0]=3 60 B10R0.4 CSCCCCCCC(=O)O Amb28652939 [0,0,0,0,0,0|2,0,2]=4 61 B10R0.4 C\C=C\CCN\C=C\C(=O)O Amb28386735 [0,0,0,0,0,0|2,0,2]=4 62 B10R0.4 NCCCCCCCC(=O)O Amb19929586 [0,0,0,0,0,0|2,0,2]=4 63 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [0,0,0,0,0,0|2,0,2]=4 64 B10R0.4 NCCCCCCNC(=O)O Amb22494605 [0,0,0,0,0,0|3,0,1]=4 65 B10R0.4 O=C(O)CCCCCCCBr Amb3940372 [0,0,0,0,0,0|2,0,2]=4 66 B10R0.4 O=C(O)CCCCCCCO Amb2688777 [0,0,0,0,0,0|2,0,2]=4 67 B10R0.4 O=C([O-])CCCCCCCO Amb33513015 [0,0,0,0,0,0|2,0,2]=4 68 B9R0.2 C#CCCCCCC(C)=O Amb28053988 [1,0,0,0,0,0|0,0,3]=4 69 B9R0.2 C#CCCC\C=C\C(C)=O Amb25205680 [1,0,0,0,0,0|0,0,2]=3 70 B9R0.2 C#CCOC\C=C\C(C)=O Amb26528467 [1,0,0,0,0,0|1,0,2]=4 71 B9R0.2 C=C(C)C#CCCCCC Amb27593421 [1,0,0,0,0,0|1,0,2]=4 72 B9R0.2 C=C(C)CCCCCCC Amb6298940 [1,0,0,0,0,0|1,0,1]=3 73 B9R0.2 C=C(C)CCCCCCCl Amb6298888 [1,0,0,0,0,0|2,0,1]=4 74 B9R0.2 C=C(C)CCCCCNC Amb27489967 [1,0,0,0,0,0|2,0,1]=4 75 B9R0.2 C=C(C)CCSCCCC Amb27199306 [1,0,0,0,0,0|2,0,1]=4 76 B9R0.2 C=C(C)CNCCCCC Amb17308711 [1,0,0,0,0,0|2,0,1]=4 77 B9R0.2 C=C(C)COCCCCC Amb27862423 [1,0,0,0,0,0|2,0,1]=4 78 B9R0.2 C=C(C)CSCCCCC Amb27977453 [1,0,0,0,0,0|2,0,1]=4 79 B9R0.2 C=C(C)\C=C\C=C\CCC Amb22641687 [1,0,0,0,0,0|1,0,2]=4 80 B9R0.2 C=C(C)\C=C\CCCC=O Amb18643329 [1,0,0,0,0,0|2,0,1]=4 81 B9R0.2 C=C(C)\C=C\OCCCO Amb27647918 [1,0,0,0,0,0|3,0,0]=4 82 B9R0.2 C=CCCCCCC(C)=O Amb33544200 [1,0,0,0,0,0|0,0,3]=4 83 B9R0.2 C=CCCCCNC(C)=O Amb27436512 [1,0,0,0,0,0|1,0,2]=4 84 B9R0.2 C=CCCCCOC(C)=O Amb10842183 [1,0,0,0,0,0|1,0,2]=4 85 B9R0.2 C=CCCC\C=C\C(C)=O Amb27628550 [1,0,0,0,0,0|0,0,2]=3 86 B9R0.2 CC(=O)CCCCCCN Amb25147578 [1,0,0,0,0,0|1,0,1]=3 87 B9R0.2 CC(=O)CCCCCCN Amb32663700 [1,0,0,0,0,0|1,0,1]=3 88 B9R0.2 CC(=O)CCCSCCO Amb9660259 [1,0,0,0,0,0|2,0,1]=4 89 B9R0.2 CC(=O)CNCCCCN Amb33483477 [1,0,0,0,0,0|2,0,1]=4 90 B9R0.2 CC(=O)CNCCCCN Amb33483478 [1,0,0,0,0,0|2,0,1]=4 91 B9R0.2 CC(=O)CSCCCCF Amb27952719 [1,0,0,0,0,0|2,0,1]=4 92 B9R0.2 CC(=O)CSCCCCN Amb17500952 [1,0,0,0,0,0|2,0,1]=4 93 B9R0.2 CC(=O)NCCCCC=O Amb24524516 [1,0,0,0,0,0|2,0,1]=4 94 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [1,0,0,0,0,0|2,0,0]=3 95 B9R0.2 CC(=O)NCCCCCN Amb18102716 [1,0,0,0,0,0|2,0,0]=3 96 B9R0.2 CC(=O)NCCNCCN Amb27596069 [1,0,0,0,0,0|3,0,0]=4 97 B9R0.2 CC(=O)NCCOCCBr Amb33528182 [1,0,0,0,0,0|3,0,0]=4 98 B9R0.2 CC(=O)NCCOCCCl Amb27461485 [1,0,0,0,0,0|3,0,0]=4 99 B9R0.2 CC(=O)NCCOCCN Amb16233780 [1,0,0,0,0,0|3,0,0]=4 100 B9R0.2 CC(=O)NCCOCCO Amb24477952 [1,0,0,0,0,0|3,0,0]=4 101 B9R0.2 CC(=O)NCCSCCN Amb8876526 [1,0,0,0,0,0|3,0,0]=4 102 B9R0.2 CC(=O)OCCCCC=O Amb26505388 [1,0,0,0,0,0|2,0,1]=4 103 B9R0.2 CC(=O)OCCCCCBr Amb8516155 [1,0,0,0,0,0|2,0,0]=3 104 B9R0.2 CC(=O)OCCCCCCl Amb2778974 [1,0,0,0,0,0|2,0,0]=3 105 B9R0.2 CC(=O)OCCCC[Zn]Br Amb22000480 [1,0,0,0,0,0|3,0,0]=4 106 B9R0.2 CC(=O)OCCNCCCl Amb28142296 [1,0,0,0,0,0|3,0,0]=4 107 B9R0.2 CC(=O)OCCOCCCl Amb9787226 [1,0,0,0,0,0|3,0,0]=4 108 B9R0.2 CC(=O)OCCOCCI Amb28050483 [1,0,0,0,0,0|3,0,0]=4 109 B9R0.2 CC(=O)OCCSCCO Amb27825930 [1,0,0,0,0,0|3,0,0]=4 110 B9R0.2 CC(=O)SCCCCC#N Amb28322815 [1,0,0,0,0,0|2,0,1]=4 111 B9R0.2 CC(=O)SCCCCC=O Amb27432569 [1,0,0,0,0,0|2,0,1]=4 112 B9R0.2 CC(=O)SCCOCCO Amb28050523 [1,0,0,0,0,0|3,0,0]=4 113 B9R0.2 CC(=O)\C=C\CCCCBr Amb24477141 [1,0,0,0,0,0|1,0,0]=2 114 B9R0.2 CC(=O)\C=C\CCCCCl Amb27599396 [1,0,0,0,0,0|1,0,0]=2 115 B9R0.2 CC(=O)\C=C\CCCCO Amb24518640 [1,0,0,0,0,0|1,0,0]=2 116 B9R0.2 CC(=O)\N=C\CCCCO Amb27169910 [1,0,0,0,0,0|2,0,0]=3 117 B9R0.2 CC(C)=CCCCCC=O Amb18643636 [1,0,0,0,0,0|2,0,1]=4 118 B9R0.2 CC(C)=CCCCCCCl Amb27879457 [1,0,0,0,0,0|2,0,0]=3 119 B9R0.2 CC(C)=CCNCCCN Amb18622357 [1,0,0,0,0,0|3,0,0]=4 120 B9R0.2 CC(C)=CCOCCCN Amb27200033 [1,0,0,0,0,0|3,0,0]=4 121 B9R0.2 CC(S)\C=C\CCCCO Amb27486620 [1,0,0,0,0,0|1,1,1]=4 122 B9R0.2 CCC#CCCCC(C)=O Amb27836855 [1,0,0,0,0,0|0,0,3]=4 123 B9R0.2 CCC#CCCOC(C)=O Amb22641578 [1,0,0,0,0,0|1,0,2]=4 124 B9R0.2 CCCC#C\C=C/C(=O)O Amb27435469 [1,0,0,0,0,0|1,0,2]=4 125 B9R0.2 CCCC#C\C=C\C(=O)O Amb27202812 [1,0,0,0,0,0|1,0,2]=4 126 B9R0.2 CCCCC=C=CC(=O)O Amb17593544 [1,0,0,0,0,0|1,0,2]=4 127 B9R0.2 CCCCCC#CC(=O)Cl Amb27950037 [1,0,0,0,0,0|1,0,2]=4 128 B9R0.2 CCCCCC#CC(=O)O Amb2778506 [1,0,0,0,0,0|1,0,2]=4 129 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [1,0,0,0,0,0|1,0,1]=3 130 B9R0.2 CCCCCCCC(=O)O Amb3940371 [1,0,0,0,0,0|1,0,1]=3 131 B9R0.2 CCCCCCCC(=O)S Amb10561702 [1,0,0,0,0,0|1,0,1]=3 132 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [1,0,0,0,0,0|1,0,1]=3 133 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [1,0,0,0,0,0|1,0,1]=3 134 B9R0.2 CCCCCCCC(C)=O Amb6891951 [1,0,0,0,0,0|0,0,1]=2 135 B9R0.2 CCCCCCCC(C)Br Amb3940567 [1,0,0,0,0,0|1,0,2]=4 136 B9R0.2 CCCCCCCC(C)C Amb6366303 [1,0,0,0,0,0|1,0,2]=4 137 B9R0.2 CCCCCCCC(C)S Amb7795228 [1,0,0,0,0,0|0,1,2]=4 138 B9R0.2 CCCCCCCC(N)=O Amb8999028 [1,0,0,0,0,0|1,0,1]=3 139 B9R0.2 CCCCCCCS(=O)Cl Amb32720351 [1,0,0,0,0,0|2,0,1]=4 140 B9R0.2 CCCCCCCS(=O)[O-] Amb32754186 [1,0,0,0,0,0|2,0,1]=4 141 B9R0.2 CCCCCCCS(N)=O Amb32720352 [1,0,0,0,0,0|2,0,1]=4 142 B9R0.2 CCCCCCC[C@@H](C)Br Amb28252396 [1,0,0,0,0,0|1,0,2]=4 143 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [1,0,0,0,0,0|1,0,2]=4 144 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [1,0,0,0,0,0|0,0,3]=4 145 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [1,0,0,0,0,0|1,0,2]=4 146 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [1,0,0,0,0,0|0,0,3]=4 147 B9R0.2 CCCCCCC[N+](=O)[O-] Amb17672611 [1,0,0,0,0,0|2,0,1]=4 148 B9R0.2 CCCCCCNC(C)=O Amb3368460 [1,0,0,0,0,0|1,0,0]=2 149 B9R0.2 CCCCCCNC(N)=O Amb23569596 [1,0,0,0,0,0|2,0,0]=3 150 B9R0.2 CCCCCCNC(N)=S Amb1152526 [1,0,0,0,0,0|2,1,0]=4 151 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [1,0,0,0,0,0|2,0,0]=3 152 B9R0.2 CCCCCCOC(=S)[S-] Amb594881 [1,0,0,0,0,0|2,1,0]=4 153 B9R0.2 CCCCCCOC(C)=O Amb8513414 [1,0,0,0,0,0|1,0,0]=2 154 B9R0.2 CCCCCCOC(C)C Amb28320041 [1,0,0,0,0,0|2,0,1]=4 155 B9R0.2 CCCCCCOC(C)Cl Amb25662692 [1,0,0,0,0,0|2,0,1]=4 156 B9R0.2 CCCCCCOC(C)O Amb28347016 [1,0,0,0,0,0|1,0,2]=4 157 B9R0.2 CCCCCCOC(N)=O Amb22495526 [1,0,0,0,0,0|2,0,0]=3 158 B9R0.2 CCCCCCO[N+](=O)[O-] Amb27233862 [1,0,0,0,0,0|3,0,0]=4 159 B9R0.2 CCCCCCSC(=N)N Amb20676030 [1,0,0,0,0,0|3,0,0]=4 160 B9R0.2 CCCCCCSC(=N)N Amb22487386 [1,0,0,0,0,0|3,0,0]=4 161 B9R0.2 CCCCCCSC(=N)N Amb27811857 [1,0,0,0,0,0|3,0,0]=4 162 B9R0.2 CCCCCCSC(=O)Cl Amb28421765 [1,0,0,0,0,0|2,0,0]=3 163 B9R0.2 CCCCCCSC(C)=O Amb27837874 [1,0,0,0,0,0|1,0,0]=2 164 B9R0.2 CCCCCCSC(C)C Amb28315852 [1,0,0,0,0,0|2,0,1]=4 165 B9R0.2 CCCCCCSC(N)=S Amb28342219 [1,0,0,0,0,0|2,1,0]=4 166 B9R0.2 CCCCCC\C=C(\C)I Amb28464058 [1,0,0,0,0,0|1,0,0]=2 167 B9R0.2 CCCCCNCC(N)=O Amb6708061 [1,0,0,0,0,0|2,0,1]=4 168 B9R0.2 CCCCCOCC(=O)O Amb8902706 [1,0,0,0,0,0|2,0,1]=4 169 B9R0.2 CCCCCONC(N)=O Amb2899790 [1,0,0,0,0,0|3,0,0]=4 170 B9R0.2 CCCCCSCC(=O)O Amb6249571 [1,0,0,0,0,0|2,0,1]=4 171 B9R0.2 CCCCC\C=C/C(C)C Amb22546691 [1,0,0,0,0,0|1,0,1]=3 172 B9R0.2 CCCCC\C=C\B(O)O Amb10068584 [1,0,0,0,0,0|2,0,1]=4 173 B9R0.2 CCCCC\C=C\C(C)C Amb22546757 [1,0,0,0,0,0|1,0,1]=3 174 B9R0.2 CCCCC\C=C\C(C)O Amb27472596 [1,0,0,0,0,0|0,0,2]=3 175 B9R0.2 CCCCC\C=C\[C@H](C)O Amb27852185 [1,0,0,0,0,0|0,0,2]=3 176 B9R0.2 CCCCNCCC(=O)O Amb7755713 [1,0,0,0,0,0|2,0,1]=4 177 B9R0.2 CCCCNCCC(C)=O Amb26381876 [1,0,0,0,0,0|1,0,1]=3 178 B9R0.2 CCCCNCCC(N)=O Amb8841106 [1,0,0,0,0,0|2,0,1]=4 179 B9R0.2 CCCCN\C=C\C(C)=O Amb25147404 [1,0,0,0,0,0|1,0,0]=2 180 B9R0.2 CCCCOCCC(N)=O Amb27480748 [1,0,0,0,0,0|2,0,1]=4 181 B9R0.2 CCCCO\C=C\C(=O)Cl Amb27804268 [1,0,0,0,0,0|2,0,0]=3 182 B9R0.2 CCCCSCCC(=O)O Amb1032992 [1,0,0,0,0,0|2,0,1]=4 183 B9R0.2 CCCCS\C=C/C(C)=O Amb27945160 [1,0,0,0,0,0|1,0,0]=2 184 B9R0.2 CCCCS\C=C\C(C)=O Amb26410917 [1,0,0,0,0,0|1,0,0]=2 185 B9R0.2 CCCC\C=C/CC(C)=O Amb26493143 [1,0,0,0,0,0|0,0,2]=3 186 B9R0.2 CCCC\C=C\CC(=O)O Amb6297257 [1,0,0,0,0,0|1,0,2]=4 187 B9R0.2 CCCC\C=C\CC(N)=O Amb1815461 [1,0,0,0,0,0|1,0,2]=4 188 B9R0.2 CCCC\C=C\NC(C)=O Amb24674131 [1,0,0,0,0,0|1,0,1]=3 189 B9R0.2 CCCC\C=C\OC(C)=O Amb25293926 [1,0,0,0,0,0|1,0,1]=3 190 B9R0.2 CCCNCCC=C(C)C Amb27238155 [1,0,0,0,0,0|2,0,0]=3 191 B9R0.2 CCCNCCCC(=O)O Amb1109953 [1,0,0,0,0,0|2,0,1]=4 192 B9R0.2 CCCNCCNS(C)=O Amb27265740 [1,0,0,0,0,0|3,0,0]=4 193 B9R0.2 CCCNCCOC(N)=O Amb27828395 [1,0,0,0,0,0|3,0,0]=4 194 B9R0.2 CCCOCCCC(=O)O Amb8874517 [1,0,0,0,0,0|2,0,1]=4 195 B9R0.2 CCCOCCOC(=O)Cl Amb26963668 [1,0,0,0,0,0|3,0,0]=4 196 B9R0.2 CCCOCCOC(C)=O Amb25354004 [1,0,0,0,0,0|2,0,0]=3 197 B9R0.2 CCCOCCOC(N)=O Amb27265626 [1,0,0,0,0,0|3,0,0]=4 198 B9R0.2 CCCONCC=C(C)C Amb28186052 [1,0,0,0,0,0|3,0,0]=4 199 B9R0.2 CCCSCCCC(=O)O Amb6680215 [1,0,0,0,0,0|2,0,1]=4 200 B9R0.2 CCCSCCCC(C)=O Amb9660304 [1,0,0,0,0,0|1,0,1]=3 201 B9R0.2 CCCSCCNC(N)=O Amb28345909 [1,0,0,0,0,0|3,0,0]=4 202 B9R0.2 CCC\C=C/C=C/C(C)=O Amb28291455 [1,0,0,0,0,0|0,0,2]=3 203 B9R0.2 CCC\C=C\C=C\C(=O)O Amb32953792 [1,0,0,0,0,0|1,0,2]=4 204 B9R0.2 CCC\C=C\C=C\C(C)=O Amb33079035 [1,0,0,0,0,0|0,0,2]=3 205 B9R0.2 CCC\C=C\C=C\C(N)=O Amb28369023 [1,0,0,0,0,0|1,0,2]=4 206 B9R0.2 CCC\C=C\CCC(C)=O Amb33359154 [1,0,0,0,0,0|0,0,3]=4 207 B9R0.2 CCC\C=C\COC(C)=O Amb8515402 [1,0,0,0,0,0|1,0,2]=4 208 B9R0.2 CCNCCCCC(=O)O Amb24385094 [1,0,0,0,0,0|2,0,1]=4 209 B9R0.2 CCNCCCCC(=O)O Amb32686610 [1,0,0,0,0,0|2,0,1]=4 210 B9R0.2 CCNCCCCC(C)=O Amb27951143 [1,0,0,0,0,0|1,0,1]=3 211 B9R0.2 CCNCCCCC(N)=O Amb27964384 [1,0,0,0,0,0|2,0,1]=4 212 B9R0.2 CCNCCCNC(N)=O Amb9466113 [1,0,0,0,0,0|3,0,0]=4 213 B9R0.2 CCNCC\C=C\C(C)C Amb27251097 [1,0,0,0,0,0|2,0,1]=4 214 B9R0.2 CCOCCCCC(=O)O Amb9207786 [1,0,0,0,0,0|2,0,1]=4 215 B9R0.2 CCOCCCCC(C)=O Amb9659807 [1,0,0,0,0,0|1,0,1]=3 216 B9R0.2 CCOCCCNC(C)=O Amb3886591 [1,0,0,0,0,0|2,0,0]=3 217 B9R0.2 CCOCCCNC(N)=O Amb404787 [1,0,0,0,0,0|3,0,0]=4 218 B9R0.2 CCOCCCOC(C)=O Amb22733319 [1,0,0,0,0,0|2,0,0]=3 219 B9R0.2 CCOCSCC=C(C)C Amb27842954 [1,0,0,0,0,0|3,0,0]=4 220 B9R0.2 CCSCCCCC(=O)O Amb7782874 [1,0,0,0,0,0|2,0,1]=4 221 B9R0.2 CCSCCCOC(C)=O Amb27605064 [1,0,0,0,0,0|2,0,0]=3 222 B9R0.2 CCSCCONC(C)=O Amb28070443 [1,0,0,0,0,0|3,0,0]=4 223 B9R0.2 CC\C=C\CCOC(C)=O Amb9134795 [1,0,0,0,0,0|1,0,2]=4 224 B9R0.2 CC\C=C\C\C=C\C(C)=O Amb27226161 [1,0,0,0,0,0|0,0,2]=3 225 B9R0.2 CNCCCCCC(C)=O Amb25728176 [1,0,0,0,0,0|1,0,1]=3 226 B9R0.2 CNCCCCCC(N)=O Amb27625362 [1,0,0,0,0,0|2,0,1]=4 227 B9R0.2 CNCCNCC=C(C)C Amb28123457 [1,0,0,0,0,0|3,0,0]=4 228 B9R0.2 CNCCOCCC(C)=O Amb18630756 [1,0,0,0,0,0|2,0,1]=4 229 B9R0.2 CNCCS\C=C\C(=O)O Amb27471288 [1,0,0,0,0,0|3,0,0]=4 230 B9R0.2 COCCCCCC(=O)O Amb10607872 [1,0,0,0,0,0|2,0,1]=4 231 B9R0.2 COCCCCCC(C)=O Amb27227265 [1,0,0,0,0,0|1,0,1]=3 232 B9R0.2 COCCCCNC(C)=O Amb27170819 [1,0,0,0,0,0|2,0,0]=3 233 B9R0.2 COCCCCOC(C)=O Amb24325176 [1,0,0,0,0,0|2,0,0]=3 234 B9R0.2 COCCNCCC(C)=O Amb24473587 [1,0,0,0,0,0|2,0,1]=4 235 B9R0.2 COCCOCOC(C)=O Amb28126918 [1,0,0,0,0,0|3,0,0]=4 236 B9R0.2 COCCS\C=C\C(=O)O Amb28398936 [1,0,0,0,0,0|3,0,0]=4 237 B9R0.2 COCOC\C=C\C(C)=O Amb26404277 [1,0,0,0,0,0|2,0,0]=3 238 B9R0.2 CS(=O)CCCCCCO Amb27771220 [1,0,0,0,0,0|2,0,1]=4 239 B9R0.2 CSCCCCCC(=O)O Amb27444761 [1,0,0,0,0,0|2,0,1]=4 240 B9R0.2 CSCCCCNC(C)=O Amb28325257 [1,0,0,0,0,0|2,0,0]=3 241 B9R0.2 CSCCCCOC(C)=O Amb28041805 [1,0,0,0,0,0|2,0,0]=3 242 B9R0.2 CSCCCSCC(C)=O Amb28059012 [1,0,0,0,0,0|2,0,1]=4 243 B9R0.2 CSCCNCC=C(C)C Amb27831042 [1,0,0,0,0,0|3,0,0]=4 244 B9R0.2 CSCCN\C=C\C(=O)O Amb27864234 [1,0,0,0,0,0|3,0,0]=4 245 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [1,0,0,0,0,0|2,0,1]=4 246 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [1,0,0,0,0,0|0,0,3]=4 247 B9R0.2 C\C=C\CCCNC(C)=O Amb24668710 [1,0,0,0,0,0|1,0,2]=4 248 B9R0.2 NC(=O)CCCCCCBr Amb27654995 [1,0,0,0,0,0|2,0,1]=4 249 B9R0.2 NC(=O)CCCCCCCl Amb27254212 [1,0,0,0,0,0|2,0,1]=4 250 B9R0.2 NCCCCCCC(=O)O Amb1151254 [1,0,0,0,0,0|2,0,1]=4 251 B9R0.2 NCCCCCCC(=O)O Amb16232099 [1,0,0,0,0,0|2,0,1]=4 252 B9R0.2 NCCCCCCC(=O)[O-] Amb32663972 [1,0,0,0,0,0|2,0,1]=4 253 B9R0.2 NCCCCCNC(N)=O Amb28120485 [1,0,0,0,0,0|3,0,0]=4 254 B9R0.2 NCCCS\C=C\C(=O)O Amb27837837 [1,0,0,0,0,0|3,0,0]=4 255 B9R0.2 O=C(Cl)\C=C\CCCCCl Amb25074569 [1,0,0,0,0,0|2,0,0]=3 256 B9R0.2 O=C(Cl)\C=C\OCCCCl Amb27863543 [1,0,0,0,0,0|3,0,0]=4 257 B9R0.2 O=C(F)OCCCCCCl Amb27391688 [1,0,0,0,0,0|3,0,0]=4 258 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [1,0,0,0,0,0|2,0,1]=4 259 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [1,0,0,0,0,0|2,0,1]=4 260 B9R0.2 O=C(O)CCCCCCF Amb25132501 [1,0,0,0,0,0|2,0,1]=4 261 B9R0.2 O=C(O)CCCCCCO Amb9787028 [1,0,0,0,0,0|2,0,1]=4 262 B9R0.2 O=C(O)CCCCCCS Amb24710334 [1,0,0,0,0,0|2,0,1]=4 263 B9R0.2 O=C(O)\C=C\CCCCCl Amb18645743 [1,0,0,0,0,0|2,0,0]=3 264 B9R0.2 O=C(O)\C=C\CSCCO Amb27205770 [1,0,0,0,0,0|3,0,0]=4 265 B9R0.45 C#C\C=C\CCCCCO Amb28050732 [1,0,0,0,0,0|1,0,2]=4 266 B9R0.45 C=CCCCCCCCC Amb3940503 [1,0,0,0,0,0|0,0,3]=4 267 B9R0.45 C=CCCCC\C=C\C=O Amb17593510 [1,0,0,0,0,0|0,0,2]=3 268 B9R0.45 C=CCNCCCCCC Amb7756950 [1,0,0,0,0,0|1,0,2]=4 269 B9R0.45 C=CCOCCCCCC Amb17933923 [1,0,0,0,0,0|1,0,2]=4 270 B9R0.45 C=CCSCCCCCC Amb22733767 [1,0,0,0,0,0|1,0,2]=4 271 B9R0.45 C=CC\C=C/CCCCC Amb27423727 [1,0,0,0,0,0|0,0,3]=4 272 B9R0.45 C=CC\C=C\CCCCC Amb27629643 [1,0,0,0,0,0|0,0,3]=4 273 B9R0.45 C=C\C=C/CCCCCC Amb22641680 [1,0,0,0,0,0|0,0,1]=2 274 B9R0.45 C=C\C=C\CCCCCO Amb27242542 [1,0,0,0,0,0|1,0,1]=3 275 B9R0.45 C=C\C=C\CCNCCC Amb28049583 [1,0,0,0,0,0|1,0,1]=3 276 B9R0.45 CC#CCCCCCCC Amb2721539 [1,0,0,0,0,0|0,0,3]=4 277 B9R0.45 CCC#CCCCCCC Amb2721540 [1,0,0,0,0,0|0,0,3]=4 278 B9R0.45 CCCCCCCCCC Amb7757835 [1,0,0,0,0,0|0,0,3]=4 279 B9R0.45 CCCCCCCCNC Amb7757640 [1,0,0,0,0,0|1,0,2]=4 280 B9R0.45 CCCCCCCCSC Amb10553780 [1,0,0,0,0,0|1,0,2]=4 281 B9R0.45 CCCCCCCN=C=O Amb3940866 [1,0,0,0,0,0|1,0,2]=4 282 B9R0.45 CCCCCCCNC=O Amb27170738 [1,0,0,0,0,0|1,0,1]=3 283 B9R0.45 CCCCCCCOC=O Amb9787223 [1,0,0,0,0,0|1,0,1]=3 284 B9R0.45 CCCCCCCOCC Amb26332517 [1,0,0,0,0,0|1,0,2]=4 285 B9R0.45 CCCCCCC\C=N\N Amb28193253 [1,0,0,0,0,0|2,0,1]=4 286 B9R0.45 CCCCCCNCCC Amb6730565 [1,0,0,0,0,0|1,0,2]=4 287 B9R0.45 CCCCCCOCC=O Amb26624223 [1,0,0,0,0,0|1,0,1]=3 288 B9R0.45 CCCCCCOCCC Amb27838831 [1,0,0,0,0,0|1,0,2]=4 289 B9R0.45 CCCCCCO\C=C/Cl Amb27984890 [1,0,0,0,0,0|2,0,0]=3 290 B9R0.45 CCCCCC\C=C/CO Amb10807383 [1,0,0,0,0,0|0,0,2]=3 291 B9R0.45 CCCCCC\C=C\C=O Amb24061310 [1,0,0,0,0,0|0,0,0]=1 292 B9R0.45 CCCCCC\C=C\CO Amb22168300 [1,0,0,0,0,0|0,0,2]=3 293 B9R0.45 CCCCCC\C=C\OC Amb30621739 [1,0,0,0,0,0|1,0,0]=2 294 B9R0.45 CCCCCOCCC=O Amb27628424 [1,0,0,0,0,0|1,0,2]=4 295 B9R0.45 CCCCC\C=C\OCC Amb27590195 [1,0,0,0,0,0|1,0,2]=4 296 B9R0.45 CCCCNC\C=C\CN Amb27391026 [1,0,0,0,0,0|2,0,1]=4 297 B9R0.45 CCCCOC\C=C/CBr Amb27798436 [1,0,0,0,0,0|2,0,1]=4 298 B9R0.45 CCCCOC\C=C\CBr Amb28318470 [1,0,0,0,0,0|2,0,1]=4 299 B9R0.45 CCCCOC\C=C\CN Amb27877410 [1,0,0,0,0,0|2,0,1]=4 300 B9R0.45 CCCCOC\C=C\CO Amb28453524 [1,0,0,0,0,0|1,0,2]=4 301 B9R0.45 CCCCOC\C=C\CS Amb27809829 [1,0,0,0,0,0|1,1,1]=4 302 B9R0.45 CCCCSC\C=C\CO Amb28205928 [1,0,0,0,0,0|1,0,2]=4 303 B9R0.45 CCCCSC\C=C\CS Amb27632116 [1,0,0,0,0,0|1,1,1]=4 304 B9R0.45 CCCOCCCNC=O Amb27453700 [1,0,0,0,0,0|2,0,1]=4 305 B9R0.45 CCC\C=C\CCCCC Amb22231673 [1,0,0,0,0,0|0,0,3]=4 306 B9R0.45 CCC\C=C\C\C=C\C=O Amb27635823 [1,0,0,0,0,0|0,0,2]=3 307 B9R0.45 CCOCCCCNC=O Amb27634560 [1,0,0,0,0,0|2,0,1]=4 308 B9R0.45 CC\C=C/CC\C=C\C=O Amb2720527 [1,0,0,0,0,0|0,0,2]=3 309 B9R0.45 CC\C=C\CCCCCC Amb22231672 [1,0,0,0,0,0|0,0,1]=2 310 B9R0.45 CC\C=C\CC\C=C\C=O Amb18124509 [1,0,0,0,0,0|0,0,2]=3 311 B9R0.45 CC\C=C\CC\C=C\CC Amb24558322 [1,0,0,0,0,0|0,0,3]=4 312 B9R0.45 CC\C=C\CNCCOC Amb27432873 [1,0,0,0,0,0|2,0,1]=4 313 B9R0.45 CC\C=C\COCCCC Amb25912010 [1,0,0,0,0,0|1,0,1]=3 314 B9R0.45 CSCCCCCNC=O Amb27165514 [1,0,0,0,0,0|2,0,1]=4 315 B9R0.45 CSCCCC\C=C\CO Amb27604531 [1,0,0,0,0,0|1,0,2]=4 316 B9R0.45 C\C=C/C=C\CCCCC Amb22641684 [1,0,0,0,0,0|0,0,1]=2 317 B9R0.45 C\C=C/CCCCCCC Amb26019969 [1,0,0,0,0,0|0,0,1]=2 318 B9R0.45 C\C=C\C=C/C=C/CCC Amb22641677 [1,0,0,0,0,0|0,0,3]=4 319 B9R0.45 C\C=C\C=C\CCCCBr Amb28137170 [1,0,0,0,0,0|1,0,1]=3 320 B9R0.45 C\C=C\C=C\COCOC Amb28185052 [1,0,0,0,0,0|2,0,1]=4 321 B9R0.45 C\C=C\CCCCCCO Amb27980554 [1,0,0,0,0,0|1,0,1]=3 322 B9R0.45 C\C=C\CCCCCNC Amb26398871 [1,0,0,0,0,0|1,0,1]=3 323 B9R0.45 C\C=C\CCNCCCC Amb27789929 [1,0,0,0,0,0|1,0,1]=3 324 B9R0.45 C\C=C\CNCCCCCl Amb28047862 [1,0,0,0,0,0|2,0,1]=4 325 B9R0.45 C\C=C\CNCCCOC Amb28254436 [1,0,0,0,0,0|2,0,1]=4 326 B9R0.45 C\C=C\CNCCOCC Amb27823197 [1,0,0,0,0,0|2,0,1]=4 327 B9R0.45 C\C=C\CNCCSCC Amb27652288 [1,0,0,0,0,0|2,0,1]=4 328 B9R0.45 C\C=C\COCCCNC Amb27487855 [1,0,0,0,0,0|2,0,1]=4 329 B9R0.45 C\C=C\OCCCCCO Amb28350349 [1,0,0,0,0,0|2,0,0]=3 330 B9R0.45 NCCCCCCNC=O Amb28251393 [1,0,0,0,0,0|2,0,1]=4 331 B9R0.45 O=CCCCCCCCF Amb25075653 [1,0,0,0,0,0|1,0,2]=4 332 B9R0.45 O=CCCCCCCCO Amb25765567 [1,0,0,0,0,0|1,0,2]=4 333 B9R0.45 O=C\C=C/CCCCC=O Amb27168965 [1,0,0,0,0,0|1,0,1]=3 334 B9R0.45 OC\C=C\CCCCCBr Amb24666213 [1,0,0,0,0,0|1,0,2]=4 335 B9R0.45 OC\C=C\CCCCCO Amb27204813 [1,0,0,0,0,0|1,0,2]=4 336 B11R0.2 CC(C)=CC(=O)NCCCCN Amb18102551 [0,1,0,0,0,0|3,0,0]=4 337 B11R0.2 CCCCCCC(=O)CC(C)C Amb18802035 [0,1,0,0,0,0|1,0,2]=4 338 B11R0.2 CCCCCCC(C)CC(=O)O Amb4001745 [0,1,0,0,0,0|1,0,2]=4 339 B11R0.2 CCCCCCC(C)OC(=O)Cl Amb24061311 [0,1,0,0,0,0|2,0,1]=4 340 B11R0.2 CCCCCCC(N)CC(=O)O Amb2229636 [0,1,0,0,0,0|1,0,2]=4 341 B11R0.2 CCCCCCC(N)CC(=O)O Amb31307615 [0,1,0,0,0,0|1,0,2]=4 342 B11R0.2 CCCCCCC(N)CC(N)=O Amb32787662 [0,1,0,0,0,0|1,0,2]=4 343 B11R0.2 CCCCCCC(O)CC(=O)O Amb18803982 [0,1,0,0,0,0|1,0,2]=4 344 B11R0.2 CCCCCCN(C)CC(=O)O Amb33552686 [0,1,0,0,0,0|2,0,1]=4 345 B11R0.2 CCCCCOC(=O)CC(C)=O Amb22734938 [0,1,0,0,0,0|1,0,1]=3 346 B11R0.2 COCCOC\C(C)=C\C(=O)O Amb32664148 [0,1,0,0,0,0|3,0,0]=4 347 B11R0.30 C=C(C)CCCCCOC(C)=O Amb6299497 [0,1,0,0,0,0|1,0,2]=4 348 B11R0.30 CC(=O)CCCCCCC(C)=O Amb21962685 [0,1,0,0,0,0|0,0,3]=4 349 B11R0.30 CC(C)CCCCCCC(=O)[O-] Amb33513097 [0,1,0,0,0,0|1,0,2]=4 350 B11R0.40 CCCCCCC#CC(=O)OC Amb2725482 [0,1,0,0,0,0|0,0,2]=3 351 B11R0.40 CCCCCCCCC(=O)CC Amb9024774 [0,1,0,0,0,0|0,0,2]=3 352 B11R0.40 CCCCCCCCC(=O)NN Amb6544507 [0,1,0,0,0,0|1,0,2]=4 353 B11R0.40 CCCCCCCCC(=O)OC Amb8517582 [0,1,0,0,0,0|0,0,2]=3 354 B11R0.40 CCCCCCCNC(=O)CBr Amb17323631 [0,1,0,0,0,0|1,0,1]=3 355 B11R0.40 CCCCCCCNC(=O)CCl Amb17329833 [0,1,0,0,0,0|1,0,1]=3 356 B11R0.40 CCCCCCCNC(=O)CN Amb24115161 [0,1,0,0,0,0|1,0,1]=3 357 B11R0.40 CCCCCCCOC(=O)CC Amb9787227 [0,1,0,0,0,0|1,0,1]=3 358 B11R0.40 CCCCCCCOC(=O)CCl Amb9787570 [0,1,0,0,0,0|1,0,1]=3 359 B11R0.40 CCCCCCCOC(=O)CS Amb9786410 [0,1,0,0,0,0|1,0,1]=3 360 B11R0.40 CCCCCC\C=C\C(=O)OC Amb33513079 [0,1,0,0,0,0|0,0,0]=1 361 B11R0.40 CCCCOCCNC(=O)CCl Amb10609737 [0,1,0,0,0,0|2,0,1]=4 362 B11R0.40 CCCNCCCOC(=O)CC Amb18263176 [0,1,0,0,0,0|2,0,1]=4 363 B11R0.40 CCOCCCCNC(=O)CCl Amb17330717 [0,1,0,0,0,0|2,0,1]=4 364 B11R0.40 COC(=O)CCCCCCCBr Amb24063235 [0,1,0,0,0,0|1,0,2]=4 365 B11R0.40 COC(=O)CCCCCCCN Amb20669115 [0,1,0,0,0,0|1,0,2]=4 366 B11R0.40 COC(=O)CCCCCCCN Amb24331924 [0,1,0,0,0,0|1,0,2]=4 367 B11R0.40 COC(=O)NCCCCCCO Amb24095886 [0,1,0,0,0,0|2,0,1]=4 368 B11R0.42 C=C(C)C(=O)OCCCCCC Amb9826759 [0,1,0,0,0,0|2,0,0]=3 369 B11R0.42 CCCCC#C\C=C(\C)C(=O)O Amb27484014 [0,1,0,0,0,0|1,0,2]=4 370 B11R0.42 CCCCCCCC(=O)C(=O)O Amb22904309 [0,1,0,0,0,0|1,0,1]=3 371 B11R0.42 CCCCCCCC(=O)N(C)C Amb2720931 [0,1,0,0,0,0|2,0,1]=4 372 B11R0.42 CCCCCCCC(N)C(=O)O Amb2229635 [0,1,0,0,0,0|1,0,2]=4 373 B11R0.42 CCCCCCCC(N)C(N)=O Amb18794469 [0,1,0,0,0,0|1,0,2]=4 374 B11R0.42 CCCCCCC[C@@H](N)C(=O)O Amb22747720 [0,1,0,0,0,0|1,0,2]=4 375 B11R0.42 CCCCCCC[C@H](N)C(=O)O Amb33308889 [0,1,0,0,0,0|1,0,2]=4 376 B11R0.42 CCCCCCNC(=O)C(C)Cl Amb9000068 [0,1,0,0,0,0|2,0,1]=4 377 B11R0.42 CCCCCCOC(=O)C(C)C Amb6366413 [0,1,0,0,0,0|2,0,1]=4 378 B11R0.42 CCCCCCOC(C)C(=O)O Amb7790036 [0,1,0,0,0,0|2,0,1]=4 379 B11R0.42 CCCCCC\C=C(/C)C(C)O Amb22546750 [0,1,0,0,0,0|0,0,2]=3 380 B11R0.46 CCCCCC(C)CCC(=O)O Amb10807482 [0,1,0,0,0,0|1,0,2]=4 381 B11R0.46 CCCCCC(C)CCC(=O)[O-] Amb33513096 [0,1,0,0,0,0|1,0,2]=4 382 B11R0.46 CCCCNC(=O)\C=C\C(=O)O Amb1234975 [0,1,0,0,0,0|2,0,1]=4 383 B11R0.46 CCCCOC(=O)\C=C\C(=O)O Amb6891964 [0,1,0,0,0,0|2,0,1]=4 384 B11R0.111 CC(=O)OCCCCC(F)CBr Amb22641499 [0,1,0,0,0,0|2,0,1]=4 385 B11R0.148 C#CCCCCC\C=C\C(=O)O Amb2609438 [0,1,0,0,0,0|1,0,1]=3 386 B11R0.148 C=C(C)CCCCCCCCC Amb6298942 [0,1,0,0,0,0|1,0,2]=4 387 B11R0.148 CC(=O)OCCCCCCC=O Amb22364796 [0,1,0,0,0,0|1,0,2]=4 388 B11R0.148 CCCCCCCCCC(=O)Cl Amb8513576 [0,1,0,0,0,0|1,0,2]=4 389 B11R0.148 CCCCCCCCCC(=O)O Amb5718031 [0,1,0,0,0,0|1,0,2]=4 390 B11R0.148 CCCCCCCCCC(C)=O Amb6307417 [0,1,0,0,0,0|0,0,2]=3 391 B11R0.148 CCCCCCCCCC(N)=O Amb6366435 [0,1,0,0,0,0|1,0,2]=4 392 B11R0.148 CCCCCCCCNC(C)=O Amb33551736 [0,1,0,0,0,0|0,0,2]=3 393 B11R0.148 CCCCCCCCOC(=O)Cl Amb8515453 [0,1,0,0,0,0|1,0,2]=4 394 B11R0.148 CCCCCCCCOC(C)=O Amb8515405 [0,1,0,0,0,0|0,0,2]=3 395 B11R0.148 CCCCCCCNCC(=O)O Amb19373457 [0,1,0,0,0,0|1,0,2]=4 396 B11R0.148 CCCCCCCNCC(=O)O Amb8827566 [0,1,0,0,0,0|1,0,2]=4 397 B11R0.148 CCCCCCC\C=C\B(O)O Amb33513070 [0,1,0,0,0,0|2,0,1]=4 398 B11R0.148 CCCCCCC\C=C\C(=O)O Amb6336657 [0,1,0,0,0,0|1,0,0]=2 399 B11R0.148 CCCCCCNCCC(=O)O Amb8830823 [0,1,0,0,0,0|1,0,2]=4 400 B11R0.148 CCCCCC\C=C/C=C(C)C Amb22546455 [0,1,0,0,0,0|1,0,0]=2 401 B11R0.148 CCCCC\C=C\CCC(=O)O Amb24079160 [0,1,0,0,0,0|1,0,2]=4 402 B11R0.148 CCCCC\C=C\COC(C)=O Amb30988128 [0,1,0,0,0,0|0,0,2]=3 403 B11R0.148 CCCCOCCOCC(=O)O Amb9204477 [0,1,0,0,0,0|2,0,1]=4 404 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [0,1,0,0,0,0|1,0,2]=4 405 B11R0.148 CCOCCOCCOC(C)=O Amb8514868 [0,1,0,0,0,0|2,0,1]=4 406 B11R0.148 O=C(O)CCCCCCCCBr Amb8631538 [0,1,0,0,0,0|1,0,2]=4 407 B11R0.148 O=C(O)CCCCCCCCO Amb3372037 [0,1,0,0,0,0|1,0,2]=4 408 B11R0.159 CCCCCCCOS(C)(=O)=O Amb28286190 [0,1,0,0,0,0|2,0,1]=4 409 B11R1.24 CCCCC1=CC(=O)C=CS1 Amb27855025 [0,0,0,1,0,0|1,0,2]=4 410 B11R1.24 CCCCC1=NC=CC(=O)N1 Amb27154437 [0,0,0,1,0,0|2,0,1]=4 411 B11R1.24 CCCCC1=NN=CC(=O)C1 Amb27246352 [0,0,0,1,0,0|2,0,1]=4 412 B11R1.24 CCCCC1C=CNC(=S)C1 Amb27470812 [0,0,0,1,0,0|1,1,1]=4 413 B11R1.24 CCCCC1CC=CC(=O)N1 Amb27483840 [0,0,0,1,0,0|1,0,0]=2 414 B11R1.24 CCCCN1CCCC(=O)C1 Amb28322509 [0,0,0,1,0,0|1,0,2]=4 415 B11R1.24 CCCC[C@H]1C=CCC(=O)N1 Amb27176608 [0,0,0,1,0,0|1,0,2]=4 416 B11R1.24 CCCC[n+]1cccc(C)c1 Amb22411627 [0,0,0,1,0,0|2,0,1]=4 417 B11R1.24 CCCC[n+]1cccc(C)c1 Amb24323548 [0,0,0,1,0,0|2,0,1]=4 418 B11R1.24 CCCC[n+]1cccc(C)c1 Amb33934312 [0,0,0,1,0,0|2,0,1]=4 419 B11R1.24 CCCCc1cccc(C)c1 Amb22730119 [0,0,0,1,0,0|1,0,2]=4 420 B11R1.24 CCOCC1CC=CC(O)C1 Amb27665133 [0,0,0,1,0,0|1,0,2]=4 421 B11R1.24 CCOCC1CCCC(=O)C1 Amb28073558 [0,0,0,1,0,0|1,0,2]=4 422 B11R1.24 CCOCC1CCNC(=O)C1 Amb32654952 [0,0,0,1,0,0|2,0,1]=4 423 B11R1.24 CCSCC1CCCC(=O)C1 Amb35699380 [0,0,0,1,0,0|1,0,2]=4 424 B11R1.24 CSCCC1CC(=O)C=CO1 Amb27593061 [0,0,0,1,0,0|2,0,0]=3 425 B11R1.24 NCCCC1CCCC(=O)C1 Amb27272657 [0,0,0,1,0,0|1,0,2]=4 426 B11R1.24 NCCCC1CCNC(=O)C1 Amb25697471 [0,0,0,1,0,0|2,0,1]=4 427 B11R1.24 NCCCC1CCNC(=O)C1 Amb33734215 [0,0,0,1,0,0|2,0,1]=4 428 B11R1.24 O=C1C=CC[C@H](CCCO)O1 Amb27775902 [0,0,0,1,0,0|2,0,0]=3 429 B11R1.24 O=C1C=CNC(CCCO)C1 Amb27875208 [0,0,0,1,0,0|2,0,0]=3 430 B11R1.27 C=C=CCCC1C=CC(=O)C1 Amb27974055 [0,0,0,1,0,0|0,0,3]=4 431 B11R1.27 CCCCCC1=CCC(=O)N1 Amb25384805 [0,0,0,1,0,0|1,0,2]=4 432 B11R1.27 CCCCCC1=CCC(=O)O1 Amb26998895 [0,0,0,1,0,0|1,0,2]=4 433 B11R1.27 CCCCCC1C=CC(=O)O1 Amb24766300 [0,0,0,1,0,0|1,0,0]=2 434 B11R1.27 CCCCCC1CCC(=O)O1 Amb569744 [0,0,0,1,0,0|1,0,2]=4 435 B11R1.27 CCCCCC1CNC(=O)O1 Amb27987874 [0,0,0,1,0,0|2,0,1]=4 436 B11R1.27 CCCCC[C@@H]1CCC(=O)C1 Amb27673726 [0,0,0,1,0,0|0,0,2]=3 437 B11R1.27 CCCCC[C@H]1CCC(=O)C1 Amb28080151 [0,0,0,1,0,0|0,0,2]=3 438 B11R1.27 CCCCC[C@H]1CCC(=O)N1 Amb28080184 [0,0,0,1,0,0|1,0,2]=4 439 B11R1.27 CCCCC[C@H]1CCC(=O)O1 Amb22348365 [0,0,0,1,0,0|1,0,2]=4 440 B11R1.27 CCCCCc1ccc(Br)s1 Amb26081675 [0,0,0,1,0,0|1,1,1]=4 441 B11R1.27 CCCCCc1ccc(C)o1 Amb27672035 [0,0,0,1,0,0|0,0,2]=3 442 B11R1.27 CCCCCn1cc(C)cn1 Amb27988784 [0,0,0,1,0,0|3,0,0]=4 443 B11R1.27 CCCCCn1cc[n+](C)c1 Amb26660881 [0,0,0,1,0,0|3,0,0]=4 444 B11R1.27 CCCCCn1ccc(Br)n1 Amb27988786 [0,0,0,1,0,0|3,0,0]=4 445 B11R1.27 CCCCCn1ccc(Cl)n1 Amb27988787 [0,0,0,1,0,0|3,0,0]=4 446 B11R1.27 CCCCCn1ccc(I)n1 Amb28386943 [0,0,0,1,0,0|3,0,0]=4 447 B11R1.27 CCCCCn1ccc(N)n1 Amb18791553 [0,0,0,1,0,0|3,0,0]=4 448 B11R1.27 CCCCOC1C=CC(=O)N1 Amb27673614 [0,0,0,1,0,0|2,0,0]=3 449 B11R1.27 CCCNCC1CNC(=O)C1 Amb28079895 [0,0,0,1,0,0|2,0,1]=4 450 B11R1.27 CCCNCc1ccc(C)o1 Amb20673507 [0,0,0,1,0,0|1,0,2]=4 451 B11R1.27 CCCNCc1ccc(C)o1 Amb2592337 [0,0,0,1,0,0|1,0,2]=4 452 B11R1.27 CCCNCc1ccc(C)s1 Amb837905 [0,0,0,1,0,0|1,1,1]=4 453 B11R1.27 CCCOCC1CCC(=O)C1 Amb27987809 [0,0,0,1,0,0|1,0,2]=4 454 B11R1.27 CCNCCc1ccc(C)o1 Amb27670957 [0,0,0,1,0,0|1,0,2]=4 455 B11R1.27 CCNCCc1ccc(C)s1 Amb27670955 [0,0,0,1,0,0|1,1,1]=4 456 B11R1.27 CNCCCc1ccc(C)o1 Amb18125591 [0,0,0,1,0,0|1,0,2]=4 457 B11R1.27 CNCCCc1ccc(C)s1 Amb28387072 [0,0,0,1,0,0|1,1,1]=4 458 B11R1.27 Cc1ccc(CCCCBr)o1 Amb27672185 [0,0,0,1,0,0|1,0,2]=4 459 B11R1.27 Cc1ccc(CCCCN)o1 Amb18831090 [0,0,0,1,0,0|1,0,2]=4 460 B11R1.27 Cc1ccc(CCCCN)s1 Amb18198974 [0,0,0,1,0,0|1,1,1]=4 461 B11R1.27 O=C1C=C[C@@H](CCCCO)O1 Amb27989710 [0,0,0,1,0,0|2,0,0]=3 462 B11R1.27 O=C1CCC(CCCCBr)C1 Amb27673519 [0,0,0,1,0,0|1,0,2]=4 463 B11R1.27 O=C1CCC(CCCCCl)C1 Amb27990027 [0,0,0,1,0,0|1,0,2]=4 464 B11R1.27 O=C1CCC(CCCCO)C1 Amb28080310 [0,0,0,1,0,0|1,0,2]=4 465 B11R1.53 CC(=O)C1CCCCC1CN Amb24488210 [0,0,0,1,0,0|1,0,2]=4 466 B11R1.53 CC(=O)C1CCCCC1CO Amb28144180 [0,0,0,1,0,0|1,0,2]=4 467 B11R1.53 CC(=O)N1CCCCC1CO Amb9277476 [0,0,0,1,0,0|2,0,1]=4 468 B11R1.53 CC(=O)N1CCCC[C@@H]1CO Amb25829477 [0,0,0,1,0,0|2,0,1]=4 469 B11R1.53 CC(=O)N1CCCC[C@H]1CO Amb25268937 [0,0,0,1,0,0|2,0,1]=4 470 B11R1.53 CC(=O)[C@@H]1CCCC[C@@H]1CN Amb33132917 [0,0,0,1,0,0|1,0,2]=4 471 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CBr Amb27252188 [0,0,0,1,0,0|1,0,2]=4 472 B11R1.53 CC(=O)[C@H]1CCCC[C@@H]1CCl Amb27634843 [0,0,0,1,0,0|1,0,2]=4 473 B11R1.53 CCC1=C(C(=O)Cl)CCCC1 Amb28324256 [0,0,0,1,0,0|1,0,2]=4 474 B11R1.53 CCC1CCCCC1C(=O)O Amb27606678 [0,0,0,1,0,0|1,0,2]=4 475 B11R1.53 CCC1CCCCC1C(N)=O Amb27989232 [0,0,0,1,0,0|1,0,2]=4 476 B11R1.53 CCC1CCCCN1C(N)=O Amb8873523 [0,0,0,1,0,0|2,0,1]=4 477 B11R1.53 CCC1CCCNC1C(=O)O Amb26014486 [0,0,0,1,0,0|2,0,1]=4 478 B11R1.53 CCC1CNCCC1C(C)=O Amb32676965 [0,0,0,1,0,0|1,0,2]=4 479 B11R1.53 CC[C@@H]1CCCC[C@H]1C(C)=O Amb25232533 [0,0,0,1,0,0|0,0,2]=3 480 B11R1.53 CC[C@@H]1CCCN[C@@H]1C(=O)O Amb28200831 [0,0,0,1,0,0|2,0,1]=4 481 B11R1.53 CC[C@H]1CCCN[C@@H]1C(=O)O Amb27620290 [0,0,0,1,0,0|2,0,1]=4 482 B11R1.53 CNC1CCCC=C1C(=O)O Amb27411507 [0,0,0,1,0,0|2,0,0]=3 483 B11R1.53 COC1CCCCC1C(C)=O Amb27762537 [0,0,0,1,0,0|1,0,2]=4 484 B11R1.53 COC1CCCCN1C(C)=O Amb25793837 [0,0,0,1,0,0|2,0,1]=4 485 B11R1.53 C\C=C1\CCCN=C1C(C)=O Amb25226841 [0,0,0,1,0,0|1,0,2]=4 486 B11R1.53 O=C(O)C1=CCCCC1CO Amb27401800 [0,0,0,1,0,0|2,0,0]=3 487 B11R1.57 CC(=O)CN1CCC[C@@H]1CO Amb29855226 [0,0,0,1,0,0|2,0,1]=4 488 B11R1.57 CC(=O)CN1CCC[C@H]1CO Amb35687993 [0,0,0,1,0,0|2,0,1]=4 489 B11R1.57 CC(=O)C[C@@H]1CCC[C@H]1CCl Amb27660210 [0,0,0,1,0,0|1,0,2]=4 490 B11R1.57 CC(=O)NC1CCCC1CCl Amb27235337 [0,0,0,1,0,0|2,0,1]=4 491 B11R1.57 CC(=O)NC1CCCC1CO Amb28044186 [0,0,0,1,0,0|2,0,1]=4 492 B11R1.57 CCC1CCCC1NC(=O)Cl Amb35633526 [0,0,0,1,0,0|2,0,1]=4 493 B11R1.57 CCC1CCC\C1=N/S(C)=O Amb35693127 [0,0,0,1,0,0|2,0,0]=3 494 B11R1.57 CCC1COCC1NC(C)=O Amb35617073 [0,0,0,1,0,0|2,0,1]=4 495 B11R1.57 CCC1COC\C1=C/C(=O)O Amb35631904 [0,0,0,1,0,0|2,0,0]=3 496 B11R1.57 CCC1COC\C1=C/C(C)=O Amb35616359 [0,0,0,1,0,0|1,0,0]=2 497 B11R1.57 CCC1COC\C1=C/C(C)O Amb35586674 [0,0,0,1,0,0|1,0,2]=4 498 B11R1.57 CCC1COC\C1=N/S(C)=O Amb35616423 [0,0,0,1,0,0|3,0,0]=4 499 B11R1.57 CCN1CCC\C1=C/[N+](=O)[O-] Amb2610617 [0,0,0,1,0,0|3,0,0]=4 500 B11R1.57 CN[C@@H]1CCC[C@H]1NC(C)=O Amb28052128 [0,0,0,1,0,0|2,0,1]=4 501 B11R1.57 CO[C@@H]1CCC[C@H]1NC(C)=O Amb27598363 [0,0,0,1,0,0|2,0,1]=4 502 B11R1.57 CSC1CCCC1NC(C)=O Amb27469729 [0,0,0,1,0,0|2,0,1]=4 503 B11R1.57 CS[C@@H]1CCC[C@H]1NC(C)=O Amb27783376 [0,0,0,1,0,0|2,0,1]=4 504 B11R1.86 CC(=O)CC1=C(C)CCCC1 Amb17593809 [0,0,0,1,0,0|0,0,2]=3 505 B11R1.86 CC(=O)CC1CCCCC1Cl Amb28137935 [0,0,0,1,0,0|1,0,2]=4 506 B11R1.86 CC(=O)CC1CCCCC1F Amb27791180 [0,0,0,1,0,0|1,0,2]=4 507 B11R1.86 CC(=O)CC1CCCCC1N Amb24582661 [0,0,0,1,0,0|1,0,2]=4 508 B11R1.86 CC(=O)CC1CCCCN1C Amb5718445 [0,0,0,1,0,0|1,0,2]=4 509 B11R1.86 CC(=O)CN1CCCCC1C Amb8427993 [0,0,0,1,0,0|1,0,1]=3 510 B11R1.86 CC(=O)C[C@@H]1CCCCN1C Amb26450192 [0,0,0,1,0,0|1,0,2]=4 511 B11R1.86 CC(=O)C[C@@H]1CCCC[C@@H]1N Amb33307982 [0,0,0,1,0,0|1,0,2]=4 512 B11R1.86 CC(=O)C[C@@H]1CCCC[C@H]1O Amb27212016 [0,0,0,1,0,0|1,0,2]=4 513 B11R1.86 CC(=O)NC1=C(C)CCCC1 Amb17845068 [0,0,0,1,0,0|1,0,1]=3 514 B11R1.86 CC(=O)NC1=C(Cl)CCCC1 Amb27199359 [0,0,0,1,0,0|2,0,1]=4 515 B11R1.86 CC(=O)NC1CCCCC1Cl Amb27875116 [0,0,0,1,0,0|2,0,1]=4 516 B11R1.86 CC(=O)NC1CCCCC1O Amb18797124 [0,0,0,1,0,0|2,0,1]=4 517 B11R1.86 CC(=O)NC1CCCCC1S Amb28292774 [0,0,0,1,0,0|2,0,1]=4 518 B11R1.86 CC(=O)NC1CCCC[C@@H]1Cl Amb24571625 [0,0,0,1,0,0|2,0,1]=4 519 B11R1.86 CC(=O)NC1CCNCC1C Amb25866016 [0,0,0,1,0,0|2,0,1]=4 520 B11R1.86 CC(=O)NC1CCNCC1C Amb33328616 [0,0,0,1,0,0|2,0,1]=4 521 B11R1.86 CC(=O)NC1CNCCC1C Amb27591818 [0,0,0,1,0,0|2,0,1]=4 522 B11R1.86 CC(=O)N[C@@H]1CCCC[C@@H]1Cl Amb26450561 [0,0,0,1,0,0|2,0,1]=4 523 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1N Amb27822700 [0,0,0,1,0,0|2,0,1]=4 524 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1C Amb28435840 [0,0,0,1,0,0|1,0,1]=3 525 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1Cl Amb27797252 [0,0,0,1,0,0|2,0,1]=4 526 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1O Amb28320855 [0,0,0,1,0,0|2,0,1]=4 527 B11R1.86 CC(=O)OC1=C(C)CCCC1 Amb28284233 [0,0,0,1,0,0|1,0,1]=3 528 B11R1.86 CC(=O)O[C@@H]1CCCC[C@@H]1Cl Amb27454844 [0,0,0,1,0,0|2,0,1]=4 529 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1C Amb26958236 [0,0,0,1,0,0|1,0,1]=3 530 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1Cl Amb27483080 [0,0,0,1,0,0|2,0,1]=4 531 B11R1.86 CC(=O)O[C@@H]1CCCC[C@H]1O Amb17844353 [0,0,0,1,0,0|2,0,1]=4 532 B11R1.86 CC(=O)O[C@H]1CCCC[C@@H]1Cl Amb27440472 [0,0,0,1,0,0|2,0,1]=4 533 B11R1.86 CC(=O)S[C@@H]1CCCC[C@@H]1Cl Amb27845415 [0,0,0,1,0,0|2,0,1]=4 534 B11R1.86 CC(=O)S[C@@H]1CCCC[C@H]1N Amb30884410 [0,0,0,1,0,0|2,0,1]=4 535 B11R1.86 CC(=O)\N=C1/NCCCN1C Amb22366635 [0,0,0,1,0,0|3,0,0]=4 536 B11R1.86 CC(C)=CC1CCCCC1O Amb26633689 [0,0,0,1,0,0|2,0,1]=4 537 B11R1.86 CC(C)=C[C@@H]1CCCC[C@H]1O Amb26436592 [0,0,0,1,0,0|2,0,1]=4 538 B11R1.86 CC(C)\C=C1\CCCCC1Cl Amb28343075 [0,0,0,1,0,0|2,0,1]=4 539 B11R1.86 CC1CCCCC1C=C(Br)Br Amb27490358 [0,0,0,1,0,0|2,0,1]=4 540 B11R1.86 CC1CCCCC1CC(=O)O Amb6749252 [0,0,0,1,0,0|1,0,2]=4 541 B11R1.86 CC1CCCCC1CC(N)=O Amb27232827 [0,0,0,1,0,0|1,0,2]=4 542 B11R1.86 CC1CCCCC1NC(=O)Cl Amb35637113 [0,0,0,1,0,0|2,0,1]=4 543 B11R1.86 CC1CCCCC1NC(N)=O Amb1105317 [0,0,0,1,0,0|2,0,1]=4 544 B11R1.86 CC1CCCCC1OC(=O)Cl Amb27648622 [0,0,0,1,0,0|2,0,1]=4 545 B11R1.86 CC1CCCCN1CC(=O)O Amb6356107 [0,0,0,1,0,0|2,0,1]=4 546 B11R1.86 CC1CCCCN1CC(N)=O Amb6528335 [0,0,0,1,0,0|2,0,1]=4 547 B11R1.86 CC1CCCC\C1=N/S(C)=O Amb35718862 [0,0,0,1,0,0|2,0,0]=3 548 B11R1.86 CC1COCC\C1=N/S(C)=O Amb29865716 [0,0,0,1,0,0|3,0,0]=4 549 B11R1.86 CC1SCCC\C1=N/S(C)=O Amb35722139 [0,0,0,1,0,0|3,0,0]=4 550 B11R1.86 CN1CCCC\C1=N/C(N)=O Amb27966531 [0,0,0,1,0,0|3,0,0]=4 551 B11R1.86 NC(=O)\C=C1/CCCCC1O Amb27813333 [0,0,0,1,0,0|2,0,0]=3 552 B11R1.86 NC1CCCC\C1=C/C(=O)O Amb28285400 [0,0,0,1,0,0|2,0,0]=3 553 B11R1.86 O=C(O)\C=C1\CCCCC1O Amb27241357 [0,0,0,1,0,0|2,0,0]=3 554 B11R1.90 CC(=N)NCC1CCCC1C Amb28072360 [0,0,0,1,0,0|2,0,1]=4 555 B11R1.90 CC(=O)CCC1CCCN1C Amb25145698 [0,0,0,1,0,0|1,0,2]=4 556 B11R1.90 CC(=O)CCC1CCOC1C Amb33426815 [0,0,0,1,0,0|1,0,2]=4 557 B11R1.90 CC(=O)COC1CCCC1O Amb27599458 [0,0,0,1,0,0|2,0,1]=4 558 B11R1.90 CC(=O)CSC1CCOC1C Amb28077033 [0,0,0,1,0,0|2,0,1]=4 559 B11R1.90 CC(=O)NCC1CCCC1C Amb27617362 [0,0,0,1,0,0|1,0,1]=3 560 B11R1.90 CC(=O)NCC1CCCN1C Amb27758772 [0,0,0,1,0,0|2,0,1]=4 561 B11R1.90 CC(=O)NC[C@@H]1CCC[C@@H]1C Amb27216289 [0,0,0,1,0,0|1,0,1]=3 562 B11R1.90 CC(=O)NC[C@@H]1CCC[C@@H]1O Amb28197193 [0,0,0,1,0,0|2,0,1]=4 563 B11R1.90 CC(=O)NC[C@@H]1CCC[C@H]1O Amb27254214 [0,0,0,1,0,0|2,0,1]=4 564 B11R1.90 CC(=O)NC[C@H]1CCC[C@@H]1O Amb27235919 [0,0,0,1,0,0|2,0,1]=4 565 B11R1.90 CC(=O)N\N=C1/CCCC1C Amb28063730 [0,0,0,1,0,0|2,0,1]=4 566 B11R1.90 CC(=O)OCC1CCCN1C Amb25199931 [0,0,0,1,0,0|2,0,1]=4 567 B11R1.90 CC(=O)OCC1OCCC1C Amb25710223 [0,0,0,1,0,0|2,0,1]=4 568 B11R1.90 CC(=O)OC[C@H]1CCC[C@@H]1O Amb27972537 [0,0,0,1,0,0|2,0,1]=4 569 B11R1.90 CC(=O)\C=C\C1CCOC1C Amb33426816 [0,0,0,1,0,0|1,0,0]=2 570 B11R1.90 CC(C)=CCC1CCCC1Cl Amb25201069 [0,0,0,1,0,0|2,0,1]=4 571 B11R1.90 CC(C)=CCN1CCCC1C Amb27598997 [0,0,0,1,0,0|2,0,1]=4 572 B11R1.90 CC(N)\C=C\C1CCOC1C Amb33426792 [0,0,0,1,0,0|2,0,1]=4 573 B11R1.90 CC1CCCC1CNC(=O)Cl Amb35633347 [0,0,0,1,0,0|2,0,1]=4 574 B11R1.90 CC1CCCN1\C=C\C(=O)O Amb27644330 [0,0,0,1,0,0|2,0,0]=3 575 B11R1.90 CC1OCCC1\C=C\C(=O)O Amb33427648 [0,0,0,1,0,0|2,0,0]=3 576 B11R1.90 CC1OCCC1\C=C\[N+](=O)[O-] Amb33427186 [0,0,0,1,0,0|3,0,0]=4 577 B11R1.90 CN1CCC[C@@H]1\C=C\C(=O)O Amb33714876 [0,0,0,1,0,0|2,0,0]=3 578 B11R1.90 C[C@H]1CCC[C@@H]1CCC(=O)O Amb28455731 [0,0,0,1,0,0|1,0,2]=4 579 B11R1.91 C=C(C)CNC1CCCCC1 Amb17308768 [0,0,0,1,0,0|2,0,1]=4 580 B11R1.91 CC(=O)C#CC1CCCCC1 Amb17593738 [0,0,0,1,0,0|0,0,2]=3 581 B11R1.91 CC(=O)C=C=C1CCCCC1 Amb26587266 [0,0,0,1,0,0|0,0,2]=3 582 B11R1.91 CC(=O)CCC1CCCCC1 Amb9031564 [0,0,0,1,0,0|0,0,2]=3 583 B11R1.91 CC(=O)CCC1CCCCN1 Amb27881489 [0,0,0,1,0,0|1,0,2]=4 584 B11R1.91 CC(=O)CCC1CCCCO1 Amb26040132 [0,0,0,1,0,0|1,0,2]=4 585 B11R1.91 CC(=O)CCC1CCCNC1 Amb25041564 [0,0,0,1,0,0|1,0,2]=4 586 B11R1.91 CC(=O)CCC1CCCOC1 Amb26058874 [0,0,0,1,0,0|1,0,2]=4 587 B11R1.91 CC(=O)CCC1CCCSC1 Amb32726147 [0,0,0,1,0,0|1,0,2]=4 588 B11R1.91 CC(=O)CCC1CCNCC1 Amb24377330 [0,0,0,1,0,0|1,0,2]=4 589 B11R1.91 CC(=O)CCC1CCOCC1 Amb18182100 [0,0,0,1,0,0|1,0,2]=4 590 B11R1.91 CC(=O)CCN1CCCCC1 Amb1130395 [0,0,0,1,0,0|1,0,2]=4 591 B11R1.91 CC(=O)CCN1CCCCC1 Amb33548792 [0,0,0,1,0,0|1,0,2]=4 592 B11R1.91 CC(=O)COC1CCNCC1 Amb25789702 [0,0,0,1,0,0|2,0,1]=4 593 B11R1.91 CC(=O)NC=C1CCCCC1 Amb27754020 [0,0,0,1,0,0|1,0,1]=3 594 B11R1.91 CC(=O)NCC1CCCCN1 Amb28555668 [0,0,0,1,0,0|2,0,1]=4 595 B11R1.91 CC(=O)NCC1CCCCN1 Amb6249084 [0,0,0,1,0,0|2,0,1]=4 596 B11R1.91 CC(=O)NCC1CCCNC1 Amb4304393 [0,0,0,1,0,0|2,0,1]=4 597 B11R1.91 CC(=O)NCC1CCCSC1 Amb27802138 [0,0,0,1,0,0|2,0,1]=4 598 B11R1.91 CC(=O)NCC1CCNCC1 Amb10205333 [0,0,0,1,0,0|2,0,1]=4 599 B11R1.91 CC(=O)NCC1CCNCC1 Amb1095014 [0,0,0,1,0,0|2,0,1]=4 600 B11R1.91 CC(=O)NCC1CCNCC1 Amb11012597 [0,0,0,1,0,0|2,0,1]=4 601 B11R1.91 CC(=O)NCC1CCOCC1 Amb27823275 [0,0,0,1,0,0|2,0,1]=4 602 B11R1.91 CC(=O)NCC1CCSCC1 Amb27165594 [0,0,0,1,0,0|2,0,1]=4 603 B11R1.91 CC(=O)NCN1CCCCC1 Amb10568234 [0,0,0,1,0,0|2,0,1]=4 604 B11R1.91 CC(=O)OCC1CCCCC1 Amb24323616 [0,0,0,1,0,0|1,0,1]=3 605 B11R1.91 CC(=O)OCC1CCCCN1 Amb25717263 [0,0,0,1,0,0|2,0,1]=4 606 B11R1.91 CC(=O)OCC1CCCCN1 Amb34202134 [0,0,0,1,0,0|2,0,1]=4 607 B11R1.91 CC(=O)OCC1CCCCO1 Amb4012775 [0,0,0,1,0,0|2,0,1]=4 608 B11R1.91 CC(=O)OCC1CCCNC1 Amb28251060 [0,0,0,1,0,0|2,0,1]=4 609 B11R1.91 CC(=O)OCC1CCCOC1 Amb27810025 [0,0,0,1,0,0|2,0,1]=4 610 B11R1.91 CC(=O)OCC1CCOCC1 Amb26911055 [0,0,0,1,0,0|2,0,1]=4 611 B11R1.91 CC(=O)OC[C@H]1CCCNC1 Amb27603139 [0,0,0,1,0,0|2,0,1]=4 612 B11R1.91 CC(=O)ON=C1CCCCC1 Amb27825886 [0,0,0,1,0,0|2,0,1]=4 613 B11R1.91 CC(=O)SCC1CCCOC1 Amb28292895 [0,0,0,1,0,0|2,0,1]=4 614 B11R1.91 CC(=O)\C=C/C1CCCCC1 Amb28141273 [0,0,0,1,0,0|0,0,0]=1 615 B11R1.91 CC(=O)\C=C\C1=CCOCC1 Amb25920994 [0,0,0,1,0,0|1,0,2]=4 616 B11R1.91 CC(=O)\C=C\C1=COCCC1 Amb33424238 [0,0,0,1,0,0|1,0,2]=4 617 B11R1.91 CC(=O)\C=C\C1C=CCCC1 Amb25735805 [0,0,0,1,0,0|0,0,2]=3 618 B11R1.91 CC(=O)\C=C\C1CC=CCC1 Amb26936607 [0,0,0,1,0,0|0,0,2]=3 619 B11R1.91 CC(=O)\C=C\C1CCC=CO1 Amb26463190 [0,0,0,1,0,0|1,0,2]=4 620 B11R1.91 CC(=O)\C=C\C1CCCCC1 Amb24625780 [0,0,0,1,0,0|0,0,0]=1 621 B11R1.91 CC(=O)\C=C\C1CCCCO1 Amb32953626 [0,0,0,1,0,0|1,0,0]=2 622 B11R1.91 CC(=O)\C=C\C1CCCOC1 Amb33474258 [0,0,0,1,0,0|1,0,0]=2 623 B11R1.91 CC(=O)\C=C\C1CCCSC1 Amb32954832 [0,0,0,1,0,0|1,0,0]=2 624 B11R1.91 CC(=O)\C=C\C1CCOCC1 Amb33171968 [0,0,0,1,0,0|1,0,0]=2 625 B11R1.91 CC(=O)\C=C\N1CCOCC1 Amb10565266 [0,0,0,1,0,0|2,0,0]=3 626 B11R1.91 CC(=O)\C=N\C1CCCCC1 Amb28052310 [0,0,0,1,0,0|1,0,0]=2 627 B11R1.91 CC(Br)\C=C\C1CCCCO1 Amb35637924 [0,0,0,1,0,0|2,0,1]=4 628 B11R1.91 CC(Br)\C=C\C1CCCOC1 Amb27657068 [0,0,0,1,0,0|2,0,1]=4 629 B11R1.91 CC(C)=CCC1CCCNC1 Amb27480407 [0,0,0,1,0,0|2,0,1]=4 630 B11R1.91 CC(Cl)\C=C\C1CCCCO1 Amb35637923 [0,0,0,1,0,0|2,0,1]=4 631 B11R1.91 CC(Cl)\C=C\C1CCCSC1 Amb27262135 [0,0,0,1,0,0|2,0,1]=4 632 B11R1.91 CC(N)\C=C\C1CCCCC1 Amb28368066 [0,0,0,1,0,0|1,0,1]=3 633 B11R1.91 CC(N)\C=C\C1CCCCO1 Amb35622319 [0,0,0,1,0,0|2,0,1]=4 634 B11R1.91 CC(N)\C=C\C1CCCOC1 Amb33080423 [0,0,0,1,0,0|2,0,1]=4 635 B11R1.91 CC(N)\C=C\C1CCCSC1 Amb33358387 [0,0,0,1,0,0|2,0,1]=4 636 B11R1.91 CC(N)\C=C\C1CCOCC1 Amb33171638 [0,0,0,1,0,0|2,0,1]=4 637 B11R1.91 CC(O)\C=C\C1CCCCC1 Amb26897095 [0,0,0,1,0,0|0,0,2]=3 638 B11R1.91 CN(C)\N=C\C1CCCCC1 Amb27766281 [0,0,0,1,0,0|3,0,0]=4 639 B11R1.91 CS(=O)\N=C\C1CCCCC1 Amb35718868 [0,0,0,1,0,0|2,0,0]=3 640 B11R1.91 CS(=O)\N=C\C1CCCCO1 Amb35741550 [0,0,0,1,0,0|3,0,0]=4 641 B11R1.91 CS(=O)\N=C\C1CCCOC1 Amb35693140 [0,0,0,1,0,0|3,0,0]=4 642 B11R1.91 CS(=O)\N=C\C1CCCSC1 Amb35718555 [0,0,0,1,0,0|3,0,0]=4 643 B11R1.91 CS(=O)\N=C\C1CCOCC1 Amb35693126 [0,0,0,1,0,0|3,0,0]=4 644 B11R1.91 NC(=O)C=C=C1CCCCC1 Amb27153201 [0,0,0,1,0,0|1,0,2]=4 645 B11R1.91 NC(=O)CCC1CCCCC1 Amb6430126 [0,0,0,1,0,0|1,0,2]=4 646 B11R1.91 NC(=O)CNC1CCCCC1 Amb6661332 [0,0,0,1,0,0|2,0,1]=4 647 B11R1.91 NC(=O)COC1CCCCC1 Amb18791809 [0,0,0,1,0,0|2,0,1]=4 648 B11R1.91 NC(=O)NCC1CCCCC1 Amb4016522 [0,0,0,1,0,0|2,0,1]=4 649 B11R1.91 NC(=O)OCC1CCCCC1 Amb28458479 [0,0,0,1,0,0|2,0,1]=4 650 B11R1.91 NC(=O)\C=C/C1CCNCC1 Amb27471045 [0,0,0,1,0,0|2,0,0]=3 651 B11R1.91 NC(=O)\C=C\C1=CCCCC1 Amb27843456 [0,0,0,1,0,0|1,0,2]=4 652 B11R1.91 NC(=O)\C=C\C1CC=CCC1 Amb27627437 [0,0,0,1,0,0|1,0,2]=4 653 B11R1.91 NC(=S)\C=C\N1CCCCC1 Amb17477775 [0,0,0,1,0,0|2,1,0]=4 654 B11R1.91 O=C(Cl)CCC1CCCCC1 Amb2720380 [0,0,0,1,0,0|1,0,2]=4 655 B11R1.91 O=C(Cl)NCC1CCCCC1 Amb35637043 [0,0,0,1,0,0|2,0,1]=4 656 B11R1.91 O=C(Cl)OCC1CCCCC1 Amb25140788 [0,0,0,1,0,0|2,0,1]=4 657 B11R1.91 O=C(O)C#CC1CCCCC1 Amb21963916 [0,0,0,1,0,0|1,0,2]=4 658 B11R1.91 O=C(O)CCC1CCCCC1 Amb3939828 [0,0,0,1,0,0|1,0,2]=4 659 B11R1.91 O=C(O)CNC1CCCCC1 Amb19263851 [0,0,0,1,0,0|2,0,1]=4 660 B11R1.91 O=C(O)CNC1CCCCC1 Amb840542 [0,0,0,1,0,0|2,0,1]=4 661 B11R1.91 O=C(O)COC1CCCCC1 Amb2693120 [0,0,0,1,0,0|2,0,1]=4 662 B11R1.91 O=C(O)CSC1CCCCC1 Amb6537757 [0,0,0,1,0,0|2,0,1]=4 663 B11R1.91 O=C(O)\C=C\C1=CCCCC1 Amb24670201 [0,0,0,1,0,0|1,0,2]=4 664 B11R1.91 O=C(O)\C=C\C1C=CCCC1 Amb27481955 [0,0,0,1,0,0|1,0,2]=4 665 B11R1.91 O=C(O)\C=C\C1CC=CCC1 Amb3992530 [0,0,0,1,0,0|1,0,2]=4 666 B11R1.91 O=C(O)\C=C\C1CCCCC1 Amb31330735 [0,0,0,1,0,0|1,0,0]=2 667 B11R1.91 O=C(O)\C=C\C1CCCCO1 Amb33475332 [0,0,0,1,0,0|2,0,0]=3 668 B11R1.91 O=C(O)\C=C\C1CCCCS1 Amb33470059 [0,0,0,1,0,0|2,0,0]=3 669 B11R1.91 O=C(O)\C=C\C1CCCNC1 Amb27783604 [0,0,0,1,0,0|2,0,0]=3 670 B11R1.91 O=C(O)\C=C\C1CCCOC1 Amb33042780 [0,0,0,1,0,0|2,0,0]=3 671 B11R1.91 O=C(O)\C=C\C1CCCSC1 Amb33474065 [0,0,0,1,0,0|2,0,0]=3 672 B11R1.91 O=C(O)\C=C\C1CCOCC1 Amb18961299 [0,0,0,1,0,0|2,0,0]=3 673 B11R1.91 O=C(O)\C=C\C1CCSCC1 Amb27619229 [0,0,0,1,0,0|2,0,0]=3 674 B11R1.91 O=C(O)\C=C\N1CCCCC1 Amb27217215 [0,0,0,1,0,0|2,0,0]=3 675 B11R1.91 O=C(O)\C=C\N1CCNCC1 Amb27167288 [0,0,0,1,0,0|3,0,0]=4 676 B11R1.91 O=C(O)\C=C\N1CCSCC1 Amb27173886 [0,0,0,1,0,0|3,0,0]=4 677 B11R1.91 O=[N+]([O-])\C=C\C1CCCCC1 Amb18181954 [0,0,0,1,0,0|2,0,0]=3 678 B11R1.91 O=[N+]([O-])\C=C\C1CCCCO1 Amb29883980 [0,0,0,1,0,0|3,0,0]=4 679 B11R1.91 O=[N+]([O-])\C=C\C1CCCOC1 Amb25862231 [0,0,0,1,0,0|3,0,0]=4 680 B11R1.91 O=[N+]([O-])\C=C\C1CCCSC1 Amb33359131 [0,0,0,1,0,0|3,0,0]=4 681 B11R1.91 O=[N+]([O-])\C=C\C1CCOCC1 Amb18797109 [0,0,0,1,0,0|3,0,0]=4 682 B11R1.91 O=[N+]([O-])\C=C\N1CCCCC1 Amb2610733 [0,0,0,1,0,0|3,0,0]=4 683 B11R1.91 OB(O)\C=C\C1CCCCC1 Amb33869732 [0,0,0,1,0,0|2,0,1]=4 684 B11R1.101 ClC1C=CCCCCCCC1 Amb28285392 [0,0,0,1,0,0|1,0,1]=3 685 B11R1.101 O=C1C=CCCCCCCC1 Amb28254479 [0,0,0,1,0,0|0,0,0]=1 686 B11R1.101 O=C1CC=CCCCCCC1 Amb26880464 [0,0,0,1,0,0|0,0,2]=3 687 B11R1.101 O=C1CCCCCCCCC1 Amb2778532 [0,0,0,1,0,0|0,0,2]=3 688 B11R1.101 O=C1CCCCCCCCN1 Amb4034840 [0,0,0,1,0,0|1,0,1]=3 689 B11R1.101 O=C1CCNCCCCCN1 Amb32679586 [0,0,0,1,0,0|2,0,1]=4 690 B11R1.101 O=C1CNCCCCCCN1 Amb28044832 [0,0,0,1,0,0|2,0,1]=4 691 B11R1.101 O[C@H]1C=CCCCCCCC1 Amb28206118 [0,0,0,1,0,0|0,0,2]=3 692 B11R1.101 S=C1CCCCCCCCN1 Amb27636863 [0,0,0,1,0,0|1,1,1]=4 693 B11R1.102 CC(C)=CCNCC1CC1C Amb27670724 [0,0,0,1,0,0|2,0,1]=4 694 B11R1.102 CC1CC1NC\C=C\C(=O)O Amb28386718 [0,0,0,1,0,0|2,0,0]=3 695 B11R1.107 CC1CCCCCCC(=O)C1 Amb28200023 [0,0,0,1,0,0|0,0,2]=3 696 B11R1.107 O=C1C=CCCCCC(=O)C1 Amb28144181 [0,0,0,1,0,0|1,0,1]=3 697 B11R1.110 CCCC1CCCCC(=O)N1 Amb2229640 [0,0,0,1,0,0|1,0,2]=4 698 B11R1.110 CCCN1CCCNC(=O)C1 Amb27176452 [0,0,0,1,0,0|2,0,1]=4 699 B11R1.110 CCC[C@@H]1CCC=CC(=O)N1 Amb27960353 [0,0,0,1,0,0|1,0,0]=2 700 B11R1.110 COCC1CCCCC(=O)C1 Amb27246950 [0,0,0,1,0,0|1,0,2]=4 701 B11R1.110 NCCC1CCCNC(=O)C1 Amb27468807 [0,0,0,1,0,0|2,0,1]=4 702 B11R1.143 CC(=O)C1=CCCCC=C1C Amb28054835 [0,0,0,1,0,0|0,0,2]=3 703 B11R1.143 CC(=O)C1=CCCCCC1=O Amb25244207 [0,0,0,1,0,0|1,0,1]=3 704 B11R1.143 CC(=O)C1CCCCCC1C Amb35725700 [0,0,0,1,0,0|0,0,2]=3 705 B11R1.143 CC(=O)C1CCCCCC1N Amb26968176 [0,0,0,1,0,0|1,0,2]=4 706 B11R1.143 CC(=O)C1CCCCCC1O Amb32945460 [0,0,0,1,0,0|1,0,2]=4 707 B11R1.143 CC(=O)C1CCCCCN1C Amb27963187 [0,0,0,1,0,0|1,0,2]=4 708 B11R1.143 CC(=O)N1CCOCCC1C Amb28349810 [0,0,0,1,0,0|2,0,1]=4 709 B11R1.143 CC(=O)[C@@H]1CCCCC[C@@H]1N Amb33307461 [0,0,0,1,0,0|1,0,2]=4 710 B11R1.143 CC(=O)[C@@H]1CCCCC[C@H]1O Amb32945317 [0,0,0,1,0,0|1,0,2]=4 711 B11R1.143 CC(C)=C1CCCCCC1O Amb27761629 [0,0,0,1,0,0|2,0,1]=4 712 B11R1.161 CC(C)=CCCC1CCC1O Amb32951008 [0,0,0,1,0,0|2,0,1]=4 713 B11R1.161 CC1CCC1CCCC(=O)O Amb27266949 [0,0,0,1,0,0|1,0,2]=4 714 B11R1.172 C=C(C)CNCC1CCCC1 Amb18796741 [0,0,0,1,0,0|2,0,1]=4 715 B11R1.172 CC(=O)CCCC1CCCC1 Amb26076138 [0,0,0,1,0,0|0,0,2]=3 716 B11R1.172 CC(=O)CCCN1CCCC1 Amb9659032 [0,0,0,1,0,0|1,0,2]=4 717 B11R1.172 CC(=O)COCC1CCCC1 Amb28386909 [0,0,0,1,0,0|1,0,1]=3 718 B11R1.172 CC(=O)COCC1CCCO1 Amb9664734 [0,0,0,1,0,0|2,0,1]=4 719 B11R1.172 CC(=O)CSCC1CCCC1 Amb27269541 [0,0,0,1,0,0|1,0,1]=3 720 B11R1.172 CC(=O)NCCC1CCCC1 Amb8328911 [0,0,0,1,0,0|1,0,1]=3 721 B11R1.172 CC(=O)NCCC1CCCN1 Amb27789209 [0,0,0,1,0,0|2,0,1]=4 722 B11R1.172 CC(=O)NCCC1CCNC1 Amb24477543 [0,0,0,1,0,0|2,0,1]=4 723 B11R1.172 CC(=O)NCCN1CCCC1 Amb24723020 [0,0,0,1,0,0|2,0,1]=4 724 B11R1.172 CC(=O)NCC[C@H]1CCCN1 Amb27427200 [0,0,0,1,0,0|2,0,1]=4 725 B11R1.172 CC(=O)N\N=C\C1CCCC1 Amb28065424 [0,0,0,1,0,0|2,0,1]=4 726 B11R1.172 CC(=O)OCCC1CCCC1 Amb28326525 [0,0,0,1,0,0|1,0,1]=3 727 B11R1.172 CC(=O)OCCC1CCCO1 Amb28326526 [0,0,0,1,0,0|2,0,1]=4 728 B11R1.172 CC(=O)\C=C\CC1CCCC1 Amb33378003 [0,0,0,1,0,0|0,0,0]=1 729 B11R1.172 CC(C)=CCCC1CCCC1 Amb30023888 [0,0,0,1,0,0|1,0,1]=3 730 B11R1.172 CC(C)=CCCC1CCNC1 Amb35582897 [0,0,0,1,0,0|2,0,1]=4 731 B11R1.172 CC(C)=CCCN1CCCC1 Amb30023689 [0,0,0,1,0,0|2,0,1]=4 732 B11R1.172 CC(C)=CCSC1CCCC1 Amb27840100 [0,0,0,1,0,0|2,0,1]=4 733 B11R1.172 CC(N)\C=C\CC1CCCC1 Amb33377994 [0,0,0,1,0,0|1,0,1]=3 734 B11R1.172 CS(=O)\N=C\CC1CCCC1 Amb35693138 [0,0,0,1,0,0|2,0,0]=3 735 B11R1.172 NC(=O)COCC1CCCC1 Amb28386904 [0,0,0,1,0,0|2,0,1]=4 736 B11R1.172 NC(=O)CSCC1CCCC1 Amb27269544 [0,0,0,1,0,0|2,0,1]=4 737 B11R1.172 O=C(Cl)NCCC1CCCC1 Amb35625732 [0,0,0,1,0,0|2,0,1]=4 738 B11R1.172 O=C(Cl)\C=C\CN1CCCC1 Amb8388224 [0,0,0,1,0,0|2,0,0]=3 739 B11R1.172 O=C(O)C#CCC1CCCC1 Amb28370188 [0,0,0,1,0,0|1,0,2]=4 740 B11R1.172 O=C(O)CCCC1CCCC1 Amb19149142 [0,0,0,1,0,0|1,0,2]=4 741 B11R1.172 O=C(O)COCC1CCCC1 Amb21963936 [0,0,0,1,0,0|2,0,1]=4 742 B11R1.172 O=C(O)C\C=C\C1CCCC1 Amb24473377 [0,0,0,1,0,0|1,0,2]=4 743 B11R1.172 O=C(O)\C=C\C=C1CCCC1 Amb27870905 [0,0,0,1,0,0|1,0,2]=4 744 B11R1.172 O=C(O)\C=C\CC1CCCC1 Amb33172382 [0,0,0,1,0,0|1,0,0]=2 745 B11R1.172 O=C(O)\C=C\CN1CCCC1 Amb33969252 [0,0,0,1,0,0|2,0,0]=3 746 B11R1.172 O=C(O)\C=C\CN1CCCC1 Amb34916713 [0,0,0,1,0,0|2,0,0]=3 747 B11R1.172 O=[N+]([O-])\C=C\CC1CCCC1 Amb33378375 [0,0,0,1,0,0|2,0,0]=3 748 B11R1.172 OB(O)\C=C\CC1CCCC1 Amb22491038 [0,0,0,1,0,0|2,0,1]=4 749 B11R1.174 CC(=O)NCCCC1CCN1 Amb27674421 [0,0,0,1,0,0|2,0,1]=4 750 B11R1.174 CC(=O)NCCCC1CNC1 Amb27674417 [0,0,0,1,0,0|2,0,1]=4 751 B11R1.174 CC(=O)NCCNC1CCC1 Amb18799705 [0,0,0,1,0,0|2,0,1]=4 752 B11R1.174 CC(=O)NCCOC1CCC1 Amb28351910 [0,0,0,1,0,0|2,0,1]=4 753 B11R1.174 CC(C)=CCNCC1CCC1 Amb27492456 [0,0,0,1,0,0|2,0,1]=4 754 B11R1.174 O=C(O)\C=C\CNC1CCC1 Amb28386721 [0,0,0,1,0,0|2,0,0]=3 755 B11R1.174 O=C(O)\C=C\CNC1COC1 Amb28386732 [0,0,0,1,0,0|3,0,0]=4 756 B11R1.174 O=C(O)\C=C\COC1CCC1 Amb19020651 [0,0,0,1,0,0|2,0,0]=3 757 B11R1.174 O=C(O)\C=C\CSC1COC1 Amb27271347 [0,0,0,1,0,0|3,0,0]=4 758 B11R1.174 O=C(O)\C=C\NCC1CCC1 Amb27495005 [0,0,0,1,0,0|2,0,0]=3 759 B11R1.174 O=C(O)\C=C\NCC1CSC1 Amb35638850 [0,0,0,1,0,0|3,0,0]=4 760 B11R1.176 O=C(O)\C=C\NCCC1CC1 Amb28386716 [0,0,0,1,0,0|2,0,0]=3 761 B11R1.191 CC1(C)C=CCCC1CCO Amb28069556 [0,0,0,1,0,0|2,0,1]=4 762 B11R1.193 CCCC1CCCC1C(=O)O Amb18644850 [0,0,0,1,0,0|1,0,2]=4 763 B11R1.193 CCCC1CCCN1C(=O)Cl Amb27493472 [0,0,0,1,0,0|2,0,1]=4 764 B11R1.193 CCCC1CCCN1C(C)=N Amb27252244 [0,0,0,1,0,0|2,0,1]=4 765 B11R1.193 CCCC1CCNC1C(=O)O Amb25241187 [0,0,0,1,0,0|2,0,1]=4 766 B11R1.193 CCCC1CCNC1C(=O)O Amb28652947 [0,0,0,1,0,0|2,0,1]=4 767 B11R1.193 CCCC1CCN[C@@H]1C(=O)O Amb28340938 [0,0,0,1,0,0|2,0,1]=4 768 B11R1.193 CCCC1COCC1C(C)=O Amb29882922 [0,0,0,1,0,0|1,0,2]=4 769 B11R1.193 CCCC1SCCN1C(C)=O Amb28061197 [0,0,0,1,0,0|2,0,1]=4 770 B11R1.193 CCC[C@@H]1CC=C[C@H]1C(C)=O Amb27629704 [0,0,0,1,0,0|0,0,2]=3 771 B11R1.193 CCC[C@@H]1CCC[C@@H]1C(=O)O Amb27878683 [0,0,0,1,0,0|1,0,2]=4 772 B11R1.193 CCC[C@@H]1CCN[C@H]1C(=O)O Amb26452406 [0,0,0,1,0,0|2,0,1]=4 773 B11R1.193 CCCn1cccc1C(C)=O Amb25689785 [0,0,0,1,0,0|1,0,2]=4 774 B11R1.193 CNC[C@@H]1CCCN1C(C)=O Amb22227518 [0,0,0,1,0,0|2,0,1]=4 775 B11R1.193 COCC1CCCN1C(C)=O Amb27872243 [0,0,0,1,0,0|2,0,1]=4 776 B11R1.193 COC[C@@H]1CCCN1C(C)=O Amb27834362 [0,0,0,1,0,0|2,0,1]=4 777 B11R1.204 CC(=O)N1CCC1CCCN Amb27674411 [0,0,0,1,0,0|2,0,1]=4 778 B11R1.204 CCCCC1=C(C(C)=O)CC1 Amb28080144 [0,0,0,1,0,0|0,0,2]=3 779 B11R1.204 CNCCC1CCN1C(C)=O Amb27674412 [0,0,0,1,0,0|2,0,1]=4 780 B11R1.241 CCC1CC1N\C=C\C(=O)O Amb28284841 [0,0,0,1,0,0|2,0,0]=3 781 B11R1.245 CCC1CCCC=CC(=O)C1 Amb27954110 [0,0,0,1,0,0|0,0,0]=1 782 B11R1.245 CCC1CCCCCC(=O)N1 Amb25313080 [0,0,0,1,0,0|1,0,2]=4 783 B11R1.245 COC1CCCCCC(=O)C1 Amb27164648 [0,0,0,1,0,0|1,0,2]=4 784 B11R1.271 C=C(C)CNC1CCC1CC Amb27272151 [0,0,0,1,0,0|2,0,1]=4 785 B11R1.271 CC(=O)OC[C@@H]1CC[C@H]1CO Amb31308520 [0,0,0,1,0,0|2,0,1]=4 786 B11R1.271 CCC1CCC1NCC(N)=O Amb27272153 [0,0,0,1,0,0|2,0,1]=4 787 B11R1.271 CCC1CCN1CCC(C)=O Amb27986910 [0,0,0,1,0,0|1,0,2]=4 788 B11R1.706 CC(=O)C1=CCC=CCCC1 Amb25713503 [0,0,0,1,0,0|0,0,2]=3 789 B11R1.706 CC(=O)C1=CCCCCC=C1 Amb26569390 [0,0,0,1,0,0|0,0,2]=3 790 B11R1.706 CC(=O)C1=CCCCCCC1 Amb27473365 [0,0,0,1,0,0|0,0,0]=1 791 B11R1.706 CC(=O)C1C=CCCCCC1 Amb22011813 [0,0,0,1,0,0|0,0,2]=3 792 B11R1.706 CC(=O)C1CCCCCCC1 Amb25327542 [0,0,0,1,0,0|0,0,2]=3 793 B11R1.706 CC(C)=C1CCCCCCC1 Amb22356359 [0,0,0,1,0,0|1,0,1]=3 794 B11R1.706 CC(C)C1=CCCCCCC1 Amb27950122 [0,0,0,1,0,0|1,0,1]=3 795 B11R1.706 C\C(O)=C1/C=CCCCCC1 Amb26494049 [0,0,0,1,0,0|0,0,2]=3 796 B11R1.706 O=C(Cl)C1CCCCCCC1 Amb25760237 [0,0,0,1,0,0|1,0,2]=4 797 B11R1.706 O=C(O)C1=CCCCCC=C1 Amb26452545 [0,0,0,1,0,0|1,0,2]=4 798 B11R1.706 O=C(O)C1C=CCCCCC1 Amb27401809 [0,0,0,1,0,0|1,0,2]=4 799 B11R1.706 O=C(O)C1CCCCCCC1 Amb18278612 [0,0,0,1,0,0|1,0,2]=4 800 B11R1.706 O=C(O)C1CCCCCCN1 Amb27760420 [0,0,0,1,0,0|2,0,1]=4 801 B11R1.706 O=C(O)C1CCCCCCN1 Amb28652940 [0,0,0,1,0,0|2,0,1]=4 802 B11R1.706 OB(O)C1=CCCCCCC1 Amb27664628 [0,0,0,1,0,0|2,0,1]=4 803 B11R1.742 CC(=N)NC1=NCCCCC1 Amb19652160 [0,0,0,1,0,0|3,0,0]=4 804 B11R1.742 CC(=N)NC1CCCCCC1 Amb27213610 [0,0,0,1,0,0|2,0,1]=4 805 B11R1.742 CC(=O)C=C1CCCCCC1 Amb27948607 [0,0,0,1,0,0|0,0,0]=1 806 B11R1.742 CC(=O)CC1=CCCCCC1 Amb28122365 [0,0,0,1,0,0|0,0,2]=3 807 B11R1.742 CC(=O)CC1CCCCCC1 Amb25094261 [0,0,0,1,0,0|0,0,2]=3 808 B11R1.742 CC(=O)CC1CCCCCN1 Amb23585599 [0,0,0,1,0,0|1,0,2]=4 809 B11R1.742 CC(=O)CC1CCCOCC1 Amb27486093 [0,0,0,1,0,0|1,0,2]=4 810 B11R1.742 CC(=O)CN1CCCCCC1 Amb8427988 [0,0,0,1,0,0|1,0,1]=3 811 B11R1.742 CC(=O)CN1CCCCCC1 Amb9173328 [0,0,0,1,0,0|1,0,1]=3 812 B11R1.742 CC(=O)CN1CCCNCC1 Amb18284149 [0,0,0,1,0,0|2,0,1]=4 813 B11R1.742 CC(=O)NC1CCCSCC1 Amb35691520 [0,0,0,1,0,0|2,0,1]=4 814 B11R1.742 CC(=O)OC1CCCCCC1 Amb26487005 [0,0,0,1,0,0|1,0,1]=3 815 B11R1.742 CC(=O)\C=C1\CCCSCC1 Amb35712539 [0,0,0,1,0,0|1,0,0]=2 816 B11R1.742 CC(O)\C=C1\CCCSCC1 Amb35684779 [0,0,0,1,0,0|1,0,2]=4 817 B11R1.742 CN(C)N=C1CCCCCC1 Amb26980787 [0,0,0,1,0,0|3,0,0]=4 818 B11R1.742 CS(=O)N=C1CCCCCC1 Amb35681686 [0,0,0,1,0,0|2,0,0]=3 819 B11R1.742 CS(=O)\N=C1/CCCOCC1 Amb35718560 [0,0,0,1,0,0|3,0,0]=4 820 B11R1.742 CS(=O)\N=C1/CCCSCC1 Amb35651095 [0,0,0,1,0,0|3,0,0]=4 821 B11R1.742 NC(=O)CC1CCCCCC1 Amb24487974 [0,0,0,1,0,0|1,0,2]=4 822 B11R1.742 NC(=O)CN1CCCCCC1 Amb8326954 [0,0,0,1,0,0|2,0,1]=4 823 B11R1.742 NC(=O)NC1CCCCCC1 Amb4008281 [0,0,0,1,0,0|2,0,1]=4 824 B11R1.742 NC(=O)\N=C1/CCCCCN1 Amb24607781 [0,0,0,1,0,0|3,0,0]=4 825 B11R1.742 O=C(Cl)NC1CCCCCC1 Amb35637080 [0,0,0,1,0,0|2,0,1]=4 826 B11R1.742 O=C(Cl)OC1CCCCCC1 Amb28365356 [0,0,0,1,0,0|2,0,1]=4 827 B11R1.742 O=C(O)C=C1CCCCCC1 Amb6749176 [0,0,0,1,0,0|1,0,0]=2 828 B11R1.742 O=C(O)CC1CCCCCC1 Amb6749261 [0,0,0,1,0,0|1,0,2]=4 829 B11R1.742 O=C(O)CN1CCCCCC1 Amb2536986 [0,0,0,1,0,0|2,0,1]=4 830 B11R1.742 O=C(O)CN1CCCCCC1 Amb9677404 [0,0,0,1,0,0|2,0,1]=4 831 B11R1.742 O=C(O)\C=C1\CCCOCC1 Amb28313065 [0,0,0,1,0,0|2,0,0]=3 832 B11R1.742 O=C(O)\C=C1\CCCSCC1 Amb35691471 [0,0,0,1,0,0|2,0,0]=3 833 B11R1.742 O=[N+]([O-])\C=C1/CCCCCN1 Amb21922604 [0,0,0,1,0,0|3,0,0]=4 834 B8R0.4 C#CCCCC\C=C/C Amb28291350 [2,0,0,0,0,0|0,0,2]=4 835 B8R0.4 C#CCCCC\C=C\C Amb28077120 [2,0,0,0,0,0|0,0,2]=4 836 B8R0.4 C=C=CCCCCCN Amb28313150 [2,0,0,0,0,0|1,0,1]=4 837 B8R0.4 C=C=CCCNCCC Amb27945550 [2,0,0,0,0,0|1,0,1]=4 838 B8R0.4 C=C=CCNCCCC Amb28043104 [2,0,0,0,0,0|1,0,1]=4 839 B8R0.4 C=CCCCCCCBr Amb3940223 [2,0,0,0,0,0|1,0,1]=4 840 B8R0.4 C=CCCCCCCC Amb3940502 [2,0,0,0,0,0|0,0,1]=3 841 B8R0.4 C=CCCCCCCCl Amb6298879 [2,0,0,0,0,0|1,0,1]=4 842 B8R0.4 C=CCCCCCCI Amb26577493 [2,0,0,0,0,0|1,0,1]=4 843 B8R0.4 C=CCCCCCCN Amb33543931 [2,0,0,0,0,0|1,0,1]=4 844 B8R0.4 C=CCCCCCCO Amb22230162 [2,0,0,0,0,0|1,0,1]=4 845 B8R0.4 C=CCCCCCNC Amb19335339 [2,0,0,0,0,0|1,0,1]=4 846 B8R0.4 C=CCCCCCSC Amb27780646 [2,0,0,0,0,0|1,0,1]=4 847 B8R0.4 C=CCCCCNCC Amb27461423 [2,0,0,0,0,0|1,0,1]=4 848 B8R0.4 C=CCCSCCCC Amb28078650 [2,0,0,0,0,0|1,0,1]=4 849 B8R0.4 C=CCNCCCCC Amb6706493 [2,0,0,0,0,0|1,0,1]=4 850 B8R0.4 C=CCSCCCCC Amb27837635 [2,0,0,0,0,0|1,0,1]=4 851 B8R0.4 C=CNCCCCCC Amb27398596 [2,0,0,0,0,0|1,0,0]=3 852 B8R0.4 C=COCCCCCC Amb24440550 [2,0,0,0,0,0|1,0,0]=3 853 B8R0.4 C=COCCCNCC Amb6735761 [2,0,0,0,0,0|2,0,0]=4 854 B8R0.4 C=C\C=C\CCCCBr Amb32688174 [2,0,0,0,0,0|1,0,1]=4 855 B8R0.4 C=C\C=C\CCCCC Amb22641683 [2,0,0,0,0,0|0,0,1]=3 856 B8R0.4 C=C\C=C\CCCCCl Amb32688173 [2,0,0,0,0,0|1,0,1]=4 857 B8R0.4 C=C\C=C\CCNCC Amb27873157 [2,0,0,0,0,0|1,0,1]=4 858 B8R0.4 C=C\C=C\CNCCC Amb26967633 [2,0,0,0,0,0|1,0,1]=4 859 B8R0.4 CC#CCCCCCC Amb9134715 [2,0,0,0,0,0|0,0,2]=4 860 B8R0.4 CCCC#C\C=C\C=O Amb25108334 [2,0,0,0,0,0|0,0,2]=4 861 B8R0.4 CCCCCC#CC=O Amb9825881 [2,0,0,0,0,0|0,0,2]=4 862 B8R0.4 CCCCCCCC=O Amb6891949 [2,0,0,0,0,0|0,0,1]=3 863 B8R0.4 CCCCCCCCC Amb8513269 [2,0,0,0,0,0|0,0,2]=4 864 B8R0.4 CCCCCCCNC Amb7761453 [2,0,0,0,0,0|1,0,1]=4 865 B8R0.4 CCCCCCCOC Amb24584912 [2,0,0,0,0,0|1,0,1]=4 866 B8R0.4 CCCCCCCSC Amb22359861 [2,0,0,0,0,0|1,0,1]=4 867 B8R0.4 CCCCCCN=C=O Amb8516659 [2,0,0,0,0,0|1,0,1]=4 868 B8R0.4 CCCCCCNC=S Amb27880264 [2,0,0,0,0,0|1,1,0]=4 869 B8R0.4 CCCCCCNCC Amb6730567 [2,0,0,0,0,0|1,0,1]=4 870 B8R0.4 CCCCCCOCC Amb17672946 [2,0,0,0,0,0|1,0,1]=4 871 B8R0.4 CCCCCCON=O Amb17672945 [2,0,0,0,0,0|2,0,0]=4 872 B8R0.4 CCCCCC\C=C\Br Amb24677708 [2,0,0,0,0,0|1,0,0]=3 873 B8R0.4 CCCCCC\C=C\I Amb24446897 [2,0,0,0,0,0|1,0,0]=3 874 B8R0.4 CCCCCC\C=N\N Amb28049289 [2,0,0,0,0,0|2,0,0]=4 875 B8R0.4 CCCCCOCC=O Amb27230502 [2,0,0,0,0,0|1,0,1]=4 876 B8R0.4 CCCCC\C=C\C#N Amb18642132 [2,0,0,0,0,0|1,0,1]=4 877 B8R0.4 CCCCC\C=C\CBr Amb17666913 [2,0,0,0,0,0|1,0,1]=4 878 B8R0.4 CCCCC\C=C\CO Amb33038088 [2,0,0,0,0,0|0,0,2]=4 879 B8R0.4 CCCCC\C=N\OC Amb28204102 [2,0,0,0,0,0|2,0,0]=4 880 B8R0.4 CCCCNC\C=C\Br Amb27631443 [2,0,0,0,0,0|2,0,0]=4 881 B8R0.4 CCCCNC\C=C\Cl Amb27860069 [2,0,0,0,0,0|2,0,0]=4 882 B8R0.4 CCCCOCCC=O Amb27880111 [2,0,0,0,0,0|1,0,1]=4 883 B8R0.4 CCCCOCNC=O Amb27392745 [2,0,0,0,0,0|2,0,0]=4 884 B8R0.4 CCCCSCNC=O Amb27656061 [2,0,0,0,0,0|2,0,0]=4 885 B8R0.4 CCCOCCCC=O Amb27795367 [2,0,0,0,0,0|1,0,1]=4 886 B8R0.4 CCCSCCNC=O Amb27630895 [2,0,0,0,0,0|2,0,0]=4 887 B8R0.4 CCC\C=C/C=C/C=O Amb27643510 [2,0,0,0,0,0|0,0,2]=4 888 B8R0.4 CCC\C=C\C=C\C=O Amb8392848 [2,0,0,0,0,0|0,0,2]=4 889 B8R0.4 CCNCCCNC=O Amb27220690 [2,0,0,0,0,0|2,0,0]=4 890 B8R0.4 CCOCO\C=C\C=O Amb26393569 [2,0,0,0,0,0|2,0,0]=4 891 B8R0.4 CCSCCCCC=O Amb24690525 [2,0,0,0,0,0|1,0,1]=4 892 B8R0.4 CCSCCCNC=O Amb27457130 [2,0,0,0,0,0|2,0,0]=4 893 B8R0.4 CC\C=C/CCCCC Amb25258581 [2,0,0,0,0,0|0,0,1]=3 894 B8R0.4 CC\C=C/CCCCN Amb28313712 [2,0,0,0,0,0|1,0,1]=4 895 B8R0.4 CC\C=C/CCCCO Amb22052636 [2,0,0,0,0,0|1,0,1]=4 896 B8R0.4 CC\C=C/C\C=C\C=O Amb28251042 [2,0,0,0,0,0|0,0,2]=4 897 B8R0.4 CC\C=C\CCCCC Amb22347893 [2,0,0,0,0,0|0,0,1]=3 898 B8R0.4 CC\C=C\CCCCN Amb33079175 [2,0,0,0,0,0|1,0,1]=4 899 B8R0.4 CC\C=C\CCNCC Amb27647277 [2,0,0,0,0,0|1,0,1]=4 900 B8R0.4 CC\C=C\CCSCC Amb27260956 [2,0,0,0,0,0|1,0,1]=4 901 B8R0.4 COCCCCCC=O Amb27467958 [2,0,0,0,0,0|1,0,1]=4 902 B8R0.4 CO\C=C\CCCCO Amb27448464 [2,0,0,0,0,0|2,0,0]=4 903 B8R0.4 CSCCCCCC=O Amb27981887 [2,0,0,0,0,0|1,0,1]=4 904 B8R0.4 CSCCCCNC=O Amb28366040 [2,0,0,0,0,0|2,0,0]=4 905 B8R0.4 C\C=C/C=C/CCCBr Amb27878672 [2,0,0,0,0,0|1,0,1]=4 906 B8R0.4 C\C=C/CCCCC=O Amb26854801 [2,0,0,0,0,0|1,0,1]=4 907 B8R0.4 C\C=C/CCCCCC Amb27478896 [2,0,0,0,0,0|0,0,0]=2 908 B8R0.4 C\C=C/CCC\C=C/C Amb22230407 [2,0,0,0,0,0|0,0,2]=4 909 B8R0.4 C\C=C/CCC\C=C\C Amb28142478 [2,0,0,0,0,0|0,0,2]=4 910 B8R0.4 C\C=C\C=C\CCCC Amb24477896 [2,0,0,0,0,0|0,0,1]=3 911 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [2,0,0,0,0,0|1,0,1]=4 912 B8R0.4 C\C=C\CCCCCC Amb19930200 [2,0,0,0,0,0|0,0,0]=2 913 B8R0.4 C\C=C\CCCCCO Amb25247777 [2,0,0,0,0,0|1,0,0]=3 914 B8R0.4 C\C=C\CCCCNO Amb27849039 [2,0,0,0,0,0|2,0,0]=4 915 B8R0.4 C\C=C\CCC\C=C\C Amb27776888 [2,0,0,0,0,0|0,0,2]=4 916 B8R0.4 C\C=C\CC\C=C\C=O Amb18642215 [2,0,0,0,0,0|0,0,2]=4 917 B8R0.4 C\C=C\CNCCCI Amb27652349 [2,0,0,0,0,0|2,0,0]=4 918 B8R0.4 C\C=C\CNCCCN Amb27175088 [2,0,0,0,0,0|2,0,0]=4 919 B8R0.4 C\C=C\COCCCBr Amb27949261 [2,0,0,0,0,0|2,0,0]=4 920 B8R0.4 C\C=C\COCCNC Amb27852522 [2,0,0,0,0,0|2,0,0]=4 921 B8R0.4 C\C=C\CSCCOC Amb27766159 [2,0,0,0,0,0|2,0,0]=4 922 B8R0.4 C\C=C\OCCCCO Amb27486247 [2,0,0,0,0,0|2,0,0]=4 923 B8R0.4 O=CCCCCCCBr Amb22755463 [2,0,0,0,0,0|1,0,1]=4 924 B8R0.4 O=CCCCCCCCl Amb27262031 [2,0,0,0,0,0|1,0,1]=4 925 B8R0.4 O=C\C=C/CCCC=O Amb28202061 [2,0,0,0,0,0|1,0,1]=4 926 B8R0.7 C=C(C)CCCCCBr Amb28436917 [2,0,0,0,0,0|2,0,0]=4 927 B8R0.7 C=C(C)CCCCCC Amb6298939 [2,0,0,0,0,0|1,0,0]=3 928 B8R0.7 C=C(C)CCCCCO Amb27641867 [2,0,0,0,0,0|2,0,0]=4 929 B8R0.7 C=C(C)CCNCCC Amb27813957 [2,0,0,0,0,0|2,0,0]=4 930 B8R0.7 C=C(C)CNCCCC Amb17308646 [2,0,0,0,0,0|2,0,0]=4 931 B8R0.7 C=C(C)COCCCC Amb22641495 [2,0,0,0,0,0|2,0,0]=4 932 B8R0.7 C=C(C)CSCCCC Amb9787751 [2,0,0,0,0,0|2,0,0]=4 933 B8R0.7 C=C(C)\C=C\CCCBr Amb25264506 [2,0,0,0,0,0|2,0,0]=4 934 B8R0.7 C=C(C)\C=C\CCCCl Amb27494353 [2,0,0,0,0,0|2,0,0]=4 935 B8R0.7 C=C(C)\C=C\CCNC Amb25883809 [2,0,0,0,0,0|2,0,0]=4 936 B8R0.7 C=CCCCCC(C)=O Amb24546961 [2,0,0,0,0,0|0,0,2]=4 937 B8R0.7 CC(=O)CCCCC#N Amb18642300 [2,0,0,0,0,0|1,0,1]=4 938 B8R0.7 CC(=O)CCCCCBr Amb27401578 [2,0,0,0,0,0|1,0,0]=3 939 B8R0.7 CC(=O)CCCCCCl Amb26591097 [2,0,0,0,0,0|1,0,0]=3 940 B8R0.7 CC(=O)CCCCCN Amb22641918 [2,0,0,0,0,0|1,0,0]=3 941 B8R0.7 CC(=O)CCCCCN Amb24113384 [2,0,0,0,0,0|1,0,0]=3 942 B8R0.7 CC(=O)CCCCCO Amb27237283 [2,0,0,0,0,0|1,0,0]=3 943 B8R0.7 CC(=O)CCNCCO Amb24481900 [2,0,0,0,0,0|2,0,0]=4 944 B8R0.7 CC(=O)CCOCCBr Amb32651831 [2,0,0,0,0,0|2,0,0]=4 945 B8R0.7 CC(=O)CCOCCCl Amb27982282 [2,0,0,0,0,0|2,0,0]=4 946 B8R0.7 CC(=O)CCOCCN Amb18628609 [2,0,0,0,0,0|2,0,0]=4 947 B8R0.7 CC(=O)COCCCN Amb18630475 [2,0,0,0,0,0|2,0,0]=4 948 B8R0.7 CC(=O)CSCCCF Amb28065634 [2,0,0,0,0,0|2,0,0]=4 949 B8R0.7 CC(=O)NCCCCCl Amb25883586 [2,0,0,0,0,0|2,0,0]=4 950 B8R0.7 CC(=O)NCCCCF Amb27180576 [2,0,0,0,0,0|2,0,0]=4 951 B8R0.7 CC(=O)NCCCCI Amb27768800 [2,0,0,0,0,0|2,0,0]=4 952 B8R0.7 CC(=O)NCCCCN Amb17053700 [2,0,0,0,0,0|2,0,0]=4 953 B8R0.7 CC(=O)NCCCCO Amb17102977 [2,0,0,0,0,0|2,0,0]=4 954 B8R0.7 CC(=O)OCCCCBr Amb2725321 [2,0,0,0,0,0|2,0,0]=4 955 B8R0.7 CC(=O)OCCCCCl Amb3940275 [2,0,0,0,0,0|2,0,0]=4 956 B8R0.7 CC(=O)OCCCCI Amb2725257 [2,0,0,0,0,0|2,0,0]=4 957 B8R0.7 CC(=O)OCCCCN Amb24657282 [2,0,0,0,0,0|2,0,0]=4 958 B8R0.7 CC(=O)OCCCCO Amb25714960 [2,0,0,0,0,0|2,0,0]=4 959 B8R0.7 CC(=O)SCCCCBr Amb22641871 [2,0,0,0,0,0|2,0,0]=4 960 B8R0.7 CC(=O)SCCCCN Amb24117263 [2,0,0,0,0,0|2,0,0]=4 961 B8R0.7 CC(=O)SCCCCN Amb27429858 [2,0,0,0,0,0|2,0,0]=4 962 B8R0.7 CC(=O)\C=C\CCC#N Amb18642111 [2,0,0,0,0,0|1,0,1]=4 963 B8R0.7 CC(=O)\C=C\NCCCl Amb27439668 [2,0,0,0,0,0|2,0,0]=4 964 B8R0.7 CC(C)=CCCCCBr Amb25933172 [2,0,0,0,0,0|2,0,0]=4 965 B8R0.7 CC(C)=CCCCCCl Amb32688153 [2,0,0,0,0,0|2,0,0]=4 966 B8R0.7 CC(C)=CCCCCN Amb28345726 [2,0,0,0,0,0|2,0,0]=4 967 B8R0.7 CC(C)=CCCCCO Amb28315431 [2,0,0,0,0,0|2,0,0]=4 968 B8R0.7 CCCCC#CC(C)=O Amb17593278 [2,0,0,0,0,0|0,0,2]=4 969 B8R0.7 CCCCCC=C(F)F Amb10840486 [2,0,0,0,0,0|2,0,0]=4 970 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [2,0,0,0,0,0|1,0,0]=3 971 B8R0.7 CCCCCCC(=O)O Amb34915914 [2,0,0,0,0,0|1,0,0]=3 972 B8R0.7 CCCCCCC(=O)O Amb3499439 [2,0,0,0,0,0|1,0,0]=3 973 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [2,0,0,0,0,0|1,0,0]=3 974 B8R0.7 CCCCCCC(C)=O Amb6891961 [2,0,0,0,0,0|0,0,0]=2 975 B8R0.7 CCCCCCC(C)Br Amb8387237 [2,0,0,0,0,0|1,0,1]=4 976 B8R0.7 CCCCCCC(C)C Amb6366318 [2,0,0,0,0,0|1,0,1]=4 977 B8R0.7 CCCCCCC(C)Cl Amb7795644 [2,0,0,0,0,0|1,0,1]=4 978 B8R0.7 CCCCCCC(C)I Amb3940584 [2,0,0,0,0,0|1,0,1]=4 979 B8R0.7 CCCCCCC(C)N Amb3940458 [2,0,0,0,0,0|1,0,1]=4 980 B8R0.7 CCCCCCC(C)O Amb3940385 [2,0,0,0,0,0|0,0,2]=4 981 B8R0.7 CCCCCCC(C)S Amb7795225 [2,0,0,0,0,0|0,1,1]=4 982 B8R0.7 CCCCCCC(N)=O Amb8858816 [2,0,0,0,0,0|1,0,0]=3 983 B8R0.7 CCCCCC[C@@H](C)Br Amb26563385 [2,0,0,0,0,0|1,0,1]=4 984 B8R0.7 CCCCCC[C@@H](C)N Amb8516401 [2,0,0,0,0,0|1,0,1]=4 985 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [2,0,0,0,0,0|0,0,2]=4 986 B8R0.7 CCCCCC[C@H](C)Br Amb28401131 [2,0,0,0,0,0|1,0,1]=4 987 B8R0.7 CCCCCC[C@H](C)N Amb8516350 [2,0,0,0,0,0|1,0,1]=4 988 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [2,0,0,0,0,0|2,0,0]=4 989 B8R0.7 CCCCCNC(C)=N Amb28127671 [2,0,0,0,0,0|2,0,0]=4 990 B8R0.7 CCCCCNC(N)=O Amb6246936 [2,0,0,0,0,0|2,0,0]=4 991 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [2,0,0,0,0,0|2,0,0]=4 992 B8R0.7 CCCCCOC(N)=O Amb27655610 [2,0,0,0,0,0|2,0,0]=4 993 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [2,0,0,0,0,0|2,0,0]=4 994 B8R0.7 CCCCNCC(=O)O Amb7766471 [2,0,0,0,0,0|2,0,0]=4 995 B8R0.7 CCCCNCC(N)=O Amb1126543 [2,0,0,0,0,0|2,0,0]=4 996 B8R0.7 CCCCNCC(N)=O Amb7969721 [2,0,0,0,0,0|2,0,0]=4 997 B8R0.7 CCCCOCC(=O)O Amb8514871 [2,0,0,0,0,0|2,0,0]=4 998 B8R0.7 CCCCOCC(N)=O Amb27855875 [2,0,0,0,0,0|2,0,0]=4 999 B8R0.7 CCCCSCC(=O)O Amb1138789 [2,0,0,0,0,0|2,0,0]=4 1000 B8R0.7 CCCC\C=C/C(C)=O Amb28074727 [2,0,0,0,0,0|0,0,0]=2 1001 B8R0.7 CCCC\C=C\C(=O)Cl Amb2688651 [2,0,0,0,0,0|1,0,0]=3 1002 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [2,0,0,0,0,0|1,0,0]=3 1003 B8R0.7 CCCC\C=C\C(=O)[O-] Amb17778116 [2,0,0,0,0,0|1,0,0]=3 1004 B8R0.7 CCCC\C=C\[C@H](C)O Amb27950980 [2,0,0,0,0,0|0,0,2]=4 1005 B8R0.7 CCCNCCC(=O)O Amb18633174 [2,0,0,0,0,0|2,0,0]=4 1006 B8R0.7 CCCNCCC(=O)O Amb2372065 [2,0,0,0,0,0|2,0,0]=4 1007 B8R0.7 CCCNCCC(C)=O Amb24700442 [2,0,0,0,0,0|1,0,0]=3 1008 B8R0.7 CCCN\C=C\C(C)=S Amb27168202 [2,0,0,0,0,0|1,1,0]=4 1009 B8R0.7 CCCOCCC(=O)O Amb8874502 [2,0,0,0,0,0|2,0,0]=4 1010 B8R0.7 CCCOCCC(C)=O Amb8874915 [2,0,0,0,0,0|1,0,0]=3 1011 B8R0.7 CCCO\C=C\C(N)=O Amb28198536 [2,0,0,0,0,0|2,0,0]=4 1012 B8R0.7 CCCS\C=C/C(=O)O Amb18644291 [2,0,0,0,0,0|2,0,0]=4 1013 B8R0.7 CCCS\C=C/C(=O)[O-] Amb19816096 [2,0,0,0,0,0|2,0,0]=4 1014 B8R0.7 CCCS\C=C/C(=O)[O-] Amb6600550 [2,0,0,0,0,0|2,0,0]=4 1015 B8R0.7 CCC\C=C/CC(C)=O Amb27974039 [2,0,0,0,0,0|0,0,2]=4 1016 B8R0.7 CCC\C=C\CC(C)=O Amb33429740 [2,0,0,0,0,0|0,0,2]=4 1017 B8R0.7 CCNCCCC(=O)O Amb30585148 [2,0,0,0,0,0|2,0,0]=4 1018 B8R0.7 CCNCCCC(=O)O Amb6253896 [2,0,0,0,0,0|2,0,0]=4 1019 B8R0.7 CCNCCCC(N)=O Amb24709859 [2,0,0,0,0,0|2,0,0]=4 1020 B8R0.7 CCNCCCS(C)=O Amb27223315 [2,0,0,0,0,0|2,0,0]=4 1021 B8R0.7 CCNCCNC(C)=O Amb6732650 [2,0,0,0,0,0|2,0,0]=4 1022 B8R0.7 CCNCCSC(C)=O Amb27187142 [2,0,0,0,0,0|2,0,0]=4 1023 B8R0.7 CCOCCCC(=O)O Amb6257602 [2,0,0,0,0,0|2,0,0]=4 1024 B8R0.7 CCOCCOC(C)=O Amb8383625 [2,0,0,0,0,0|2,0,0]=4 1025 B8R0.7 CCOC\C=C/C(=O)O Amb27807906 [2,0,0,0,0,0|2,0,0]=4 1026 B8R0.7 CCOC\C=C\C(=O)O Amb19020649 [2,0,0,0,0,0|2,0,0]=4 1027 B8R0.7 CCSCCCC(=O)O Amb6680204 [2,0,0,0,0,0|2,0,0]=4 1028 B8R0.7 CCSCCCC(C)=O Amb9660283 [2,0,0,0,0,0|1,0,0]=3 1029 B8R0.7 CCSCCNC(C)=O Amb27848944 [2,0,0,0,0,0|2,0,0]=4 1030 B8R0.7 CCSC\C=C\C(=O)O Amb33449652 [2,0,0,0,0,0|2,0,0]=4 1031 B8R0.7 CCSC\C=C\C(C)=O Amb33323646 [2,0,0,0,0,0|1,0,0]=3 1032 B8R0.7 CC\C=C/C=C/C(C)=O Amb27164670 [2,0,0,0,0,0|0,0,2]=4 1033 B8R0.7 CC\C=C\C=C\C(C)=O Amb24667251 [2,0,0,0,0,0|0,0,2]=4 1034 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [2,0,0,0,0,0|0,0,2]=4 1035 B8R0.7 CNCCCCC(=O)O Amb10605773 [2,0,0,0,0,0|2,0,0]=4 1036 B8R0.7 CNCCCCC(=O)O Amb24340485 [2,0,0,0,0,0|2,0,0]=4 1037 B8R0.7 CNCCCCC(N)=O Amb27780478 [2,0,0,0,0,0|2,0,0]=4 1038 B8R0.7 CNCCCNC(C)=O Amb33547919 [2,0,0,0,0,0|2,0,0]=4 1039 B8R0.7 CNCCCNC(C)=O Amb34913785 [2,0,0,0,0,0|2,0,0]=4 1040 B8R0.7 CNCCCNC(C)=O Amb9464418 [2,0,0,0,0,0|2,0,0]=4 1041 B8R0.7 CNCCOCC(C)=O Amb18111838 [2,0,0,0,0,0|2,0,0]=4 1042 B8R0.7 COCCCCC(=O)O Amb9207785 [2,0,0,0,0,0|2,0,0]=4 1043 B8R0.7 COCCCCC(C)=O Amb9659801 [2,0,0,0,0,0|1,0,0]=3 1044 B8R0.7 COCCCNC(C)=O Amb3358083 [2,0,0,0,0,0|2,0,0]=4 1045 B8R0.7 COCCCOC(C)=O Amb22732978 [2,0,0,0,0,0|2,0,0]=4 1046 B8R0.7 COCCOCC(C)=O Amb9665444 [2,0,0,0,0,0|2,0,0]=4 1047 B8R0.7 COCC\C=C\C(=O)O Amb33080389 [2,0,0,0,0,0|2,0,0]=4 1048 B8R0.7 COCC\C=C\C(C)=O Amb33377354 [2,0,0,0,0,0|1,0,0]=3 1049 B8R0.7 CS(=O)CCCCCCl Amb27173793 [2,0,0,0,0,0|2,0,0]=4 1050 B8R0.7 CSCCCCC(=O)O Amb17503764 [2,0,0,0,0,0|2,0,0]=4 1051 B8R0.7 CSCCCCC(C)=O Amb27815140 [2,0,0,0,0,0|1,0,0]=3 1052 B8R0.7 CSCCCCC(N)=O Amb27662727 [2,0,0,0,0,0|2,0,0]=4 1053 B8R0.7 CSCCCOC(C)=O Amb8392861 [2,0,0,0,0,0|2,0,0]=4 1054 B8R0.7 CSCC\C=C\C(=O)O Amb33475293 [2,0,0,0,0,0|2,0,0]=4 1055 B8R0.7 CSCC\C=C\C(C)=O Amb33197615 [2,0,0,0,0,0|1,0,0]=3 1056 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [2,0,0,0,0,0|0,0,2]=4 1057 B8R0.7 NC(=O)CCCCCBr Amb2685265 [2,0,0,0,0,0|2,0,0]=4 1058 B8R0.7 NC(=O)CCCCCCl Amb27392074 [2,0,0,0,0,0|2,0,0]=4 1059 B8R0.7 NC(=O)CCCCCF Amb27837777 [2,0,0,0,0,0|2,0,0]=4 1060 B8R0.7 NC(=O)CCCCCO Amb22524369 [2,0,0,0,0,0|2,0,0]=4 1061 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [2,0,0,0,0,0|2,0,0]=4 1062 B8R0.7 NCCCCCC(=O)O Amb17607928 [2,0,0,0,0,0|2,0,0]=4 1063 B8R0.7 NCCCCCC(=O)O Amb1905625 [2,0,0,0,0,0|2,0,0]=4 1064 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [2,0,0,0,0,0|2,0,0]=4 1065 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [2,0,0,0,0,0|2,0,0]=4 1066 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [2,0,0,0,0,0|2,0,0]=4 1067 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [2,0,0,0,0,0|2,0,0]=4 1068 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [2,0,0,0,0,0|2,0,0]=4 1069 B8R0.7 O=C(Cl)\C=C\CCCCl Amb27439280 [2,0,0,0,0,0|2,0,0]=4 1070 B8R0.7 O=C(F)CCCCCCl Amb27173031 [2,0,0,0,0,0|2,0,0]=4 1071 B8R0.7 O=C(O)CCCCCBr Amb2081955 [2,0,0,0,0,0|2,0,0]=4 1072 B8R0.7 O=C(O)CCCCCCl Amb18796646 [2,0,0,0,0,0|2,0,0]=4 1073 B8R0.7 O=C(O)CCCCCF Amb26063796 [2,0,0,0,0,0|2,0,0]=4 1074 B8R0.7 O=C(O)CCCCCI Amb22736492 [2,0,0,0,0,0|2,0,0]=4 1075 B8R0.7 O=C(O)CCCCCO Amb8515991 [2,0,0,0,0,0|2,0,0]=4 1076 B8R0.7 O=C(O)\C=C\CCCCl Amb18644386 [2,0,0,0,0,0|2,0,0]=4 1077 B8R0.7 O=C([O-])CCCCCO Amb22491268 [2,0,0,0,0,0|2,0,0]=4 1078 B10R0.3 CC(C)=CCCC(C)CCO Amb532963 [1,1,0,0,0,0|2,0,0]=4 1079 B10R0.3 CC(C)=CCC[C@@H](C)CCO Amb571421 [1,1,0,0,0,0|2,0,0]=4 1080 B10R0.3 CC(C)=CCC[C@H](C)CCO Amb17611216 [1,1,0,0,0,0|2,0,0]=4 1081 B10R0.3 CCCC(C)CCCC(=O)O Amb20669051 [1,1,0,0,0,0|1,0,1]=4 1082 B10R0.3 CCCC(C)CCCC(C)=O Amb32668762 [1,1,0,0,0,0|0,0,1]=3 1083 B10R0.3 CCCC(C)CCOC(C)=O Amb24087389 [1,1,0,0,0,0|1,0,0]=3 1084 B10R0.3 CCCC(S)CCOC(C)=O Amb10071332 [1,1,0,0,0,0|1,0,0]=3 1085 B10R0.3 C\C=C\C(C)C\C=C\C(C)=O Amb26659861 [1,1,0,0,0,0|0,0,2]=4 1086 B10R0.6 CC(=O)\C=C(/C)CCCC#N Amb27672662 [1,1,0,0,0,0|1,0,1]=4 1087 B10R0.6 CC(=O)\C=C(/C)NCCCN Amb27672527 [1,1,0,0,0,0|2,0,0]=4 1088 B10R0.6 CC(=O)\C=C(/C)NCCCO Amb27673861 [1,1,0,0,0,0|2,0,0]=4 1089 B10R0.6 CC(=O)\C=C(\C)NCCCN Amb26660553 [1,1,0,0,0,0|2,0,0]=4 1090 B10R0.6 CCCCCC(C)CC(=O)O Amb19375410 [1,1,0,0,0,0|1,0,1]=4 1091 B10R0.6 CCCCCC(N)CC(=O)O Amb21857987 [1,1,0,0,0,0|1,0,1]=4 1092 B10R0.6 CCCCCC(N)CC(=O)O Amb31307614 [1,1,0,0,0,0|1,0,1]=4 1093 B10R0.6 CCCCCC(N)CC(N)=O Amb33255748 [1,1,0,0,0,0|1,0,1]=4 1094 B10R0.6 CCCCCC(O)CC(=O)O Amb18797787 [1,1,0,0,0,0|1,0,1]=4 1095 B10R0.6 CCCCC[C@@H](O)CC(=O)O Amb31308365 [1,1,0,0,0,0|1,0,1]=4 1096 B10R0.6 CCCCC[C@H](O)CC(=O)O Amb33872470 [1,1,0,0,0,0|1,0,1]=4 1097 B10R0.6 CCCCNC(=O)CC(C)=O Amb4025888 [1,1,0,0,0,0|1,0,1]=4 1098 B10R0.6 CCCCNC(=O)NC(C)=O Amb26601898 [1,1,0,0,0,0|2,0,0]=4 1099 B10R0.6 CCCCNC(=S)C=C(C)C Amb27990298 [1,1,0,0,0,0|2,0,0]=4 1100 B10R0.6 CCCCN\C(C)=C\C(C)=O Amb27672522 [1,1,0,0,0,0|1,0,0]=3 1101 B10R0.6 CCCCOC(=O)CC(C)=O Amb2412117 [1,1,0,0,0,0|1,0,1]=4 1102 B10R0.6 CCCNCC(=O)NC(C)=O Amb28352092 [1,1,0,0,0,0|2,0,0]=4 1103 B10R0.6 CCCNCC(C)OC(C)=O Amb18265960 [1,1,0,0,0,0|2,0,0]=4 1104 B10R0.6 CCOCCC(=O)CC(C)=O Amb18182347 [1,1,0,0,0,0|1,0,1]=4 1105 B10R0.6 CNCCN\C(C)=C\C(C)=O Amb27990317 [1,1,0,0,0,0|2,0,0]=4 1106 B10R0.6 COCCN\C(C)=C/C(C)=O Amb27990279 [1,1,0,0,0,0|2,0,0]=4 1107 B10R0.6 C\C=C/CC\C(O)=C\C(C)=O Amb27673601 [1,1,0,0,0,0|0,0,2]=4 1108 B10R0.6 [2H]\C(=C/C(C)C)CCCCC Amb22546752 [1,1,0,0,0,0|1,0,1]=4 1109 B10R0.22 CCCCCCOS(C)(=O)=O Amb22388879 [1,1,0,0,0,0|2,0,0]=4 1110 B10R0.22 CCCCC\C=C\C(C)(C)C Amb22546599 [1,1,0,0,0,0|1,0,1]=4 1111 B10R0.55 CC(=O)OCCCC(F)CBr Amb22641505 [1,1,0,0,0,0|2,0,0]=4 1112 B10R0.55 CCC(C)CCCCC(=O)O Amb24271145 [1,1,0,0,0,0|1,0,1]=4 1113 B10R0.55 CCC(C)CN\C=C\C(=O)O Amb28386709 [1,1,0,0,0,0|2,0,0]=4 1114 B10R0.55 CCC(O)CN\C=C\C(=O)O Amb28386737 [1,1,0,0,0,0|2,0,0]=4 1115 B10R0.74 C=CC(C)\C=C/CCCCC Amb22546637 [1,1,0,0,0,0|1,0,1]=4 1116 B10R0.74 CCC(=O)NCCCCCN Amb18102728 [1,1,0,0,0,0|2,0,0]=4 1117 B10R0.74 CCCCCC#CC(=O)CF Amb25383110 [1,1,0,0,0,0|0,0,2]=4 1118 B10R0.74 CCCCCC#CC(=O)OC Amb2721698 [1,1,0,0,0,0|0,0,2]=4 1119 B10R0.74 CCCCCCCC(=O)CC Amb6366429 [1,1,0,0,0,0|0,0,1]=3 1120 B10R0.74 CCCCCCCC(=O)NN Amb6564834 [1,1,0,0,0,0|1,0,1]=4 1121 B10R0.74 CCCCCCCC(=O)NO Amb7764666 [1,1,0,0,0,0|1,0,1]=4 1122 B10R0.74 CCCCCCCC(=O)OC Amb8516706 [1,1,0,0,0,0|0,0,1]=3 1123 B10R0.74 CCCCCCNC(=O)CBr Amb17331633 [1,1,0,0,0,0|1,0,0]=3 1124 B10R0.74 CCCCCCNC(=O)CCl Amb6753822 [1,1,0,0,0,0|1,0,0]=3 1125 B10R0.74 CCCCCCNC(=O)CN Amb9279196 [1,1,0,0,0,0|1,0,0]=3 1126 B10R0.74 CCCCCCOC(=O)C=O Amb17614962 [1,1,0,0,0,0|1,0,1]=4 1127 B10R0.74 CCCCCCOC(=O)CCl Amb9787731 [1,1,0,0,0,0|1,0,0]=3 1128 B10R0.74 CCCCCCOC(=O)CN Amb2688622 [1,1,0,0,0,0|1,0,0]=3 1129 B10R0.74 CCCCCCOC(=O)CS Amb2778632 [1,1,0,0,0,0|1,0,0]=3 1130 B10R0.74 CCCCCC\C=C(\I)CC Amb22641682 [1,1,0,0,0,0|1,0,0]=3 1131 B10R0.74 CCCCC\C=C\C(=O)OC Amb24066773 [1,1,0,0,0,0|0,0,0]=2 1132 B10R0.74 CCOCCCNC(=O)CBr Amb17331104 [1,1,0,0,0,0|2,0,0]=4 1133 B10R0.74 CCOCCCNC(=O)CCl Amb2370647 [1,1,0,0,0,0|2,0,0]=4 1134 B10R0.74 CCOCCCNC(=O)CN Amb6275486 [1,1,0,0,0,0|2,0,0]=4 1135 B10R0.74 COC(=O)CCCCCCBr Amb10604007 [1,1,0,0,0,0|1,0,1]=4 1136 B10R0.74 COC(=O)CCCCCCI Amb32410699 [1,1,0,0,0,0|1,0,1]=4 1137 B10R0.74 COC(=O)CCCCCCN Amb35747961 [1,1,0,0,0,0|1,0,1]=4 1138 B10R0.74 COC(=O)CCCCCCN Amb7762677 [1,1,0,0,0,0|1,0,1]=4 1139 B10R0.74 COC(=O)CCCCCCN Amb7969645 [1,1,0,0,0,0|1,0,1]=4 1140 B10R0.74 COC(=O)CCCCCCO Amb13887312 [1,1,0,0,0,0|1,0,1]=4 1141 B10R0.74 COCCCCNC(=O)CBr Amb17328559 [1,1,0,0,0,0|2,0,0]=4 1142 B10R0.74 COCCCCNC(=O)CCl Amb17328159 [1,1,0,0,0,0|2,0,0]=4 1143 B10R0.74 NCC(=O)NCCCCCBr Amb31289663 [1,1,0,0,0,0|2,0,0]=4 1144 B10R0.74 O=C(CBr)NCCCCCO Amb17329962 [1,1,0,0,0,0|2,0,0]=4 1145 B10R0.74 O=C(CCl)NCCCCCO Amb17329578 [1,1,0,0,0,0|2,0,0]=4 1146 B10R0.75 C#CCCC\C=C(/C)C(C)=O Amb27672669 [1,1,0,0,0,0|0,0,2]=4 1147 B10R0.75 CC(=O)N(O)CCCCCN Amb33379128 [1,1,0,0,0,0|2,0,0]=4 1148 B10R0.75 CC(=O)N(O)CCCCCN Amb33379129 [1,1,0,0,0,0|2,0,0]=4 1149 B10R0.75 CCCCCCC(=O)C(C)C Amb4605884 [1,1,0,0,0,0|1,0,1]=4 1150 B10R0.75 CCCCCCC(Br)C(=O)Br Amb24061160 [1,1,0,0,0,0|1,0,1]=4 1151 B10R0.75 CCCCCCC(C)C(=O)O Amb10843971 [1,1,0,0,0,0|1,0,1]=4 1152 B10R0.75 CCCCCCC(F)C(=O)O Amb32663880 [1,1,0,0,0,0|1,0,1]=4 1153 B10R0.75 CCCCCCC(N)C(=O)O Amb2613445 [1,1,0,0,0,0|1,0,1]=4 1154 B10R0.75 CCCCCCC(N)C(N)=O Amb18791950 [1,1,0,0,0,0|1,0,1]=4 1155 B10R0.75 CCCCCC[C@@H](N)C(=O)O Amb16183913 [1,1,0,0,0,0|1,0,1]=4 1156 B10R0.75 CCCCCC[C@H](N)C(=O)O Amb16183914 [1,1,0,0,0,0|1,0,1]=4 1157 B10R0.78 C#CCCC(C)\C=C\C(C)=O Amb24766518 [1,1,0,0,0,0|0,0,2]=4 1158 B10R0.78 CC(=O)NCC(Cl)CCCCl Amb10068525 [1,1,0,0,0,0|2,0,0]=4 1159 B10R0.78 CCCCC(C)CCC(=O)O Amb2689572 [1,1,0,0,0,0|1,0,1]=4 1160 B10R0.78 CCCCC(C)CCC(=O)[O-] Amb33513011 [1,1,0,0,0,0|1,0,1]=4 1161 B10R0.78 CCCCC(N)CCC(=O)O Amb33172614 [1,1,0,0,0,0|1,0,1]=4 1162 B10R0.78 CCCCC(O)CCC(=O)O Amb33539237 [1,1,0,0,0,0|1,0,1]=4 1163 B10R0.78 CCCCC(O)CCC(=O)[O-] Amb32674867 [1,1,0,0,0,0|1,0,1]=4 1164 B10R0.97 CC(=O)\C=C/CCC=C(C)C Amb27672366 [1,1,0,0,0,0|0,0,2]=4 1165 B10R0.97 CC(C)CCCCCC(=O)O Amb16232096 [1,1,0,0,0,0|1,0,1]=4 1166 B10R0.97 CC(O)CCCCCC(=O)O Amb24117232 [1,1,0,0,0,0|1,0,1]=4 1167 B10R0.97 CC(O)CCN\C=C\C(=O)O Amb28386713 [1,1,0,0,0,0|2,0,0]=4 1168 B10R0.1 CCCCC#C\C(C)=C/C=O Amb27176508 [1,1,0,0,0,0|0,0,2]=4 1169 B10R0.1 CCCCC#C\C(C)=C\C=O Amb28197977 [1,1,0,0,0,0|0,0,2]=4 1170 B10R0.1 CCCCCCC(=O)CCC Amb8513848 [1,1,0,0,0,0|0,0,2]=4 1171 B10R0.1 CCCCCCC(=O)OCC Amb8515401 [1,1,0,0,0,0|1,0,1]=4 1172 B10R0.71 C=C\C=C/C=C/CCCCC Amb22546765 [1,1,0,0,0,0|0,0,2]=4 1173 B10R0.71 CCCCCC#C\C=C\CO Amb25383013 [1,1,0,0,0,0|0,0,2]=4 1174 B10R0.71 CCCCCCCCCC=O Amb3940437 [1,1,0,0,0,0|0,0,2]=4 1175 B10R0.71 CCCCCCCCNC=O Amb9787543 [1,1,0,0,0,0|0,0,2]=4 1176 B10R0.71 CCCCCCC\C=C\C=O Amb8517160 [1,1,0,0,0,0|0,0,0]=2 1177 B10R0.71 CCCCCC\C=C\CCO Amb22641690 [1,1,0,0,0,0|0,0,1]=3 1178 B10R0.71 CCCCC\C=C\C=C\C=O Amb8392854 [1,1,0,0,0,0|0,0,1]=3 1179 B10R0.71 CCCCC\C=C\CCC=O Amb33512982 [1,1,0,0,0,0|0,0,2]=4 1180 B10R0.71 C\C=C/C\C=C/CCCCC Amb22546768 [1,1,0,0,0,0|0,0,1]=3 1181 B10R0.71 C\C=C\C=C\CCCCCC Amb22546597 [1,1,0,0,0,0|0,0,0]=2 1182 B10R0.71 C\C=C\CNCCCCCO Amb32454907 [1,1,0,0,0,0|1,0,1]=4 1183 B12R0.4 CC(C)=CC(=O)NCCCCCN Amb18620076 [0,2,0,0,0,0|2,0,0]=4 1184 B12R0.4 CCCCCCCC(=O)CC(C)=O Amb19068864 [0,2,0,0,0,0|0,0,1]=3 1185 B12R0.4 CCCCCCCC(C)OC(C)=O Amb22734609 [0,2,0,0,0,0|0,0,2]=4 1186 B12R0.4 CCCCCCOC(C)NC(C)=O Amb24096324 [0,2,0,0,0,0|1,0,1]=4 1187 B12R0.4 CCCNCCOC(=O)C=C(C)C Amb18266009 [0,2,0,0,0,0|2,0,0]=4 1188 B12R0.113 CCCCCCC(C)NC(=O)CCl Amb1156522 [0,2,0,0,0,0|1,0,1]=4 1189 B12R0.113 CCCCCCC(C)OC(=O)CCl Amb21858582 [0,2,0,0,0,0|1,0,1]=4 1190 B12R0.113 CCCCCCC(N)CC(=O)OC Amb33254138 [0,2,0,0,0,0|0,0,2]=4 1191 B12R0.113 CCCCCCC(O)CC(=O)OC Amb21928832 [0,2,0,0,0,0|0,0,2]=4 1192 B12R0.113 CCCCCC[C@@H](O)CC(=O)OC Amb31308360 [0,2,0,0,0,0|0,0,2]=4 1193 B12R0.113 CCCCCC\C(C)=C\C(=O)OC Amb33472151 [0,2,0,0,0,0|0,0,0]=2 1194 B12R0.202 CCCCCCC(CC)OC(C)=O Amb30867684 [0,2,0,0,0,0|1,0,1]=4 1195 B12R0.184 CC(C)CCCCCOC(=O)CS Amb22168040 [0,2,0,0,0,0|1,0,1]=4 1196 B12R0.184 COC(=O)CCCCCCC(C)C Amb21928858 [0,2,0,0,0,0|0,0,2]=4 1197 B12R0.1 CCCCCCCCC(=O)OCC Amb8515442 [0,2,0,0,0,0|0,0,2]=4 1198 B12R0.1 CCCCCCCCC(=O)OCCl Amb32414071 [0,2,0,0,0,0|0,0,2]=4 1199 B12R0.1 CCCCCCCNC(=O)CC#N Amb1225538 [0,2,0,0,0,0|1,0,1]=4 1200 B12R0.1 CCCCCCCNC(=O)CCCl Amb3365413 [0,2,0,0,0,0|1,0,1]=4 1201 B12R0.1 CCCCCCCNC(=O)CNC Amb20141923 [0,2,0,0,0,0|1,0,1]=4 1202 B12R0.49 CCCCCCCC(N)C(=O)OC Amb19059295 [0,2,0,0,0,0|0,0,2]=4 1203 B12R0.248 CCCCCCCCCC(=O)OC Amb4378003 [0,2,0,0,0,0|0,0,2]=4 1204 B12R0.248 CCCCCCCCNC(=O)CBr Amb17329848 [0,2,0,0,0,0|0,0,2]=4 1205 B12R0.248 CCCCCCCCNC(=O)CCl Amb9786173 [0,2,0,0,0,0|0,0,2]=4 1206 B12R0.248 CCCCCCCCNC(=O)CN Amb24115163 [0,2,0,0,0,0|0,0,2]=4 1207 B12R0.248 CCCCCCCCOC(=O)CN Amb2688623 [0,2,0,0,0,0|0,0,2]=4 1208 B12R0.248 CCCCCCCCOC(=O)C[NH3+] Amb22049491 [0,2,0,0,0,0|0,0,2]=4 1209 B12R0.248 CCCCC\C=C/CCC(=O)OC Amb24093816 [0,2,0,0,0,0|0,0,2]=4 1210 B12R0.248 CCCCOCCCNC(=O)CBr Amb17329849 [0,2,0,0,0,0|1,0,1]=4 1211 B12R0.248 CCCCOCCCNC(=O)CN Amb24115103 [0,2,0,0,0,0|1,0,1]=4 1212 B12R0.248 COC(=O)CCCCCCCCBr Amb34913614 [0,2,0,0,0,0|0,0,2]=4 1213 B12R0.248 COC(=O)CCCCCCCCO Amb17616943 [0,2,0,0,0,0|0,0,2]=4 1214 B12R0.248 COCCCCCNCC(=O)OC Amb33133279 [0,2,0,0,0,0|1,0,1]=4 1215 B12R0.251 C=C(C)C(=O)NCCCCCCO Amb32411249 [0,2,0,0,0,0|2,0,0]=4 1216 B12R0.251 C=C(C)C(=O)OCCOCCCC Amb22338106 [0,2,0,0,0,0|2,0,0]=4 1217 B12R0.251 CCCCCCCCC(=O)C(F)F Amb35744492 [0,2,0,0,0,0|0,0,2]=4 1218 B12R0.251 CCCCCCCCN(C)C(C)=O Amb24096791 [0,2,0,0,0,0|0,0,2]=4 1219 B12R0.251 CCCCCCCNC(=O)C(C)Cl Amb17326983 [0,2,0,0,0,0|1,0,1]=4 1220 B12R0.251 CCCCOCCNC(=O)C(=O)O Amb19077636 [0,2,0,0,0,0|2,0,0]=4 1221 B12R0.123 CCCCCC(=O)CC(=O)C(C)=O Amb33355377 [0,2,0,0,0,0|0,0,2]=4 1222 B12R0.255 C=C(C)COC(=O)CCCCCC Amb22641514 [0,2,0,0,0,0|1,0,1]=4 1223 B12R0.255 CCCCCCC(=O)NCC(=O)O Amb9013683 [0,2,0,0,0,0|1,0,1]=4 1224 B12R0.240 CCC(O)CC(C)CCC=C(C)C Amb24093802 [0,2,0,0,0,0|1,0,1]=4 1225 B12R0.254 CCCCC(CC)CCNC(C)=O Amb24072187 [0,2,0,0,0,0|1,0,1]=4 1226 B12R0.234 CC(=O)NCCCNCCCCN Amb22641893 [0,2,0,0,0,0|1,0,1]=4 1227 B12R0.234 CC(=O)NOCCCNCCCN Amb24073412 [0,2,0,0,0,0|2,0,0]=4 1228 B12R0.234 CC(=O)OCCCCCCCCBr Amb24063233 [0,2,0,0,0,0|0,0,2]=4 1229 B12R0.234 CCCCCCCCCCC(C)=O Amb6366439 [0,2,0,0,0,0|0,0,2]=4 1230 B12R0.234 CCCCCCCCCOC(C)=O Amb6366259 [0,2,0,0,0,0|0,0,2]=4 1231 B12R0.234 CCCCCCCC\C=C\C(=O)O Amb33987634 [0,2,0,0,0,0|1,0,0]=3 1232 B12R0.234 O=C(O)\C=C\CCCCCCCO Amb33757093 [0,2,0,0,0,0|1,0,0]=3 1233 B12R0.268 CC(=O)CCCCC\C=C\C(=O)O Amb2610938 [0,2,0,0,0,0|1,0,0]=3 1234 B10R1.10 C=CC[C@@H]1CC=CC(=O)C1 Amb27802475 [1,0,0,1,0,0|0,0,2]=4 1235 B10R1.10 CCCC1CC(=O)C=CN1 Amb28250951 [1,0,0,1,0,0|1,0,0]=3 1236 B10R1.10 CCCC1CC(=O)CCN1 Amb18643754 [1,0,0,1,0,0|1,0,1]=4 1237 B10R1.10 CCCC1CC(=O)CCN1 Amb22235732 [1,0,0,1,0,0|1,0,1]=4 1238 B10R1.10 CCCC1CC(=O)CCO1 Amb24661952 [1,0,0,1,0,0|1,0,1]=4 1239 B10R1.10 CCCC1CC(=O)CCS1 Amb25759710 [1,0,0,1,0,0|1,0,1]=4 1240 B10R1.10 CCCC1CC=CC(=O)N1 Amb27236833 [1,0,0,1,0,0|1,0,0]=3 1241 B10R1.10 CCCC1CC=CC(=O)O1 Amb24099235 [1,0,0,1,0,0|1,0,0]=3 1242 B10R1.10 CCCC1CCCC(=O)C1 Amb22754799 [1,0,0,1,0,0|0,0,1]=3 1243 B10R1.10 CCCC1CCN=C(N)C1 Amb24665362 [1,0,0,1,0,0|2,0,0]=4 1244 B10R1.10 CCCC1CCNC(=O)C1 Amb26026704 [1,0,0,1,0,0|1,0,0]=3 1245 B10R1.10 CCCC1CCNC(=O)N1 Amb26026362 [1,0,0,1,0,0|2,0,0]=4 1246 B10R1.10 CCCN1CCC=C(C)C1 Amb24086395 [1,0,0,1,0,0|2,0,0]=4 1247 B10R1.10 CCCN1CCCC(=O)C1 Amb16187099 [1,0,0,1,0,0|1,0,1]=4 1248 B10R1.10 CCC[C@@H]1CC(=O)C=CN1 Amb27850175 [1,0,0,1,0,0|1,0,0]=3 1249 B10R1.10 CCC[C@H]1CC(=O)CCN1 Amb27208619 [1,0,0,1,0,0|1,0,1]=4 1250 B10R1.10 CCC[C@H]1CCCC(=O)C1 Amb27436290 [1,0,0,1,0,0|0,0,1]=3 1251 B10R1.10 CCC[C@H]1CCCC(=O)N1 Amb27770582 [1,0,0,1,0,0|1,0,1]=4 1252 B10R1.10 CCOC1CCCC(=O)C1 Amb27880749 [1,0,0,1,0,0|1,0,1]=4 1253 B10R1.10 CNCC1CCNC(=O)C1 Amb28319543 [1,0,0,1,0,0|2,0,0]=4 1254 B10R1.10 COCC1CC(=O)C=CO1 Amb27752309 [1,0,0,1,0,0|2,0,0]=4 1255 B10R1.10 COCC1CCCC(=O)C1 Amb25070154 [1,0,0,1,0,0|1,0,1]=4 1256 B10R1.10 COCC1CCNC(=O)C1 Amb25728486 [1,0,0,1,0,0|2,0,0]=4 1257 B10R1.10 CSCC1CCCC(=O)C1 Amb27429893 [1,0,0,1,0,0|1,0,1]=4 1258 B10R1.10 N#CCC1CC=CC(=O)C1 Amb27835520 [1,0,0,1,0,0|1,0,1]=4 1259 B10R1.10 NCCC1CCCC(=O)C1 Amb27191780 [1,0,0,1,0,0|1,0,1]=4 1260 B10R1.10 NCCC1CCNC(=O)C1 Amb18831624 [1,0,0,1,0,0|2,0,0]=4 1261 B10R1.10 O=C1CC(CCO)CCN1 Amb26424744 [1,0,0,1,0,0|2,0,0]=4 1262 B10R1.10 O=C1CCCC(CCBr)C1 Amb27607892 [1,0,0,1,0,0|1,0,1]=4 1263 B10R1.10 O=C1CCCC(CCO)C1 Amb26539684 [1,0,0,1,0,0|1,0,1]=4 1264 B10R1.16 CCCCC1CC(=O)CO1 Amb35718938 [1,0,0,1,0,0|1,0,1]=4 1265 B10R1.16 CCCCC1CC(=O)NN1 Amb29859945 [1,0,0,1,0,0|2,0,0]=4 1266 B10R1.16 CCCCC1CCC(=O)O1 Amb8513275 [1,0,0,1,0,0|1,0,1]=4 1267 B10R1.16 CCCCC1CCS(=O)C1 Amb27776452 [1,0,0,1,0,0|1,0,1]=4 1268 B10R1.16 CCCCC1CNC(=O)C1 Amb26346287 [1,0,0,1,0,0|1,0,0]=3 1269 B10R1.16 CCCCC1CNC(=O)O1 Amb27830443 [1,0,0,1,0,0|2,0,0]=4 1270 B10R1.16 CCCCC1CNC(C)=N1 Amb35737152 [1,0,0,1,0,0|2,0,0]=4 1271 B10R1.16 CCCCC1COC(=O)N1 Amb24482077 [1,0,0,1,0,0|2,0,0]=4 1272 B10R1.16 CCCCN1C=CC(=O)N1 Amb32794680 [1,0,0,1,0,0|2,0,0]=4 1273 B10R1.16 CCCC[C@@H]1C=CC(=O)C1 Amb28381113 [1,0,0,1,0,0|0,0,0]=2 1274 B10R1.16 CCCC[C@@H]1C=C[C@H](O)C1 Amb27851085 [1,0,0,1,0,0|0,0,2]=4 1275 B10R1.16 CCCC[C@@H]1CCC(=O)N1 Amb28134882 [1,0,0,1,0,0|1,0,1]=4 1276 B10R1.16 CCCC[C@@H]1CNC(=O)C1 Amb27770599 [1,0,0,1,0,0|1,0,0]=3 1277 B10R1.16 CCCC[C@@H]1COC(=O)N1 Amb22225366 [1,0,0,1,0,0|2,0,0]=4 1278 B10R1.16 CCCCc1ccc(C)o1 Amb4018006 [1,0,0,1,0,0|0,0,2]=4 1279 B10R1.16 CCCCc1ccc(C)s1 Amb10807431 [1,0,0,1,0,0|0,1,1]=4 1280 B10R1.16 CCCCn1ccc(C)n1 Amb6890349 [1,0,0,1,0,0|2,0,0]=4 1281 B10R1.16 CCCOC1CCC(=O)C1 Amb28183094 [1,0,0,1,0,0|1,0,1]=4 1282 B10R1.16 CCOCC1CCC(=O)C1 Amb26649290 [1,0,0,1,0,0|1,0,1]=4 1283 B10R1.16 CCSCC1CNC(=O)C1 Amb25744015 [1,0,0,1,0,0|2,0,0]=4 1284 B10R1.16 CNCCC1CNC(=O)C1 Amb27638975 [1,0,0,1,0,0|2,0,0]=4 1285 B10R1.16 COCCC1CNC(=O)C1 Amb27841463 [1,0,0,1,0,0|2,0,0]=4 1286 B10R1.16 COCO[C@@H]1C=CC(=O)C1 Amb28381134 [1,0,0,1,0,0|2,0,0]=4 1287 B10R1.16 CSCCC1CNC(=O)C1 Amb27626421 [1,0,0,1,0,0|2,0,0]=4 1288 B10R1.16 NCCCC1CNC(=O)C1 Amb27848618 [1,0,0,1,0,0|2,0,0]=4 1289 B10R1.16 O=C1C=C[C@H](CCCO)O1 Amb27171273 [1,0,0,1,0,0|2,0,0]=4 1290 B10R1.16 O=C1CCC(CCCBr)C1 Amb27768574 [1,0,0,1,0,0|1,0,1]=4 1291 B10R1.18 CC(=N)NC1CCCCC1 Amb24383066 [1,0,0,1,0,0|2,0,0]=4 1292 B10R1.18 CC(=O)C=C1CCCCC1 Amb27974960 [1,0,0,1,0,0|0,0,0]=2 1293 B10R1.18 CC(=O)C=C1CCSCC1 Amb27652034 [1,0,0,1,0,0|1,0,0]=3 1294 B10R1.18 CC(=O)CC1=CCCCC1 Amb27392965 [1,0,0,1,0,0|0,0,2]=4 1295 B10R1.18 CC(=O)CC1CCCCC1 Amb4034580 [1,0,0,1,0,0|0,0,1]=3 1296 B10R1.18 CC(=O)CC1CCCCN1 Amb10607341 [1,0,0,1,0,0|1,0,1]=4 1297 B10R1.18 CC(=O)CC1CCCCO1 Amb25298544 [1,0,0,1,0,0|1,0,1]=4 1298 B10R1.18 CC(=O)CC1CCCNC1 Amb26047010 [1,0,0,1,0,0|1,0,1]=4 1299 B10R1.18 CC(=O)CC1CCCOC1 Amb26842438 [1,0,0,1,0,0|1,0,1]=4 1300 B10R1.18 CC(=O)CC1CCCSC1 Amb32726331 [1,0,0,1,0,0|1,0,1]=4 1301 B10R1.18 CC(=O)CC1CCNCC1 Amb22227662 [1,0,0,1,0,0|1,0,1]=4 1302 B10R1.18 CC(=O)CC1CCNCC1 Amb27395398 [1,0,0,1,0,0|1,0,1]=4 1303 B10R1.18 CC(=O)CC1CCOCC1 Amb19374940 [1,0,0,1,0,0|1,0,1]=4 1304 B10R1.18 CC(=O)CN1CCCCC1 Amb8427989 [1,0,0,1,0,0|1,0,1]=4 1305 B10R1.18 CC(=O)C[C@H]1CCCCN1 Amb27807842 [1,0,0,1,0,0|1,0,1]=4 1306 B10R1.18 CC(=O)NC1=CCCCC1 Amb28126799 [1,0,0,1,0,0|1,0,1]=4 1307 B10R1.18 CC(=O)NC1CCCCC1 Amb2237063 [1,0,0,1,0,0|1,0,0]=3 1308 B10R1.18 CC(=O)NC1CCCNC1 Amb9713130 [1,0,0,1,0,0|2,0,0]=4 1309 B10R1.18 CC(=O)NC1CCCSC1 Amb27614944 [1,0,0,1,0,0|2,0,0]=4 1310 B10R1.18 CC(=O)NC1CCNCC1 Amb1138685 [1,0,0,1,0,0|2,0,0]=4 1311 B10R1.18 CC(=O)NC1CCNCC1 Amb13951609 [1,0,0,1,0,0|2,0,0]=4 1312 B10R1.18 CC(=O)NC1CCOCC1 Amb22584264 [1,0,0,1,0,0|2,0,0]=4 1313 B10R1.18 CC(=O)NN1CCCCC1 Amb2125333 [1,0,0,1,0,0|2,0,0]=4 1314 B10R1.18 CC(=O)N[C@@H]1CCCNC1 Amb22225406 [1,0,0,1,0,0|2,0,0]=4 1315 B10R1.18 CC(=O)N[C@@H]1CCCOC1 Amb27809926 [1,0,0,1,0,0|2,0,0]=4 1316 B10R1.18 CC(=O)N[C@H]1CCCCO1 Amb28141339 [1,0,0,1,0,0|2,0,0]=4 1317 B10R1.18 CC(=O)N[C@H]1CCCNC1 Amb19892549 [1,0,0,1,0,0|2,0,0]=4 1318 B10R1.18 CC(=O)N[C@H]1CCCNC1 Amb22226767 [1,0,0,1,0,0|2,0,0]=4 1319 B10R1.18 CC(=O)OC1=CCCCC1 Amb9677480 [1,0,0,1,0,0|1,0,1]=4 1320 B10R1.18 CC(=O)OC1CCCCS1 Amb17607385 [1,0,0,1,0,0|2,0,0]=4 1321 B10R1.18 CC(=O)OC1CCCNC1 Amb21956163 [1,0,0,1,0,0|2,0,0]=4 1322 B10R1.18 CC(=O)OC1CCCNC1 Amb22011794 [1,0,0,1,0,0|2,0,0]=4 1323 B10R1.18 CC(=O)OC1CCNCC1 Amb18644008 [1,0,0,1,0,0|2,0,0]=4 1324 B10R1.18 CC(=O)OC1CCNCC1 Amb21856811 [1,0,0,1,0,0|2,0,0]=4 1325 B10R1.18 CC(=O)OC1CCSCC1 Amb28050264 [1,0,0,1,0,0|2,0,0]=4 1326 B10R1.18 CC(=O)O[C@@H]1CCCNC1 Amb27196231 [1,0,0,1,0,0|2,0,0]=4 1327 B10R1.18 CC(=O)O[C@H]1CCCNC1 Amb28050160 [1,0,0,1,0,0|2,0,0]=4 1328 B10R1.18 CC(=O)SC1CCNCC1 Amb24117885 [1,0,0,1,0,0|2,0,0]=4 1329 B10R1.18 CC(=O)\C=C1/C=CCCC1 Amb27209037 [1,0,0,1,0,0|0,0,2]=4 1330 B10R1.18 CC(=O)\C=C1\CCCCN1 Amb24591348 [1,0,0,1,0,0|1,0,0]=3 1331 B10R1.18 CC(C)=CC1CCNCC1 Amb25682532 [1,0,0,1,0,0|2,0,0]=4 1332 B10R1.18 CC(C)=CN1CCCCC1 Amb4017521 [1,0,0,1,0,0|2,0,0]=4 1333 B10R1.18 CC(C)C=C1CCCCC1 Amb32988220 [1,0,0,1,0,0|1,0,1]=4 1334 B10R1.18 CC(O)C=C1CCCCC1 Amb28043220 [1,0,0,1,0,0|0,0,2]=4 1335 B10R1.18 CS(=O)CC1CCCCC1 Amb28197111 [1,0,0,1,0,0|1,0,1]=4 1336 B10R1.18 CS(=O)N=C1CCCCC1 Amb35681702 [1,0,0,1,0,0|2,0,0]=4 1337 B10R1.18 CS(=O)NC1CCCCC1 Amb28200792 [1,0,0,1,0,0|2,0,0]=4 1338 B10R1.18 C[C@H](O)C=C1CCCCC1 Amb27829700 [1,0,0,1,0,0|0,0,2]=4 1339 B10R1.18 C\C(Br)=C/C1CCCCC1 Amb28326007 [1,0,0,1,0,0|1,0,0]=3 1340 B10R1.18 NC(=O)C=C1CCCCC1 Amb24725376 [1,0,0,1,0,0|1,0,0]=3 1341 B10R1.18 NC(=O)C=C1CCNCC1 Amb27625168 [1,0,0,1,0,0|2,0,0]=4 1342 B10R1.18 NC(=O)C=C1CCOCC1 Amb28348699 [1,0,0,1,0,0|2,0,0]=4 1343 B10R1.18 NC(=O)CC1CCCCC1 Amb33551594 [1,0,0,1,0,0|1,0,1]=4 1344 B10R1.18 NC(=O)NC1CCCCC1 Amb1151266 [1,0,0,1,0,0|2,0,0]=4 1345 B10R1.18 NC(=O)OC1CCCCC1 Amb4012086 [1,0,0,1,0,0|2,0,0]=4 1346 B10R1.18 NC(=O)SC1CCCCC1 Amb27607116 [1,0,0,1,0,0|2,0,0]=4 1347 B10R1.18 O=C(Cl)CC1CCCCC1 Amb33528414 [1,0,0,1,0,0|1,0,1]=4 1348 B10R1.18 O=C(Cl)NC1CCCCC1 Amb26068583 [1,0,0,1,0,0|2,0,0]=4 1349 B10R1.18 O=C(Cl)OC1CCCCC1 Amb8390640 [1,0,0,1,0,0|2,0,0]=4 1350 B10R1.18 O=C(Cl)SC1CCCCC1 Amb32679652 [1,0,0,1,0,0|2,0,0]=4 1351 B10R1.18 O=C(F)NC1CCCCC1 Amb27242067 [1,0,0,1,0,0|2,0,0]=4 1352 B10R1.18 O=C(O)C=C1CCCCC1 Amb2429191 [1,0,0,1,0,0|1,0,0]=3 1353 B10R1.18 O=C(O)C=C1CCNCC1 Amb18560139 [1,0,0,1,0,0|2,0,0]=4 1354 B10R1.18 O=C(O)C=C1CCOCC1 Amb2700184 [1,0,0,1,0,0|2,0,0]=4 1355 B10R1.18 O=C(O)C=C1CCSCC1 Amb26480822 [1,0,0,1,0,0|2,0,0]=4 1356 B10R1.18 O=C(O)CC1CCCCC1 Amb3939015 [1,0,0,1,0,0|1,0,1]=4 1357 B10R1.18 O=C(O)NC1CCCCC1 Amb22039352 [1,0,0,1,0,0|2,0,0]=4 1358 B10R1.18 O=C(O)\C=C1\CCCOC1 Amb27828465 [1,0,0,1,0,0|2,0,0]=4 1359 B10R1.18 O=C(O)\C=C1\CCCSC1 Amb18948509 [1,0,0,1,0,0|2,0,0]=4 1360 B10R1.24 O=C1CC(CCCCO)O1 Amb28079077 [1,0,0,1,0,0|2,0,0]=4 1361 B10R1.39 C=CC1CCC=C1C(C)=O Amb26998410 [1,0,0,1,0,0|0,0,2]=4 1362 B10R1.39 CC(=O)C1CCCC1CCl Amb28251128 [1,0,0,1,0,0|1,0,1]=4 1363 B10R1.39 CC(=O)C1CCCC1CN Amb25169358 [1,0,0,1,0,0|1,0,1]=4 1364 B10R1.39 CC(=O)N1CCCC1CBr Amb21861144 [1,0,0,1,0,0|2,0,0]=4 1365 B10R1.39 CC(=O)N1CCCC1CCl Amb21861142 [1,0,0,1,0,0|2,0,0]=4 1366 B10R1.39 CC(=O)N1CCCC1CN Amb18251238 [1,0,0,1,0,0|2,0,0]=4 1367 B10R1.39 CC(=O)N1CCCC1CN Amb20622612 [1,0,0,1,0,0|2,0,0]=4 1368 B10R1.39 CC(=O)N1CCCC1CO Amb17102424 [1,0,0,1,0,0|2,0,0]=4 1369 B10R1.39 CC(=O)N1CCC[C@@H]1CBr Amb18027506 [1,0,0,1,0,0|2,0,0]=4 1370 B10R1.39 CC(=O)N1CCC[C@@H]1CCl Amb18533760 [1,0,0,1,0,0|2,0,0]=4 1371 B10R1.39 CC(=O)N1CCC[C@@H]1CN Amb18016514 [1,0,0,1,0,0|2,0,0]=4 1372 B10R1.39 CC(=O)N1CCC[C@@H]1CO Amb27843306 [1,0,0,1,0,0|2,0,0]=4 1373 B10R1.39 CC(=O)N1CCC[C@H]1CBr Amb17103861 [1,0,0,1,0,0|2,0,0]=4 1374 B10R1.39 CC(=O)N1CCC[C@H]1CCl Amb17103489 [1,0,0,1,0,0|2,0,0]=4 1375 B10R1.39 CC(=O)N1CCC[C@H]1CI Amb22227517 [1,0,0,1,0,0|2,0,0]=4 1376 B10R1.39 CC(=O)N1CCC[C@H]1CN Amb17046511 [1,0,0,1,0,0|2,0,0]=4 1377 B10R1.39 CC(=O)N1CCC[C@H]1CO Amb22227516 [1,0,0,1,0,0|2,0,0]=4 1378 B10R1.39 CC(=O)[C@@H]1CCC[C@@H]1CN Amb27243633 [1,0,0,1,0,0|1,0,1]=4 1379 B10R1.39 CCC1=C(C(=O)O)CCC1 Amb29864676 [1,0,0,1,0,0|1,0,1]=4 1380 B10R1.39 CCC1=C(C(C)=O)COC1 Amb25373168 [1,0,0,1,0,0|1,0,1]=4 1381 B10R1.39 CCC1CCC=C1C(=O)O Amb27788569 [1,0,0,1,0,0|1,0,0]=3 1382 B10R1.39 CCC1CCCC1C(=O)O Amb18643940 [1,0,0,1,0,0|1,0,1]=4 1383 B10R1.39 CCC1CCCN1C(=O)Cl Amb26053464 [1,0,0,1,0,0|2,0,0]=4 1384 B10R1.39 CCC1COCC1C(C)=O Amb29882928 [1,0,0,1,0,0|1,0,1]=4 1385 B10R1.39 CCC1NCCC1C(C)=O Amb33131417 [1,0,0,1,0,0|1,0,1]=4 1386 B10R1.39 CCC1OCCC1C(C)=O Amb27170224 [1,0,0,1,0,0|1,0,1]=4 1387 B10R1.39 CCC1SCCN1C(C)=O Amb27837962 [1,0,0,1,0,0|2,0,0]=4 1388 B10R1.39 CCN1CCCC1C(C)=O Amb27617177 [1,0,0,1,0,0|1,0,1]=4 1389 B10R1.39 CC[C@@H]1SCCN1C(C)=O Amb27859958 [1,0,0,1,0,0|2,0,0]=4 1390 B10R1.39 CC[C@H]1CCC[C@@H]1C(N)=O Amb27786258 [1,0,0,1,0,0|1,0,1]=4 1391 B10R1.39 COC1CCCN1C(C)=O Amb27811858 [1,0,0,1,0,0|2,0,0]=4 1392 B10R1.61 CC(=O)C1=C(C)CCCN1 Amb26968313 [1,0,0,1,0,0|1,0,1]=4 1393 B10R1.61 CC(=O)C1=C(C)CCNC1 Amb26321966 [1,0,0,1,0,0|1,0,1]=4 1394 B10R1.61 CC(=O)C1=C(C)NCCC1 Amb26857622 [1,0,0,1,0,0|1,0,1]=4 1395 B10R1.61 CC(=O)C1=C(C)SCCC1 Amb27424854 [1,0,0,1,0,0|1,0,1]=4 1396 B10R1.61 CC(=O)C1=C(Cl)CCCC1 Amb27410834 [1,0,0,1,0,0|1,0,1]=4 1397 B10R1.61 CC(=O)C1=C(N)CCCC1 Amb22893525 [1,0,0,1,0,0|1,0,1]=4 1398 B10R1.61 CC(=O)C1=C(S)CCCC1 Amb27267186 [1,0,0,1,0,0|1,0,1]=4 1399 B10R1.61 CC(=O)C1=CCCCC1=O Amb17593495 [1,0,0,1,0,0|1,0,1]=4 1400 B10R1.61 CC(=O)C1=CCCCC1C Amb24480506 [1,0,0,1,0,0|0,0,0]=2 1401 B10R1.61 CC(=O)C1=CCCCC1O Amb27425119 [1,0,0,1,0,0|1,0,0]=3 1402 B10R1.61 CC(=O)C1=CCCC[C@H]1O Amb27255579 [1,0,0,1,0,0|1,0,0]=3 1403 B10R1.61 CC(=O)C1=NCCCC1C Amb26972106 [1,0,0,1,0,0|1,0,0]=3 1404 B10R1.61 CC(=O)C1CCCCC1Br Amb25926848 [1,0,0,1,0,0|1,0,1]=4 1405 B10R1.61 CC(=O)C1CCCCC1C Amb26021911 [1,0,0,1,0,0|0,0,1]=3 1406 B10R1.61 CC(=O)C1CCCCC1F Amb27755308 [1,0,0,1,0,0|1,0,1]=4 1407 B10R1.61 CC(=O)C1CCCCC1N Amb18124599 [1,0,0,1,0,0|1,0,1]=4 1408 B10R1.61 CC(=O)C1CCCCC1N Amb33447090 [1,0,0,1,0,0|1,0,1]=4 1409 B10R1.61 CC(=O)C1CCCCC1O Amb25735279 [1,0,0,1,0,0|1,0,1]=4 1410 B10R1.61 CC(=O)C1CCCCN1C Amb25763077 [1,0,0,1,0,0|1,0,1]=4 1411 B10R1.61 CC(=O)C1CCCNC1C Amb26040936 [1,0,0,1,0,0|1,0,1]=4 1412 B10R1.61 CC(=O)C1CCNCC1C Amb26849111 [1,0,0,1,0,0|1,0,1]=4 1413 B10R1.61 CC(=O)C1CCOCC1C Amb28041252 [1,0,0,1,0,0|1,0,1]=4 1414 B10R1.61 CC(=O)C1CNCCC1C Amb30007896 [1,0,0,1,0,0|1,0,1]=4 1415 B10R1.61 CC(=O)C1NCCCC1C Amb32410373 [1,0,0,1,0,0|1,0,1]=4 1416 B10R1.61 CC(=O)N1CCNCC1C Amb18278177 [1,0,0,1,0,0|2,0,0]=4 1417 B10R1.61 CC(=O)N1CCNC[C@H]1C Amb27780517 [1,0,0,1,0,0|2,0,0]=4 1418 B10R1.61 CC(=O)N1CCOCC1C Amb26456170 [1,0,0,1,0,0|2,0,0]=4 1419 B10R1.61 CC(=O)N1CCOC[C@@H]1C Amb28184783 [1,0,0,1,0,0|2,0,0]=4 1420 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1C Amb28131403 [1,0,0,1,0,0|0,0,1]=3 1421 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1N Amb33307705 [1,0,0,1,0,0|1,0,1]=4 1422 B10R1.61 CC(=O)[C@@H]1CCCC[C@H]1C Amb25948878 [1,0,0,1,0,0|0,0,1]=3 1423 B10R1.61 CC(=O)[C@@H]1CCCC[C@H]1O Amb26451216 [1,0,0,1,0,0|1,0,1]=4 1424 B10R1.61 CC(=O)[C@H]1CCCC[C@@H]1C Amb28052336 [1,0,0,1,0,0|0,0,1]=3 1425 B10R1.61 CC(=O)[C@H]1CCCC[C@@H]1O Amb28196697 [1,0,0,1,0,0|1,0,1]=4 1426 B10R1.61 CC(=O)[C@H]1CCCN[C@H]1C Amb33307649 [1,0,0,1,0,0|1,0,1]=4 1427 B10R1.61 CC(C)=C1CCNCC1C Amb28194470 [1,0,0,1,0,0|2,0,0]=4 1428 B10R1.61 CC1=C(C(=O)O)CCCC1 Amb18643592 [1,0,0,1,0,0|1,0,1]=4 1429 B10R1.61 CC1CCCC=C1C(=O)O Amb22407010 [1,0,0,1,0,0|1,0,0]=3 1430 B10R1.61 CC1CCCCC1C(=O)Br Amb27635544 [1,0,0,1,0,0|1,0,1]=4 1431 B10R1.61 CC1CCCCC1C(=O)O Amb1923858 [1,0,0,1,0,0|1,0,1]=4 1432 B10R1.61 CC1CCCCC1C(N)=O Amb4035366 [1,0,0,1,0,0|1,0,1]=4 1433 B10R1.61 CC1CCCCN1C(=O)Cl Amb17563085 [1,0,0,1,0,0|2,0,0]=4 1434 B10R1.61 C[C@@H]1CCCC=C1C(=O)Cl Amb27617097 [1,0,0,1,0,0|1,0,0]=3 1435 B10R1.61 C[C@@H]1CCCCN1C(=O)Cl Amb25349193 [1,0,0,1,0,0|2,0,0]=4 1436 B10R1.61 C[C@@H]1CCCC[C@H]1C(=O)O Amb10843965 [1,0,0,1,0,0|1,0,1]=4 1437 B10R1.61 C\C(Cl)=C1\CCCCC1Cl Amb28193710 [1,0,0,1,0,0|2,0,0]=4 1438 B10R1.61 O=C(O)C1=CCCCC1O Amb27792988 [1,0,0,1,0,0|2,0,0]=4 1439 B10R1.64 CC(=O)CC1CCCC1C Amb24480371 [1,0,0,1,0,0|0,0,1]=3 1440 B10R1.64 CC(=O)CC1CCCC1N Amb33130291 [1,0,0,1,0,0|1,0,1]=4 1441 B10R1.64 CC(=O)CC1CCCC1O Amb27171126 [1,0,0,1,0,0|1,0,1]=4 1442 B10R1.64 CC(=O)CC1CCCN1C Amb27259135 [1,0,0,1,0,0|1,0,1]=4 1443 B10R1.64 CC(=O)CC1CCOC1C Amb33427952 [1,0,0,1,0,0|1,0,1]=4 1444 B10R1.64 CC(=O)CC1CNCC1C Amb33132731 [1,0,0,1,0,0|1,0,1]=4 1445 B10R1.64 CC(=O)CC1OCCC1C Amb24722883 [1,0,0,1,0,0|1,0,1]=4 1446 B10R1.64 CC(=O)CN1CCCC1C Amb22292307 [1,0,0,1,0,0|1,0,1]=4 1447 B10R1.64 CC(=O)C[C@@H]1CCCN1C Amb19132763 [1,0,0,1,0,0|1,0,1]=4 1448 B10R1.64 CC(=O)C[C@@H]1CCC[C@H]1C Amb27768009 [1,0,0,1,0,0|0,0,1]=3 1449 B10R1.64 CC(=O)C[C@@H]1CCC[C@H]1N Amb33308036 [1,0,0,1,0,0|1,0,1]=4 1450 B10R1.64 CC(=O)C[C@@H]1CNC[C@H]1C Amb33132736 [1,0,0,1,0,0|1,0,1]=4 1451 B10R1.64 CC(=O)C[C@H]1CCCN1C Amb17615973 [1,0,0,1,0,0|1,0,1]=4 1452 B10R1.64 CC(=O)C[C@H]1COC[C@@H]1C Amb27844184 [1,0,0,1,0,0|1,0,1]=4 1453 B10R1.64 CC(=O)C[C@H]1OCC[C@@H]1C Amb27201954 [1,0,0,1,0,0|1,0,1]=4 1454 B10R1.64 CC(=O)NC1=C(C)CCC1 Amb28384906 [1,0,0,1,0,0|1,0,1]=4 1455 B10R1.64 CC(=O)NC1CCCC1Cl Amb27480291 [1,0,0,1,0,0|2,0,0]=4 1456 B10R1.64 CC(=O)NC1CCCC1O Amb27638264 [1,0,0,1,0,0|2,0,0]=4 1457 B10R1.64 CC(=O)NC1CNCC1C Amb18643958 [1,0,0,1,0,0|2,0,0]=4 1458 B10R1.64 CC(=O)NC1COCC1C Amb32697723 [1,0,0,1,0,0|2,0,0]=4 1459 B10R1.64 CC(=O)NC1CSCC1C Amb28126279 [1,0,0,1,0,0|2,0,0]=4 1460 B10R1.64 CC(=O)NN1CCCC1C Amb27480539 [1,0,0,1,0,0|2,0,0]=4 1461 B10R1.64 CC(=O)N[C@@H]1CCC[C@H]1O Amb28368826 [1,0,0,1,0,0|2,0,0]=4 1462 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O Amb27801087 [1,0,0,1,0,0|2,0,0]=4 1463 B10R1.64 CC(=O)OC1CCCC1Cl Amb27597361 [1,0,0,1,0,0|2,0,0]=4 1464 B10R1.64 CC(=O)OC1CCCC1O Amb25233512 [1,0,0,1,0,0|2,0,0]=4 1465 B10R1.64 CC(=O)O[C@@H]1CCC[C@H]1O Amb22363055 [1,0,0,1,0,0|2,0,0]=4 1466 B10R1.64 CC(=O)SC1CCCC1O Amb17594010 [1,0,0,1,0,0|2,0,0]=4 1467 B10R1.64 CC(=O)\C=C1/CCCN1C Amb25146900 [1,0,0,1,0,0|1,0,0]=3 1468 B10R1.64 CC(=O)\C=C1/COCC1C Amb35616355 [1,0,0,1,0,0|1,0,0]=3 1469 B10R1.64 CC(=O)\C=C1/NCCN1C Amb27768613 [1,0,0,1,0,0|2,0,0]=4 1470 B10R1.64 CC(=O)\C=C1/SCCN1C Amb27854895 [1,0,0,1,0,0|2,0,0]=4 1471 B10R1.64 CC(=O)\C=C1\CCCC1O Amb28246591 [1,0,0,1,0,0|1,0,0]=3 1472 B10R1.64 CC(C)=CC1CCCC1O Amb25048584 [1,0,0,1,0,0|2,0,0]=4 1473 B10R1.64 CC(C)=C[C@@H]1CCC[C@H]1O Amb32945224 [1,0,0,1,0,0|2,0,0]=4 1474 B10R1.64 CC(C)=C[C@H]1CCC[C@@H]1O Amb28430123 [1,0,0,1,0,0|2,0,0]=4 1475 B10R1.64 CC(O)\C=C1\CCCC1C Amb27834361 [1,0,0,1,0,0|0,0,2]=4 1476 B10R1.64 CC1CCCC1CC(=O)O Amb2696312 [1,0,0,1,0,0|1,0,1]=4 1477 B10R1.64 CC1CCCC1CC(N)=O Amb27828187 [1,0,0,1,0,0|1,0,1]=4 1478 B10R1.64 CC1CCCC1NC(=O)Cl Amb35625932 [1,0,0,1,0,0|2,0,0]=4 1479 B10R1.64 CC1CCC\C1=C/C(=O)O Amb20622694 [1,0,0,1,0,0|1,0,0]=3 1480 B10R1.64 CC1CCC\C1=N/S(C)=O Amb35692874 [1,0,0,1,0,0|2,0,0]=4 1481 B10R1.64 CC1COC\C1=C/C(=O)O Amb35647041 [1,0,0,1,0,0|2,0,0]=4 1482 B10R1.64 CC1CSC\C1=C/C(=O)O Amb27477097 [1,0,0,1,0,0|2,0,0]=4 1483 B10R1.64 CC1OCC\C1=C/C(=O)O Amb25793839 [1,0,0,1,0,0|2,0,0]=4 1484 B10R1.64 CC1SCC\C1=C\C(=O)O Amb33468656 [1,0,0,1,0,0|2,0,0]=4 1485 B10R1.64 NC1CCC\C1=C/C(=O)O Amb27630675 [1,0,0,1,0,0|2,0,0]=4 1486 B10R1.66 CC(=O)C#CC1CCCC1 Amb24383777 [1,0,0,1,0,0|0,0,2]=4 1487 B10R1.66 CC(=O)CCC1CCCC1 Amb19374837 [1,0,0,1,0,0|0,0,1]=3 1488 B10R1.66 CC(=O)CCC1CCCN1 Amb24363350 [1,0,0,1,0,0|1,0,1]=4 1489 B10R1.66 CC(=O)CCC1CCCO1 Amb4056391 [1,0,0,1,0,0|1,0,1]=4 1490 B10R1.66 CC(=O)CCC1CCCS1 Amb33416798 [1,0,0,1,0,0|1,0,1]=4 1491 B10R1.66 CC(=O)CCC1CCNC1 Amb28050353 [1,0,0,1,0,0|1,0,1]=4 1492 B10R1.66 CC(=O)CCC1CCOC1 Amb25271586 [1,0,0,1,0,0|1,0,1]=4 1493 B10R1.66 CC(=O)CCC1CCSC1 Amb33141522 [1,0,0,1,0,0|1,0,1]=4 1494 B10R1.66 CC(=O)CCN1CCCC1 Amb1127641 [1,0,0,1,0,0|1,0,1]=4 1495 B10R1.66 CC(=O)CNC1CCCC1 Amb25291662 [1,0,0,1,0,0|1,0,1]=4 1496 B10R1.66 CC(=O)NCC1CCCS1 Amb27654747 [1,0,0,1,0,0|2,0,0]=4 1497 B10R1.66 CC(=O)NCC1CCNC1 Amb21861238 [1,0,0,1,0,0|2,0,0]=4 1498 B10R1.66 CC(=O)NCC1CCNC1 Amb29752226 [1,0,0,1,0,0|2,0,0]=4 1499 B10R1.66 CC(=O)NCC1CCNC1 Amb32664244 [1,0,0,1,0,0|2,0,0]=4 1500 B10R1.66 CC(=O)NCC1CCSC1 Amb27191983 [1,0,0,1,0,0|2,0,0]=4 1501 B10R1.66 CC(=O)NC[C@@H]1CCCN1 Amb22274353 [1,0,0,1,0,0|2,0,0]=4 1502 B10R1.66 CC(=O)NC[C@@H]1CCNC1 Amb27488695 [1,0,0,1,0,0|2,0,0]=4 1503 B10R1.66 CC(=O)NC[C@H]1CCCN1 Amb27405723 [1,0,0,1,0,0|2,0,0]=4 1504 B10R1.66 CC(=O)NC[C@H]1CCNC1 Amb24624104 [1,0,0,1,0,0|2,0,0]=4 1505 B10R1.66 CC(=O)NNC1CCCC1 Amb27165281 [1,0,0,1,0,0|2,0,0]=4 1506 B10R1.66 CC(=O)OCC1CCCC1 Amb27856070 [1,0,0,1,0,0|1,0,0]=3 1507 B10R1.66 CC(=O)OC[C@@H]1CCCO1 Amb27809975 [1,0,0,1,0,0|2,0,0]=4 1508 B10R1.66 CC(=O)SCC1CCCC1 Amb25169354 [1,0,0,1,0,0|1,0,0]=3 1509 B10R1.66 CC(=O)SC[C@@H]1CCCN1 Amb24120346 [1,0,0,1,0,0|2,0,0]=4 1510 B10R1.66 CC(=O)\C=C/N1CCCC1 Amb27617656 [1,0,0,1,0,0|1,0,0]=3 1511 B10R1.66 CC(=O)\C=C\C1=CCCC1 Amb25209541 [1,0,0,1,0,0|0,0,2]=4 1512 B10R1.66 CC(=O)\C=C\C1CCCC1 Amb33359527 [1,0,0,1,0,0|0,0,0]=2 1513 B10R1.66 CC(=O)\C=C\C1CCCO1 Amb25887982 [1,0,0,1,0,0|1,0,0]=3 1514 B10R1.66 CC(=O)\C=C\C1CCCS1 Amb33415401 [1,0,0,1,0,0|1,0,0]=3 1515 B10R1.66 CC(=O)\C=C\C1CCOC1 Amb22264587 [1,0,0,1,0,0|1,0,0]=3 1516 B10R1.66 CC(=O)\C=C\C1CCSC1 Amb33359190 [1,0,0,1,0,0|1,0,0]=3 1517 B10R1.66 CC(Br)\C=C\C1CCCC1 Amb27473003 [1,0,0,1,0,0|1,0,1]=4 1518 B10R1.66 CC(C)=CCC1CCNC1 Amb27265395 [1,0,0,1,0,0|2,0,0]=4 1519 B10R1.66 CC(N)\C=C\C1CCCC1 Amb33448394 [1,0,0,1,0,0|1,0,1]=4 1520 B10R1.66 CN(C)\C=C\C1CCCC1 Amb25101861 [1,0,0,1,0,0|2,0,0]=4 1521 B10R1.66 CS(=O)\N=C\C1CCCC1 Amb35693120 [1,0,0,1,0,0|2,0,0]=4 1522 B10R1.66 NC(=O)CCC1CCCC1 Amb3742782 [1,0,0,1,0,0|1,0,1]=4 1523 B10R1.66 NC(=O)\C=C\C1CCCC1 Amb25975142 [1,0,0,1,0,0|1,0,0]=3 1524 B10R1.66 NC(=O)\C=C\N1CCCC1 Amb27420138 [1,0,0,1,0,0|2,0,0]=4 1525 B10R1.66 O=C(Cl)CCC1CCCC1 Amb3939147 [1,0,0,1,0,0|1,0,1]=4 1526 B10R1.66 O=C(Cl)NCC1CCCC1 Amb35625671 [1,0,0,1,0,0|2,0,0]=4 1527 B10R1.66 O=C(Cl)OCC1CCCC1 Amb27652154 [1,0,0,1,0,0|2,0,0]=4 1528 B10R1.66 O=C(Cl)\C=C\C1CCCC1 Amb26437917 [1,0,0,1,0,0|1,0,0]=3 1529 B10R1.66 O=C(O)CCC1CCCC1 Amb2792875 [1,0,0,1,0,0|1,0,1]=4 1530 B10R1.66 O=C(O)\C=C/C1CCCC1 Amb28072852 [1,0,0,1,0,0|1,0,0]=3 1531 B10R1.66 O=C(O)\C=C\C1CCCC1 Amb18285121 [1,0,0,1,0,0|1,0,0]=3 1532 B10R1.66 O=C(O)\C=C\C1CCCO1 Amb25330231 [1,0,0,1,0,0|2,0,0]=4 1533 B10R1.66 O=C(O)\C=C\C1CCCS1 Amb33416187 [1,0,0,1,0,0|2,0,0]=4 1534 B10R1.66 O=C(O)\C=C\C1CCOC1 Amb33529972 [1,0,0,1,0,0|2,0,0]=4 1535 B10R1.66 O=C(O)\C=C\C1CCSC1 Amb25890464 [1,0,0,1,0,0|2,0,0]=4 1536 B10R1.66 O=C(O)\C=C\N1CCCC1 Amb27837839 [1,0,0,1,0,0|2,0,0]=4 1537 B10R1.66 O=[N+]([O-])\C=C\C1CCCC1 Amb4015080 [1,0,0,1,0,0|2,0,0]=4 1538 B10R1.73 CC1CC1CCCC(=O)O Amb25921322 [1,0,0,1,0,0|1,0,1]=4 1539 B10R1.73 C[C@@H]1C[C@@H]1CCCC(=O)O Amb27494069 [1,0,0,1,0,0|1,0,1]=4 1540 B10R1.78 BrC1C=CCCCCCC1 Amb24638769 [1,0,0,1,0,0|1,0,1]=4 1541 B10R1.78 O=C1C#CCCCCCC1 Amb27409529 [1,0,0,1,0,0|0,0,2]=4 1542 B10R1.78 O=C1C=C=CCCCCC1 Amb28253726 [1,0,0,1,0,0|0,0,2]=4 1543 B10R1.78 O=C1C=CC=CCCCC1 Amb22342438 [1,0,0,1,0,0|0,0,2]=4 1544 B10R1.78 O=C1C=CCCCCCC1 Amb22363956 [1,0,0,1,0,0|0,0,0]=2 1545 B10R1.78 O=C1CCCCCCCC1 Amb16185450 [1,0,0,1,0,0|0,0,1]=3 1546 B10R1.78 O=C1CCCCCCCN1 Amb8513494 [1,0,0,1,0,0|1,0,0]=3 1547 B10R1.78 O=C1CCCCOCCN1 Amb27201667 [1,0,0,1,0,0|2,0,0]=4 1548 B10R1.78 O=C1CCCCSCCC1 Amb28144124 [1,0,0,1,0,0|1,0,1]=4 1549 B10R1.86 CCCC1CCN1C(N)=O Amb27223621 [1,0,0,1,0,0|2,0,0]=4 1550 B10R1.86 CNCC1CCN1C(C)=O Amb27778316 [1,0,0,1,0,0|2,0,0]=4 1551 B10R1.97 CCCC1CC1NC(=O)Cl Amb35633481 [1,0,0,1,0,0|2,0,0]=4 1552 B10R1.117 CC(=O)OC[C@H]1CC[C@H]1O Amb27465735 [1,0,0,1,0,0|2,0,0]=4 1553 B10R1.126 CC(=O)CCNCC1CC1 Amb33307828 [1,0,0,1,0,0|1,0,1]=4 1554 B10R1.126 CC(=O)CSCCC1CC1 Amb27650340 [1,0,0,1,0,0|1,0,1]=4 1555 B10R1.126 CC(=O)NCCCC1CC1 Amb28060659 [1,0,0,1,0,0|1,0,0]=3 1556 B10R1.126 CC(=O)NOCCC1CC1 Amb28345253 [1,0,0,1,0,0|2,0,0]=4 1557 B10R1.126 CC(=O)SCCCC1CC1 Amb32680259 [1,0,0,1,0,0|1,0,0]=3 1558 B10R1.126 CC(C)=CCCNC1CC1 Amb19025216 [1,0,0,1,0,0|2,0,0]=4 1559 B10R1.126 O=C(O)CCCCC1CC1 Amb24480443 [1,0,0,1,0,0|1,0,1]=4 1560 B10R1.127 CC(=O)CCCC1COC1 Amb27866248 [1,0,0,1,0,0|1,0,1]=4 1561 B10R1.127 CC(=O)CCCN1CCC1 Amb27663262 [1,0,0,1,0,0|1,0,1]=4 1562 B10R1.127 CC(=O)CCNC1CCC1 Amb32675825 [1,0,0,1,0,0|1,0,1]=4 1563 B10R1.127 CC(=O)CSCC1CCC1 Amb27753589 [1,0,0,1,0,0|1,0,1]=4 1564 B10R1.127 CC(=O)OCCC1CCC1 Amb27981998 [1,0,0,1,0,0|1,0,0]=3 1565 B10R1.127 CC(C)=CCCC1CCC1 Amb35582947 [1,0,0,1,0,0|1,0,0]=3 1566 B10R1.127 CC(C)=CCCC1CNC1 Amb35588090 [1,0,0,1,0,0|2,0,0]=4 1567 B10R1.127 O=C(Cl)NCCC1CCC1 Amb35633269 [1,0,0,1,0,0|2,0,0]=4 1568 B10R1.127 O=C(O)CCCC1CCC1 Amb26345789 [1,0,0,1,0,0|1,0,1]=4 1569 B10R1.144 CCCCC1CC1C(=O)O Amb10608641 [1,0,0,1,0,0|1,0,1]=4 1570 B10R1.144 CCCCC1OC1C(C)=O Amb27750786 [1,0,0,1,0,0|1,0,1]=4 1571 B10R1.144 CCCC[C@@H]1C[C@@H]1C(C)=O Amb27619227 [1,0,0,1,0,0|0,0,1]=3 1572 B10R1.144 CCCC[C@@H]1C[C@H]1C(=O)O Amb25960764 [1,0,0,1,0,0|1,0,1]=4 1573 B10R1.144 CCCC[C@@H]1O[C@H]1C(C)=O Amb28244724 [1,0,0,1,0,0|1,0,1]=4 1574 B10R1.156 CC(=O)OC[C@@H]1C[C@@H]1CO Amb27665243 [1,0,0,1,0,0|2,0,0]=4 1575 B10R1.156 CC(=O)OC[C@@H]1C[C@H]1CO Amb27208149 [1,0,0,1,0,0|2,0,0]=4 1576 B10R1.156 CC(=O)OC[C@H]1C[C@H]1CO Amb27788275 [1,0,0,1,0,0|2,0,0]=4 1577 B10R1.156 CCC1CC1CNC(=O)Cl Amb35633499 [1,0,0,1,0,0|2,0,0]=4 1578 B10R1.156 CCC1CC1CNC(C)=N Amb27781164 [1,0,0,1,0,0|2,0,0]=4 1579 B10R1.156 CC[C@@H]1C[C@H]1CNC(=O)Cl Amb35636906 [1,0,0,1,0,0|2,0,0]=4 1580 B10R1.156 CC[C@@H]1C[C@H]1CNC(C)=O Amb27471144 [1,0,0,1,0,0|1,0,0]=3 1581 B10R1.156 CC[C@@H]1C[C@H]1CNC(N)=O Amb27228042 [1,0,0,1,0,0|2,0,0]=4 1582 B10R1.162 CCC1CC(=O)NCCN1 Amb18202576 [1,0,0,1,0,0|2,0,0]=4 1583 B10R1.162 CCC1CCCCC(=O)C1 Amb28126018 [1,0,0,1,0,0|0,0,1]=3 1584 B10R1.162 CCC1CCCNC(=O)C1 Amb27627781 [1,0,0,1,0,0|1,0,0]=3 1585 B10R1.162 CC[C@@H]1CCCCC(=O)C1 Amb27236500 [1,0,0,1,0,0|0,0,1]=3 1586 B10R1.162 CC[C@H]1CCCCC(=O)C1 Amb27615128 [1,0,0,1,0,0|0,0,1]=3 1587 B10R1.162 CSC1CCCNC(=O)C1 Amb27473291 [1,0,0,1,0,0|2,0,0]=4 1588 B10R1.348 CC(=O)C1=CC=CCCC1 Amb28351614 [1,0,0,1,0,0|0,0,2]=4 1589 B10R1.348 CC(=O)C1=CCCCCO1 Amb25744240 [1,0,0,1,0,0|1,0,0]=3 1590 B10R1.348 CC(=O)C1=CSCCCC1 Amb26322340 [1,0,0,1,0,0|1,0,0]=3 1591 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [1,0,0,1,0,0|0,0,1]=3 1592 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [1,0,0,1,0,0|1,0,1]=4 1593 B10R1.348 CC(=O)C1CCCOCC1 Amb27772516 [1,0,0,1,0,0|1,0,1]=4 1594 B10R1.348 CC(=O)C1CCCSCC1 Amb30031083 [1,0,0,1,0,0|1,0,1]=4 1595 B10R1.348 CC(=O)N1CCCCCC1 Amb6340881 [1,0,0,1,0,0|1,0,0]=3 1596 B10R1.348 CC(=O)N1CCCNCC1 Amb1157142 [1,0,0,1,0,0|2,0,0]=4 1597 B10R1.348 CC(=O)N1CCCNCC1 Amb19959942 [1,0,0,1,0,0|2,0,0]=4 1598 B10R1.348 CC(=O)N1CCCNCC1 Amb22587131 [1,0,0,1,0,0|2,0,0]=4 1599 B10R1.348 CC(=O)N1CCCOCC1 Amb28126728 [1,0,0,1,0,0|2,0,0]=4 1600 B10R1.348 CC(C)=C1CCCCCC1 Amb25048552 [1,0,0,1,0,0|1,0,0]=3 1601 B10R1.348 CC(C)C1=CCCCCC1 Amb25146390 [1,0,0,1,0,0|1,0,1]=4 1602 B10R1.348 CC(N)C1=CCCCCC1 Amb18278571 [1,0,0,1,0,0|1,0,1]=4 1603 B10R1.348 NC(=O)C1CCCCCC1 Amb24182051 [1,0,0,1,0,0|1,0,1]=4 1604 B10R1.348 NC(=O)N1CCCCCC1 Amb1107239 [1,0,0,1,0,0|2,0,0]=4 1605 B10R1.348 O=C(Cl)C1CCCCCC1 Amb18797932 [1,0,0,1,0,0|1,0,1]=4 1606 B10R1.348 O=C(Cl)N1CCCCCC1 Amb17563067 [1,0,0,1,0,0|2,0,0]=4 1607 B10R1.348 O=C(O)C1=CCCCCC1 Amb26605756 [1,0,0,1,0,0|1,0,0]=3 1608 B10R1.348 O=C(O)C1=CCCNCC1 Amb28119954 [1,0,0,1,0,0|2,0,0]=4 1609 B10R1.348 O=C(O)C1=CCCOCC1 Amb27197038 [1,0,0,1,0,0|2,0,0]=4 1610 B10R1.348 O=C(O)C1=CCNCCC1 Amb27254135 [1,0,0,1,0,0|2,0,0]=4 1611 B10R1.348 O=C(O)C1CCCCCC1 Amb2721236 [1,0,0,1,0,0|1,0,1]=4 1612 B10R1.4 CC1=C(NC=O)CCCC1 Amb27252124 [1,0,0,1,0,0|1,0,1]=4 1613 B10R1.4 CC1=C(\C=C/Cl)CCCC1 Amb27791809 [1,0,0,1,0,0|1,0,1]=4 1614 B10R1.4 CC1=CCCCC1CCBr Amb27872282 [1,0,0,1,0,0|1,0,1]=4 1615 B10R1.4 CC1=CCCCC1CCO Amb27406532 [1,0,0,1,0,0|1,0,1]=4 1616 B10R1.4 CC1CCCCC1=C=CCl Amb27444968 [1,0,0,1,0,0|1,0,1]=4 1617 B10R1.4 CC1CCCCC1NC=O Amb27589339 [1,0,0,1,0,0|1,0,1]=4 1618 B10R1.4 CC1CCCCC1\C=C\Br Amb33135579 [1,0,0,1,0,0|1,0,1]=4 1619 B10R1.4 CC1CCCC\C1=C/C#N Amb24477991 [1,0,0,1,0,0|1,0,1]=4 1620 B10R1.4 CC1CCCC\C1=C/C=O Amb25951883 [1,0,0,1,0,0|0,0,0]=2 1621 B10R1.4 CCCC1CCC=CC1=O Amb27750345 [1,0,0,1,0,0|0,0,0]=2 1622 B10R1.4 CCCC1CCCCC1=O Amb22228916 [1,0,0,1,0,0|0,0,2]=4 1623 B10R1.4 CCCC1CCCNC1=O Amb27475482 [1,0,0,1,0,0|1,0,1]=4 1624 B10R1.4 CCCC1CCCOC1=O Amb25068420 [1,0,0,1,0,0|1,0,1]=4 1625 B10R1.4 CCCC1CCNCC1=O Amb27629020 [1,0,0,1,0,0|1,0,1]=4 1626 B10R1.4 CCC[C@@H]1CCCCC1=O Amb25146733 [1,0,0,1,0,0|0,0,2]=4 1627 B10R1.4 CC\C=C1\CCCC[C@@H]1O Amb28321399 [1,0,0,1,0,0|1,0,1]=4 1628 B10R1.4 CC\C=C1\CCCNC1C Amb27780234 [1,0,0,1,0,0|1,0,1]=4 1629 B10R1.4 CN1CCCC\C1=C\C=O Amb18643454 [1,0,0,1,0,0|1,0,0]=3 1630 B10R1.4 C\C=C\C1CCCCC1O Amb25990050 [1,0,0,1,0,0|1,0,1]=4 1631 B10R1.4 C\C=C\[C@@H]1CCCC[C@@H]1O Amb27853111 [1,0,0,1,0,0|1,0,1]=4 1632 B10R1.4 C\C=C\[C@@H]1CCCC[C@H]1O Amb28293167 [1,0,0,1,0,0|1,0,1]=4 1633 B10R1.4 O=CCC1CCC=CC1=O Amb28255699 [1,0,0,1,0,0|1,0,1]=4 1634 B10R1.5 CCC1CCC\C1=C/CN Amb28383733 [1,0,0,1,0,0|1,0,1]=4 1635 B10R1.5 CCC[C@@H]1SCC=C1C=O Amb28382595 [1,0,0,1,0,0|1,0,0]=3 1636 B10R1.5 CCN1CCC\C1=C/C=O Amb27435814 [1,0,0,1,0,0|1,0,0]=3 1637 B10R1.7 CC1=CCCCCCC1O Amb27617211 [1,0,0,1,0,0|1,0,1]=4 1638 B10R1.7 CC1C=CCCCCC1O Amb27756520 [1,0,0,1,0,0|1,0,1]=4 1639 B10R1.7 CC1CCCCCCC1=O Amb4020430 [1,0,0,1,0,0|0,0,2]=4 1640 B10R1.7 CN1CCCNC=CC1=O Amb28050134 [1,0,0,1,0,0|2,0,0]=4 1641 B10R1.7 C[C@@H]1C=CCCCC[C@H]1O Amb27481268 [1,0,0,1,0,0|1,0,1]=4 1642 B10R1.7 O=C1C=CCCCCC1Cl Amb27471827 [1,0,0,1,0,0|1,0,0]=3 1643 B10R1.17 BrCCCC1CC=CCC1 Amb33477989 [1,0,0,1,0,0|1,0,1]=4 1644 B10R1.17 BrC\C=C\C1CCCCC1 Amb32653503 [1,0,0,1,0,0|1,0,1]=4 1645 B10R1.17 Br\C=C\CC1CCCCC1 Amb33135221 [1,0,0,1,0,0|1,0,1]=4 1646 B10R1.17 CCCCN1CC=CCC1 Amb27804605 [1,0,0,1,0,0|1,0,1]=4 1647 B10R1.17 CC\C=C\C1CCCCN1 Amb33269457 [1,0,0,1,0,0|1,0,1]=4 1648 B10R1.17 CC\C=C\C1CCCNC1 Amb33269456 [1,0,0,1,0,0|1,0,1]=4 1649 B10R1.17 CC\C=C\C1CCNCC1 Amb33269448 [1,0,0,1,0,0|1,0,1]=4 1650 B10R1.17 CC\C=C\N1CCCCC1 Amb17673715 [1,0,0,1,0,0|1,0,1]=4 1651 B10R1.17 CNCCC1CC=CCC1 Amb26016974 [1,0,0,1,0,0|1,0,1]=4 1652 B10R1.17 CO\N=C\C1CCCCC1 Amb27452232 [1,0,0,1,0,0|2,0,0]=4 1653 B10R1.17 C\C=C\C=C1CCCCC1 Amb27233863 [1,0,0,1,0,0|0,0,1]=3 1654 B10R1.17 C\C=C\CC1CCCCN1 Amb27202726 [1,0,0,1,0,0|1,0,1]=4 1655 B10R1.17 C\C=C\CC1CCCNC1 Amb32670930 [1,0,0,1,0,0|1,0,1]=4 1656 B10R1.17 Cl\C=C\C=C1CCCCC1 Amb27878642 [1,0,0,1,0,0|1,0,1]=4 1657 B10R1.17 NCCCC1CC=CCC1 Amb30012160 [1,0,0,1,0,0|1,0,1]=4 1658 B10R1.17 NC\C=C\C1CCCCC1 Amb25828178 [1,0,0,1,0,0|1,0,1]=4 1659 B10R1.17 O=CC#CC1CCCCC1 Amb17593454 [1,0,0,1,0,0|0,0,2]=4 1660 B10R1.17 O=CC=C=C1CCCCC1 Amb17593457 [1,0,0,1,0,0|0,0,2]=4 1661 B10R1.17 O=CCCC1CCCCC1 Amb3372079 [1,0,0,1,0,0|0,0,2]=4 1662 B10R1.17 O=CCOC1CCCCC1 Amb28423544 [1,0,0,1,0,0|1,0,1]=4 1663 B10R1.17 O=CNCC1CCCCC1 Amb27394363 [1,0,0,1,0,0|1,0,1]=4 1664 B10R1.17 O=C\C=C/N1CCOCC1 Amb28201317 [1,0,0,1,0,0|2,0,0]=4 1665 B10R1.17 O=C\C=C\C1=CCCCC1 Amb18643092 [1,0,0,1,0,0|0,0,2]=4 1666 B10R1.17 O=C\C=C\C1CC=CCC1 Amb25691324 [1,0,0,1,0,0|0,0,2]=4 1667 B10R1.17 O=C\C=C\C1CCCCC1 Amb18643296 [1,0,0,1,0,0|0,0,0]=2 1668 B10R1.17 O=C\C=C\C1CCCCO1 Amb33473942 [1,0,0,1,0,0|1,0,0]=3 1669 B10R1.17 O=C\C=C\C1CCCOC1 Amb33474517 [1,0,0,1,0,0|1,0,0]=3 1670 B10R1.17 O=C\C=C\C1CCCSC1 Amb33172303 [1,0,0,1,0,0|1,0,0]=3 1671 B10R1.17 O=C\C=C\C1CCSCC1 Amb24587287 [1,0,0,1,0,0|1,0,0]=3 1672 B10R1.17 O=C\C=C\C1SCCCS1 Amb24679198 [1,0,0,1,0,0|2,0,0]=4 1673 B10R1.17 O=C\C=C\N1CCCCC1 Amb25941560 [1,0,0,1,0,0|1,0,0]=3 1674 B10R1.17 OCCCC1CC=CCC1 Amb27150884 [1,0,0,1,0,0|1,0,1]=4 1675 B10R1.17 OC\C=C\C1CCCCC1 Amb25789470 [1,0,0,1,0,0|0,0,2]=4 1676 B10R1.17 SCCCC1CC=CCC1 Amb33318626 [1,0,0,1,0,0|1,0,1]=4 1677 B10R1.19 CC1CCCCC=C1C=O Amb28240981 [1,0,0,1,0,0|0,0,0]=2 1678 B10R1.19 CC1CCCCCC1C=O Amb28049958 [1,0,0,1,0,0|0,0,2]=4 1679 B10R1.19 CCC1CCCCCC1=O Amb25948482 [1,0,0,1,0,0|0,0,2]=4 1680 B10R1.19 CC[C@H]1CCCCCC1=O Amb27951448 [1,0,0,1,0,0|0,0,2]=4 1681 B10R1.19 CSC1=CCCCCN1C Amb27481870 [1,0,0,1,0,0|2,0,0]=4 1682 B10R1.19 C\C=C1\CCCCCC1O Amb27839310 [1,0,0,1,0,0|1,0,1]=4 1683 B10R1.19 O=CC1=CCCCCC1=O Amb28288321 [1,0,0,1,0,0|1,0,1]=4 1684 B10R1.20 CCC1=C(C=O)CCCC1 Amb28050009 [1,0,0,1,0,0|0,0,2]=4 1685 B10R1.20 CCC1CCCCC1C=O Amb28069911 [1,0,0,1,0,0|0,0,2]=4 1686 B10R1.20 COC1CCCC=C1C=O Amb24480532 [1,0,0,1,0,0|1,0,0]=3 1687 B10R1.20 O=CC1=CCCC[C@H]1C=O Amb27229618 [1,0,0,1,0,0|1,0,1]=4 1688 B10R1.21 CCCCCc1ccco1 Amb8393189 [1,0,0,1,0,0|0,0,2]=4 1689 B10R1.21 CCCCCc1cccs1 Amb2779226 [1,0,0,1,0,0|0,1,1]=4 1690 B10R1.21 CCCCNC1C=CCC1 Amb27252122 [1,0,0,1,0,0|1,0,1]=4 1691 B10R1.21 CC\C=C\CC1CCCN1 Amb33268700 [1,0,0,1,0,0|1,0,1]=4 1692 B10R1.21 CC\C=C\CC1CCNC1 Amb32953772 [1,0,0,1,0,0|1,0,1]=4 1693 B10R1.21 C\C=C\C=C\C1CCNC1 Amb27223015 [1,0,0,1,0,0|1,0,1]=4 1694 B10R1.21 NC\C=C\CC1CCCC1 Amb33378377 [1,0,0,1,0,0|1,0,1]=4 1695 B10R1.21 O=CC#CCC1CCCC1 Amb28186614 [1,0,0,1,0,0|0,0,2]=4 1696 B10R1.21 O=CCCCC1CCCC1 Amb25838994 [1,0,0,1,0,0|0,0,2]=4 1697 B10R1.21 O=CCSCC1CCCC1 Amb28197773 [1,0,0,1,0,0|1,0,1]=4 1698 B10R1.21 O=C\C=C\CC1CCCC1 Amb33358587 [1,0,0,1,0,0|0,0,0]=2 1699 B10R1.21 O=C\C=C\CC1OCCO1 Amb24391761 [1,0,0,1,0,0|2,0,0]=4 1700 B10R1.21 OCCCCC1C=CCC1 Amb28139719 [1,0,0,1,0,0|1,0,1]=4 1701 B10R1.21 OC\C=C\CC1CCCC1 Amb27980617 [1,0,0,1,0,0|0,0,2]=4 1702 B10R1.29 CC1OCCC1\C=C\C=O Amb33427141 [1,0,0,1,0,0|1,0,0]=3 1703 B10R1.29 CCCCC1CCCC1=O Amb19301037 [1,0,0,1,0,0|0,0,2]=4 1704 B10R1.29 CCCCC1COCC1=O Amb29885828 [1,0,0,1,0,0|1,0,1]=4 1705 B10R1.29 CCCCn1nccc1C Amb6890350 [1,0,0,1,0,0|2,0,0]=4 1706 B10R1.29 C\C=C\CC1CCCC1O Amb27790303 [1,0,0,1,0,0|1,0,1]=4 1707 B10R1.29 C\C=C\C[C@@H]1CCC[C@H]1O Amb27448874 [1,0,0,1,0,0|1,0,1]=4 1708 B10R1.37 C\C=C\CNC1CCC1C Amb27237088 [1,0,0,1,0,0|1,0,1]=4 1709 B10R1.57 C\C=C\CCNC1CCC1 Amb28122521 [1,0,0,1,0,0|1,0,1]=4 1710 B10R1.57 C\C=C\CNCC1CCC1 Amb27471681 [1,0,0,1,0,0|1,0,1]=4 1711 B10R1.57 C\C=C\CSCC1CCC1 Amb27466875 [1,0,0,1,0,0|1,0,1]=4 1712 B10R1.60 CO\C=C\C1CC1CCO Amb27826488 [1,0,0,1,0,0|2,0,0]=4 1713 B10R1.85 Br\C=C\C1CCCCCC1 Amb33135243 [1,0,0,1,0,0|1,0,1]=4 1714 B10R1.85 C=C\C=C1\CCCNCC1 Amb28250329 [1,0,0,1,0,0|1,0,1]=4 1715 B10R1.85 CNCC1CCC=CCC1 Amb27173087 [1,0,0,1,0,0|1,0,1]=4 1716 B10R1.85 ClCC=C1CCCCCC1 Amb27234644 [1,0,0,1,0,0|1,0,1]=4 1717 B10R1.85 N#CC=C1CCCCCC1 Amb24444699 [1,0,0,1,0,0|1,0,1]=4 1718 B10R1.85 O=CCC1CCCCCC1 Amb28315719 [1,0,0,1,0,0|0,0,2]=4 1719 B10R1.85 OCC=C1CCCCCC1 Amb27977336 [1,0,0,1,0,0|0,0,2]=4 1720 B10R1.129 CCCCCC1CC1C=O Amb26343852 [1,0,0,1,0,0|0,0,2]=4 1721 B10R1.129 CCCCC[C@@H]1O[C@@H]1C=O Amb27640547 [1,0,0,1,0,0|1,0,1]=4 1722 B10R1.129 CC\C=C\CC1CC1CO Amb28073942 [1,0,0,1,0,0|1,0,1]=4 1723 B10R1.129 C\C=C\CNC1CC1CC Amb27424897 [1,0,0,1,0,0|1,0,1]=4 1724 B10R1.161 BrCC1CCC=CCCC1 Amb26064028 [1,0,0,1,0,0|1,0,1]=4 1725 B10R1.161 C#CC1=CCCCCCC1 Amb27813275 [1,0,0,1,0,0|0,0,2]=4 1726 B10R1.161 CC=C1CCCCCCC1 Amb22730433 [1,0,0,1,0,0|0,0,1]=3 1727 B10R1.161 COC1=CCCCCCC1 Amb2721275 [1,0,0,1,0,0|1,0,0]=3 1728 B10R1.161 COC1=NCCCCCC1 Amb25859090 [1,0,0,1,0,0|2,0,0]=4 1729 B10R1.161 ClCC1CCC=CCCC1 Amb32691343 [1,0,0,1,0,0|1,0,1]=4 1730 B10R1.161 N#CC1=CCCCCCC1 Amb27470756 [1,0,0,1,0,0|1,0,1]=4 1731 B10R1.161 NCC1CCC=CCCC1 Amb27461448 [1,0,0,1,0,0|1,0,1]=4 1732 B10R1.161 NCC1CCC=CCCC1 Amb32721501 [1,0,0,1,0,0|1,0,1]=4 1733 B10R1.161 O=CC1=CCCCCCC1 Amb17621598 [1,0,0,1,0,0|0,0,0]=2 1734 B10R1.161 O=CC1CCCCCCC1 Amb31307750 [1,0,0,1,0,0|0,0,2]=4 1735 B10R1.161 O=CC1CCCCCCC1 Amb8390588 [1,0,0,1,0,0|0,0,2]=4 1736 B10R1.161 O=CN1CCCCCCC1 Amb27150999 [1,0,0,1,0,0|1,0,1]=4 1737 B10R1.161 OCC1=CCCCCCC1 Amb28185100 [1,0,0,1,0,0|0,0,2]=4 1738 B10R1.161 OCC1CCC=CCCC1 Amb25098662 [1,0,0,1,0,0|1,0,1]=4 1739 B12R1.7 CCCCCCC1CCC(=O)O1 Amb569753 [0,1,0,1,0,0|1,0,1]=4 1740 B12R1.7 CCCCCCc1cc(Br)cs1 Amb24079075 [0,1,0,1,0,0|1,0,1]=4 1741 B12R1.7 CCCCCCc1cc(N)on1 Amb28653055 [0,1,0,1,0,0|1,0,1]=4 1742 B12R1.7 CCCCCCc1ccc(Br)s1 Amb22235381 [0,1,0,1,0,0|1,1,0]=4 1743 B12R1.7 CCCCCCc1csc(N)n1 Amb22284509 [0,1,0,1,0,0|2,0,0]=4 1744 B12R1.7 CCCCCCn1cc[n+](C)c1 Amb22411623 [0,1,0,1,0,0|2,0,0]=4 1745 B12R1.7 CCCCCCn1cc[n+](C)c1 Amb8516216 [0,1,0,1,0,0|2,0,0]=4 1746 B12R1.7 CCCCCCn1cc[n+](C)c1 Amb8516222 [0,1,0,1,0,0|2,0,0]=4 1747 B12R1.7 CCCCCCn1cc[n+](C)c1 Amb8516226 [0,1,0,1,0,0|2,0,0]=4 1748 B12R1.7 CCCCCCn1ccc(N)n1 Amb18792974 [0,1,0,1,0,0|2,0,0]=4 1749 B12R1.7 CCCCNCc1ccc(C)o1 Amb19890503 [0,1,0,1,0,0|0,0,2]=4 1750 B12R1.7 CCCCNCc1ccc(C)o1 Amb2592338 [0,1,0,1,0,0|0,0,2]=4 1751 B12R1.7 CCCCNCc1ccc(C)s1 Amb1927259 [0,1,0,1,0,0|0,1,1]=4 1752 B12R1.7 CCCCNCc1ccc(C)s1 Amb6864537 [0,1,0,1,0,0|0,1,1]=4 1753 B12R1.7 CCCCNCc1ncc(C)s1 Amb19648796 [0,1,0,1,0,0|1,1,0]=4 1754 B12R1.7 CCCNCCc1nc(C)cs1 Amb17316273 [0,1,0,1,0,0|2,0,0]=4 1755 B12R1.100 CCCCC1CC(=O)C=C(C)C1 Amb20621578 [0,1,0,1,0,0|0,0,0]=2 1756 B12R1.100 CCCCC1CC(=O)N=C(N)S1 Amb27759062 [0,1,0,1,0,0|2,0,0]=4 1757 B12R1.100 CCCCC1CC(=O)OC(=O)C1 Amb33428080 [0,1,0,1,0,0|1,0,0]=3 1758 B12R1.100 CCCCN1CC(=O)CC(=O)C1 Amb32648795 [0,1,0,1,0,0|1,0,1]=4 1759 B12R1.100 CCCCN1CC(=O)NC(=O)C1 Amb17334803 [0,1,0,1,0,0|2,0,0]=4 1760 B12R1.100 CCCCN1CC(=O)OC(=O)C1 Amb27391482 [0,1,0,1,0,0|2,0,0]=4 1761 B12R1.100 CCCC[C@@H]1CC(=O)C[C@@H](C)C1 Amb27844192 [0,1,0,1,0,0|0,0,2]=4 1762 B12R1.100 CCCC[C@H]1CC(=O)C=C(C)C1 Amb27828841 [0,1,0,1,0,0|0,0,0]=2 1763 B12R1.100 CCSCC1CC(=O)OC(=O)C1 Amb33323656 [0,1,0,1,0,0|2,0,0]=4 1764 B12R1.100 COCCC1CC(=O)OC(=O)C1 Amb33377345 [0,1,0,1,0,0|2,0,0]=4 1765 B12R1.100 CSCCC1CC(=O)OC(=O)C1 Amb33203367 [0,1,0,1,0,0|2,0,0]=4 1766 B12R1.107 C=C(C)\C=C(\C)C1CCCNC1 Amb35736998 [0,1,0,1,0,0|2,0,0]=4 1767 B12R1.107 C=C(CC(=O)O)C1CCCCC1 Amb27411597 [0,1,0,1,0,0|1,0,1]=4 1768 B12R1.107 CC(=O)CC(=O)C1CCCCC1 Amb9775081 [0,1,0,1,0,0|0,0,1]=3 1769 B12R1.107 CC(=O)CC(=O)N1CCCCC1 Amb842609 [0,1,0,1,0,0|1,0,1]=4 1770 B12R1.107 CC(=O)CC(O)C1CCCCC1 Amb28120564 [0,1,0,1,0,0|0,0,2]=4 1771 B12R1.107 CC(=O)CS(=O)C1CCCCC1 Amb27800713 [0,1,0,1,0,0|1,0,1]=4 1772 B12R1.107 CC(=O)NC(=O)C1CCCCC1 Amb27178301 [0,1,0,1,0,0|1,0,0]=3 1773 B12R1.107 CC(=O)NC(=S)N1CCCCC1 Amb25159568 [0,1,0,1,0,0|2,0,0]=4 1774 B12R1.107 CC(=O)OC(C)C1CCCCC1 Amb27614524 [0,1,0,1,0,0|1,0,1]=4 1775 B12R1.107 CC(=O)\C=C(/C)C1=CCCCC1 Amb27177907 [0,1,0,1,0,0|0,0,2]=4 1776 B12R1.107 CC(=O)\C=C(\C)C1=CCCCC1 Amb28201039 [0,1,0,1,0,0|0,0,2]=4 1777 B12R1.107 CC(=O)\C=C(\C)C1CCCCC1 Amb27883326 [0,1,0,1,0,0|0,0,0]=2 1778 B12R1.107 CC(=O)\C=C(\C)N1CCCCC1 Amb27599399 [0,1,0,1,0,0|1,0,0]=3 1779 B12R1.107 CC(=O)\C=C(\N)N1CCOCC1 Amb26891037 [0,1,0,1,0,0|2,0,0]=4 1780 B12R1.107 CC(C)=CC(=O)C1CCCCS1 Amb27614742 [0,1,0,1,0,0|2,0,0]=4 1781 B12R1.107 CC(C)=CC(=O)C1CCNCC1 Amb28313611 [0,1,0,1,0,0|2,0,0]=4 1782 B12R1.107 CC(C)=CC(=O)C1CCOCC1 Amb27982198 [0,1,0,1,0,0|2,0,0]=4 1783 B12R1.107 CC(C)=CC(=O)C1CCSCC1 Amb35694907 [0,1,0,1,0,0|2,0,0]=4 1784 B12R1.107 CC(C)=CC(=O)[C@@H]1CCCCN1 Amb35617572 [0,1,0,1,0,0|2,0,0]=4 1785 B12R1.107 CC(C)=CC(=O)[C@@H]1CCCNC1 Amb35617758 [0,1,0,1,0,0|2,0,0]=4 1786 B12R1.107 CC(C)=CC(=O)[C@H]1CCCCN1 Amb35588379 [0,1,0,1,0,0|2,0,0]=4 1787 B12R1.107 CC(C)=CC(=O)[C@H]1CCCNC1 Amb35623747 [0,1,0,1,0,0|2,0,0]=4 1788 B12R1.107 CS(=O)CC(=O)C1CCCCC1 Amb27812675 [0,1,0,1,0,0|1,0,1]=4 1789 B12R1.107 C\C(=C/C(=O)O)C1CCCCC1 Amb33534648 [0,1,0,1,0,0|1,0,0]=3 1790 B12R1.107 C\C(=C/C(=O)O)N1CCCCC1 Amb24109410 [0,1,0,1,0,0|2,0,0]=4 1791 B12R1.107 C\C(=C/C(N)=O)C1CCCCC1 Amb27254821 [0,1,0,1,0,0|1,0,0]=3 1792 B12R1.107 C\C(=C\C(=O)O)C1CCOCC1 Amb31101949 [0,1,0,1,0,0|2,0,0]=4 1793 B12R1.107 C\C(=N/S(C)=O)C1CCCCC1 Amb35718858 [0,1,0,1,0,0|2,0,0]=4 1794 B12R1.107 C\C(N)=C\C(=O)N1CCCCC1 Amb8485564 [0,1,0,1,0,0|2,0,0]=4 1795 B12R1.107 C\C(O)=C/C(=O)C1CCNCC1 Amb27630455 [0,1,0,1,0,0|1,0,1]=4 1796 B12R1.107 C\C(O)=C\C(=O)C1CCNCC1 Amb27430564 [0,1,0,1,0,0|1,0,1]=4 1797 B12R1.141 CC1=CC(=O)CCCCCCC1 Amb28253959 [0,1,0,1,0,0|0,0,0]=2 1798 B12R1.141 CC1CCCCCCCC(=O)N1 Amb27616243 [0,1,0,1,0,0|1,0,1]=4 1799 B12R1.141 O=C1CCCCCCCC(=O)O1 Amb26420851 [0,1,0,1,0,0|1,0,0]=3 1800 B12R1.141 O=C1CCCCCCCC(O)C1 Amb27262870 [0,1,0,1,0,0|0,0,2]=4 1801 B12R1.141 O=C1CCCCCCOC(=O)C1 Amb27177481 [0,1,0,1,0,0|1,0,1]=4 1802 B12R1.144 C=C(C)CC(=O)C1CCCC1C Amb27465765 [0,1,0,1,0,0|1,0,1]=4 1803 B12R1.144 CC(=O)CN(C)C1CCCC1C Amb35734066 [0,1,0,1,0,0|1,0,1]=4 1804 B12R1.144 CC(C)=CC(=O)C1CCCN1C Amb35600330 [0,1,0,1,0,0|2,0,0]=4 1805 B12R1.144 CC(C)=CC(=O)C1CCNC1C Amb27416371 [0,1,0,1,0,0|2,0,0]=4 1806 B12R1.144 CC(C)=CC(=O)[C@@H]1CCC[C@@H]1N Amb35660160 [0,1,0,1,0,0|2,0,0]=4 1807 B12R1.144 CC(C)=CC(O)C1CCCC1C Amb28061089 [0,1,0,1,0,0|1,0,1]=4 1808 B12R1.144 C\C(N)=C/C(=O)[C@@H]1CCCN1C Amb28255598 [0,1,0,1,0,0|2,0,0]=4 1809 B12R1.144 C\C(N)=C\C(=O)C1CCCN1C Amb27178110 [0,1,0,1,0,0|2,0,0]=4 1810 B12R1.144 C\C(N)=C\C(=O)[C@@H]1CCCN1C Amb26390954 [0,1,0,1,0,0|2,0,0]=4 1811 B12R1.181 CCCC1CCC(=O)N1C(C)=O Amb17940084 [0,1,0,1,0,0|1,0,0]=3 1812 B12R1.182 CCCN1CC\C(=C/C(=O)O)C1 Amb31161631 [0,1,0,1,0,0|2,0,0]=4 1813 B12R1.212 C=C(C)C1=CCCCCCC1=O Amb27256592 [0,1,0,1,0,0|1,0,1]=4 1814 B12R1.212 C=C(C)C1=CCCCCCC1O Amb28188251 [0,1,0,1,0,0|1,0,0]=3 1815 B12R1.212 C=C(C)C1CCCCCCC1=O Amb28243905 [0,1,0,1,0,0|1,0,1]=4 1816 B12R1.212 CC(=O)C1=C(O)CCCCCC1 Amb27854664 [0,1,0,1,0,0|0,0,0]=2 1817 B12R1.212 CC(=O)C1=CCCCCCC1=O Amb28066770 [0,1,0,1,0,0|0,0,1]=3 1818 B12R1.212 CC(=O)C1CCCCCCC1N Amb33447098 [0,1,0,1,0,0|0,0,2]=4 1819 B12R1.212 CC(C)=C1CCCCCCC1=O Amb27256366 [0,1,0,1,0,0|1,0,0]=3 1820 B12R1.212 CC(O)C1=C(Cl)CCCCCC1 Amb28435826 [0,1,0,1,0,0|0,0,2]=4 1821 B12R1.212 C\C(N)=C1/CCCCCCC1=O Amb22363602 [0,1,0,1,0,0|1,0,0]=3 1822 B12R1.212 C\C(O)=C1/CCCCCCC1=O Amb27175968 [0,1,0,1,0,0|0,0,1]=3 1823 B12R1.212 NC(=O)C1=C(N)CCCCCC1 Amb28201210 [0,1,0,1,0,0|1,0,0]=3 1824 B12R1.260 C=C(C)\C=C(\C)CC1CCCN1 Amb28075411 [0,1,0,1,0,0|2,0,0]=4 1825 B12R1.260 CC(=O)CC(=O)NC1CCCC1 Amb3685937 [0,1,0,1,0,0|1,0,1]=4 1826 B12R1.260 CC(=O)\C=C(\C)CC1CCCC1 Amb35683551 [0,1,0,1,0,0|0,0,0]=2 1827 B12R1.260 CC(=O)\C=C(\C)CC1CCCO1 Amb35683552 [0,1,0,1,0,0|1,0,0]=3 1828 B12R1.260 CC(=O)\C=C(\C)CC1CCOC1 Amb35683553 [0,1,0,1,0,0|1,0,0]=3 1829 B12R1.260 CC(C)=CC(=O)CC1CCCC1 Amb28288976 [0,1,0,1,0,0|1,0,0]=3 1830 B12R1.260 CC(C)=CC(=O)CC1CCCN1 Amb27173331 [0,1,0,1,0,0|2,0,0]=4 1831 B12R1.260 CC(C)=CC(=O)CC1CCCO1 Amb27272850 [0,1,0,1,0,0|2,0,0]=4 1832 B12R1.260 CC(C)=CC(=O)OC1CCCC1 Amb27625965 [0,1,0,1,0,0|2,0,0]=4 1833 B12R1.260 C\C(=C/C(=O)O)CC1CCCC1 Amb35683484 [0,1,0,1,0,0|1,0,0]=3 1834 B12R1.260 C\C(=C/C(=O)O)CC1CCCO1 Amb35683489 [0,1,0,1,0,0|2,0,0]=4 1835 B12R1.260 C\C(=C/C(=O)O)CC1CCOC1 Amb35683493 [0,1,0,1,0,0|2,0,0]=4 1836 B12R1.260 C\C(=C\C(C)O)CC1CCCC1 Amb35672967 [0,1,0,1,0,0|0,0,2]=4 1837 B12R1.260 C\C(CC1CCCC1)=N/S(C)=O Amb35722098 [0,1,0,1,0,0|2,0,0]=4 1838 B12R1.418 CC[C@@H]1C[C@H]1NC(=O)C=C(C)C Amb27649755 [0,1,0,1,0,0|2,0,0]=4 1839 B12R1.437 CCC1=C(C(C)=O)C(=O)CCC1 Amb27265928 [0,1,0,1,0,0|0,0,1]=3 1840 B12R1.437 CCC1CCCC(N)=C1C(C)=O Amb25940698 [0,1,0,1,0,0|0,0,0]=2 1841 B12R1.437 CNC1=C(C(C)=O)C(=O)CCC1 Amb4454102 [0,1,0,1,0,0|1,0,1]=4 1842 B12R1.438 CCC1CCCC(CC(C)=O)C1 Amb28042751 [0,1,0,1,0,0|0,0,2]=4 1843 B12R1.438 CCC1CCCC(NC(C)=O)C1 Amb27800438 [0,1,0,1,0,0|1,0,1]=4 1844 B12R1.438 CCC1CCC\C(=C/C(C)=O)C1 Amb28288577 [0,1,0,1,0,0|0,0,0]=2 1845 B12R1.438 CCC1CCC\C(=C/C(C)O)C1 Amb28122778 [0,1,0,1,0,0|0,0,2]=4 1846 B12R1.438 CCC1CCC\C(=N/S(C)=O)C1 Amb35718516 [0,1,0,1,0,0|2,0,0]=4 1847 B12R1.438 CCC1C\C(=C\C(=O)O)CCS1 Amb28076694 [0,1,0,1,0,0|2,0,0]=4 1848 B12R1.438 CCN1CCC\C(=C/C(=O)O)C1 Amb31161630 [0,1,0,1,0,0|2,0,0]=4 1849 B12R1.438 CSC1CCC\C(=C/C(=O)O)C1 Amb27608173 [0,1,0,1,0,0|2,0,0]=4 1850 B12R1.456 CCCCCn1nc(C)cc1N Amb8504675 [0,1,0,1,0,0|2,0,0]=4 1851 B12R1.874 CC(=O)O[C@H]1CCCC[C@@H](O)C1 Amb27964523 [0,1,0,1,0,0|1,0,1]=4 1852 B12R1.1392 CC(=O)C=C1CCCCCCC1 Amb28253982 [0,1,0,1,0,0|0,0,0]=2 1853 B12R1.1392 CC(=O)CC1=CC=CCCCC1 Amb27770130 [0,1,0,1,0,0|0,0,2]=4 1854 B12R1.1392 CC(=O)CC1CCCCCCN1 Amb27395289 [0,1,0,1,0,0|0,0,2]=4 1855 B12R1.1392 CC(=O)NC1=CC=CCCCC1 Amb25307952 [0,1,0,1,0,0|0,0,2]=4 1856 B12R1.1392 CC(=O)NC1C=CCCCCC1 Amb27268481 [0,1,0,1,0,0|0,0,2]=4 1857 B12R1.1392 CC(=O)NC1CCCCCCC1 Amb5797421 [0,1,0,1,0,0|0,0,2]=4 1858 B12R1.1392 CC(=O)NC1CCCCCNC1 Amb32659965 [0,1,0,1,0,0|1,0,1]=4 1859 B12R1.1392 CC(=O)N[C@@H]1C=CCCCCC1 Amb28434672 [0,1,0,1,0,0|0,0,2]=4 1860 B12R1.1392 CC(=O)OC1=CCCCCCC1 Amb3994643 [0,1,0,1,0,0|0,0,0]=2 1861 B12R1.1392 CC(=O)OC1C=CCCCCC1 Amb6359572 [0,1,0,1,0,0|0,0,2]=4 1862 B12R1.1392 CC(=O)OC1CCCCCCC1 Amb4016350 [0,1,0,1,0,0|0,0,2]=4 1863 B12R1.1392 CS(=O)N=C1CCCCCCC1 Amb35681706 [0,1,0,1,0,0|1,0,1]=4 1864 B12R1.1392 C[C@@H](O)CC1=CCCCCCC1 Amb27853897 [0,1,0,1,0,0|0,0,2]=4 1865 B12R1.1392 O=C(O)C=C1CCCCCCC1 Amb6749166 [0,1,0,1,0,0|1,0,0]=3 1866 B12R1.1453 CCCC1CCC(C)=CC(=O)N1 Amb28243988 [0,1,0,1,0,0|1,0,0]=3 1867 B12R1.1453 CCC[C@@H]1CC[C@@H](C)CC(=O)C1 Amb28052261 [0,1,0,1,0,0|0,0,2]=4 1868 B12R1.105 CC(=O)NOCC1CCC(C)O1 Amb28064800 [0,1,0,1,0,0|2,0,0]=4 1869 B12R1.105 CC(C)=CCCC1CCC(Br)C1 Amb35744301 [0,1,0,1,0,0|1,0,1]=4 1870 B12R1.105 CC(C)=CCCC1CCC(Cl)C1 Amb35744300 [0,1,0,1,0,0|1,0,1]=4 1871 B12R1.105 CC(C)=CCCC1CCC(N)C1 Amb35738217 [0,1,0,1,0,0|1,0,1]=4 1872 B12R1.105 CC(C)=CCCC1CCC(O)C1 Amb35738241 [0,1,0,1,0,0|1,0,1]=4 1873 B12R1.105 CC1CCN(C\C=C\C(=O)O)C1 Amb18296456 [0,1,0,1,0,0|2,0,0]=4 1874 B12R1.105 NC1CCN(C\C=C\C(=O)O)C1 Amb18988797 [0,1,0,1,0,0|2,0,0]=4 1875 B12R1.105 O=C(O)\C=C\CC1CCC(=O)C1 Amb18646935 [0,1,0,1,0,0|1,0,1]=4 1876 B12R1.105 O=C(O)\C=C\CN1CCC(F)C1 Amb35614256 [0,1,0,1,0,0|2,0,0]=4 1877 B12R1.220 CC1CC(CN\C=C\C(=O)O)C1 Amb35644283 [0,1,0,1,0,0|2,0,0]=4 1878 B12R1.226 CC(=O)COC1CCCC(C)C1 Amb9667432 [0,1,0,1,0,0|1,0,1]=4 1879 B12R1.226 CC(=O)NCC1CCCC(C)C1 Amb27758968 [0,1,0,1,0,0|1,0,1]=4 1880 B12R1.226 CC(=O)NCC1CCCC(C)N1 Amb18960009 [0,1,0,1,0,0|1,0,1]=4 1881 B12R1.226 CC(=O)NCC1CCCC(C)O1 Amb35637305 [0,1,0,1,0,0|1,0,1]=4 1882 B12R1.226 CC(=O)OCC1CCCC(N)C1 Amb26938407 [0,1,0,1,0,0|1,0,1]=4 1883 B12R1.226 CC(=O)OCC1CCCC(N)C1 Amb32652390 [0,1,0,1,0,0|1,0,1]=4 1884 B12R1.226 CC(=O)OC[C@@H]1CCC[C@H](N)C1 Amb25095974 [0,1,0,1,0,0|1,0,1]=4 1885 B12R1.226 CC(=O)OC[C@@H]1CCC[C@H](N)C1 Amb32652550 [0,1,0,1,0,0|1,0,1]=4 1886 B12R1.226 CC(=O)OC[C@H]1CCC[C@@H](N)C1 Amb26433305 [0,1,0,1,0,0|1,0,1]=4 1887 B12R1.226 CC(=O)\C=C\C1CCCC(=O)N1 Amb25246636 [0,1,0,1,0,0|1,0,1]=4 1888 B12R1.226 CC(=O)\C=C\C1CCCC(C)C1 Amb27770063 [0,1,0,1,0,0|0,0,0]=2 1889 B12R1.226 CC(Br)\C=C\C1CCCC(C)C1 Amb27416899 [0,1,0,1,0,0|1,0,1]=4 1890 B12R1.226 CC(C)CCC1CC(=O)C=CO1 Amb27669264 [0,1,0,1,0,0|1,0,0]=3 1891 B12R1.226 CC(C)CC[C@H]1CCCC(=O)C1 Amb28253824 [0,1,0,1,0,0|0,0,2]=4 1892 B12R1.226 CC(C)\C=C\C1CCCC(O)C1 Amb27432280 [0,1,0,1,0,0|1,0,1]=4 1893 B12R1.226 CC(N)\C=C\C1CCCC(C)C1 Amb27873790 [0,1,0,1,0,0|1,0,1]=4 1894 B12R1.226 CC1CCCC(\C=C\C(=O)O)C1 Amb27770062 [0,1,0,1,0,0|1,0,0]=3 1895 B12R1.226 CC1CCCC(\C=N\S(C)=O)C1 Amb35722126 [0,1,0,1,0,0|2,0,0]=4 1896 B12R1.226 CC1CCCN(\C=C\C(=O)O)C1 Amb27162679 [0,1,0,1,0,0|2,0,0]=4 1897 B12R1.226 C[C@H]1CC(\C=C\C(=O)O)CCO1 Amb27666882 [0,1,0,1,0,0|2,0,0]=4 1898 B12R1.226 NC1CCCN(\C=C\C(=O)O)C1 Amb28186071 [0,1,0,1,0,0|2,0,0]=4 1899 B12R1.226 O=C(O)\C=C\C1CCCC(=O)C1 Amb18646911 [0,1,0,1,0,0|1,0,1]=4 1900 B12R1.226 O=C(O)\C=C\N1CCCC(F)C1 Amb30028544 [0,1,0,1,0,0|2,0,0]=4 1901 B12R1.226 O=C(O)\C=C\N1CCCC(O)C1 Amb27828238 [0,1,0,1,0,0|2,0,0]=4 1902 B12R1.261 CC(=O)C1=CCCCN1C(C)C Amb26325819 [0,1,0,1,0,0|1,0,0]=3 1903 B12R1.261 CC(=O)N1CCCCC1C(C)C Amb27806330 [0,1,0,1,0,0|1,0,1]=4 1904 B12R1.261 CC(=O)N1CCCCC1C(C)O Amb27970713 [0,1,0,1,0,0|1,0,1]=4 1905 B12R1.261 CC(=O)[C@@H]1CCCC[C@H]1C(C)C Amb27420186 [0,1,0,1,0,0|0,0,2]=4 1906 B12R1.261 CC(=O)[C@H]1CCCC[C@@H]1[C@@H](C)O Amb27253580 [0,1,0,1,0,0|0,0,2]=4 1907 B12R1.391 CC(=O)CC1CCCCC1(C)O Amb35667386 [0,1,0,1,0,0|0,0,2]=4 1908 B12R1.391 CC(=O)C[C@@H]1CCCC[C@@]1(C)O Amb35669083 [0,1,0,1,0,0|0,0,2]=4 1909 B12R1.391 CC(=O)NC1=CCCCC1(C)C Amb28208263 [0,1,0,1,0,0|1,0,1]=4 1910 B12R1.391 CC(=O)NC1=CCCCC1(C)O Amb27876357 [0,1,0,1,0,0|1,0,1]=4 1911 B12R1.391 CC(=O)\C=C1\CCCCC1(C)C Amb28074436 [0,1,0,1,0,0|0,0,0]=2 1912 B12R1.391 CC(C)=CC1CCCCC1(C)O Amb33212951 [0,1,0,1,0,0|1,0,1]=4 1913 B12R1.391 CC(C)=C[C@@H]1CCCC[C@@]1(C)O Amb33212920 [0,1,0,1,0,0|1,0,1]=4 1914 B12R1.391 CC1(C)CCCC\C1=C/C(=O)O Amb22059704 [0,1,0,1,0,0|1,0,0]=3 1915 B12R1.391 CS(=O)\N=C1/CCCCC1(C)C Amb35685210 [0,1,0,1,0,0|2,0,0]=4 1916 B12R1.392 CC(=O)CC1CCC=C1C(C)=O Amb25838769 [0,1,0,1,0,0|0,0,1]=3 1917 B12R1.392 CC(=O)\C=C1/COCC1C(C)C Amb35616358 [0,1,0,1,0,0|1,0,0]=3 1918 B12R1.392 CC(C)C1COC\C1=C/C(=O)O Amb35631897 [0,1,0,1,0,0|2,0,0]=4 1919 B12R1.924 CC(=O)NOC1CCCC1(C)C Amb27591098 [0,1,0,1,0,0|2,0,0]=4 1920 B12R1.924 CC(=O)\C=C\C1CCSC1(C)C Amb33224338 [0,1,0,1,0,0|1,0,0]=3 1921 B12R1.924 CC1(C)CCCN1\C=C\C(=O)O Amb27804238 [0,1,0,1,0,0|2,0,0]=4 1922 B12R1.924 CC1(C)SCCC1\C=C\C(=O)O Amb33339603 [0,1,0,1,0,0|2,0,0]=4 1923 B12R1.1011 CC(=O)C1CCCCCC(C)C1 Amb27175954 [0,1,0,1,0,0|0,0,2]=4 1924 B12R1.1011 CC(C)C1CCCC=CC(=O)C1 Amb27176190 [0,1,0,1,0,0|0,0,0]=2 1925 B12R1.1 C#CCCCC1C=CC(=O)CC1 Amb28126617 [0,1,0,1,0,0|0,0,2]=4 1926 B12R1.1 CCCCCC1CC=C(Br)CC1 Amb22001437 [0,1,0,1,0,0|1,0,1]=4 1927 B12R1.1 CCCCCC1CCC(=O)CC1 Amb6357562 [0,1,0,1,0,0|0,0,2]=4 1928 B12R1.25 CCCCC1CC=CC(=O)C1C Amb28324346 [0,1,0,1,0,0|0,0,0]=2 1929 B12R1.25 CCCCC1CCCC(=O)C1C Amb27177608 [0,1,0,1,0,0|0,0,2]=4 1930 B12R1.25 CCCCN1C=CC=C(C)C1=O Amb18405639 [0,1,0,1,0,0|1,0,1]=4 1931 B12R1.25 CCCC[C@@H]1CCCC(=O)[C@@H]1C Amb28052225 [0,1,0,1,0,0|0,0,2]=4 1932 B12R1.27 CCC(=O)NCC1CCCCC1 Amb8336376 [0,1,0,1,0,0|1,0,1]=4 1933 B12R1.27 CCC(=O)NOC1CCCCC1 Amb28127634 [0,1,0,1,0,0|2,0,0]=4 1934 B12R1.27 CCC(=O)\C=C/C1CCCCC1 Amb27486163 [0,1,0,1,0,0|0,0,0]=2 1935 B12R1.27 CCC(=O)\C=C\C1CCCCC1 Amb27262952 [0,1,0,1,0,0|0,0,0]=2 1936 B12R1.27 CCS(=O)\N=C\C1CCCCC1 Amb35685228 [0,1,0,1,0,0|2,0,0]=4 1937 B12R1.27 CNC(=O)CCC1CCCCC1 Amb3447278 [0,1,0,1,0,0|0,0,2]=4 1938 B12R1.27 CNC(=O)OCC1CCCCC1 Amb26457506 [0,1,0,1,0,0|1,0,1]=4 1939 B12R1.27 CNC(=S)\C=C\C1CCCCC1 Amb27463169 [0,1,0,1,0,0|0,1,0]=3 1940 B12R1.27 COC(=O)C#CC1CCCCC1 Amb26433181 [0,1,0,1,0,0|0,0,2]=4 1941 B12R1.27 COC(=O)C=C=C1CCCCC1 Amb32423565 [0,1,0,1,0,0|0,0,2]=4 1942 B12R1.27 COC(=O)CNC1CCCCC1 Amb32666984 [0,1,0,1,0,0|1,0,1]=4 1943 B12R1.27 COC(=O)CNC1CCCCC1 Amb6687137 [0,1,0,1,0,0|1,0,1]=4 1944 B12R1.27 COC(=O)COC1CCCCC1 Amb9206351 [0,1,0,1,0,0|1,0,1]=4 1945 B12R1.27 COC(=O)CSC1CCCCC1 Amb6760939 [0,1,0,1,0,0|1,0,1]=4 1946 B12R1.27 COC(=O)\C=C\C1=CCCCC1 Amb24488525 [0,1,0,1,0,0|0,0,2]=4 1947 B12R1.27 COC(=O)\C=C\C1CCCCC1 Amb25148638 [0,1,0,1,0,0|0,0,0]=2 1948 B12R1.27 COC(=O)\C=C\C1CCCCO1 Amb35634607 [0,1,0,1,0,0|1,0,0]=3 1949 B12R1.27 COC(=O)\C=C\C1CCCOC1 Amb25760294 [0,1,0,1,0,0|1,0,0]=3 1950 B12R1.27 COC(=O)\C=C\C1CCOCC1 Amb27178306 [0,1,0,1,0,0|1,0,0]=3 1951 B12R1.27 COC(=O)\C=C\N1CCCCC1 Amb26952207 [0,1,0,1,0,0|1,0,0]=3 1952 B12R1.27 COC(=O)\C=C\N1CCOCC1 Amb33985916 [0,1,0,1,0,0|2,0,0]=4 1953 B12R1.27 C\C(=C/CC1CCCCC1)CN Amb27661437 [0,1,0,1,0,0|1,0,1]=4 1954 B12R1.27 C\C(C#N)=C/NC1CCCCC1 Amb27259209 [0,1,0,1,0,0|2,0,0]=4 1955 B12R1.27 C\C(C=O)=C/CC1CCCCC1 Amb28388685 [0,1,0,1,0,0|0,0,1]=3 1956 B12R1.27 O=C(CBr)NCC1CCCCC1 Amb17331507 [0,1,0,1,0,0|1,0,1]=4 1957 B12R1.27 O=C(CCl)NCC1CCCCC1 Amb372259 [0,1,0,1,0,0|1,0,1]=4 1958 B12R1.27 O=C(CO)NCC1CCCCC1 Amb1110661 [0,1,0,1,0,0|1,0,1]=4 1959 B12R1.27 O=C(CO)NOC1CCCCC1 Amb27829208 [0,1,0,1,0,0|2,0,0]=4 1960 B12R1.27 O=C(\C=C\N1CCCCC1)CCl Amb27875109 [0,1,0,1,0,0|1,0,0]=3 1961 B12R1.27 O=C(\C=C\N1CCOCC1)CCl Amb19515082 [0,1,0,1,0,0|2,0,0]=4 1962 B12R1.27 O=C\C(Br)=C\OC1CCCCC1 Amb26617550 [0,1,0,1,0,0|2,0,0]=4 1963 B12R1.27 OCC(O)\C=C\C1CCCCC1 Amb27972460 [0,1,0,1,0,0|0,0,2]=4 1964 B12R1.77 CCC1CCCCN1C(=O)CBr Amb17332393 [0,1,0,1,0,0|1,0,1]=4 1965 B12R1.77 CCC1CCCCN1C(=O)CCl Amb9747353 [0,1,0,1,0,0|1,0,1]=4 1966 B12R1.77 CCC1CCCCN1C(=O)CO Amb1110412 [0,1,0,1,0,0|1,0,1]=4 1967 B12R1.77 CCC1CCCCN1C(=O)CS Amb27638567 [0,1,0,1,0,0|1,0,1]=4 1968 B12R1.77 CCC1CCCCN1C(=O)OC Amb3373232 [0,1,0,1,0,0|1,0,1]=4 1969 B12R1.77 CCC1CCCC\C1=C(\C)CN Amb27167830 [0,1,0,1,0,0|1,0,1]=4 1970 B12R1.77 CCN1CCCC=C1C(=O)OC Amb23585375 [0,1,0,1,0,0|1,0,0]=3 1971 B12R1.82 CCC(=O)NC1CCCC1CC Amb27652567 [0,1,0,1,0,0|1,0,1]=4 1972 B12R1.82 CCC1CCCC1NC(=O)CN Amb27187991 [0,1,0,1,0,0|1,0,1]=4 1973 B12R1.82 CCC1CCC\C1=N/S(=O)CC Amb29858820 [0,1,0,1,0,0|2,0,0]=4 1974 B12R1.82 CCC1COC\C1=C/C(=O)OC Amb35631907 [0,1,0,1,0,0|1,0,0]=3 1975 B12R1.82 CCN1CCN\C1=C/C(=O)OC Amb27666968 [0,1,0,1,0,0|2,0,0]=4 1976 B12R1.82 COC(=O)\C=C1\CCCC1OC Amb33492936 [0,1,0,1,0,0|1,0,0]=3 1977 B12R1.150 C[C@@H]1CCCCCCCNC1=O Amb28047251 [0,1,0,1,0,0|1,0,1]=4 1978 B12R1.150 C[C@H]1CCCCCCCNC1=O Amb28059295 [0,1,0,1,0,0|1,0,1]=4 1979 B12R1.150 O=C1CCCCCCCCC1=O Amb17594209 [0,1,0,1,0,0|0,0,1]=3 1980 B12R1.150 O=C1CCCCCCCCC1Br Amb28244232 [0,1,0,1,0,0|0,0,2]=4 1981 B12R1.150 O=C1CCCCCCCCC1Cl Amb27233508 [0,1,0,1,0,0|0,0,2]=4 1982 B12R1.150 O=C1CCCCCCCCC1F Amb27828822 [0,1,0,1,0,0|0,0,2]=4 1983 B12R1.150 O=C1CCCCCCCCC1O Amb4017052 [0,1,0,1,0,0|0,0,2]=4 1984 B12R1.150 O=C1NCCCCCCCC1Br Amb27410410 [0,1,0,1,0,0|1,0,1]=4 1985 B12R1.150 O=C1NCCCCCCNC1=O Amb27178124 [0,1,0,1,0,0|2,0,0]=4 1986 B12R1.215 O=C1C=CCCC=CCCCC1 Amb28198631 [0,1,0,1,0,0|0,0,1]=3 1987 B12R1.215 O=C1CC=CC#CCCCCC1 Amb27486088 [0,1,0,1,0,0|0,0,2]=4 1988 B12R1.215 O=C1CCCCCCCCCC1 Amb2778534 [0,1,0,1,0,0|0,0,2]=4 1989 B12R1.215 O=C1CCCCCCCCCN1 Amb26068652 [0,1,0,1,0,0|0,0,2]=4 1990 B12R1.215 O=C1CCCCCOCCCC1 Amb27177976 [0,1,0,1,0,0|0,0,2]=4 1991 B12R1.215 O=C1CCNCCCCCCN1 Amb25704380 [0,1,0,1,0,0|1,0,1]=4 1992 B12R1.215 O[C@H]1C=C=CCCCCCCC1 Amb27665486 [0,1,0,1,0,0|0,0,2]=4 1993 B12R1.291 CCCC1CCNC1C(=O)OC Amb33726850 [0,1,0,1,0,0|1,0,1]=4 1994 B12R1.348 CCCCC1CCNC(=O)CC1 Amb28129642 [0,1,0,1,0,0|1,0,1]=4 1995 B12R1.353 CC1CCCC1CNC(=O)CCl Amb27392255 [0,1,0,1,0,0|1,0,1]=4 1996 B12R1.353 CNC(=O)CNC1CCCC1C Amb27240472 [0,1,0,1,0,0|1,0,1]=4 1997 B12R1.353 CNC(=O)NCC1CCCC1C Amb28127040 [0,1,0,1,0,0|1,0,1]=4 1998 B12R1.353 COC(=O)C#CC1CCCC1C Amb28044321 [0,1,0,1,0,0|0,0,2]=4 1999 B12R1.353 COC(=O)NCC1CCCC1C Amb27203590 [0,1,0,1,0,0|1,0,1]=4 2000 B12R1.353 COC(=O)\C=C\C1CCCC1=O Amb25985953 [0,1,0,1,0,0|1,0,1]=4 2001 B12R1.365 CC1CCCCCN1C(=O)CN Amb27168188 [0,1,0,1,0,0|1,0,1]=4 2002 B12R1.365 COC(=O)C1=CCCCCC1=O Amb27178050 [0,1,0,1,0,0|1,0,1]=4 2003 B12R1.371 C=C(\C=C1\CCCNC1C)CC Amb27846846 [0,1,0,1,0,0|2,0,0]=4 2004 B12R1.371 CC1CCCCC1NC(=O)CBr Amb17326862 [0,1,0,1,0,0|1,0,1]=4 2005 B12R1.371 CC1CCCCC1NC(=O)CCl Amb1149865 [0,1,0,1,0,0|1,0,1]=4 2006 B12R1.371 CC1CCCCC1NC(=O)CN Amb6280373 [0,1,0,1,0,0|1,0,1]=4 2007 B12R1.371 CC1CCCCC1OC(=O)CN Amb18974496 [0,1,0,1,0,0|1,0,1]=4 2008 B12R1.371 CC1CCCCC1OC(=O)CO Amb27834792 [0,1,0,1,0,0|1,0,1]=4 2009 B12R1.371 CCS(=O)\N=C1/CCCCC1C Amb35685222 [0,1,0,1,0,0|2,0,0]=4 2010 B12R1.371 CNC(=O)CN1CCCCC1C Amb28138245 [0,1,0,1,0,0|1,0,1]=4 2011 B12R1.371 CNC(=O)N[C@@H]1CCCC[C@@H]1C Amb35746984 [0,1,0,1,0,0|1,0,1]=4 2012 B12R1.371 COC(=O)N[C@H]1CCCC[C@H]1C Amb27261699 [0,1,0,1,0,0|1,0,1]=4 2013 B12R1.371 COC(=O)\C=C1/CCCCC1C Amb32667121 [0,1,0,1,0,0|0,0,0]=2 2014 B12R1.371 COC(=O)\C=C1/CCCCC1Cl Amb27407106 [0,1,0,1,0,0|1,0,0]=3 2015 B12R1.371 COC(=O)\C=C1/NCCCC1C Amb27668886 [0,1,0,1,0,0|1,0,0]=3 2016 B12R1.371 COC(=O)\C=C1\CCCCC1C Amb25808199 [0,1,0,1,0,0|0,0,0]=2 2017 B12R1.371 COC(=O)\C=C1\CCOCC1C Amb25355108 [0,1,0,1,0,0|1,0,0]=3 2018 B12R1.371 COC(=O)\C=C1\NCCCC1C Amb28077089 [0,1,0,1,0,0|1,0,0]=3 2019 B12R1.371 C\C(=C\C1CCCCC1C)CCl Amb27658136 [0,1,0,1,0,0|1,0,1]=4 2020 B12R1.477 COC(=O)\C=C\NC1CCOC1 Amb27868927 [0,1,0,1,0,0|2,0,0]=4 2021 B12R1.477 COC(=O)\C=C\NC1CCSC1 Amb28320992 [0,1,0,1,0,0|2,0,0]=4 2022 B12R1.477 O=C(CBr)NCCC1CCCC1 Amb17329841 [0,1,0,1,0,0|1,0,1]=4 2023 B12R1.1659 COC(=O)C1CCCCCCC1 Amb24537636 [0,1,0,1,0,0|0,0,2]=4 2024 B12R1.1659 COC(=O)C1CCCCCCN1 Amb25246058 [0,1,0,1,0,0|1,0,1]=4 2025 B12R1.1659 COC(=O)N1CCCCCCC1 Amb2125356 [0,1,0,1,0,0|1,0,1]=4 2026 B12R1.1659 O=C(CCl)C1CCCCCCC1 Amb25294397 [0,1,0,1,0,0|0,0,2]=4 2027 B12R1.1659 O=C(CCl)N1CCCCCCC1 Amb2125573 [0,1,0,1,0,0|1,0,1]=4 2028 B12R1.1659 O=CC(O)C1=CCCCCCC1 Amb28319768 [0,1,0,1,0,0|1,0,1]=4 2029 B12R1.1659 OCC(O)C1=CCCCCCC1 Amb27652846 [0,1,0,1,0,0|0,0,2]=4 2030 B12R1.1748 CCC(=O)OC1CCCCCC1 Amb25154716 [0,1,0,1,0,0|1,0,1]=4 2031 B12R1.1748 CCS(=O)N=C1CCCCCC1 Amb35726576 [0,1,0,1,0,0|2,0,0]=4 2032 B12R1.1748 CNC(=O)CC1=CCCCCC1 Amb27659431 [0,1,0,1,0,0|0,0,2]=4 2033 B12R1.1748 COC(=O)C=C1CCCCCC1 Amb9826915 [0,1,0,1,0,0|0,0,0]=2 2034 B12R1.1748 COC(=O)C=C1COCCOC1 Amb28381079 [0,1,0,1,0,0|2,0,0]=4 2035 B12R1.1748 COC(=O)CC1CCCCCC1 Amb26860987 [0,1,0,1,0,0|0,0,2]=4 2036 B12R1.1748 COC(=O)\C=C1\CCCCCN1 Amb23510204 [0,1,0,1,0,0|1,0,0]=3 2037 B12R1.1748 COC(=O)\C=C1\CCCNCC1 Amb28129906 [0,1,0,1,0,0|1,0,0]=3 2038 B12R1.1748 COC(=O)\C=C1\CCCOCC1 Amb26864215 [0,1,0,1,0,0|1,0,0]=3 2039 B12R1.1748 COC(=O)\C=C1\CCCSCC1 Amb35691473 [0,1,0,1,0,0|1,0,0]=3 2040 B12R1.1748 NCC(=O)CC1CCCCCC1 Amb28206489 [0,1,0,1,0,0|0,0,2]=4 2041 B12R1.1748 NCC(=O)NC1CCCCCC1 Amb5783139 [0,1,0,1,0,0|1,0,1]=4 2042 B12R1.1748 NNC(=O)N=C1CCCCCC1 Amb2611252 [0,1,0,1,0,0|2,0,0]=4 2043 B12R1.1748 O=C(CBr)NC1CCCCCC1 Amb17324791 [0,1,0,1,0,0|1,0,1]=4 2044 B12R1.1748 O=C(CCl)CC1CCCCCC1 Amb27662588 [0,1,0,1,0,0|0,0,2]=4 2045 B12R1.1748 O=C(CCl)NC1CCCCCC1 Amb6599838 [0,1,0,1,0,0|1,0,1]=4 2046 B12R1.1748 O=C(CF)NC1CCCCCC1 Amb28041369 [0,1,0,1,0,0|1,0,1]=4 2047 B12R1.1748 O=C(CO)NC1CCCCCC1 Amb5798095 [0,1,0,1,0,0|1,0,1]=4 2048 B12R1.1748 O=C(CO)OC1CCCCCC1 Amb28047956 [0,1,0,1,0,0|1,0,1]=4 2049 B12R1.1748 O=C(CS)NC1CCCCCC1 Amb27393805 [0,1,0,1,0,0|1,0,1]=4 2050 B12R1.1759 CCC#CCCC1=C(C)C(=O)C1 Amb27175876 [0,1,0,1,0,0|0,0,2]=4 2051 B12R1.43 C=C(C)C(=O)NC1CCCCC1 Amb17933988 [0,1,0,1,0,0|2,0,0]=4 2052 B12R1.43 C=C(CC1CCCCC1)C(=O)O Amb27984845 [0,1,0,1,0,0|1,0,1]=4 2053 B12R1.43 CC(=O)C(=O)CC1CCCCC1 Amb24434603 [0,1,0,1,0,0|0,0,1]=3 2054 B12R1.43 CC(=O)C(=O)CC1CCCCN1 Amb27408275 [0,1,0,1,0,0|1,0,1]=4 2055 B12R1.43 CC(=O)C(=O)CN1CCCCC1 Amb28246576 [0,1,0,1,0,0|1,0,1]=4 2056 B12R1.43 CC(=O)C(=O)NC1CCCCC1 Amb17400306 [0,1,0,1,0,0|1,0,0]=3 2057 B12R1.43 CC(=O)C(C)NC1CCCCC1 Amb27441146 [0,1,0,1,0,0|1,0,1]=4 2058 B12R1.43 CC(=O)C(C)SC1CCCCC1 Amb19076175 [0,1,0,1,0,0|1,0,1]=4 2059 B12R1.43 CC(=O)\C(C)=C\C1CCCCC1 Amb28399038 [0,1,0,1,0,0|0,0,0]=2 2060 B12R1.43 CC(=O)\C(C)=C\C1CCCCO1 Amb35742239 [0,1,0,1,0,0|1,0,0]=3 2061 B12R1.43 CC(=O)\C(C)=C\C1CCOCC1 Amb27587450 [0,1,0,1,0,0|1,0,0]=3 2062 B12R1.43 CC(=O)\C(O)=C\N1CCOCC1 Amb28321935 [0,1,0,1,0,0|2,0,0]=4 2063 B12R1.43 C\C(=C/C1CCCCC1)C(C)Cl Amb27416772 [0,1,0,1,0,0|1,0,1]=4 2064 B12R1.43 C\C(=C/C1CCCCN1)C(=O)O Amb27247552 [0,1,0,1,0,0|2,0,0]=4 2065 B12R1.43 C\C(=C/C1CCCCO1)C(=O)O Amb35634609 [0,1,0,1,0,0|2,0,0]=4 2066 B12R1.43 C\C(=C/C1CCCNC1)C(=O)O Amb27850858 [0,1,0,1,0,0|2,0,0]=4 2067 B12R1.43 C\C(=C/C1CCNCC1)C(=O)O Amb27796028 [0,1,0,1,0,0|2,0,0]=4 2068 B12R1.43 O=C(O)C(=O)CC1CCCCC1 Amb18296282 [0,1,0,1,0,0|1,0,1]=4 2069 B12R1.43 O=C(O)C(=O)NC1CCCCC1 Amb2693954 [0,1,0,1,0,0|2,0,0]=4 2070 B12R1.43 O=C(O)C(=O)OC1CCCCC1 Amb28365635 [0,1,0,1,0,0|2,0,0]=4 2071 B12R1.43 O=C(O)\C(F)=C/C1CCCCC1 Amb28281955 [0,1,0,1,0,0|1,0,0]=3 2072 B12R1.43 O=C(O)\C(F)=C\C1CCCCC1 Amb24597554 [0,1,0,1,0,0|1,0,0]=3 2073 B12R1.43 O=C(O)\C(F)=C\C1CCCCO1 Amb35634610 [0,1,0,1,0,0|2,0,0]=4 2074 B12R1.43 O=C(O)\C(F)=C\C1CCCOC1 Amb28347522 [0,1,0,1,0,0|2,0,0]=4 2075 B12R1.43 O=C(O)\C(F)=C\C1CCNCC1 Amb27845232 [0,1,0,1,0,0|2,0,0]=4 2076 B12R1.80 CCC1CCCN1C(=O)C(=O)O Amb18950724 [0,1,0,1,0,0|2,0,0]=4 2077 B12R1.80 CCC1CCCN1C(C)C(C)=O Amb18793469 [0,1,0,1,0,0|1,0,1]=4 2078 B12R1.80 CCC1CCC\C1=C(\F)C(=O)O Amb27490545 [0,1,0,1,0,0|1,0,0]=3 2079 B12R1.80 CCC1COC\C1=C(\C)C(=O)O Amb35631909 [0,1,0,1,0,0|2,0,0]=4 2080 B12R1.80 CCC1COC\C1=C(\F)C(=O)O Amb35631910 [0,1,0,1,0,0|2,0,0]=4 2081 B12R1.124 CC1CCCCN1C(=O)C(=O)O Amb9303794 [0,1,0,1,0,0|2,0,0]=4 2082 B12R1.124 C\C(C(=O)O)=C1\CCCCC1C Amb27599516 [0,1,0,1,0,0|1,0,0]=3 2083 B12R1.231 C\C(=C\CN1CCC1C)C(=O)O Amb35585122 [0,1,0,1,0,0|2,0,0]=4 2084 B12R1.264 C=C(CCC1CCCC1)C(=O)O Amb33374531 [0,1,0,1,0,0|1,0,1]=4 2085 B12R1.264 CC(=O)C(=O)NCC1CCCC1 Amb27595373 [0,1,0,1,0,0|1,0,0]=3 2086 B12R1.264 CC(=O)C(=O)NCC1CCCO1 Amb17400347 [0,1,0,1,0,0|2,0,0]=4 2087 B12R1.264 CC(=O)C(=O)NCC1CCOC1 Amb27981448 [0,1,0,1,0,0|2,0,0]=4 2088 B12R1.264 C\C(=C/CC1CCCC1)C(=O)O Amb27866687 [0,1,0,1,0,0|1,0,0]=3 2089 B12R1.264 O=C(O)C(=O)CCC1CCCC1 Amb33378682 [0,1,0,1,0,0|1,0,1]=4 2090 B12R1.279 CCCN1C=C(C(C)=O)CCC1 Amb24467539 [0,1,0,1,0,0|1,0,1]=4 2091 B12R1.279 CCCN1CCC=C(C(=O)O)C1 Amb18635456 [0,1,0,1,0,0|2,0,0]=4 2092 B12R1.279 CCCN1CCC=C(C(C)=O)C1 Amb28044057 [0,1,0,1,0,0|1,0,0]=3 2093 B12R1.279 COCC1CCC=C(C(=O)O)O1 Amb17594301 [0,1,0,1,0,0|2,0,0]=4 2094 B12R1.385 CCCCC1CC=C(C)C(=O)C1 Amb28285851 [0,1,0,1,0,0|0,0,0]=2 2095 B12R1.385 CCCC[C@H]1CC(=O)C(C)=CO1 Amb27433161 [0,1,0,1,0,0|1,0,0]=3 2096 B12R1.457 CCCCCn1cc(N)c(C)n1 Amb32706615 [0,1,0,1,0,0|2,0,0]=4 2097 B12R1.1028 C[C@@H]1CCCCCC(=O)C(=O)C1 Amb28202301 [0,1,0,1,0,0|0,0,1]=3 2098 B12R1.1335 CC(=O)N1CCCCCCCC1 Amb25169087 [0,1,0,1,0,0|0,0,2]=4 2099 B12R1.1335 O=C(O)C1=CCCCCCCC1 Amb28325718 [0,1,0,1,0,0|1,0,0]=3 2100 B12R1.1385 CC(=O)C1(C)CCCCCCC1 Amb28199847 [0,1,0,1,0,0|0,0,2]=4 2101 B12R1.2197 C=C(C(=O)O)C1CCCCCC1 Amb33267274 [0,1,0,1,0,0|1,0,1]=4 2102 B12R1.2197 CC(=O)C(=O)N1CCCCCC1 Amb17400308 [0,1,0,1,0,0|1,0,0]=3 2103 B12R1.2197 CC(=O)C(=O)N1CCCNCC1 Amb28348613 [0,1,0,1,0,0|2,0,0]=4 2104 B12R1.2197 CC(=O)C(=O)N1CCCSCC1 Amb27835708 [0,1,0,1,0,0|2,0,0]=4 2105 B12R1.2197 CC(=O)C(C)C1CCCCCC1 Amb27771010 [0,1,0,1,0,0|0,0,2]=4 2106 B12R1.2197 CC(=O)N(C)C1CCCCCC1 Amb8326259 [0,1,0,1,0,0|1,0,1]=4 2107 B12R1.2197 CC(C(=O)O)=C1CCCCCC1 Amb27171923 [0,1,0,1,0,0|1,0,0]=3 2108 B12R1.2197 C\C(C(=O)O)=C1/CCCOCC1 Amb27433248 [0,1,0,1,0,0|2,0,0]=4 2109 B12R1.2197 C\C(C(=O)O)=C1/CCCSCC1 Amb35691475 [0,1,0,1,0,0|2,0,0]=4 2110 B12R1.2197 O=C(O)C(=O)C1CCCCCC1 Amb26371674 [0,1,0,1,0,0|1,0,1]=4 2111 B12R1.2197 O=C(O)C(=O)N1CCCCCC1 Amb2693952 [0,1,0,1,0,0|2,0,0]=4 2112 B12R1.2197 O=C(O)\C(F)=C1\CCCSCC1 Amb35691476 [0,1,0,1,0,0|2,0,0]=4 2113 B12R1.54 CC(=O)NCC(O)C1CCCC1 Amb27810072 [0,1,0,1,0,0|1,0,1]=4 2114 B12R1.54 CC(=O)\C=C\C(=O)N1CCCC1 Amb26599263 [0,1,0,1,0,0|1,0,1]=4 2115 B12R1.54 CC(=O)\C=C\C(C)C1CCCC1 Amb26428716 [0,1,0,1,0,0|0,0,0]=2 2116 B12R1.54 CC(C)=CCC(N)C1CCCC1 Amb30029221 [0,1,0,1,0,0|1,0,1]=4 2117 B12R1.54 CN(\C=C\C(=O)O)C1CCCC1 Amb27816710 [0,1,0,1,0,0|2,0,0]=4 2118 B12R1.54 O=C(O)\C=C\C(=O)C1CCCC1 Amb29873238 [0,1,0,1,0,0|1,0,1]=4 2119 B12R1.54 O=C(O)\C=C\S(=O)C1CCCC1 Amb28457944 [0,1,0,1,0,0|2,0,0]=4 2120 B12R1.131 CC(C)=CCC1(N)CCCC1C Amb35642690 [0,1,0,1,0,0|1,0,1]=4 2121 B12R1.210 CC(=O)CC1CCCCCC1Cl Amb28047319 [0,1,0,1,0,0|0,0,2]=4 2122 B12R1.210 CC(=O)CC1CCCCCN1C Amb27458157 [0,1,0,1,0,0|0,0,2]=4 2123 B12R1.210 CC(=O)C[C@H]1CCCCC[C@@H]1Cl Amb27844358 [0,1,0,1,0,0|0,0,2]=4 2124 B12R1.210 CC(=O)NC1=CCCCCC1=O Amb27169499 [0,1,0,1,0,0|1,0,1]=4 2125 B12R1.210 CC(=O)NC1CCCCCC1Br Amb28370391 [0,1,0,1,0,0|1,0,1]=4 2126 B12R1.210 CC(=O)NC1CCCCCC1C Amb27489458 [0,1,0,1,0,0|0,0,2]=4 2127 B12R1.210 CC(=O)NC1CCCCCC1N Amb27266098 [0,1,0,1,0,0|1,0,1]=4 2128 B12R1.210 CC(=O)\C=C1/CCCCCC1C Amb35734060 [0,1,0,1,0,0|0,0,0]=2 2129 B12R1.210 CC(C)=CC1CCCCCC1O Amb32945193 [0,1,0,1,0,0|1,0,1]=4 2130 B12R1.210 CC(C)=C[C@@H]1CCCCC[C@H]1O Amb32950758 [0,1,0,1,0,0|1,0,1]=4 2131 B12R1.210 CC(O)\C=C1\CCCCCC1C Amb35672747 [0,1,0,1,0,0|0,0,2]=4 2132 B12R1.210 CC1=C(CC(=O)O)CCCCC1 Amb27614696 [0,1,0,1,0,0|1,0,1]=4 2133 B12R1.210 CC1CCCCC\C1=C/C(=O)O Amb35721698 [0,1,0,1,0,0|1,0,0]=3 2134 B12R1.210 CC1CCCCC\C1=N/S(C)=O Amb35722114 [0,1,0,1,0,0|1,0,1]=4 2135 B12R1.210 O=C(O)\C=C1\CCCCCC1=O Amb29873240 [0,1,0,1,0,0|1,0,1]=4 2136 B12R1.374 CCCCC1CC(=O)CCC1C Amb25735768 [0,1,0,1,0,0|0,0,2]=4 2137 B12R1.528 CCCCOC1C=CS(=O)(=O)C1 Amb32711877 [0,1,0,1,0,0|2,0,0]=4 2138 B12R1.1009 CC(=O)NC1C(C)CCCC1C Amb25704120 [0,1,0,1,0,0|1,0,1]=4 2139 B12R1.1009 CC(=O)NC1[C@H](C)CCC[C@H]1C Amb28247113 [0,1,0,1,0,0|1,0,1]=4 2140 B12R1.1009 CC(=O)NN1C(C)CCCC1C Amb27652657 [0,1,0,1,0,0|2,0,0]=4 2141 B12R1.1009 CC(=O)N[C@H]1[C@@H](C)CCC[C@H]1C Amb27622130 [0,1,0,1,0,0|1,0,1]=4 2142 B12R1.1009 CC(=O)OC1C(C)CCCC1C Amb27954461 [0,1,0,1,0,0|1,0,1]=4 2143 B12R1.1009 CC1CCCC(O)\C1=C/C(=O)O Amb28118936 [0,1,0,1,0,0|1,0,0]=3 2144 B12R1.1009 CC1CCCC(O)\C1=C\C(=O)O Amb27788509 [0,1,0,1,0,0|1,0,0]=3 2145 B12R1.1157 CCC[C@@H]1CC(=O)CC[C@H](C)C1 Amb28074675 [0,1,0,1,0,0|0,0,2]=4 2146 B12R1.1343 CC(=O)C#CC1=CCCCCC1 Amb28199910 [0,1,0,1,0,0|0,0,2]=4 2147 B12R1.1343 CC(=O)CCC1CCCCCC1 Amb27468725 [0,1,0,1,0,0|0,0,2]=4 2148 B12R1.1343 CC(=O)CCN1CCCCCC1 Amb1136685 [0,1,0,1,0,0|0,0,2]=4 2149 B12R1.1343 CC(=O)NCC1CCCCCC1 Amb27208386 [0,1,0,1,0,0|0,0,2]=4 2150 B12R1.1343 CC(=O)NCC1CCCCCN1 Amb33038736 [0,1,0,1,0,0|1,0,1]=4 2151 B12R1.1343 CC(=O)NCC1CCCCNC1 Amb26605896 [0,1,0,1,0,0|1,0,1]=4 2152 B12R1.1343 CC(=O)NCC1CCCSCC1 Amb29883281 [0,1,0,1,0,0|1,0,1]=4 2153 B12R1.1343 CC(=O)N\N=C1\CCCOCC1 Amb27979408 [0,1,0,1,0,0|2,0,0]=4 2154 B12R1.1343 CC(=O)\C=C\C1CCCCCC1 Amb27968526 [0,1,0,1,0,0|0,0,0]=2 2155 B12R1.1343 CC(=O)\C=C\N1CCCCCC1 Amb22524689 [0,1,0,1,0,0|0,0,0]=2 2156 B12R1.1343 CC(Br)\C=C\C1CCCCCC1 Amb27416894 [0,1,0,1,0,0|1,0,1]=4 2157 B12R1.1343 CC(N)\C=C\C1CCCCCC1 Amb32954310 [0,1,0,1,0,0|1,0,1]=4 2158 B12R1.1343 CS(=O)\N=C\C1CCCCCC1 Amb35693177 [0,1,0,1,0,0|1,0,1]=4 2159 B12R1.1343 O=C(O)\C=C\C1=CCCCCC1 Amb28052137 [0,1,0,1,0,0|1,0,1]=4 2160 B12R1.1343 O=C(O)\C=C\C1CCCCCC1 Amb24715822 [0,1,0,1,0,0|1,0,0]=3 2161 B12R1.1343 O=C(O)\C=C\N1CCCCCC1 Amb27272954 [0,1,0,1,0,0|1,0,0]=3 2162 B12R1.1343 O=C(O)\C=C\N1CCCSCC1 Amb27190912 [0,1,0,1,0,0|2,0,0]=4 2163 B12R1.1343 O=[N+]([O-])\C=C\C1CCCCCC1 Amb33449464 [0,1,0,1,0,0|2,0,0]=4 2164 B12R1.3110 CC(=O)CCC1(C)CCCCC1 Amb28381165 [0,1,0,1,0,0|0,0,2]=4 2165 B12R1.3110 CC(=O)CCC1(O)CCCCC1 Amb27495367 [0,1,0,1,0,0|0,0,2]=4 2166 B12R1.3110 CC(=O)NCC1(C)CCCCC1 Amb28056742 [0,1,0,1,0,0|1,0,1]=4 2167 B12R1.3110 CC(=O)NCC1(F)CCCCC1 Amb27661965 [0,1,0,1,0,0|1,0,1]=4 2168 B12R1.3110 CC(=O)NCC1(N)CCCCC1 Amb28990857 [0,1,0,1,0,0|1,0,1]=4 2169 B12R1.3110 CC(=O)OCC1(C)CCCCC1 Amb27867457 [0,1,0,1,0,0|1,0,1]=4 2170 B12R1.3110 CC(=O)\C=C\C1(C)CCCCC1 Amb33417933 [0,1,0,1,0,0|0,0,0]=2 2171 B12R1.3110 CC(=O)\C=C\C1(C)CCOCC1 Amb33415155 [0,1,0,1,0,0|1,0,0]=3 2172 B12R1.3110 CC(Br)\C=C\C1(C)CCCCC1 Amb27191683 [0,1,0,1,0,0|1,0,1]=4 2173 B12R1.3110 CC(C)=CCC1(N)CCCCC1 Amb30029632 [0,1,0,1,0,0|1,0,1]=4 2174 B12R1.3110 CC(N)\C=C\C1(C)CCCCC1 Amb27965213 [0,1,0,1,0,0|1,0,1]=4 2175 B12R1.3110 CC1(\C=C\C(=O)O)CCCCC1 Amb33358910 [0,1,0,1,0,0|1,0,0]=3 2176 B12R1.3110 CC1(\C=C\C(=O)O)CCOCC1 Amb27983653 [0,1,0,1,0,0|2,0,0]=4 2177 B12R1.3110 CC1(\C=C\C(N)=O)CCCCC1 Amb24402966 [0,1,0,1,0,0|1,0,0]=3 2178 B12R1.3110 CC1(\C=C\[N+](=O)[O-])CCCCC1 Amb27191679 [0,1,0,1,0,0|2,0,0]=4 2179 B12R1.3110 CS(=O)\N=C\C1(C)CCCCC1 Amb29865970 [0,1,0,1,0,0|2,0,0]=4 2180 B12R1.21 CC(=O)CCC1CCC(C)CC1 Amb25262982 [0,1,0,1,0,0|0,0,2]=4 2181 B12R1.21 CC(=O)NCC1CCC(O)CC1 Amb27409703 [0,1,0,1,0,0|1,0,1]=4 2182 B12R1.21 CC(=O)OCC1CCC(C)CC1 Amb27640208 [0,1,0,1,0,0|1,0,1]=4 2183 B12R1.21 CC(=O)OCC1CCC(N)CC1 Amb27880617 [0,1,0,1,0,0|1,0,1]=4 2184 B12R1.21 CC(=O)SC[C@H]1CC[C@H](N)CC1 Amb32413279 [0,1,0,1,0,0|1,0,1]=4 2185 B12R1.21 CC(=O)\C=C/C1CC=C(C)CC1 Amb27177561 [0,1,0,1,0,0|0,0,2]=4 2186 B12R1.21 CC(=O)\C=C\C1=CCC(C)CC1 Amb27818185 [0,1,0,1,0,0|0,0,2]=4 2187 B12R1.21 CC(=O)\C=C\C1CCC(C)CC1 Amb33358787 [0,1,0,1,0,0|0,0,0]=2 2188 B12R1.21 CC(=O)\C=C\C1CCN(C)CC1 Amb33270336 [0,1,0,1,0,0|1,0,0]=3 2189 B12R1.21 CC(=O)\C=C\N1CCN(C)CC1 Amb24577835 [0,1,0,1,0,0|2,0,0]=4 2190 B12R1.21 CC(N)\C=C\C1CCC(C)CC1 Amb33380766 [0,1,0,1,0,0|1,0,1]=4 2191 B12R1.21 CC1CCC(\C=C\C(=O)O)CC1 Amb33225597 [0,1,0,1,0,0|1,0,0]=3 2192 B12R1.21 CC1CCC(\C=C\[N+](=O)[O-])CC1 Amb33449435 [0,1,0,1,0,0|2,0,0]=4 2193 B12R1.21 CC1CCC(\C=N\S(C)=O)CC1 Amb35722124 [0,1,0,1,0,0|2,0,0]=4 2194 B12R1.21 CN1CCC(\C=C\C(=O)O)CC1 Amb33079332 [0,1,0,1,0,0|2,0,0]=4 2195 B12R1.21 O=C(O)\C=C\N1CCC(F)CC1 Amb35592106 [0,1,0,1,0,0|2,0,0]=4 2196 B12R1.154 O=C1CCCC(O)CCCCO1 Amb27853898 [0,1,0,1,0,0|1,0,1]=4 2197 B12R1.224 CC(=O)OC1CCCC(C)C1C Amb27660600 [0,1,0,1,0,0|1,0,1]=4 2198 B12R1.224 CC(=O)OC1CCCC(O)C1C Amb27665428 [0,1,0,1,0,0|1,0,1]=4 2199 B12R1.224 CC(=O)\C=C1/CCCC(C)C1=O Amb27880652 [0,1,0,1,0,0|1,0,1]=4 2200 B12R1.224 CC1CCC\C(=C/C(=O)O)C1C Amb27954478 [0,1,0,1,0,0|1,0,0]=3 2201 B12R1.224 CC1CCC\C(=N/S(C)=O)C1C Amb35718506 [0,1,0,1,0,0|2,0,0]=4 2202 B12R1.368 CC(=O)C1=CCC[C@H]1[C@@H](O)CO Amb27966767 [0,1,0,1,0,0|1,0,0]=3 2203 B12R1.368 CC(=O)C1=CCC[C@H]1[C@H](O)CO Amb28052306 [0,1,0,1,0,0|1,0,0]=3 2204 B12R1.669 CCC1(C)CCCCC1C(C)=O Amb27948589 [0,1,0,1,0,0|0,0,2]=4 2205 B12R1.1020 CC1CCC\C(=C\C(=O)O)CC1 Amb33468165 [0,1,0,1,0,0|1,0,0]=3 2206 B12R1.1020 CC1CCC\C(=N/S(C)=O)CC1 Amb35718561 [0,1,0,1,0,0|2,0,0]=4 2207 B12R1.1020 CN1CCC\C(=C\C(=O)O)CC1 Amb33468659 [0,1,0,1,0,0|2,0,0]=4 2208 B12R1.2352 CCC1(C)CCCCCC(=O)C1 Amb27177879 [0,1,0,1,0,0|0,0,2]=4 2209 B12R1.2352 CC[C@@]1(C)CCCCCC(=O)C1 Amb27954062 [0,1,0,1,0,0|0,0,2]=4 2210 B12R1.29 CCCCC(N)c1ccc(C)o1 Amb18798878 [0,1,0,1,0,0|0,0,2]=4 2211 B12R1.29 CCCCC(N)c1ccc(C)s1 Amb6704332 [0,1,0,1,0,0|0,1,1]=4 2212 B12R1.125 C=C(C)\C=C\C1CCCCC1O Amb27972420 [0,1,0,1,0,0|1,0,0]=3 2213 B12R1.125 CC(=O)C#CC1=CCCCC1C Amb27861215 [0,1,0,1,0,0|0,0,2]=4 2214 B12R1.125 CC(=O)C=C=C1CCCC[C@@H]1Cl Amb27878746 [0,1,0,1,0,0|1,0,0]=3 2215 B12R1.125 CC(=O)CCC1CCCCN1C Amb25034626 [0,1,0,1,0,0|0,0,2]=4 2216 B12R1.125 CC(=O)CCN1CCCCC1C Amb7755660 [0,1,0,1,0,0|0,0,2]=4 2217 B12R1.125 CC(=O)C\C=C1/C=CCCC1C Amb27861489 [0,1,0,1,0,0|0,0,2]=4 2218 B12R1.125 CC(=O)C\C=C1/CCCC=C1C Amb27211924 [0,1,0,1,0,0|0,0,2]=4 2219 B12R1.125 CC(=O)C\C=C1\CCCC=C1C Amb27789962 [0,1,0,1,0,0|0,0,2]=4 2220 B12R1.125 CC(=O)NCC1CCCCC1N Amb27190710 [0,1,0,1,0,0|1,0,1]=4 2221 B12R1.125 CC(=O)NCC1CCCCC1O Amb27760777 [0,1,0,1,0,0|1,0,1]=4 2222 B12R1.125 CC(=O)NCC1CCCCN1C Amb28201206 [0,1,0,1,0,0|1,0,1]=4 2223 B12R1.125 CC(=O)NCC1CCNCC1C Amb26626243 [0,1,0,1,0,0|1,0,1]=4 2224 B12R1.125 CC(=O)NC[C@H]1CCCC[C@@H]1O Amb27790347 [0,1,0,1,0,0|1,0,1]=4 2225 B12R1.125 CC(=O)NC[C@H]1CCCC[C@H]1O Amb27208254 [0,1,0,1,0,0|1,0,1]=4 2226 B12R1.125 CC(=O)N\N=C1/CCCCC1C Amb27220027 [0,1,0,1,0,0|1,0,0]=3 2227 B12R1.125 CC(=O)O\C=C1\CCCCC1=O Amb25943440 [0,1,0,1,0,0|1,0,1]=4 2228 B12R1.125 CC(=O)\C=C\C1CCCCN1C Amb33322455 [0,1,0,1,0,0|0,0,0]=2 2229 B12R1.125 CC(C)=CCC1CCCCC1O Amb18805990 [0,1,0,1,0,0|1,0,1]=4 2230 B12R1.125 CC(C)=CCN1CCCCC1C Amb27662086 [0,1,0,1,0,0|1,0,1]=4 2231 B12R1.125 CC(C)=CC[C@H]1CCCC[C@H]1O Amb28194191 [0,1,0,1,0,0|1,0,1]=4 2232 B12R1.125 CC(Cl)\C=C\C1CCCCC1C Amb27658137 [0,1,0,1,0,0|1,0,1]=4 2233 B12R1.125 CC(N)\C=C\C1CCCCN1C Amb33322438 [0,1,0,1,0,0|1,0,1]=4 2234 B12R1.125 CC1CC=CCC1\C=C\C(=O)O Amb28343110 [0,1,0,1,0,0|1,0,1]=4 2235 B12R1.125 CC1CCCCC1\C=N\S(C)=O Amb35722138 [0,1,0,1,0,0|1,0,1]=4 2236 B12R1.125 CC1CCCCN1\C=C\C(=O)O Amb28071417 [0,1,0,1,0,0|1,0,0]=3 2237 B12R1.125 CC1CCCC\C1=N/CC(=O)O Amb27400353 [0,1,0,1,0,0|1,0,1]=4 2238 B12R1.125 CC1CSCCN1\C=C\C(=O)O Amb27646734 [0,1,0,1,0,0|2,0,0]=4 2239 B12R1.125 CN1CCCCC1\C=C\C(=O)O Amb33323102 [0,1,0,1,0,0|1,0,0]=3 2240 B12R1.125 CN1CCCCC1\C=C\[N+](=O)[O-] Amb33322707 [0,1,0,1,0,0|2,0,0]=4 2241 B12R1.127 CC(=O)CN1CC(O)CCC1C Amb27787155 [0,1,0,1,0,0|1,0,1]=4 2242 B12R1.127 CC(=O)CN1C[C@H](O)CC[C@H]1C Amb30011468 [0,1,0,1,0,0|1,0,1]=4 2243 B12R1.127 CC(=O)NC1CC(Cl)CCC1C Amb4010861 [0,1,0,1,0,0|1,0,1]=4 2244 B12R1.127 CC1CCC(C)\C(=C\C(=O)O)C1 Amb27616902 [0,1,0,1,0,0|1,0,0]=3 2245 B12R1.127 CC1CCC(C)\C(=N\S(C)=O)C1 Amb35692839 [0,1,0,1,0,0|2,0,0]=4 2246 B12R1.127 C[C@H]1C\C(=C/C(=O)O)[C@H](C)CS1 Amb28429574 [0,1,0,1,0,0|2,0,0]=4 2247 B12R1.252 CC(=O)CCC=C1CCCCC1 Amb2610904 [0,1,0,1,0,0|0,0,2]=4 2248 B12R1.252 CC(=O)CCCC1CCCCC1 Amb33359306 [0,1,0,1,0,0|0,0,2]=4 2249 B12R1.252 CC(=O)CCNC1CCCCC1 Amb18647221 [0,1,0,1,0,0|0,0,2]=4 2250 B12R1.252 CC(=O)NCCC1CCCCN1 Amb9725754 [0,1,0,1,0,0|1,0,1]=4 2251 B12R1.252 CC(=O)NCCC1CCCNC1 Amb18982294 [0,1,0,1,0,0|1,0,1]=4 2252 B12R1.252 CC(=O)NCCC1CCCNC1 Amb21960598 [0,1,0,1,0,0|1,0,1]=4 2253 B12R1.252 CC(=O)NCCC1CCNCC1 Amb1080251 [0,1,0,1,0,0|1,0,1]=4 2254 B12R1.252 CC(=O)NCNC1CCCCC1 Amb27770101 [0,1,0,1,0,0|1,0,1]=4 2255 B12R1.252 CC(=O)NOCC1CCCCO1 Amb28065582 [0,1,0,1,0,0|2,0,0]=4 2256 B12R1.252 CC(=O)\C=C\CC1CCCCC1 Amb32953373 [0,1,0,1,0,0|0,0,0]=2 2257 B12R1.252 CC(=O)\C=C\CN1CCOCC1 Amb26413357 [0,1,0,1,0,0|1,0,0]=3 2258 B12R1.252 CC(=O)\C=N\NC1CCCCC1 Amb27444785 [0,1,0,1,0,0|1,0,0]=3 2259 B12R1.252 CC(C)=CCCC1CCCCC1 Amb35582921 [0,1,0,1,0,0|1,0,1]=4 2260 B12R1.252 CC(C)=CCCC1CCCCN1 Amb35744179 [0,1,0,1,0,0|1,0,1]=4 2261 B12R1.252 CC(C)=CCCC1CCCNC1 Amb35624125 [0,1,0,1,0,0|1,0,1]=4 2262 B12R1.252 CC(C)=CCCC1CCOCC1 Amb35582922 [0,1,0,1,0,0|1,0,1]=4 2263 B12R1.252 CC(C)=CCCN1CCCCC1 Amb30023690 [0,1,0,1,0,0|1,0,1]=4 2264 B12R1.252 CC(C)=C\C=C/C1CCCCC1 Amb22546613 [0,1,0,1,0,0|1,0,0]=3 2265 B12R1.252 CC(N)\C=C\CC1CCCCC1 Amb33422123 [0,1,0,1,0,0|1,0,1]=4 2266 B12R1.252 CC(O)C\C=C\C1CCCCC1 Amb28244317 [0,1,0,1,0,0|0,0,2]=4 2267 B12R1.252 CS(=O)\N=C\CC1CCCCC1 Amb35693165 [0,1,0,1,0,0|1,0,1]=4 2268 B12R1.252 C\C(Cl)=C/CNC1CCCCC1 Amb27420006 [0,1,0,1,0,0|1,0,1]=4 2269 B12R1.252 NC(=O)N\N=C\C1CCCCC1 Amb27600436 [0,1,0,1,0,0|2,0,0]=4 2270 B12R1.252 O=C(Cl)\C=C\CN1CCCCC1 Amb25999147 [0,1,0,1,0,0|1,0,0]=3 2271 B12R1.252 O=C(O)C\C=C\C1CCCCC1 Amb26861470 [0,1,0,1,0,0|1,0,0]=3 2272 B12R1.252 O=C(O)C\C=C\C1CCOCC1 Amb26883733 [0,1,0,1,0,0|2,0,0]=4 2273 B12R1.252 O=C(O)\C=C\CC1CCCCC1 Amb26527903 [0,1,0,1,0,0|1,0,0]=3 2274 B12R1.252 O=C(O)\C=C\CC1OCCCO1 Amb25937883 [0,1,0,1,0,0|2,0,0]=4 2275 B12R1.252 O=C(O)\C=C\CN1CCCCC1 Amb18988789 [0,1,0,1,0,0|1,0,0]=3 2276 B12R1.252 O=C(O)\C=C\CN1CCCCC1 Amb30634362 [0,1,0,1,0,0|1,0,0]=3 2277 B12R1.252 O=C(O)\C=C\CN1CCOCC1 Amb18296130 [0,1,0,1,0,0|2,0,0]=4 2278 B12R1.252 O=C(O)\C=C\CN1CCOCC1 Amb33495166 [0,1,0,1,0,0|2,0,0]=4 2279 B12R1.252 O=C(O)\C=C\CN1CCSCC1 Amb18296451 [0,1,0,1,0,0|2,0,0]=4 2280 B12R1.252 O=C(O)\C=C\NC1CCCSC1 Amb27587576 [0,1,0,1,0,0|2,0,0]=4 2281 B12R1.252 O=C(O)\C=C\NC1CCSCC1 Amb27601144 [0,1,0,1,0,0|2,0,0]=4 2282 B12R1.252 O=[N+]([O-])\C=C\CC1CCCCC1 Amb33422419 [0,1,0,1,0,0|2,0,0]=4 2283 B12R1.895 C=C1CCC(C)C1\C=C\C(C)=O Amb27859448 [0,1,0,1,0,0|0,0,1]=3 2284 B12R1.895 C=C1CC[C@@H](C)[C@@H]1\C=C\C(C)=O Amb28285920 [0,1,0,1,0,0|0,0,1]=3 2285 B12R1.1267 CC(C)=CCCC1(O)CCC1C Amb35664043 [0,1,0,1,0,0|1,0,1]=4 2286 B12R1.1809 CC(=O)NCCC1(O)CCCC1 Amb35704642 [0,1,0,1,0,0|1,0,1]=4 2287 B12R1.1809 CC(=O)\C=C\CC1(C)CCCO1 Amb26043011 [0,1,0,1,0,0|1,0,0]=3 2288 B12R1.1809 CC(C)=CCCC1(N)CCCC1 Amb35738440 [0,1,0,1,0,0|1,0,1]=4 2289 B12R1.1809 CC(C)=CCCC1(O)CCCC1 Amb35664045 [0,1,0,1,0,0|1,0,1]=4 2290 B12R1.2277 CCCCC1(O)CCOC(=O)C1 Amb27495709 [0,1,0,1,0,0|1,0,1]=4 2291 B12R1.2277 CCCC[C@]1(C)CCCC(=O)C1 Amb27954111 [0,1,0,1,0,0|0,0,2]=4 2292 B12R1.2277 CCOCC1(C)CC(=O)C=CO1 Amb27389430 [0,1,0,1,0,0|2,0,0]=4 2293 B12R1.2277 COCCC1(C)CC(=O)C=CO1 Amb27860977 [0,1,0,1,0,0|2,0,0]=4 2294 B12R1.28 CCCOCC1CCNC(=O)C1 Amb32654949 [0,1,0,1,0,0|1,0,1]=4 2295 B12R1.75 CC(=O)CN1CCCCC1CO Amb18806940 [0,1,0,1,0,0|1,0,1]=4 2296 B12R1.75 CC(=O)NC1CCCCC1CN Amb27257787 [0,1,0,1,0,0|1,0,1]=4 2297 B12R1.75 CC(=O)NC1CCCCC1CO Amb27868462 [0,1,0,1,0,0|1,0,1]=4 2298 B12R1.75 CC(=O)N[C@H]1CCCC[C@H]1CO Amb28428478 [0,1,0,1,0,0|1,0,1]=4 2299 B12R1.75 CC(=O)O[C@H]1CCCC[C@@H]1CO Amb27420620 [0,1,0,1,0,0|1,0,1]=4 2300 B12R1.75 CCC1CCCCC1CC(C)=O Amb27495385 [0,1,0,1,0,0|0,0,2]=4 2301 B12R1.75 CCC1CCCCC1OC(C)=O Amb27766398 [0,1,0,1,0,0|0,0,2]=4 2302 B12R1.75 CCC1CCCC\C1=C\C(=O)O Amb33468654 [0,1,0,1,0,0|1,0,0]=3 2303 B12R1.75 CCC1CCCC\C1=N/S(C)=O Amb35692831 [0,1,0,1,0,0|1,0,1]=4 2304 B12R1.75 CCC1CCNCC1NC(C)=O Amb32677496 [0,1,0,1,0,0|1,0,1]=4 2305 B12R1.75 COC1CCCC\C1=N/S(C)=O Amb35685192 [0,1,0,1,0,0|2,0,0]=4 2306 B12R1.75 COC1COCC\C1=C/C(=O)O Amb27810547 [0,1,0,1,0,0|2,0,0]=4 2307 B12R1.75 CO[C@@H]1CCCC[C@@H]1NC(C)=O Amb28074111 [0,1,0,1,0,0|1,0,1]=4 2308 B12R1.75 CO[C@H]1CCCC[C@@H]1NC(C)=O Amb27956180 [0,1,0,1,0,0|1,0,1]=4 2309 B12R1.75 CSC1CCCCC1NC(C)=O Amb28067814 [0,1,0,1,0,0|1,0,1]=4 2310 B12R1.81 C=C(C)\C=C\N1CCC[C@H]1CO Amb27771030 [0,1,0,1,0,0|2,0,0]=4 2311 B12R1.81 C=C(C)\C=C\[C@@H]1CCC[C@@H]1C=O Amb27631316 [0,1,0,1,0,0|1,0,1]=4 2312 B12R1.81 CC(=O)NCC1CCCC1CBr Amb27178312 [0,1,0,1,0,0|1,0,1]=4 2313 B12R1.81 O=C(O)\C=C\N1CCC[C@@H]1CO Amb35711276 [0,1,0,1,0,0|2,0,0]=4 2314 B12R1.81 O=C(O)\C=C\N1CCC[C@H]1CO Amb35711274 [0,1,0,1,0,0|2,0,0]=4 2315 B12R1.130 CC(=O)CCCC1CCCN1C Amb33320329 [0,1,0,1,0,0|0,0,2]=4 2316 B12R1.130 CC(=O)NCCC1CCCN1C Amb35682238 [0,1,0,1,0,0|1,0,1]=4 2317 B12R1.130 CC(=O)NCC[C@@H]1CNC[C@H]1C Amb32696178 [0,1,0,1,0,0|1,0,1]=4 2318 B12R1.130 CC(=O)\C=C\CC1CCCC1=O Amb26927565 [0,1,0,1,0,0|0,0,1]=3 2319 B12R1.130 CC(=O)\C=C\CC1CCCN1C Amb33320331 [0,1,0,1,0,0|0,0,0]=2 2320 B12R1.130 CC(C)=CCCC1CCCC1Br Amb35618150 [0,1,0,1,0,0|1,0,1]=4 2321 B12R1.130 CC(C)=CCCC1CCCC1Cl Amb35618149 [0,1,0,1,0,0|1,0,1]=4 2322 B12R1.130 CC(C)=CCCC1CCCC1N Amb35744195 [0,1,0,1,0,0|1,0,1]=4 2323 B12R1.130 CC(C)=CCCC1CCCC1O Amb33212805 [0,1,0,1,0,0|1,0,1]=4 2324 B12R1.130 CC(C)=CCC[C@@H]1CCC[C@H]1O Amb32950032 [0,1,0,1,0,0|1,0,1]=4 2325 B12R1.130 CC(C)=CCNC1CCCC1C Amb27830225 [0,1,0,1,0,0|1,0,1]=4 2326 B12R1.130 CC(N)\C=C\CC1CCCN1C Amb33320339 [0,1,0,1,0,0|1,0,1]=4 2327 B12R1.130 CC1CCCC1N\C=C\C(=O)O Amb27172585 [0,1,0,1,0,0|1,0,0]=3 2328 B12R1.130 CC1COCC1N\C=C\C(=O)O Amb29878366 [0,1,0,1,0,0|2,0,0]=4 2329 B12R1.130 CC1OCCC1S\C=C\C(=O)O Amb27840755 [0,1,0,1,0,0|2,0,0]=4 2330 B12R1.130 CC1SCCC1N\C=C\C(=O)O Amb28251834 [0,1,0,1,0,0|2,0,0]=4 2331 B12R1.130 CN1CCCC1C\C=C\C(=O)O Amb33320769 [0,1,0,1,0,0|1,0,0]=3 2332 B12R1.130 CN1CCCC1C\C=C\[N+](=O)[O-] Amb33320401 [0,1,0,1,0,0|2,0,0]=4 2333 B12R1.130 O=C(O)\C=C\CC1CCCC1=O Amb25772855 [0,1,0,1,0,0|1,0,1]=4 2334 B12R1.130 O=C(O)\C=C\NC1CCCC1O Amb27266225 [0,1,0,1,0,0|2,0,0]=4 2335 B12R1.170 CCOC1CCCCCC(=O)C1 Amb27177931 [0,1,0,1,0,0|0,0,2]=4 2336 B12R1.255 CC(=O)CCCCC1CCCC1 Amb33448571 [0,1,0,1,0,0|0,0,2]=4 2337 B12R1.255 CC(=O)CCCCN1CCCC1 Amb9659031 [0,1,0,1,0,0|0,0,2]=4 2338 B12R1.255 CC(=O)\C=C\C=C\C1CCCC1 Amb27201338 [0,1,0,1,0,0|0,0,1]=3 2339 B12R1.255 CC(=O)\C=C\CCC1CCCC1 Amb33379446 [0,1,0,1,0,0|0,0,0]=2 2340 B12R1.255 CC(=O)\C=C\CCN1CCCC1 Amb33274871 [0,1,0,1,0,0|0,0,0]=2 2341 B12R1.255 CC(N)\C=C\CCC1CCCC1 Amb33379959 [0,1,0,1,0,0|1,0,1]=4 2342 B12R1.255 CC(N)\C=C\CCN1CCCC1 Amb33274835 [0,1,0,1,0,0|1,0,1]=4 2343 B12R1.255 NC(=O)N\N=C\CC1CCCC1 Amb28458417 [0,1,0,1,0,0|2,0,0]=4 2344 B12R1.255 O=C(O)\C=C\C=C\C1CCCC1 Amb28127009 [0,1,0,1,0,0|1,0,1]=4 2345 B12R1.255 O=C(O)\C=C\CCC1CCCC1 Amb33374577 [0,1,0,1,0,0|1,0,0]=3 2346 B12R1.255 O=C(O)\C=C\CCN1CCCC1 Amb33275245 [0,1,0,1,0,0|1,0,0]=3 2347 B12R1.255 O=C(O)\C=C\NCC1CCSC1 Amb28321166 [0,1,0,1,0,0|2,0,0]=4 2348 B12R1.255 O=[N+]([O-])\C=C\CCC1CCCC1 Amb33481467 [0,1,0,1,0,0|2,0,0]=4 2349 B12R1.255 O=[N+]([O-])\C=C\CCN1CCCC1 Amb33275166 [0,1,0,1,0,0|2,0,0]=4 2350 B12R1.283 CC(=O)N1CCCCC1CCBr Amb17103917 [0,1,0,1,0,0|1,0,1]=4 2351 B12R1.283 CC(=O)N1CCCCC1CCCl Amb17103644 [0,1,0,1,0,0|1,0,1]=4 2352 B12R1.283 CC(=O)N1CCCCC1CCN Amb17046292 [0,1,0,1,0,0|1,0,1]=4 2353 B12R1.283 CC(=O)N1CCCCC1CCO Amb5797426 [0,1,0,1,0,0|1,0,1]=4 2354 B12R1.283 CC(=O)N1CCCC[C@@H]1CCO Amb25295318 [0,1,0,1,0,0|1,0,1]=4 2355 B12R1.283 CC(=O)N1CCCC[C@H]1CCO Amb25700843 [0,1,0,1,0,0|1,0,1]=4 2356 B12R1.283 CCCC1=C(C(C)=O)CCCC1 Amb27614636 [0,1,0,1,0,0|0,0,1]=3 2357 B12R1.283 CCCC1CCCCC1C(C)=O Amb27762565 [0,1,0,1,0,0|0,0,2]=4 2358 B12R1.283 CCCC1CNCCN1C(C)=O Amb28285684 [0,1,0,1,0,0|1,0,1]=4 2359 B12R1.283 CCO[C@@H]1CCCC[C@H]1C(C)=O Amb28248007 [0,1,0,1,0,0|0,0,2]=4 2360 B12R1.289 CC(=O)\C=C1/NCCN1CCO Amb28240528 [0,1,0,1,0,0|2,0,0]=4 2361 B12R1.289 CCCC1COCC1NC(C)=O Amb35617217 [0,1,0,1,0,0|1,0,1]=4 2362 B12R1.289 CCCC1COC\C1=C/C(=O)O Amb35631892 [0,1,0,1,0,0|1,0,0]=3 2363 B12R1.289 CCCC1COC\C1=C/C(C)=O Amb35616357 [0,1,0,1,0,0|0,0,0]=2 2364 B12R1.289 CCCC1COC\C1=C/C(C)O Amb35608161 [0,1,0,1,0,0|0,0,2]=4 2365 B12R1.289 CCCC1COC\C1=N/S(C)=O Amb35616416 [0,1,0,1,0,0|2,0,0]=4 2366 B12R1.321 CCCCC1CC(=O)NCCN1 Amb27950409 [0,1,0,1,0,0|1,0,1]=4 2367 B12R1.321 CCCCN1CCCNC(=O)C1 Amb25938139 [0,1,0,1,0,0|1,0,1]=4 2368 B12R1.386 CC(=O)N1CCCC1CCCN Amb31161636 [0,1,0,1,0,0|1,0,1]=4 2369 B12R1.386 CCNCC1CCCN1C(C)=O Amb21861191 [0,1,0,1,0,0|1,0,1]=4 2370 B12R1.405 CC(=O)N1CCCCCC1CN Amb24671055 [0,1,0,1,0,0|1,0,1]=4 2371 B12R1.17 CCCC(C)C1CCCC(=O)C1 Amb27434180 [0,1,0,1,0,0|0,0,2]=4 2372 B12R1.17 CCOC(=O)C1CC=CC(=O)C1 Amb27177764 [0,1,0,1,0,0|1,0,1]=4 2373 B12R1.89 CCN1\C(=C\C(C)=O)CCC1C Amb27267198 [0,1,0,1,0,0|1,0,0]=3 2374 B12R1.233 CC(=O)CN1CCC(C)CC1C Amb18801420 [0,1,0,1,0,0|1,0,1]=4 2375 B12R1.233 CC(=O)N[C@H]1CC[C@@H](C)C[C@@H]1C Amb28325855 [0,1,0,1,0,0|1,0,1]=4 2376 B12R1.233 CC1CC\C(=N/S(C)=O)C(C)C1 Amb35693156 [0,1,0,1,0,0|2,0,0]=4 2377 B12R1.233 CC1CN(C)CC\C1=C/C(=O)O Amb28199651 [0,1,0,1,0,0|2,0,0]=4 2378 B12R1.861 CC1CC(O)CN1\C=C\C(=O)O Amb28455889 [0,1,0,1,0,0|2,0,0]=4 2379 B12R1.1007 CC1CCCCC(=O)CCCC1 Amb27177486 [0,1,0,1,0,0|0,0,2]=4 2380 B12R1.1007 O=C1CC=CCC(Cl)CCCC1 Amb27875110 [0,1,0,1,0,0|0,0,2]=4 2381 B12R1.1007 O=C1CCCCC(O)CCCC1 Amb4020519 [0,1,0,1,0,0|0,0,2]=4 2382 B12R1.1007 O=C1CCCCC(O)CCCO1 Amb27443581 [0,1,0,1,0,0|1,0,1]=4 2383 B12R1.2795 CC1(CN\C=C\C(=O)O)CCC1 Amb27199292 [0,1,0,1,0,0|2,0,0]=4 2384 B12R1.2795 O=C(O)\C=C\NCC1(O)CCC1 Amb27395241 [0,1,0,1,0,0|2,0,0]=4 2385 B12R2.24 C[C@@H]1C=C[C@H]2CCCC[C@H]2N1 Amb27423958 [0,0,0,2,0,0|1,0,1]=4 2386 B12R2.24 O=C1C=C2CCCCC2CC1 Amb17593740 [0,0,0,2,0,0|0,0,0]=2 2387 B12R2.24 O=C1C=C2CCCCC2OC1 Amb27970141 [0,0,0,2,0,0|1,0,0]=3 2388 B12R2.24 O=C1C=C2CCCC[C@@H]2CC1 Amb28074789 [0,0,0,2,0,0|0,0,0]=2 2389 B12R2.24 O=C1C=C2CCNCC2CC1 Amb27606458 [0,0,0,2,0,0|1,0,0]=3 2390 B12R2.24 O=C1C=C2CCOCC2CC1 Amb24467580 [0,0,0,2,0,0|1,0,0]=3 2391 B12R2.24 O=C1C=C2NCCCC2CC1 Amb24728266 [0,0,0,2,0,0|1,0,0]=3 2392 B12R2.24 O=C1C=C2OCCCC2CC1 Amb28284787 [0,0,0,2,0,0|1,0,0]=3 2393 B12R2.24 O=C1C=C[C@@H]2CC=CC[C@@H]2C1 Amb28351449 [0,0,0,2,0,0|0,0,2]=4 2394 B12R2.24 O=C1C=NC2CCCCC2N1 Amb28364406 [0,0,0,2,0,0|2,0,0]=4 2395 B12R2.24 O=C1CC2CCCCC2CN1 Amb27600042 [0,0,0,2,0,0|1,0,1]=4 2396 B12R2.24 O=C1CC2CCCCC2NN1 Amb28460723 [0,0,0,2,0,0|2,0,0]=4 2397 B12R2.24 O=C1CCC2=C(CCCC2)C1 Amb17593744 [0,0,0,2,0,0|0,0,2]=4 2398 B12R2.24 O=C1CCC2=C(CCCC2)O1 Amb26013850 [0,0,0,2,0,0|1,0,1]=4 2399 B12R2.24 O=C1CCC2CCCC=C2N1 Amb27598014 [0,0,0,2,0,0|1,0,1]=4 2400 B12R2.24 O=C1CCC2CCCCC2C1 Amb2782888 [0,0,0,2,0,0|0,0,2]=4 2401 B12R2.24 O=C1CCC2CCCCC2O1 Amb3361282 [0,0,0,2,0,0|1,0,1]=4 2402 B12R2.24 O=C1CCC2CCCCN2C1 Amb27950553 [0,0,0,2,0,0|1,0,1]=4 2403 B12R2.24 O=C1CCC2CCCC[C@H]2C1 Amb28122431 [0,0,0,2,0,0|0,0,2]=4 2404 B12R2.24 O=C1CC[C@@H]2CCCC[C@@H]2C1 Amb28246539 [0,0,0,2,0,0|0,0,2]=4 2405 B12R2.24 O=C1CC[C@@H]2CCCC[C@H]2C1 Amb17674190 [0,0,0,2,0,0|0,0,2]=4 2406 B12R2.24 O=C1CC[C@H]2CCCC[C@H]2O1 Amb24590114 [0,0,0,2,0,0|1,0,1]=4 2407 B12R2.24 O=C1CN[C@H]2CCCC[C@@H]2C1 Amb27794443 [0,0,0,2,0,0|1,0,1]=4 2408 B12R2.24 OC1C=C2CCCCC2CC1 Amb28067462 [0,0,0,2,0,0|0,0,2]=4 2409 B12R2.24 O[C@@H]1C=C[C@H]2CCCC[C@@H]2C1 Amb28321550 [0,0,0,2,0,0|0,0,2]=4 2410 B12R2.24 O[C@H]1C=C2CCCC[C@@H]2CC1 Amb27858028 [0,0,0,2,0,0|0,0,2]=4 2411 B12R2.162 CCC[C@@H]1[C@H]2CC[C@@H]1C(=O)C2 Amb27432605 [0,0,0,2,0,0|0,0,2]=4 2412 B12R2.203 CC1CC[C@@H]2CCCC(=O)[C@H]12 Amb27204873 [0,0,0,2,0,0|0,0,2]=4 2413 B12R2.203 C[C@@H]1CCC[C@H]2C=CC(=O)[C@H]21 Amb28321997 [0,0,0,2,0,0|0,0,0]=2 2414 B12R2.203 C[C@@H]1CCC[C@H]2CCC(=O)[C@H]21 Amb27802554 [0,0,0,2,0,0|0,0,2]=4 2415 B12R2.203 C[C@@H]1CC[C@@H]2CCCC(=O)[C@@H]21 Amb27844188 [0,0,0,2,0,0|0,0,2]=4 2416 B12R2.203 C[C@@H]1OCC[C@H]2C=CC(=O)[C@H]21 Amb27262860 [0,0,0,2,0,0|1,0,0]=3 2417 B12R2.203 C[C@H]1CCC[C@@H]2CCC(=O)[C@@H]12 Amb28052428 [0,0,0,2,0,0|0,0,2]=4 2418 B12R2.203 C[C@H]1CC[C@H]2CCCC(=O)[C@@H]12 Amb27216476 [0,0,0,2,0,0|0,0,2]=4 2419 B12R2.203 O=C1C=CC2CCCC(O)C12 Amb27948558 [0,0,0,2,0,0|1,0,0]=3 2420 B12R2.203 O=C1C=C[C@@H]2CCC[C@H](O)[C@H]12 Amb27262887 [0,0,0,2,0,0|1,0,0]=3 2421 B12R2.215 O=C1CC2CCCCC1CC2 Amb27256513 [0,0,0,2,0,0|0,0,2]=4 2422 B12R2.276 CCCC[C@H]1CC(=O)[C@@H]2C[C@H]12 Amb27427777 [0,0,0,2,0,0|0,0,2]=4 2423 B12R2.330 CC[C@@H]1C[C@H]2CN[C@@H]1C(=O)C2 Amb27782333 [0,0,0,2,0,0|1,0,1]=4 2424 B12R2.594 O=C1CC2CCCC(CN1)C2 Amb27224733 [0,0,0,2,0,0|1,0,1]=4 2425 B12R2.594 O=C1C[C@H]2CCC[C@@H](CN1)C2 Amb28052667 [0,0,0,2,0,0|1,0,1]=4 2426 B12R2.612 CC1CCC2CC(=O)NCC12 Amb28118427 [0,0,0,2,0,0|1,0,1]=4 2427 B12R2.612 C[C@H]1CC[C@@H]2CC(=O)NC[C@H]12 Amb27841094 [0,0,0,2,0,0|1,0,1]=4 2428 B12R2.1020 O=C1C=C2CCCCC(=C1)C2 Amb28202329 [0,0,0,2,0,0|0,0,2]=4 2429 B12R2.1020 O=C1C=C2CCCCC(C1)C2 Amb27164653 [0,0,0,2,0,0|0,0,0]=2 2430 B12R2.1020 O=C1C=C2CCCCC(C1)N2 Amb27823147 [0,0,0,2,0,0|1,0,0]=3 2431 B12R2.1081 BrC1C=CCC2CCCCC12 Amb27879580 [0,0,0,2,0,0|1,0,1]=4 2432 B12R2.1081 O=C1C=CCN2CCCC[C@@H]12 Amb28386556 [0,0,0,2,0,0|1,0,0]=3 2433 B12R2.1081 O=C1C=CC[C@@H]2C=CCC[C@H]12 Amb27227060 [0,0,0,2,0,0|0,0,2]=4 2434 B12R2.1081 O=C1C=CC[C@H]2C=CCC[C@H]12 Amb28202102 [0,0,0,2,0,0|0,0,2]=4 2435 B12R2.1081 O=C1CCCC2CCCCC12 Amb3941631 [0,0,0,2,0,0|0,0,2]=4 2436 B12R2.1081 O=C1CCC[C@@H]2CCCC[C@@H]12 Amb22800177 [0,0,0,2,0,0|0,0,2]=4 2437 B12R2.1081 O=C1NC=N[C@@H]2CCCC[C@@H]12 Amb28350400 [0,0,0,2,0,0|2,0,0]=4 2438 B12R2.1081 O=C1NC=N[C@H]2CCCC[C@@H]12 Amb27855677 [0,0,0,2,0,0|2,0,0]=4 2439 B12R2.1081 O=C1NCCC2CCNC=C12 Amb33803096 [0,0,0,2,0,0|2,0,0]=4 2440 B12R2.1081 O=C1NCCN2CCCC=C12 Amb22230752 [0,0,0,2,0,0|2,0,0]=4 2441 B12R2.1081 O=C1OCCC2CCNC=C12 Amb27945470 [0,0,0,2,0,0|2,0,0]=4 2442 B12R2.1081 O[C@@H]1C=CC[C@H]2CCCC[C@H]12 Amb27198135 [0,0,0,2,0,0|0,0,2]=4 2443 B12R2.1081 O[C@@H]1CCC[C@H]2CCCC=C12 Amb27969072 [0,0,0,2,0,0|0,0,2]=4 2444 B12R2.1081 O[C@H]1CCC[C@H]2CCCC=C12 Amb27219825 [0,0,0,2,0,0|0,0,2]=4 2445 B12R2.2092 CCCC[C@@H]1[C@@H]2CCC(=O)[C@@H]21 Amb27434195 [0,0,0,2,0,0|0,0,2]=4 2446 B12R2.2313 O=C1C=COC(C2CCC2)C1 Amb27948163 [0,0,0,2,0,0|1,0,0]=3 2447 B12R2.5121 O=C1C=COC2(CCCC2)C1 Amb25145775 [0,0,0,2,0,0|1,0,0]=3 2448 B12R2.5121 O=C1C=COC2(CCCO2)C1 Amb27262926 [0,0,0,2,0,0|2,0,0]=4 2449 B12R2.5121 O=C1CC2(CCCC2)CCN1 Amb26926734 [0,0,0,2,0,0|1,0,1]=4 2450 B12R2.5121 O=C1CC=CC2(CCCC2)C1 Amb24665746 [0,0,0,2,0,0|0,0,2]=4 2451 B12R2.6 Cc1ccn(C2CCCC2)n1 Amb6890637 [0,0,0,2,0,0|2,0,0]=4 2452 B12R2.6 O=C1C=CC(C2OCCO2)C1 Amb27260512 [0,0,0,2,0,0|2,0,0]=4 2453 B12R2.6 O=C1CC(C2CCCC2)CN1 Amb26641863 [0,0,0,2,0,0|1,0,1]=4 2454 B12R2.6 O=C1CC(C2CCCC2)NN1 Amb28453514 [0,0,0,2,0,0|2,0,0]=4 2455 B12R2.6 O=C1CCC(C2CCCC2)C1 Amb8503561 [0,0,0,2,0,0|0,0,2]=4 2456 B12R2.6 O=C1CC[C@H](C2CCCC2)C1 Amb28182520 [0,0,0,2,0,0|0,0,2]=4 2457 B12R2.6 O=C1COC(C2CCCC2)C1 Amb35734216 [0,0,0,2,0,0|1,0,1]=4 2458 B12R2.202 CC1CCCN2CC(=O)N=C12 Amb29850773 [0,0,0,2,0,0|2,0,0]=4 2459 B12R2.202 C[C@H]1CCC[C@@H]2CC(=O)CN12 Amb27802509 [0,0,0,2,0,0|1,0,1]=4 2460 B12R2.586 O=C1CCC2=C1C=CCCC2 Amb27605676 [0,0,0,2,0,0|0,0,2]=4 2461 B12R2.586 O=C1CC[C@@H]2CCCCC[C@H]12 Amb28351654 [0,0,0,2,0,0|0,0,2]=4 2462 B12R2.586 O=C1NC[C@@H]2CCCCC[C@H]12 Amb27853850 [0,0,0,2,0,0|1,0,1]=4 2463 B12R2.1041 Cc1cc2n(n1)CCCCC2 Amb22503920 [0,0,0,2,0,0|2,0,0]=4 2464 B12R2.1041 O=C1C=C2CCCCCC2C1 Amb26053092 [0,0,0,2,0,0|0,0,0]=2 2465 B12R2.1041 O=C1C=C2CCCCCC2O1 Amb27848525 [0,0,0,2,0,0|1,0,0]=3 2466 B12R2.1041 O=C1CC2CCCCCC2C1 Amb24486177 [0,0,0,2,0,0|0,0,2]=4 2467 B12R2.1041 O=C1CC2CCCCCN2C1 Amb27851753 [0,0,0,2,0,0|1,0,1]=4 2468 B12R2.1041 O=C1C[C@@H]2CCCCC[C@@H]2N1 Amb28455139 [0,0,0,2,0,0|1,0,1]=4 2469 B12R2.1041 O=C1C[C@H]2CCCCC[C@@H]2N1 Amb27446186 [0,0,0,2,0,0|1,0,1]=4 2470 B12R2.2298 O=C1CC(CCC2CC2)NN1 Amb35685995 [0,0,0,2,0,0|2,0,0]=4 2471 B12R2.2298 O=C1COC(CCC2CC2)C1 Amb35717184 [0,0,0,2,0,0|1,0,1]=4 2472 B12R2.2301 Cc1ccn(CC2CCC2)n1 Amb25873093 [0,0,0,2,0,0|2,0,0]=4 2473 B12R2.2314 CC1CCCC12CC(=O)CO2 Amb35726697 [0,0,0,2,0,0|1,0,1]=4 2474 B12R2.2314 CC1CCCC12CC(=O)NN2 Amb35685988 [0,0,0,2,0,0|2,0,0]=4 2475 B12R2.2314 CC1CCCC12CNC(=O)C2 Amb27399849 [0,0,0,2,0,0|1,0,1]=4 2476 B12R2.2918 O=C1C=CC2(C=CCCC2)C1 Amb27261967 [0,0,0,2,0,0|0,0,2]=4 2477 B12R2.2918 O=C1C=CC2(CCCCC2)C1 Amb28202155 [0,0,0,2,0,0|0,0,0]=2 2478 B12R2.2918 O=C1C=CC2(CCOCC2)C1 Amb35749436 [0,0,0,2,0,0|1,0,0]=3 2479 B12R2.2918 O=C1CC2(CCCCC2)CN1 Amb7990390 [0,0,0,2,0,0|1,0,1]=4 2480 B12R2.2918 O=C1CC2(CCCCC2)CO1 Amb25697017 [0,0,0,2,0,0|1,0,1]=4 2481 B12R2.2918 O=C1CC2(CCCCC2)NN1 Amb25062534 [0,0,0,2,0,0|2,0,0]=4 2482 B12R2.2918 O=C1CCC2(CCCCC2)C1 Amb28253675 [0,0,0,2,0,0|0,0,2]=4 2483 B12R2.550 O=C1CCCCCC2CC2C1 Amb28122424 [0,0,0,2,0,0|0,0,2]=4 2484 B12R2.1365 CC(=O)N1C2CCCC1CC2 Amb28285665 [0,0,0,2,0,0|1,0,1]=4 2485 B12R2.1387 CC(=O)C1=CCC2C=CC1C2 Amb28254273 [0,0,0,2,0,0|0,0,2]=4 2486 B12R2.1387 CC(=O)C1=CCC2CCC1N2 Amb28144950 [0,0,0,2,0,0|1,0,0]=3 2487 B12R2.1387 CC(=O)C1=CCC2CC[C@@H]1N2 Amb28200832 [0,0,0,2,0,0|1,0,0]=3 2488 B12R2.1387 CC(=O)C1=CC[C@@H]2CC[C@H]1N2 Amb25966064 [0,0,0,2,0,0|1,0,0]=3 2489 B12R2.1387 O=C(O)C1=CCC2CCC1N2 Amb27407691 [0,0,0,2,0,0|2,0,0]=4 2490 B12R2.1392 CC(=O)C1=CN2CCC1CC2 Amb24433803 [0,0,0,2,0,0|1,0,0]=3 2491 B12R2.1392 CC(=O)C1CC2CCC1CC2 Amb22728930 [0,0,0,2,0,0|0,0,2]=4 2492 B12R2.1392 CC(=O)N1CC2CCC1CC2 Amb27832910 [0,0,0,2,0,0|1,0,1]=4 2493 B12R2.1392 CC(=O)N1OC2CCC1CC2 Amb27768011 [0,0,0,2,0,0|2,0,0]=4 2494 B12R2.1392 NC(=O)C1=CC2CCC1CC2 Amb24465050 [0,0,0,2,0,0|1,0,0]=3 2495 B12R2.2028 CC1CC(=O)C2=C1CCCC2 Amb16191935 [0,0,0,2,0,0|0,0,2]=4 2496 B12R2.2028 CC1CC(=O)C2=CCCCC21 Amb28381255 [0,0,0,2,0,0|0,0,0]=2 2497 B12R2.2028 O=C1C[C@@H](O)[C@@H]2CCOC=C12 Amb27970193 [0,0,0,2,0,0|2,0,0]=4 2498 B12R2.2597 CC(=O)[C@@]12CCCC[C@@H]1[C@H]2C Amb28253707 [0,0,0,2,0,0|0,0,2]=4 2499 B12R2.7773 CCC1C2CCCC12C(C)=O Amb27599500 [0,0,0,2,0,0|0,0,2]=4 2500 B12R2.114 O=C1C=C2CCCC2CCN1 Amb27184113 [0,0,0,2,0,0|1,0,0]=3 2501 B12R2.114 O=C1C=CC[C@@H]2CCC[C@@H]2C1 Amb28411254 [0,0,0,2,0,0|0,0,0]=2 2502 B12R2.114 O=C1CCC[C@H]2CCC[C@@H]2C1 Amb27434256 [0,0,0,2,0,0|0,0,2]=4 2503 B12R2.246 C[C@@H]1CC(=O)C2=CCC[C@@H]2C1 Amb28324333 [0,0,0,2,0,0|0,0,0]=2 2504 B12R2.246 C[C@@H]1CC(=O)N[C@@H]2CCC[C@H]12 Amb24547017 [0,0,0,2,0,0|1,0,1]=4 2505 B12R2.246 C[C@H]1CC(=O)C2=CCC[C@H]2C1 Amb27785500 [0,0,0,2,0,0|0,0,0]=2 2506 B12R2.246 C[C@H]1CC(=O)N[C@H]2CCC[C@@H]12 Amb27879486 [0,0,0,2,0,0|1,0,1]=4 2507 B12R2.1362 CC(=O)C1=C2CCCC2OC1 Amb25992747 [0,0,0,2,0,0|1,0,0]=3 2508 B12R2.1362 CC(=O)C1=NOC2CCCC12 Amb24460782 [0,0,0,2,0,0|2,0,0]=4 2509 B12R2.1362 CC(=O)N1CCC2CCCC21 Amb26033416 [0,0,0,2,0,0|1,0,1]=4 2510 B12R2.1362 NC(=O)C1=C2CCCC2CC1 Amb27617409 [0,0,0,2,0,0|1,0,0]=3 2511 B12R2.1362 O=C(O)C1=C2CCCC2CC1 Amb27961330 [0,0,0,2,0,0|1,0,0]=3 2512 B12R2.1661 CC(=O)CC1CC2CCC1C2 Amb26854646 [0,0,0,2,0,0|0,0,2]=4 2513 B12R2.1661 CC(=O)CC1C[C@H]2CC[C@@H]1C2 Amb27844149 [0,0,0,2,0,0|0,0,2]=4 2514 B12R2.1661 CC(=O)N[C@H]1CC2CCC1C2 Amb25225741 [0,0,0,2,0,0|1,0,1]=4 2515 B12R2.1661 CC(=O)OC1CC2CCC1C2 Amb4014580 [0,0,0,2,0,0|1,0,1]=4 2516 B12R2.1661 CC(=O)OC1C[C@H]2CC[C@@H]1C2 Amb28254572 [0,0,0,2,0,0|1,0,1]=4 2517 B12R2.1661 CS(=O)\N=C1/CC2CCC1C2 Amb35685174 [0,0,0,2,0,0|2,0,0]=4 2518 B12R2.1661 NC(=O)\C=C1\CC2CCC1C2 Amb27461031 [0,0,0,2,0,0|1,0,0]=3 2519 B12R2.1661 O=C(O)\C=C1\CC2CCC1C2 Amb24509294 [0,0,0,2,0,0|1,0,0]=3 2520 B12R2.1661 O=[N+]([O-])\C=C1\CC2CCC1C2 Amb27635031 [0,0,0,2,0,0|2,0,0]=4 2521 B12R2.22 O=C1C=C(N2CCCCC2)C1 Amb27267191 [0,0,0,2,0,0|1,0,0]=3 2522 B12R2.22 O=C1C=C(N2CCOCC2)C1 Amb27164584 [0,0,0,2,0,0|2,0,0]=4 2523 B12R2.22 O=C1CC(C2CCCCC2)C1 Amb26984732 [0,0,0,2,0,0|0,0,2]=4 2524 B12R2.22 O=C1CC(C2CCCCC2)O1 Amb27445110 [0,0,0,2,0,0|1,0,1]=4 2525 B12R2.111 CC1CCCN1C2=CC(=O)C2 Amb27227259 [0,0,0,2,0,0|1,0,0]=3 2526 B12R2.1058 O=C1CC2(CCCCCC2)C1 Amb28314770 [0,0,0,2,0,0|0,0,2]=4 2527 B12R2.1058 O=C1CC2(CCCCCC2)N1 Amb26363368 [0,0,0,2,0,0|1,0,1]=4 2528 B12R2.1067 O=C1CC2=C1CCCCCC2 Amb28144214 [0,0,0,2,0,0|0,0,0]=2 2529 B12R2.1067 O=C1CC2CCCCCCC12 Amb27666446 [0,0,0,2,0,0|0,0,2]=4 2530 B12R2.1067 O=C1C[C@@H]2CCCCCC[C@H]12 Amb28429638 [0,0,0,2,0,0|0,0,2]=4 2531 B12R2.1067 O=C1NC2CCCCCCC12 Amb20667702 [0,0,0,2,0,0|1,0,1]=4 2532 B12R2.1067 O=C1N[C@@H]2CCCCCC[C@H]12 Amb26891895 [0,0,0,2,0,0|1,0,1]=4 2533 B12R2.1067 O=C1N[C@H]2CCCCCC[C@@H]12 Amb27207647 [0,0,0,2,0,0|1,0,1]=4 2534 B12R2.19 CC12CCC=CC1=CC(=O)C2 Amb27861359 [0,0,0,2,0,0|0,0,2]=4 2535 B12R2.19 C[C@@]12CCCC[C@@H]1CC(=O)C2 Amb27844101 [0,0,0,2,0,0|0,0,2]=4 2536 B12R2.19 C[C@@]12CCCC[C@H]1CC(=O)C2 Amb27818183 [0,0,0,2,0,0|0,0,2]=4 2537 B12R2.19 C[C@]12CCCC[C@H]1CC(=O)C2 Amb25179810 [0,0,0,2,0,0|0,0,2]=4 2538 B12R2.1412 CC(=O)NC12CCCCC1C2 Amb35724139 [0,0,0,2,0,0|1,0,1]=4 2539 B12R2.3190 CC(=O)C1=C2CCCCC2C1 Amb28054838 [0,0,0,2,0,0|0,0,0]=2 2540 B12R2.3190 CC(=O)C1=CC2CCCCC12 Amb24647660 [0,0,0,2,0,0|0,0,0]=2 2541 B12R2.3190 CC(=O)[C@H]1C[C@@H]2CCCC[C@@H]21 Amb27227096 [0,0,0,2,0,0|0,0,2]=4 2542 B12R2.3190 CC(=O)[C@H]1C[C@H]2CCCC[C@@H]12 Amb27199096 [0,0,0,2,0,0|0,0,2]=4 2543 B12R2.3190 NC(=O)C1=C2CCCCC2C1 Amb27968835 [0,0,0,2,0,0|1,0,0]=3 2544 B12R2.3190 O=C(O)C1=C[C@@H]2CCCC[C@H]12 Amb33620433 [0,0,0,2,0,0|1,0,0]=3 2545 B12R2.3255 CC(=O)NC1CCCC2CC21 Amb28077688 [0,0,0,2,0,0|1,0,1]=4 2546 B12R2.3255 CC(=O)\C=C1\CCCC2CC12 Amb27981123 [0,0,0,2,0,0|0,0,0]=2 2547 B12R2.3255 CS(=O)\N=C1/CCCC2CC12 Amb35718553 [0,0,0,2,0,0|2,0,0]=4 2548 B12R2.83 O=C1C=CC2CCCC2C=C1 Amb28202142 [0,0,0,2,0,0|0,0,2]=4 2549 B12R2.83 O=C1C=C[C@H]2CCC[C@H]2C=C1 Amb27861454 [0,0,0,2,0,0|0,0,2]=4 2550 B12R2.83 O=C1CCC2CCCC2CC1 Amb17593806 [0,0,0,2,0,0|0,0,2]=4 2551 B12R2.83 O=C1CCC2CCCC2CN1 Amb24689525 [0,0,0,2,0,0|1,0,1]=4 2552 B12R2.83 O=C1CC[C@@H]2CCC[C@@H]2CN1 Amb27207694 [0,0,0,2,0,0|1,0,1]=4 2553 B12R2.84 CC12CCCC1CCC(=O)C2 Amb27261978 [0,0,0,2,0,0|0,0,2]=4 2554 B12R2.252 CC(=O)N1C[C@H]2CCC[C@H]2C1 Amb28072858 [0,0,0,2,0,0|1,0,1]=4 2555 B12R2.252 NC(=O)C1=CC2CCCC2C1 Amb28123188 [0,0,0,2,0,0|1,0,0]=3 2556 B12R2.252 O=C(O)C1=CC2CCCC2C1 Amb26994706 [0,0,0,2,0,0|1,0,0]=3 2557 B12R2.1370 CC(=O)NCC12CCCC1C2 Amb35692004 [0,0,0,2,0,0|1,0,1]=4 2558 B12R2.1413 O=C(O)\C=C1/CC2CCCC12 Amb23512877 [0,0,0,2,0,0|1,0,0]=3 2559 B12R2.1413 O=C(O)\C=C1\C[C@@H]2CCC[C@H]12 Amb27451007 [0,0,0,2,0,0|1,0,0]=3 2560 B12R2.250 CC(=O)C1CC12CCCCC2 Amb27215552 [0,0,0,2,0,0|0,0,2]=4 2561 B12R2.250 CC(=O)C1OC12CCCCC2 Amb28351539 [0,0,0,2,0,0|1,0,1]=4 2562 B12R2.250 CC(=O)N1CC12CCCCC2 Amb24078312 [0,0,0,2,0,0|1,0,1]=4 2563 B12R2.1381 CC(=O)CCC1CC2CC2C1 Amb35624457 [0,0,0,2,0,0|0,0,2]=4 2564 B12R2.1381 CC(=O)NCC1CC2CC2C1 Amb35622780 [0,0,0,2,0,0|1,0,1]=4 2565 B12R2.1381 CC(=O)\C=C\C1CC2CC2C1 Amb35598472 [0,0,0,2,0,0|0,0,0]=2 2566 B12R2.1381 CC(Br)\C=C\C1CC2CC2C1 Amb35598505 [0,0,0,2,0,0|1,0,1]=4 2567 B12R2.1381 CC(Cl)\C=C\C1CC2CC2C1 Amb35598504 [0,0,0,2,0,0|1,0,1]=4 2568 B12R2.1381 CC(N)\C=C\C1CC2CC2C1 Amb35598670 [0,0,0,2,0,0|1,0,1]=4 2569 B12R2.1381 CC(O)\C=C\C1CC2CC2C1 Amb35598833 [0,0,0,2,0,0|0,0,2]=4 2570 B12R2.1381 CS(=O)\N=C\C1CC2CC2C1 Amb35668828 [0,0,0,2,0,0|2,0,0]=4 2571 B12R2.1381 O=C(O)\C=C\C1CC2CC2C1 Amb33470056 [0,0,0,2,0,0|1,0,0]=3 2572 B12R2.1381 O=C(O)\C=C\N1CC2CC2C1 Amb27491069 [0,0,0,2,0,0|2,0,0]=4 2573 B12R2.1381 O=[N+]([O-])\C=C\C1CC2CC2C1 Amb35668931 [0,0,0,2,0,0|2,0,0]=4 2574 B12R2.2474 O=C1CCCCCC[C@@H]2C[C@H]12 Amb28429558 [0,0,0,2,0,0|0,0,2]=4 2575 B12R2.2474 O=C1CCCCCC[C@H]2C[C@@H]12 Amb27435391 [0,0,0,2,0,0|0,0,2]=4 2576 B12R2.2474 O[C@@H]1C=CCCCC[C@H]2C[C@@H]12 Amb28345000 [0,0,0,2,0,0|0,0,2]=4 2577 B12R2.229 O=C1C=CCC[C@@H]2CCCC12 Amb27227133 [0,0,0,2,0,0|0,0,0]=2 2578 B12R2.229 O=C1CCCCC2=C1C=NC2 Amb27218360 [0,0,0,2,0,0|1,0,1]=4 2579 B12R2.229 O=C1NCCCC2CCCC12 Amb25046678 [0,0,0,2,0,0|1,0,1]=4 2580 B12R2.229 O=C1NCCC[C@@H]2CCC[C@H]12 Amb27767881 [0,0,0,2,0,0|1,0,1]=4 2581 B12R2.229 O=C1NCCC[C@H]2CCC[C@@H]12 Amb25248002 [0,0,0,2,0,0|1,0,1]=4 2582 B12R2.2017 C1=C2CCCCC(CCC1)N2 Amb27798332 [0,0,0,2,0,0|1,0,1]=4 2583 B12R2.1655 CC(=O)CC1CCC2CC2C1 Amb35704914 [0,0,0,2,0,0|0,0,2]=4 2584 B12R2.1655 CC(=O)CN1CCC2CC2C1 Amb35631231 [0,0,0,2,0,0|1,0,1]=4 2585 B12R2.959 CCC[C@@H]1CC(=O)[C@H]2O[C@H]2C1 Amb27252296 [0,0,0,2,0,0|1,0,1]=4 2586 B12R2.3161 CC(=O)CCC1CC12CCC2 Amb28052749 [0,0,0,2,0,0|0,0,2]=4 2587 B12R2.1357 CC(=O)C12CCCCCC1C2 Amb28199934 [0,0,0,2,0,0|0,0,2]=4 2588 B12R2.1658 CC(=O)CN1CC2CCC2C1 Amb35626494 [0,0,0,2,0,0|1,0,1]=4 2589 B12R2.254 CC(=O)C1CCC12CCCC2 Amb29874091 [0,0,0,2,0,0|0,0,2]=4 2590 B12R2.1356 CC(=O)N1CCCC1C2CC2 Amb27840385 [0,0,0,2,0,0|1,0,1]=4