0 B9R0.2 C#CCCCCCC(=O)O Amb22232010 [0,0,0,0,0,0|0,0,4]=4 1 B9R0.2 C#CCCCSCC(=O)O Amb27984745 [0,0,0,0,0,0|1,0,3]=4 2 B9R0.2 C#CCCC\C=C\C(C)=O Amb25205680 [0,0,0,0,0,0|1,0,2]=3 3 B9R0.2 C#CCOC\C=C\C(C)=O Amb26528467 [0,0,0,0,0,0|2,0,2]=4 4 B9R0.2 C=C(Br)CNCCCCC Amb27641587 [0,0,0,0,0,0|3,0,1]=4 5 B9R0.2 C=C(Br)CSCCCCC Amb27810009 [0,0,0,0,0,0|3,0,1]=4 6 B9R0.2 C=C(C)C#CCCCCC Amb27593421 [0,0,0,0,0,0|2,0,2]=4 7 B9R0.2 C=C(C)CCCCCCC Amb6298940 [0,0,0,0,0,0|2,0,2]=4 8 B9R0.2 C=C(C)CNCCCCC Amb17308711 [0,0,0,0,0,0|3,0,1]=4 9 B9R0.2 C=C(C)COCCCCC Amb27862423 [0,0,0,0,0,0|3,0,1]=4 10 B9R0.2 C=C(C)CSCCCCC Amb27977453 [0,0,0,0,0,0|3,0,1]=4 11 B9R0.2 C=C(C)\C=C\C=C\CCC Amb22641687 [0,0,0,0,0,0|2,0,2]=4 12 B9R0.2 C=C(C)\C=C\CCCC=O Amb18643329 [0,0,0,0,0,0|3,0,1]=4 13 B9R0.2 C=C(C)\C=C\OCCCO Amb27647918 [0,0,0,0,0,0|4,0,0]=4 14 B9R0.2 C=CCCCCCC(=O)O Amb6299579 [0,0,0,0,0,0|0,0,4]=4 15 B9R0.2 C=CCCCNCC(=O)O Amb28119977 [0,0,0,0,0,0|1,0,3]=4 16 B9R0.2 C=CCCCOCC(=O)O Amb27217276 [0,0,0,0,0,0|1,0,3]=4 17 B9R0.2 C=CCCCSCC(=O)O Amb27838988 [0,0,0,0,0,0|1,0,3]=4 18 B9R0.2 C=CCCC\C=C\C(C)=O Amb27628550 [0,0,0,0,0,0|1,0,2]=3 19 B9R0.2 C=CCCN\C=C\C(=O)O Amb27474278 [0,0,0,0,0,0|1,0,2]=3 20 B9R0.2 C=CCC\C=C\CC(=O)O Amb18643551 [0,0,0,0,0,0|0,0,4]=4 21 B9R0.2 CC(=O)CCCCCCN Amb25147578 [0,0,0,0,0,0|2,0,2]=4 22 B9R0.2 CC(=O)CCCCCCN Amb32663700 [0,0,0,0,0,0|2,0,2]=4 23 B9R0.2 CC(=O)CNCCCCN Amb33483477 [0,0,0,0,0,0|3,0,1]=4 24 B9R0.2 CC(=O)CNCCCCN Amb33483478 [0,0,0,0,0,0|3,0,1]=4 25 B9R0.2 CC(=O)CSCCCCF Amb27952719 [0,0,0,0,0,0|3,0,1]=4 26 B9R0.2 CC(=O)CSCCCCN Amb17500952 [0,0,0,0,0,0|3,0,1]=4 27 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [0,0,0,0,0,0|3,0,1]=4 28 B9R0.2 CC(=O)NCCCCCN Amb18102716 [0,0,0,0,0,0|3,0,1]=4 29 B9R0.2 CC(=O)OCCCCCBr Amb8516155 [0,0,0,0,0,0|3,0,1]=4 30 B9R0.2 CC(=O)OCCCCCCl Amb2778974 [0,0,0,0,0,0|3,0,1]=4 31 B9R0.2 CC(=O)\C=C\CCCCBr Amb24477141 [0,0,0,0,0,0|2,0,0]=2 32 B9R0.2 CC(=O)\C=C\CCCCCl Amb27599396 [0,0,0,0,0,0|2,0,0]=2 33 B9R0.2 CC(=O)\C=C\CCCCO Amb24518640 [0,0,0,0,0,0|2,0,0]=2 34 B9R0.2 CC(=O)\N=C\CCCCO Amb27169910 [0,0,0,0,0,0|3,0,0]=3 35 B9R0.2 CC(C)=CCCCCCCl Amb27879457 [0,0,0,0,0,0|3,0,1]=4 36 B9R0.2 CC(S)\C=C\CCCCO Amb27486620 [0,0,0,0,0,0|2,1,1]=4 37 B9R0.2 CCC#CCCCC(=O)O Amb27628844 [0,0,0,0,0,0|0,0,4]=4 38 B9R0.2 CCC#CCOCC(=O)O Amb27425006 [0,0,0,0,0,0|1,0,3]=4 39 B9R0.2 CCCC#CCCC(=O)O Amb27663886 [0,0,0,0,0,0|0,0,4]=4 40 B9R0.2 CCCC#C\C=C/C(=O)O Amb27435469 [0,0,0,0,0,0|0,0,2]=2 41 B9R0.2 CCCC#C\C=C\C(=O)O Amb27202812 [0,0,0,0,0,0|0,0,2]=2 42 B9R0.2 CCCC=C=CCC(=O)O Amb27814505 [0,0,0,0,0,0|0,0,3]=3 43 B9R0.2 CCCCC#CCC(=O)O Amb26327934 [0,0,0,0,0,0|0,0,3]=3 44 B9R0.2 CCCCC=C=CC(=O)O Amb17593544 [0,0,0,0,0,0|0,0,2]=2 45 B9R0.2 CCCCCC#CC(=O)Cl Amb27950037 [0,0,0,0,0,0|1,0,2]=3 46 B9R0.2 CCCCCC#CC(=O)O Amb2778506 [0,0,0,0,0,0|0,0,2]=2 47 B9R0.2 CCCCCC#CC(O)O Amb27978450 [0,0,0,0,0,0|0,0,4]=4 48 B9R0.2 CCCCCCCB(O)O Amb13890611 [0,0,0,0,0,0|1,0,3]=4 49 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [0,0,0,0,0,0|1,0,2]=3 50 B9R0.2 CCCCCCCC(=O)O Amb3940371 [0,0,0,0,0,0|0,0,2]=2 51 B9R0.2 CCCCCCCC(=O)S Amb10561702 [0,0,0,0,0,0|0,1,2]=3 52 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [0,0,0,0,0,0|0,0,3]=3 53 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [0,0,0,0,0,0|0,0,3]=3 54 B9R0.2 CCCCCCCC(C)=O Amb6891951 [0,0,0,0,0,0|1,0,2]=3 55 B9R0.2 CCCCCCCC(N)=O Amb8999028 [0,0,0,0,0,0|1,0,2]=3 56 B9R0.2 CCCCCCCP(O)O Amb28042243 [0,0,0,0,0,0|1,0,3]=4 57 B9R0.2 CCCCCCCS(=O)Cl Amb32720351 [0,0,0,0,0,0|2,0,2]=4 58 B9R0.2 CCCCCCCS(=O)[O-] Amb32754186 [0,0,0,0,0,0|1,0,3]=4 59 B9R0.2 CCCCCCCS(N)=O Amb32720352 [0,0,0,0,0,0|2,0,2]=4 60 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,0,0,0,0,0|1,0,3]=4 61 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,0,0,0,0,0|1,0,3]=4 62 B9R0.2 CCCCCCC[N+](=O)[O-] Amb17672611 [0,0,0,0,0,0|1,0,3]=4 63 B9R0.2 CCCCCCNC(C)=O Amb3368460 [0,0,0,0,0,0|2,0,1]=3 64 B9R0.2 CCCCCCNC(N)=O Amb23569596 [0,0,0,0,0,0|2,0,1]=3 65 B9R0.2 CCCCCCNC(N)=S Amb1152526 [0,0,0,0,0,0|2,1,1]=4 66 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [0,0,0,0,0,0|2,0,1]=3 67 B9R0.2 CCCCCCOC(=S)[S-] Amb594881 [0,0,0,0,0,0|1,2,1]=4 68 B9R0.2 CCCCCCOC(C)=O Amb8513414 [0,0,0,0,0,0|2,0,1]=3 69 B9R0.2 CCCCCCOC(C)O Amb28347016 [0,0,0,0,0,0|2,0,2]=4 70 B9R0.2 CCCCCCOC(N)=O Amb22495526 [0,0,0,0,0,0|2,0,1]=3 71 B9R0.2 CCCCCCO[N+](=O)[O-] Amb27233862 [0,0,0,0,0,0|2,0,2]=4 72 B9R0.2 CCCCCCSC(=N)N Amb20676030 [0,0,0,0,0,0|3,0,1]=4 73 B9R0.2 CCCCCCSC(=N)N Amb22487386 [0,0,0,0,0,0|3,0,1]=4 74 B9R0.2 CCCCCCSC(=N)N Amb27811857 [0,0,0,0,0,0|3,0,1]=4 75 B9R0.2 CCCCCCSC(=O)Cl Amb28421765 [0,0,0,0,0,0|2,0,1]=3 76 B9R0.2 CCCCCCSC(C)=O Amb27837874 [0,0,0,0,0,0|2,0,1]=3 77 B9R0.2 CCCCCCSC(N)=S Amb28342219 [0,0,0,0,0,0|2,1,1]=4 78 B9R0.2 CCCCCC\C=C(\C)I Amb28464058 [0,0,0,0,0,0|2,0,1]=3 79 B9R0.2 CCCCCNCC(N)=O Amb6708061 [0,0,0,0,0,0|2,0,1]=3 80 B9R0.2 CCCCCOCC(=O)O Amb8902706 [0,0,0,0,0,0|1,0,1]=2 81 B9R0.2 CCCCCOC[C@H](C)O Amb27620605 [0,0,0,0,0,0|2,0,2]=4 82 B9R0.2 CCCCCONC(N)=O Amb2899790 [0,0,0,0,0,0|3,0,0]=3 83 B9R0.2 CCCCCSCC(=O)O Amb6249571 [0,0,0,0,0,0|1,0,1]=2 84 B9R0.2 CCCCC\C=C/C(C)C Amb22546691 [0,0,0,0,0,0|2,0,1]=3 85 B9R0.2 CCCCC\C=C\B(O)O Amb10068584 [0,0,0,0,0,0|1,0,1]=2 86 B9R0.2 CCCCC\C=C\C(C)C Amb22546757 [0,0,0,0,0,0|2,0,1]=3 87 B9R0.2 CCCCC\C=C\C(C)O Amb27472596 [0,0,0,0,0,0|1,0,1]=2 88 B9R0.2 CCCCC\C=C\[C@H](C)O Amb27852185 [0,0,0,0,0,0|1,0,1]=2 89 B9R0.2 CCCCNCCC(=O)O Amb7755713 [0,0,0,0,0,0|1,0,2]=3 90 B9R0.2 CCCCNCCC(C)=O Amb26381876 [0,0,0,0,0,0|2,0,2]=4 91 B9R0.2 CCCCNCCC(N)=O Amb8841106 [0,0,0,0,0,0|2,0,2]=4 92 B9R0.2 CCCCN\C=C\C(C)=O Amb25147404 [0,0,0,0,0,0|2,0,0]=2 93 B9R0.2 CCCCOCCC(N)=O Amb27480748 [0,0,0,0,0,0|2,0,2]=4 94 B9R0.2 CCCCO\C=C\C(=O)Cl Amb27804268 [0,0,0,0,0,0|2,0,0]=2 95 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,0,0,0,0,0|1,0,2]=3 96 B9R0.2 CCCCS\C=C/C(C)=O Amb27945160 [0,0,0,0,0,0|2,0,0]=2 97 B9R0.2 CCCCS\C=C\C(C)=O Amb26410917 [0,0,0,0,0,0|2,0,0]=2 98 B9R0.2 CCCC\C=C/CC(C)=O Amb26493143 [0,0,0,0,0,0|1,0,2]=3 99 B9R0.2 CCCC\C=C\CC(=O)O Amb6297257 [0,0,0,0,0,0|0,0,2]=2 100 B9R0.2 CCCC\C=C\CC(C)O Amb27839464 [0,0,0,0,0,0|1,0,3]=4 101 B9R0.2 CCCC\C=C\CC(N)=O Amb1815461 [0,0,0,0,0,0|1,0,2]=3 102 B9R0.2 CCCC\C=C\NC(C)=O Amb24674131 [0,0,0,0,0,0|2,0,1]=3 103 B9R0.2 CCCC\C=C\OC(C)=O Amb25293926 [0,0,0,0,0,0|2,0,1]=3 104 B9R0.2 CCCC\C=N\NC(N)=O Amb28050098 [0,0,0,0,0,0|3,0,1]=4 105 B9R0.2 CCCNCCC=C(C)C Amb27238155 [0,0,0,0,0,0|3,0,1]=4 106 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,0,0,0,0,0|1,0,2]=3 107 B9R0.2 CCCNCCOC(N)=O Amb27828395 [0,0,0,0,0,0|3,0,1]=4 108 B9R0.2 CCCOCC#CC(N)=O Amb33495811 [0,0,0,0,0,0|2,0,2]=4 109 B9R0.2 CCCOCCCC(=O)O Amb8874517 [0,0,0,0,0,0|1,0,2]=3 110 B9R0.2 CCCOCCOC(=O)Cl Amb26963668 [0,0,0,0,0,0|3,0,1]=4 111 B9R0.2 CCCOCCOC(C)=O Amb25354004 [0,0,0,0,0,0|3,0,1]=4 112 B9R0.2 CCCOCCOC(N)=O Amb27265626 [0,0,0,0,0,0|3,0,1]=4 113 B9R0.2 CCCONCCC(=O)O Amb27233908 [0,0,0,0,0,0|2,0,2]=4 114 B9R0.2 CCCSCCCC(=O)O Amb6680215 [0,0,0,0,0,0|1,0,2]=3 115 B9R0.2 CCCSCCCC(C)=O Amb9660304 [0,0,0,0,0,0|2,0,2]=4 116 B9R0.2 CCCSCCNC(N)=O Amb28345909 [0,0,0,0,0,0|3,0,1]=4 117 B9R0.2 CCC\C=C/C=C/C(C)=O Amb28291455 [0,0,0,0,0,0|1,0,2]=3 118 B9R0.2 CCC\C=C/CCC(=O)O Amb26566880 [0,0,0,0,0,0|0,0,4]=4 119 B9R0.2 CCC\C=C\C=C\C(=O)O Amb32953792 [0,0,0,0,0,0|0,0,2]=2 120 B9R0.2 CCC\C=C\C=C\C(C)=O Amb33079035 [0,0,0,0,0,0|1,0,2]=3 121 B9R0.2 CCC\C=C\C=C\C(N)=O Amb28369023 [0,0,0,0,0,0|1,0,2]=3 122 B9R0.2 CCC\C=C\C=C\[N+](=O)[O-] Amb33424826 [0,0,0,0,0,0|1,0,3]=4 123 B9R0.2 CCC\C=C\CCC(=O)O Amb25378821 [0,0,0,0,0,0|0,0,4]=4 124 B9R0.2 CCC\C=N\NCC(=O)O Amb27432508 [0,0,0,0,0,0|2,0,2]=4 125 B9R0.2 CCNCCCCC(=O)O Amb24385094 [0,0,0,0,0,0|1,0,2]=3 126 B9R0.2 CCNCCCCC(=O)O Amb32686610 [0,0,0,0,0,0|1,0,2]=3 127 B9R0.2 CCNCCCCC(C)=O Amb27951143 [0,0,0,0,0,0|2,0,2]=4 128 B9R0.2 CCNCCCCC(N)=O Amb27964384 [0,0,0,0,0,0|2,0,2]=4 129 B9R0.2 CCNCCCNC(N)=O Amb9466113 [0,0,0,0,0,0|3,0,1]=4 130 B9R0.2 CCNCC\C=C\C(C)C Amb27251097 [0,0,0,0,0,0|3,0,1]=4 131 B9R0.2 CCOCCC#CC(=O)O Amb33168968 [0,0,0,0,0,0|1,0,2]=3 132 B9R0.2 CCOCCCCC(=O)O Amb9207786 [0,0,0,0,0,0|1,0,2]=3 133 B9R0.2 CCOCCCCC(C)=O Amb9659807 [0,0,0,0,0,0|2,0,2]=4 134 B9R0.2 CCOCCCNC(C)=O Amb3886591 [0,0,0,0,0,0|3,0,1]=4 135 B9R0.2 CCOCCCNC(N)=O Amb404787 [0,0,0,0,0,0|3,0,1]=4 136 B9R0.2 CCOCCCOC(C)=O Amb22733319 [0,0,0,0,0,0|3,0,1]=4 137 B9R0.2 CCOCCOCC(=O)O Amb6258165 [0,0,0,0,0,0|2,0,1]=3 138 B9R0.2 CCOCCOCC(N)=O Amb28203011 [0,0,0,0,0,0|3,0,1]=4 139 B9R0.2 CCOCCONC(N)=O Amb27432448 [0,0,0,0,0,0|4,0,0]=4 140 B9R0.2 CCOCSCCC(=O)O Amb27447358 [0,0,0,0,0,0|2,0,2]=4 141 B9R0.2 CCONCCCC(=O)O Amb27839067 [0,0,0,0,0,0|2,0,2]=4 142 B9R0.2 CCSCCCCC(=O)O Amb7782874 [0,0,0,0,0,0|1,0,2]=3 143 B9R0.2 CCSCCCOC(C)=O Amb27605064 [0,0,0,0,0,0|3,0,1]=4 144 B9R0.2 CCSCCONC(C)=O Amb28070443 [0,0,0,0,0,0|4,0,0]=4 145 B9R0.2 CCSCCONC(N)=O Amb28185803 [0,0,0,0,0,0|4,0,0]=4 146 B9R0.2 CCSCCSCC(=O)O Amb28126747 [0,0,0,0,0,0|2,0,1]=3 147 B9R0.2 CCSCCSCC(N)=O Amb28293850 [0,0,0,0,0,0|3,0,1]=4 148 B9R0.2 CCS\C=C\C=C\C(=O)O Amb27471801 [0,0,0,0,0,0|1,0,2]=3 149 B9R0.2 CC\C=C\CNCC(=O)O Amb27422845 [0,0,0,0,0,0|1,0,3]=4 150 B9R0.2 CC\C=C\C\C=C\C(C)=O Amb27226161 [0,0,0,0,0,0|1,0,2]=3 151 B9R0.2 CNCCCCCC(C)=O Amb25728176 [0,0,0,0,0,0|2,0,2]=4 152 B9R0.2 CNCCCCCC(N)=O Amb27625362 [0,0,0,0,0,0|2,0,2]=4 153 B9R0.2 CNCCOCCC(=O)O Amb18111840 [0,0,0,0,0,0|2,0,2]=4 154 B9R0.2 CNCCSCCC(=O)O Amb27442544 [0,0,0,0,0,0|2,0,2]=4 155 B9R0.2 CNCCS\C=C\C(=O)O Amb27471288 [0,0,0,0,0,0|2,0,0]=2 156 B9R0.2 COCC#C\C=C/C(=O)O Amb27450580 [0,0,0,0,0,0|1,0,2]=3 157 B9R0.2 COCCCCCC(=O)O Amb10607872 [0,0,0,0,0,0|1,0,2]=3 158 B9R0.2 COCCCCCC(C)=O Amb27227265 [0,0,0,0,0,0|2,0,2]=4 159 B9R0.2 COCCCCNC(C)=O Amb27170819 [0,0,0,0,0,0|3,0,1]=4 160 B9R0.2 COCCCCOC(C)=O Amb24325176 [0,0,0,0,0,0|3,0,1]=4 161 B9R0.2 COCCCOCC(=O)O Amb25304314 [0,0,0,0,0,0|2,0,1]=3 162 B9R0.2 COCCNCCC(=O)O Amb33527038 [0,0,0,0,0,0|2,0,2]=4 163 B9R0.2 COCCNCCC(=O)O Amb7755691 [0,0,0,0,0,0|2,0,2]=4 164 B9R0.2 COCCOCCC(=O)O Amb6268336 [0,0,0,0,0,0|2,0,2]=4 165 B9R0.2 COCCS\C=C\C(=O)O Amb28398936 [0,0,0,0,0,0|2,0,0]=2 166 B9R0.2 COCOC\C=C\C(C)=O Amb26404277 [0,0,0,0,0,0|3,0,0]=3 167 B9R0.2 COC\C=C\C=C\C(=O)O Amb28058297 [0,0,0,0,0,0|1,0,2]=3 168 B9R0.2 CSCCCCCC(=O)O Amb27444761 [0,0,0,0,0,0|1,0,2]=3 169 B9R0.2 CSCCCCNC(C)=O Amb28325257 [0,0,0,0,0,0|3,0,1]=4 170 B9R0.2 CSCCCCOC(C)=O Amb28041805 [0,0,0,0,0,0|3,0,1]=4 171 B9R0.2 CSCCCNCC(=O)O Amb8827601 [0,0,0,0,0,0|2,0,1]=3 172 B9R0.2 CSCCCOCC(=O)O Amb28042679 [0,0,0,0,0,0|2,0,1]=3 173 B9R0.2 CSCCCSCC(C)=O Amb28059012 [0,0,0,0,0,0|3,0,1]=4 174 B9R0.2 CSCCNCCC(=O)O Amb25055507 [0,0,0,0,0,0|2,0,2]=4 175 B9R0.2 CSCCN\C=C\C(=O)O Amb27864234 [0,0,0,0,0,0|2,0,0]=2 176 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [0,0,0,0,0,0|1,0,2]=3 177 B9R0.2 C\C=C\C=C\C=C\C(=O)O Amb3987814 [0,0,0,0,0,0|0,0,4]=4 178 B9R0.2 C\C=C\CCCCC(=O)O Amb18643887 [0,0,0,0,0,0|0,0,4]=4 179 B9R0.2 C\C=C\CCOCC(=O)O Amb28340908 [0,0,0,0,0,0|1,0,3]=4 180 B9R0.2 N#CCCCC#CC(=O)O Amb27191002 [0,0,0,0,0,0|1,0,3]=4 181 B9R0.2 N#CCCCCCC(=O)O Amb18643705 [0,0,0,0,0,0|1,0,3]=4 182 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [0,0,0,0,0,0|2,0,2]=4 183 B9R0.2 N#CCCC\C=C\B(O)O Amb25176210 [0,0,0,0,0,0|2,0,2]=4 184 B9R0.2 NC(=O)CCCCCCBr Amb27654995 [0,0,0,0,0,0|2,0,2]=4 185 B9R0.2 NC(=O)CCCCCCCl Amb27254212 [0,0,0,0,0,0|2,0,2]=4 186 B9R0.2 NC(=O)COCCCCO Amb27195620 [0,0,0,0,0,0|3,0,1]=4 187 B9R0.2 NC(=O)CSCCCCCl Amb27806823 [0,0,0,0,0,0|3,0,1]=4 188 B9R0.2 NC(=O)CSCCCCS Amb27776386 [0,0,0,0,0,0|3,0,1]=4 189 B9R0.2 NC(=O)NOCCCCF Amb27946674 [0,0,0,0,0,0|4,0,0]=4 190 B9R0.2 NCCCCCCC(=O)O Amb1151254 [0,0,0,0,0,0|1,0,2]=3 191 B9R0.2 NCCCCCCC(=O)O Amb16232099 [0,0,0,0,0,0|1,0,2]=3 192 B9R0.2 NCCCCCCC(=O)[O-] Amb32663972 [0,0,0,0,0,0|1,0,3]=4 193 B9R0.2 NCCCCCNC(N)=O Amb28120485 [0,0,0,0,0,0|3,0,1]=4 194 B9R0.2 NCCCCNCC(=O)O Amb27800960 [0,0,0,0,0,0|2,0,1]=3 195 B9R0.2 NCCCCSCC(=O)O Amb17500919 [0,0,0,0,0,0|2,0,1]=3 196 B9R0.2 NCCCCSCC(N)=O Amb17500917 [0,0,0,0,0,0|3,0,1]=4 197 B9R0.2 NCCCNCCC(=O)O Amb27959846 [0,0,0,0,0,0|2,0,2]=4 198 B9R0.2 NCCCOCCC(=O)O Amb18111494 [0,0,0,0,0,0|2,0,2]=4 199 B9R0.2 NCCCSCCC(=O)O Amb24496605 [0,0,0,0,0,0|2,0,2]=4 200 B9R0.2 NCCCS\C=C\C(=O)O Amb27837837 [0,0,0,0,0,0|2,0,0]=2 201 B9R0.2 NCCNCCNC(=O)O Amb24069145 [0,0,0,0,0,0|3,0,1]=4 202 B9R0.2 NCCOCCCC(=O)O Amb18111467 [0,0,0,0,0,0|2,0,2]=4 203 B9R0.2 NCCSCCCC(=O)O Amb17500468 [0,0,0,0,0,0|2,0,2]=4 204 B9R0.2 NOCCCCCC(=O)O Amb32708458 [0,0,0,0,0,0|2,0,2]=4 205 B9R0.2 O=C(Cl)\C=C\CCCCCl Amb25074569 [0,0,0,0,0,0|2,0,0]=2 206 B9R0.2 O=C(Cl)\C=C\OCCCCl Amb27863543 [0,0,0,0,0,0|3,0,0]=3 207 B9R0.2 O=C(F)OCCCCCCl Amb27391688 [0,0,0,0,0,0|3,0,1]=4 208 B9R0.2 O=C(O)C#CCCCCO Amb28050129 [0,0,0,0,0,0|1,0,2]=3 209 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [0,0,0,0,0,0|1,0,2]=3 210 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [0,0,0,0,0,0|1,0,2]=3 211 B9R0.2 O=C(O)CCCCCCF Amb25132501 [0,0,0,0,0,0|1,0,2]=3 212 B9R0.2 O=C(O)CCCCCCO Amb9787028 [0,0,0,0,0,0|1,0,2]=3 213 B9R0.2 O=C(O)CCCCCCS Amb24710334 [0,0,0,0,0,0|1,0,2]=3 214 B9R0.2 O=C(O)CCCCCNBr Amb28054088 [0,0,0,0,0,0|2,0,2]=4 215 B9R0.2 O=C(O)CCCNCCO Amb9333522 [0,0,0,0,0,0|2,0,2]=4 216 B9R0.2 O=C(O)CCCOCCO Amb6680919 [0,0,0,0,0,0|2,0,2]=4 217 B9R0.2 O=C(O)CCCSCCF Amb27614997 [0,0,0,0,0,0|2,0,2]=4 218 B9R0.2 O=C(O)CCCSCCO Amb9481728 [0,0,0,0,0,0|2,0,2]=4 219 B9R0.2 O=C(O)CCNCCCF Amb28049536 [0,0,0,0,0,0|2,0,2]=4 220 B9R0.2 O=C(O)CCNCCCO Amb9239888 [0,0,0,0,0,0|2,0,2]=4 221 B9R0.2 O=C(O)CCOCCCO Amb24476864 [0,0,0,0,0,0|2,0,2]=4 222 B9R0.2 O=C(O)CCSCCCCl Amb26421708 [0,0,0,0,0,0|2,0,2]=4 223 B9R0.2 O=C(O)CCSCCCF Amb27251653 [0,0,0,0,0,0|2,0,2]=4 224 B9R0.2 O=C(O)CNCCCCO Amb28063278 [0,0,0,0,0,0|2,0,1]=3 225 B9R0.2 O=C(O)COCCCCF Amb27770553 [0,0,0,0,0,0|2,0,1]=3 226 B9R0.2 O=C(O)COCCCCO Amb27465121 [0,0,0,0,0,0|2,0,1]=3 227 B9R0.2 O=C(O)CSCCCCCl Amb27165750 [0,0,0,0,0,0|2,0,1]=3 228 B9R0.2 O=C(O)CSCCCCF Amb28062594 [0,0,0,0,0,0|2,0,1]=3 229 B9R0.2 O=C(O)\C=C\CC#CCBr Amb24393543 [0,0,0,0,0,0|1,0,2]=3 230 B9R0.2 O=C(O)\C=C\CCCCCl Amb18645743 [0,0,0,0,0,0|1,0,0]=1 231 B9R0.2 O=C(O)\C=C\CSCCO Amb27205770 [0,0,0,0,0,0|2,0,0]=2 232 B9R0.2 O=CCCCCCC(=O)O Amb26548890 [0,0,0,0,0,0|1,0,3]=4 233 B9R0.2 O=CCCC\C=C\B(O)O Amb24678117 [0,0,0,0,0,0|2,0,2]=4 234 B9R0.2 OB(O)\C=C\CCCCCl Amb25961679 [0,0,0,0,0,0|2,0,1]=3 235 B9R0.2 OCCCC\C=C\B(O)O Amb24478495 [0,0,0,0,0,0|2,0,1]=3 236 B8R0.4 C#C\C=C\CCNCC Amb27174739 [1,0,0,0,0,0|2,0,1]=4 237 B8R0.4 C#C\C=C\NCCCC Amb27247245 [1,0,0,0,0,0|2,0,1]=4 238 B8R0.4 C=CCCCCCCC Amb3940502 [1,0,0,0,0,0|1,0,2]=4 239 B8R0.4 C=CCCC\C=C\CO Amb19930201 [1,0,0,0,0,0|0,0,3]=4 240 B8R0.4 C=CCNCCCCC Amb6706493 [1,0,0,0,0,0|2,0,1]=4 241 B8R0.4 C=CCSCCCCC Amb27837635 [1,0,0,0,0,0|2,0,1]=4 242 B8R0.4 C=CNCCCCCC Amb27398596 [1,0,0,0,0,0|2,0,1]=4 243 B8R0.4 C=COCCCCCC Amb24440550 [1,0,0,0,0,0|2,0,1]=4 244 B8R0.4 C=C\C=C\C=C\CCC Amb22641675 [1,0,0,0,0,0|1,0,2]=4 245 B8R0.4 C=C\C=C\CCCCBr Amb32688174 [1,0,0,0,0,0|2,0,0]=3 246 B8R0.4 C=C\C=C\CCCCC Amb22641683 [1,0,0,0,0,0|1,0,0]=2 247 B8R0.4 C=C\C=C\CCCCCl Amb32688173 [1,0,0,0,0,0|2,0,0]=3 248 B8R0.4 C=C\C=C\CCNCC Amb27873157 [1,0,0,0,0,0|2,0,0]=3 249 B8R0.4 C=C\C=C\CNCCC Amb26967633 [1,0,0,0,0,0|2,0,0]=3 250 B8R0.4 CCC#CCC\C=C\O Amb28049153 [1,0,0,0,0,0|0,0,3]=4 251 B8R0.4 CCC#CC\C=C/CO Amb17593279 [1,0,0,0,0,0|0,0,3]=4 252 B8R0.4 CCCC#C\C=C\C=O Amb25108334 [1,0,0,0,0,0|0,0,2]=3 253 B8R0.4 CCCCC#C\C=C/Cl Amb27849416 [1,0,0,0,0,0|1,0,2]=4 254 B8R0.4 CCCCC#C\C=C\Cl Amb27803057 [1,0,0,0,0,0|1,0,2]=4 255 B8R0.4 CCCCCC#CC=O Amb9825881 [1,0,0,0,0,0|0,0,2]=3 256 B8R0.4 CCCCCCCC=O Amb6891949 [1,0,0,0,0,0|0,0,2]=3 257 B8R0.4 CCCCCCCCO Amb6608788 [1,0,0,0,0,0|0,0,3]=4 258 B8R0.4 CCCCCCN=C=O Amb8516659 [1,0,0,0,0,0|1,0,2]=4 259 B8R0.4 CCCCCCNC=S Amb27880264 [1,0,0,0,0,0|1,1,1]=4 260 B8R0.4 CCCCCCON=O Amb17672945 [1,0,0,0,0,0|2,0,1]=4 261 B8R0.4 CCCCCC\C=C\Br Amb24677708 [1,0,0,0,0,0|1,0,1]=3 262 B8R0.4 CCCCCC\C=C\I Amb24446897 [1,0,0,0,0,0|1,0,1]=3 263 B8R0.4 CCCCCC\C=N\N Amb28049289 [1,0,0,0,0,0|2,0,1]=4 264 B8R0.4 CCCCCNCCO Amb3940022 [1,0,0,0,0,0|1,0,2]=4 265 B8R0.4 CCCCCOCC=O Amb27230502 [1,0,0,0,0,0|1,0,1]=3 266 B8R0.4 CCCCCOCCO Amb22264988 [1,0,0,0,0,0|1,0,2]=4 267 B8R0.4 CCCCCSCCO Amb1032987 [1,0,0,0,0,0|1,0,2]=4 268 B8R0.4 CCCCC\C=C\C#N Amb18642132 [1,0,0,0,0,0|1,0,1]=3 269 B8R0.4 CCCCC\C=C\CBr Amb17666913 [1,0,0,0,0,0|1,0,1]=3 270 B8R0.4 CCCCC\C=C\CO Amb33038088 [1,0,0,0,0,0|0,0,1]=2 271 B8R0.4 CCCCC\C=N\OC Amb28204102 [1,0,0,0,0,0|3,0,0]=4 272 B8R0.4 CCCCNC\C=C\Br Amb27631443 [1,0,0,0,0,0|2,0,1]=4 273 B8R0.4 CCCCNC\C=C\Cl Amb27860069 [1,0,0,0,0,0|2,0,1]=4 274 B8R0.4 CCCCOC#CC=O Amb27947485 [1,0,0,0,0,0|1,0,2]=4 275 B8R0.4 CCCCOCCC=O Amb27880111 [1,0,0,0,0,0|1,0,2]=4 276 B8R0.4 CCCCOCNC=O Amb27392745 [1,0,0,0,0,0|2,0,1]=4 277 B8R0.4 CCCCSC=C=CCl Amb27202608 [1,0,0,0,0,0|2,0,1]=4 278 B8R0.4 CCCCSCNC=O Amb27656061 [1,0,0,0,0,0|2,0,1]=4 279 B8R0.4 CCCCS\C=C\CO Amb27219509 [1,0,0,0,0,0|1,0,1]=3 280 B8R0.4 CCCC\C=C/CCO Amb26586236 [1,0,0,0,0,0|0,0,3]=4 281 B8R0.4 CCCC\C=C\CCO Amb9134733 [1,0,0,0,0,0|0,0,3]=4 282 B8R0.4 CCCOCCCC=O Amb27795367 [1,0,0,0,0,0|1,0,2]=4 283 B8R0.4 CCCOC\C=C\CCl Amb27628817 [1,0,0,0,0,0|2,0,1]=4 284 B8R0.4 CCCSCCNC=O Amb27630895 [1,0,0,0,0,0|2,0,1]=4 285 B8R0.4 CCC\C=C/C=C/C=O Amb27643510 [1,0,0,0,0,0|0,0,2]=3 286 B8R0.4 CCC\C=C\C=C\C=O Amb8392848 [1,0,0,0,0,0|0,0,2]=3 287 B8R0.4 CCC\C=C\C=C\CO Amb22053869 [1,0,0,0,0,0|0,0,3]=4 288 B8R0.4 CCNCCCNC=O Amb27220690 [1,0,0,0,0,0|2,0,1]=4 289 B8R0.4 CCOCCOCC=O Amb33539619 [1,0,0,0,0,0|2,0,1]=4 290 B8R0.4 CCOCC\C=C\CCl Amb27470132 [1,0,0,0,0,0|2,0,1]=4 291 B8R0.4 CCOCO\C=C\C=O Amb26393569 [1,0,0,0,0,0|2,0,0]=3 292 B8R0.4 CCSCCCCC=O Amb24690525 [1,0,0,0,0,0|1,0,2]=4 293 B8R0.4 CCSCCCNC=O Amb27457130 [1,0,0,0,0,0|2,0,1]=4 294 B8R0.4 CC\C=C/CCCCC Amb25258581 [1,0,0,0,0,0|1,0,1]=3 295 B8R0.4 CC\C=C/CCCCN Amb28313712 [1,0,0,0,0,0|2,0,1]=4 296 B8R0.4 CC\C=C/CCCCO Amb22052636 [1,0,0,0,0,0|2,0,1]=4 297 B8R0.4 CC\C=C/C\C=C\C=O Amb28251042 [1,0,0,0,0,0|0,0,2]=3 298 B8R0.4 CC\C=C\CCCCC Amb22347893 [1,0,0,0,0,0|1,0,1]=3 299 B8R0.4 CC\C=C\CCCCN Amb33079175 [1,0,0,0,0,0|2,0,1]=4 300 B8R0.4 CC\C=C\CCNCC Amb27647277 [1,0,0,0,0,0|2,0,1]=4 301 B8R0.4 CC\C=C\CCSCC Amb27260956 [1,0,0,0,0,0|2,0,1]=4 302 B8R0.4 COCCCCCC=O Amb27467958 [1,0,0,0,0,0|1,0,2]=4 303 B8R0.4 CO\C=C\CCCCO Amb27448464 [1,0,0,0,0,0|3,0,0]=4 304 B8R0.4 CSCCCCCC=O Amb27981887 [1,0,0,0,0,0|1,0,2]=4 305 B8R0.4 CSCCCCNC=O Amb28366040 [1,0,0,0,0,0|2,0,1]=4 306 B8R0.4 CSCCCOCC=O Amb28286017 [1,0,0,0,0,0|2,0,1]=4 307 B8R0.4 CSCOC\C=C\CO Amb27452450 [1,0,0,0,0,0|2,0,1]=4 308 B8R0.4 C\C=C/C=C/CCCBr Amb27878672 [1,0,0,0,0,0|2,0,1]=4 309 B8R0.4 C\C=C/CCCCCC Amb27478896 [1,0,0,0,0,0|1,0,1]=3 310 B8R0.4 C\C=C\C=C\CCCC Amb24477896 [1,0,0,0,0,0|1,0,1]=3 311 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [1,0,0,0,0,0|2,0,1]=4 312 B8R0.4 C\C=C\CCCCCC Amb19930200 [1,0,0,0,0,0|1,0,1]=3 313 B8R0.4 C\C=C\CCCCCO Amb25247777 [1,0,0,0,0,0|2,0,1]=4 314 B8R0.4 C\C=C\CC\C=C\C=O Amb18642215 [1,0,0,0,0,0|0,0,2]=3 315 B8R0.4 C\C=C\OCCCCO Amb27486247 [1,0,0,0,0,0|3,0,0]=4 316 B8R0.4 N#C\C=C\CCCCBr Amb27965026 [1,0,0,0,0,0|2,0,1]=4 317 B8R0.4 N#C\C=C\CCCCCl Amb27622521 [1,0,0,0,0,0|2,0,1]=4 318 B8R0.4 NCCCC\C=C\CO Amb24117507 [1,0,0,0,0,0|1,0,1]=3 319 B8R0.4 NCCCC\C=C\CO Amb27780423 [1,0,0,0,0,0|1,0,1]=3 320 B8R0.4 O=CCCCCCCBr Amb22755463 [1,0,0,0,0,0|1,0,2]=4 321 B8R0.4 O=CCCCCCCCl Amb27262031 [1,0,0,0,0,0|1,0,2]=4 322 B8R0.4 O=CCCC\C=C\CO Amb27169480 [1,0,0,0,0,0|1,0,2]=4 323 B8R0.4 O=C\C=C/CCCC=O Amb28202061 [1,0,0,0,0,0|1,0,1]=3 324 B8R0.4 OC\C=C\CCCCO Amb27642149 [1,0,0,0,0,0|1,0,1]=3 325 B8R0.7 C#CCCCCC(=O)O Amb2721485 [1,0,0,0,0,0|0,0,3]=4 326 B8R0.7 C#CCO\C=C\C(=O)O Amb27215687 [1,0,0,0,0,0|1,0,2]=4 327 B8R0.7 C=C(C)CCCCCC Amb6298939 [1,0,0,0,0,0|2,0,1]=4 328 B8R0.7 C=C(C)\C=C\CCCBr Amb25264506 [1,0,0,0,0,0|3,0,0]=4 329 B8R0.7 C=C(C)\C=C\CCCCl Amb27494353 [1,0,0,0,0,0|3,0,0]=4 330 B8R0.7 C=C(C)\C=C\CCNC Amb25883809 [1,0,0,0,0,0|3,0,0]=4 331 B8R0.7 C=CCCCCC(=O)O Amb6299578 [1,0,0,0,0,0|0,0,3]=4 332 B8R0.7 C=CCC\C=C\C(=O)O Amb25756053 [1,0,0,0,0,0|0,0,2]=3 333 B8R0.7 CC#CCCCC(=O)O Amb28046337 [1,0,0,0,0,0|0,0,3]=4 334 B8R0.7 CC(=O)CCCCCBr Amb27401578 [1,0,0,0,0,0|2,0,1]=4 335 B8R0.7 CC(=O)CCCCCCl Amb26591097 [1,0,0,0,0,0|2,0,1]=4 336 B8R0.7 CC(=O)CCCCCN Amb22641918 [1,0,0,0,0,0|2,0,1]=4 337 B8R0.7 CC(=O)CCCCCN Amb24113384 [1,0,0,0,0,0|2,0,1]=4 338 B8R0.7 CC(=O)CCCCCO Amb27237283 [1,0,0,0,0,0|2,0,1]=4 339 B8R0.7 CC(=O)NCCCCCl Amb25883586 [1,0,0,0,0,0|3,0,0]=4 340 B8R0.7 CC(=O)NCCCCF Amb27180576 [1,0,0,0,0,0|3,0,0]=4 341 B8R0.7 CC(=O)NCCCCI Amb27768800 [1,0,0,0,0,0|3,0,0]=4 342 B8R0.7 CC(=O)NCCCCN Amb17053700 [1,0,0,0,0,0|3,0,0]=4 343 B8R0.7 CC(=O)NCCCCO Amb17102977 [1,0,0,0,0,0|3,0,0]=4 344 B8R0.7 CC(=O)OCCCCBr Amb2725321 [1,0,0,0,0,0|3,0,0]=4 345 B8R0.7 CC(=O)OCCCCCl Amb3940275 [1,0,0,0,0,0|3,0,0]=4 346 B8R0.7 CC(=O)OCCCCI Amb2725257 [1,0,0,0,0,0|3,0,0]=4 347 B8R0.7 CC(=O)OCCCCN Amb24657282 [1,0,0,0,0,0|3,0,0]=4 348 B8R0.7 CC(=O)OCCCCO Amb25714960 [1,0,0,0,0,0|3,0,0]=4 349 B8R0.7 CC(=O)SCCCCBr Amb22641871 [1,0,0,0,0,0|3,0,0]=4 350 B8R0.7 CC(=O)SCCCCN Amb24117263 [1,0,0,0,0,0|3,0,0]=4 351 B8R0.7 CC(=O)SCCCCN Amb27429858 [1,0,0,0,0,0|3,0,0]=4 352 B8R0.7 CC(=O)\C=C\CCC#N Amb18642111 [1,0,0,0,0,0|2,0,1]=4 353 B8R0.7 CC(=O)\C=C\NCCCl Amb27439668 [1,0,0,0,0,0|3,0,0]=4 354 B8R0.7 CC(C)=CCCCCBr Amb25933172 [1,0,0,0,0,0|3,0,0]=4 355 B8R0.7 CC(C)=CCCCCCl Amb32688153 [1,0,0,0,0,0|3,0,0]=4 356 B8R0.7 CC(C)=CCCCCN Amb28345726 [1,0,0,0,0,0|3,0,0]=4 357 B8R0.7 CC(C)=CCCCCO Amb28315431 [1,0,0,0,0,0|3,0,0]=4 358 B8R0.7 CCC#CCCC(=O)O Amb28046178 [1,0,0,0,0,0|0,0,3]=4 359 B8R0.7 CCC#C\C=C\C(N)=O Amb27626671 [1,0,0,0,0,0|1,0,2]=4 360 B8R0.7 CCCC#CCC(=O)O Amb17593307 [1,0,0,0,0,0|0,0,3]=4 361 B8R0.7 CCCCC#CC(=O)O Amb2721486 [1,0,0,0,0,0|0,0,2]=3 362 B8R0.7 CCCCC#CC(C)=O Amb17593278 [1,0,0,0,0,0|1,0,2]=4 363 B8R0.7 CCCCC#CC(N)=O Amb27782976 [1,0,0,0,0,0|1,0,2]=4 364 B8R0.7 CCCCCC=C(F)F Amb10840486 [1,0,0,0,0,0|2,0,0]=3 365 B8R0.7 CCCCCCB(O)O Amb2722519 [1,0,0,0,0,0|1,0,2]=4 366 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [1,0,0,0,0,0|1,0,1]=3 367 B8R0.7 CCCCCCC(=O)O Amb34915914 [1,0,0,0,0,0|0,0,1]=2 368 B8R0.7 CCCCCCC(=O)O Amb3499439 [1,0,0,0,0,0|0,0,1]=2 369 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [1,0,0,0,0,0|0,0,2]=3 370 B8R0.7 CCCCCCC(C)=O Amb6891961 [1,0,0,0,0,0|1,0,1]=3 371 B8R0.7 CCCCCCC(C)O Amb3940385 [1,0,0,0,0,0|1,0,2]=4 372 B8R0.7 CCCCCCC(N)=O Amb8858816 [1,0,0,0,0,0|1,0,1]=3 373 B8R0.7 CCCCCCC(O)O Amb27451028 [1,0,0,0,0,0|0,0,3]=4 374 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [1,0,0,0,0,0|1,0,2]=4 375 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [1,0,0,0,0,0|1,0,2]=4 376 B8R0.7 CCCCCNC(=N)N Amb28049568 [1,0,0,0,0,0|3,0,0]=4 377 B8R0.7 CCCCCNC(C)=N Amb28127671 [1,0,0,0,0,0|3,0,0]=4 378 B8R0.7 CCCCCNC(N)=O Amb6246936 [1,0,0,0,0,0|2,0,0]=3 379 B8R0.7 CCCCCNC(N)=S Amb9212112 [1,0,0,0,0,0|2,1,0]=4 380 B8R0.7 CCCCCOB(O)O Amb24716868 [1,0,0,0,0,0|2,0,1]=4 381 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [1,0,0,0,0,0|2,0,0]=3 382 B8R0.7 CCCCCOC(N)=O Amb27655610 [1,0,0,0,0,0|2,0,0]=3 383 B8R0.7 CCCCCSC(=N)N Amb20675976 [1,0,0,0,0,0|3,0,0]=4 384 B8R0.7 CCCCCSC(=N)N Amb23590643 [1,0,0,0,0,0|3,0,0]=4 385 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [1,0,0,0,0,0|2,0,1]=4 386 B8R0.7 CCCCNCC(=O)O Amb7766471 [1,0,0,0,0,0|1,0,1]=3 387 B8R0.7 CCCCNCC(N)=O Amb1126543 [1,0,0,0,0,0|2,0,1]=4 388 B8R0.7 CCCCNCC(N)=O Amb7969721 [1,0,0,0,0,0|2,0,1]=4 389 B8R0.7 CCCCOCC(=O)O Amb8514871 [1,0,0,0,0,0|1,0,1]=3 390 B8R0.7 CCCCOCC(N)=O Amb27855875 [1,0,0,0,0,0|2,0,1]=4 391 B8R0.7 CCCCONC(N)=O Amb2899789 [1,0,0,0,0,0|3,0,0]=4 392 B8R0.7 CCCCSCC(=O)O Amb1138789 [1,0,0,0,0,0|1,0,1]=3 393 B8R0.7 CCCC\C=C/C(C)=O Amb28074727 [1,0,0,0,0,0|1,0,0]=2 394 B8R0.7 CCCC\C=C\B(O)O Amb10068585 [1,0,0,0,0,0|1,0,1]=3 395 B8R0.7 CCCC\C=C\C(=O)Cl Amb2688651 [1,0,0,0,0,0|1,0,0]=2 396 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [1,0,0,0,0,0|0,0,0]=1 397 B8R0.7 CCCC\C=C\C(=O)[O-] Amb17778116 [1,0,0,0,0,0|0,0,1]=2 398 B8R0.7 CCCC\C=C\[C@H](C)O Amb27950980 [1,0,0,0,0,0|1,0,1]=3 399 B8R0.7 CCCNCCC(=O)O Amb18633174 [1,0,0,0,0,0|1,0,1]=3 400 B8R0.7 CCCNCCC(=O)O Amb2372065 [1,0,0,0,0,0|1,0,1]=3 401 B8R0.7 CCCNCCC(C)=O Amb24700442 [1,0,0,0,0,0|2,0,1]=4 402 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [1,0,0,0,0,0|2,0,1]=4 403 B8R0.7 CCCN\C=C\C(C)=S Amb27168202 [1,0,0,0,0,0|2,1,0]=4 404 B8R0.7 CCCOCCC(=O)O Amb8874502 [1,0,0,0,0,0|1,0,1]=3 405 B8R0.7 CCCOCCC(C)=O Amb8874915 [1,0,0,0,0,0|2,0,1]=4 406 B8R0.7 CCCONCC(=O)O Amb27401902 [1,0,0,0,0,0|2,0,1]=4 407 B8R0.7 CCCO\C=C\C(N)=O Amb28198536 [1,0,0,0,0,0|2,0,0]=3 408 B8R0.7 CCCS\C=C/C(=O)O Amb18644291 [1,0,0,0,0,0|1,0,0]=2 409 B8R0.7 CCCS\C=C/C(=O)[O-] Amb19816096 [1,0,0,0,0,0|1,0,1]=3 410 B8R0.7 CCCS\C=C/C(=O)[O-] Amb6600550 [1,0,0,0,0,0|1,0,1]=3 411 B8R0.7 CCC\C=C/CC(C)=O Amb27974039 [1,0,0,0,0,0|1,0,2]=4 412 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [1,0,0,0,0,0|0,0,2]=3 413 B8R0.7 CCC\C=C\CC(C)=O Amb33429740 [1,0,0,0,0,0|1,0,2]=4 414 B8R0.7 CCNCC#CC(=O)O Amb33168956 [1,0,0,0,0,0|1,0,2]=4 415 B8R0.7 CCNCCCC(=O)O Amb30585148 [1,0,0,0,0,0|1,0,1]=3 416 B8R0.7 CCNCCCC(=O)O Amb6253896 [1,0,0,0,0,0|1,0,1]=3 417 B8R0.7 CCNCCCC(N)=O Amb24709859 [1,0,0,0,0,0|2,0,1]=4 418 B8R0.7 CCNCCNC(C)=O Amb6732650 [1,0,0,0,0,0|3,0,0]=4 419 B8R0.7 CCNCCSC(C)=O Amb27187142 [1,0,0,0,0,0|3,0,0]=4 420 B8R0.7 CCOCCCC(=O)O Amb6257602 [1,0,0,0,0,0|1,0,1]=3 421 B8R0.7 CCOCCNC(N)=O Amb9454688 [1,0,0,0,0,0|3,0,0]=4 422 B8R0.7 CCOCCOC(=O)Cl Amb22228804 [1,0,0,0,0,0|3,0,0]=4 423 B8R0.7 CCOCCOC(C)=O Amb8383625 [1,0,0,0,0,0|3,0,0]=4 424 B8R0.7 CCOCCOC(N)=O Amb27760038 [1,0,0,0,0,0|3,0,0]=4 425 B8R0.7 CCOC\C=C/C(=O)O Amb27807906 [1,0,0,0,0,0|1,0,0]=2 426 B8R0.7 CCOC\C=C\C(=O)O Amb19020649 [1,0,0,0,0,0|1,0,0]=2 427 B8R0.7 CCSCCCC(=O)O Amb6680204 [1,0,0,0,0,0|1,0,1]=3 428 B8R0.7 CCSCCCC(C)=O Amb9660283 [1,0,0,0,0,0|2,0,1]=4 429 B8R0.7 CCSCCNC(C)=O Amb27848944 [1,0,0,0,0,0|3,0,0]=4 430 B8R0.7 CCSCCNC(N)=O Amb27639100 [1,0,0,0,0,0|3,0,0]=4 431 B8R0.7 CCSC\C=C\C(=O)O Amb33449652 [1,0,0,0,0,0|1,0,0]=2 432 B8R0.7 CCSC\C=C\C(C)=O Amb33323646 [1,0,0,0,0,0|2,0,0]=3 433 B8R0.7 CCSC\C=C\[N+](=O)[O-] Amb33223923 [1,0,0,0,0,0|2,0,1]=4 434 B8R0.7 CCSSCCC(=O)O Amb27837279 [1,0,0,0,0,0|2,0,1]=4 435 B8R0.7 CC\C=C/C=C/C(C)=O Amb27164670 [1,0,0,0,0,0|1,0,2]=4 436 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [1,0,0,0,0,0|0,0,3]=4 437 B8R0.7 CC\C=C\C=C\C(=O)O Amb33359031 [1,0,0,0,0,0|0,0,2]=3 438 B8R0.7 CC\C=C\C=C\C(C)=O Amb24667251 [1,0,0,0,0,0|1,0,2]=4 439 B8R0.7 CC\C=C\C=C\C(N)=O Amb27445409 [1,0,0,0,0,0|1,0,2]=4 440 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [1,0,0,0,0,0|0,0,3]=4 441 B8R0.7 CNCCCCC(=O)O Amb10605773 [1,0,0,0,0,0|1,0,1]=3 442 B8R0.7 CNCCCCC(=O)O Amb24340485 [1,0,0,0,0,0|1,0,1]=3 443 B8R0.7 CNCCCCC(N)=O Amb27780478 [1,0,0,0,0,0|2,0,1]=4 444 B8R0.7 CNCCCNC(C)=O Amb33547919 [1,0,0,0,0,0|3,0,0]=4 445 B8R0.7 CNCCCNC(C)=O Amb34913785 [1,0,0,0,0,0|3,0,0]=4 446 B8R0.7 CNCCCNC(C)=O Amb9464418 [1,0,0,0,0,0|3,0,0]=4 447 B8R0.7 CNCCOCC(=O)O Amb18630741 [1,0,0,0,0,0|2,0,1]=4 448 B8R0.7 COCCC#CC(=O)O Amb27392974 [1,0,0,0,0,0|1,0,2]=4 449 B8R0.7 COCCCCC(=O)O Amb9207785 [1,0,0,0,0,0|1,0,1]=3 450 B8R0.7 COCCCCC(C)=O Amb9659801 [1,0,0,0,0,0|2,0,1]=4 451 B8R0.7 COCCCNC(=O)Cl Amb27791959 [1,0,0,0,0,0|3,0,0]=4 452 B8R0.7 COCCCNC(C)=O Amb3358083 [1,0,0,0,0,0|3,0,0]=4 453 B8R0.7 COCCCNC(N)=O Amb1105274 [1,0,0,0,0,0|3,0,0]=4 454 B8R0.7 COCCCOC(C)=O Amb22732978 [1,0,0,0,0,0|3,0,0]=4 455 B8R0.7 COCCNCC(=O)O Amb19514667 [1,0,0,0,0,0|2,0,1]=4 456 B8R0.7 COCCNCC(=O)O Amb7766415 [1,0,0,0,0,0|2,0,1]=4 457 B8R0.7 COCCOCC(=O)O Amb2721259 [1,0,0,0,0,0|2,0,1]=4 458 B8R0.7 COCCSCC(=O)O Amb6245777 [1,0,0,0,0,0|2,0,1]=4 459 B8R0.7 COCC\C=C\C(=O)O Amb33080389 [1,0,0,0,0,0|1,0,0]=2 460 B8R0.7 COCC\C=C\C(C)=O Amb33377354 [1,0,0,0,0,0|2,0,0]=3 461 B8R0.7 COCC\C=C\[N+](=O)[O-] Amb33377480 [1,0,0,0,0,0|2,0,1]=4 462 B8R0.7 COCOCCC(=O)O Amb27784860 [1,0,0,0,0,0|2,0,1]=4 463 B8R0.7 COCSCCC(=O)O Amb27263382 [1,0,0,0,0,0|2,0,1]=4 464 B8R0.7 CO\C=C\C=C\C(=O)O Amb27784611 [1,0,0,0,0,0|1,0,2]=4 465 B8R0.7 CSCCCCC(=O)O Amb17503764 [1,0,0,0,0,0|1,0,1]=3 466 B8R0.7 CSCCCCC(C)=O Amb27815140 [1,0,0,0,0,0|2,0,1]=4 467 B8R0.7 CSCCCCC(N)=O Amb27662727 [1,0,0,0,0,0|2,0,1]=4 468 B8R0.7 CSCCCOC(C)=O Amb8392861 [1,0,0,0,0,0|3,0,0]=4 469 B8R0.7 CSCCNCC(=O)O Amb24401934 [1,0,0,0,0,0|2,0,1]=4 470 B8R0.7 CSCCNCC(=O)O Amb28934977 [1,0,0,0,0,0|2,0,1]=4 471 B8R0.7 CSCCOCC(=O)O Amb27392229 [1,0,0,0,0,0|2,0,1]=4 472 B8R0.7 CSCCSCC(=O)O Amb27964765 [1,0,0,0,0,0|2,0,1]=4 473 B8R0.7 CSCC\C=C\C(=O)O Amb33475293 [1,0,0,0,0,0|1,0,0]=2 474 B8R0.7 CSCC\C=C\C(C)=O Amb33197615 [1,0,0,0,0,0|2,0,0]=3 475 B8R0.7 CSCC\C=C\[N+](=O)[O-] Amb33198276 [1,0,0,0,0,0|2,0,1]=4 476 B8R0.7 CSC\C=C\CC(=O)O Amb28072070 [1,0,0,0,0,0|1,0,2]=4 477 B8R0.7 CSSCCCC(=O)O Amb25269470 [1,0,0,0,0,0|2,0,1]=4 478 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [1,0,0,0,0,0|0,0,3]=4 479 B8R0.7 C\C=C\C\C=C\C(=O)O Amb27440048 [1,0,0,0,0,0|0,0,2]=3 480 B8R0.7 FC(F)=CCCCCBr Amb27863490 [1,0,0,0,0,0|3,0,0]=4 481 B8R0.7 N#CCCCCC(=O)O Amb17593332 [1,0,0,0,0,0|1,0,2]=4 482 B8R0.7 N#CNC\C=C\C(=O)O Amb35634496 [1,0,0,0,0,0|2,0,1]=4 483 B8R0.7 NC(=O)CCCCCBr Amb2685265 [1,0,0,0,0,0|2,0,1]=4 484 B8R0.7 NC(=O)CCCCCCl Amb27392074 [1,0,0,0,0,0|2,0,1]=4 485 B8R0.7 NC(=O)CCCCCF Amb27837777 [1,0,0,0,0,0|2,0,1]=4 486 B8R0.7 NC(=O)CCCCCO Amb22524369 [1,0,0,0,0,0|2,0,1]=4 487 B8R0.7 NC(=O)NCCCCBr Amb27614497 [1,0,0,0,0,0|3,0,0]=4 488 B8R0.7 NC(=O)NCCCCF Amb27663218 [1,0,0,0,0,0|3,0,0]=4 489 B8R0.7 NCCCC#CC(=O)O Amb33168806 [1,0,0,0,0,0|1,0,2]=4 490 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [1,0,0,0,0,0|2,0,1]=4 491 B8R0.7 NCCCCCC(=O)O Amb17607928 [1,0,0,0,0,0|1,0,1]=3 492 B8R0.7 NCCCCCC(=O)O Amb1905625 [1,0,0,0,0,0|1,0,1]=3 493 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [1,0,0,0,0,0|1,0,2]=4 494 B8R0.7 NCCCCNC(N)=O Amb19026975 [1,0,0,0,0,0|3,0,0]=4 495 B8R0.7 NCCCCNC(N)=O Amb19374296 [1,0,0,0,0,0|3,0,0]=4 496 B8R0.7 NCCCOCC(=O)O Amb18111435 [1,0,0,0,0,0|2,0,1]=4 497 B8R0.7 NCCCOCC(=O)O Amb31217489 [1,0,0,0,0,0|2,0,1]=4 498 B8R0.7 NCCCSCC(=O)O Amb17500676 [1,0,0,0,0,0|2,0,1]=4 499 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [1,0,0,0,0,0|1,0,0]=2 500 B8R0.7 NCCNCCC(=O)O Amb20668304 [1,0,0,0,0,0|2,0,1]=4 501 B8R0.7 NCCNCCC(=O)O Amb22058790 [1,0,0,0,0,0|2,0,1]=4 502 B8R0.7 NCCOCCC(=O)O Amb18630461 [1,0,0,0,0,0|2,0,1]=4 503 B8R0.7 NCCOCCC(=O)O Amb33330744 [1,0,0,0,0,0|2,0,1]=4 504 B8R0.7 NCCSCCC(=O)O Amb21988844 [1,0,0,0,0,0|2,0,1]=4 505 B8R0.7 NC\C=C\C=C\C(=O)O Amb25146005 [1,0,0,0,0,0|1,0,2]=4 506 B8R0.7 NOCCCCC(=O)O Amb27596055 [1,0,0,0,0,0|2,0,1]=4 507 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [1,0,0,0,0,0|2,0,1]=4 508 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [1,0,0,0,0,0|2,0,1]=4 509 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [1,0,0,0,0,0|2,0,1]=4 510 B8R0.7 O=C(Cl)OCCCCCl Amb8515449 [1,0,0,0,0,0|3,0,0]=4 511 B8R0.7 O=C(Cl)\C=C\CCCCl Amb27439280 [1,0,0,0,0,0|2,0,0]=3 512 B8R0.7 O=C(F)CCCCCCl Amb27173031 [1,0,0,0,0,0|2,0,1]=4 513 B8R0.7 O=C(O)CCCCCBr Amb2081955 [1,0,0,0,0,0|1,0,1]=3 514 B8R0.7 O=C(O)CCCCCCl Amb18796646 [1,0,0,0,0,0|1,0,1]=3 515 B8R0.7 O=C(O)CCCCCF Amb26063796 [1,0,0,0,0,0|1,0,1]=3 516 B8R0.7 O=C(O)CCCCCI Amb22736492 [1,0,0,0,0,0|1,0,1]=3 517 B8R0.7 O=C(O)CCCCCO Amb8515991 [1,0,0,0,0,0|1,0,1]=3 518 B8R0.7 O=C(O)CCCCNO Amb28410171 [1,0,0,0,0,0|2,0,1]=4 519 B8R0.7 O=C(O)CCNCCF Amb27954272 [1,0,0,0,0,0|2,0,1]=4 520 B8R0.7 O=C(O)CCNCCO Amb1110010 [1,0,0,0,0,0|2,0,1]=4 521 B8R0.7 O=C(O)CCNCCS Amb28285239 [1,0,0,0,0,0|2,0,1]=4 522 B8R0.7 O=C(O)CCOCCBr Amb24057757 [1,0,0,0,0,0|2,0,1]=4 523 B8R0.7 O=C(O)CCOCCF Amb27807548 [1,0,0,0,0,0|2,0,1]=4 524 B8R0.7 O=C(O)CCOCCO Amb6680916 [1,0,0,0,0,0|2,0,1]=4 525 B8R0.7 O=C(O)CCOCCS Amb27226892 [1,0,0,0,0,0|2,0,1]=4 526 B8R0.7 O=C(O)CCSCCBr Amb27468126 [1,0,0,0,0,0|2,0,1]=4 527 B8R0.7 O=C(O)CCSCCF Amb27172860 [1,0,0,0,0,0|2,0,1]=4 528 B8R0.7 O=C(O)CCSCCS Amb18126456 [1,0,0,0,0,0|2,0,1]=4 529 B8R0.7 O=C(O)CNCCCCl Amb28055692 [1,0,0,0,0,0|2,0,1]=4 530 B8R0.7 O=C(O)CNCCCF Amb27649256 [1,0,0,0,0,0|2,0,1]=4 531 B8R0.7 O=C(O)CNCCCO Amb9325805 [1,0,0,0,0,0|2,0,1]=4 532 B8R0.7 O=C(O)COCCCO Amb28288633 [1,0,0,0,0,0|2,0,1]=4 533 B8R0.7 O=C(O)C\C=C/CCO Amb28410474 [1,0,0,0,0,0|1,0,2]=4 534 B8R0.7 O=C(O)C\C=C\CCO Amb27221056 [1,0,0,0,0,0|1,0,2]=4 535 B8R0.7 O=C(O)C\C=C\CCS Amb27421360 [1,0,0,0,0,0|1,0,2]=4 536 B8R0.7 O=C(O)\C=C/SCCO Amb27430273 [1,0,0,0,0,0|2,0,0]=3 537 B8R0.7 O=C(O)\C=C\C=C\CO Amb27779174 [1,0,0,0,0,0|1,0,2]=4 538 B8R0.7 O=C(O)\C=C\CCCCl Amb18644386 [1,0,0,0,0,0|1,0,0]=2 539 B8R0.7 O=C(O)\C=C\NCCO Amb28056766 [1,0,0,0,0,0|2,0,0]=3 540 B8R0.7 O=C(O)\C=C\SCCO Amb28281149 [1,0,0,0,0,0|2,0,0]=3 541 B8R0.7 O=C([O-])CCCCCO Amb22491268 [1,0,0,0,0,0|1,0,2]=4 542 B8R0.7 O=CCCCCC(=O)O Amb18642763 [1,0,0,0,0,0|1,0,2]=4 543 B8R0.7 O=CNC\C=C\C(=O)O Amb28045342 [1,0,0,0,0,0|2,0,1]=4 544 B8R0.7 OCCCCC=C(F)F Amb27225930 [1,0,0,0,0,0|3,0,0]=4 545 B8R0.7 OCCC\C=C\B(O)O Amb24588560 [1,0,0,0,0,0|2,0,1]=4 546 B10R0.3 C#CCC(C)N\C=C\C(=O)O Amb27823534 [0,1,0,0,0,0|1,0,2]=4 547 B10R0.3 C=CCC(C)N\C=C\C(=O)O Amb28386740 [0,1,0,0,0,0|1,0,2]=4 548 B10R0.3 CC(CCO)N\C=C\C(=O)O Amb28386727 [0,1,0,0,0,0|2,0,0]=3 549 B10R0.3 CCCC(=O)CCCC(=O)O Amb6305240 [0,1,0,0,0,0|0,0,3]=4 550 B10R0.3 CCCC(=O)N\C=C/C(=O)O Amb27974152 [0,1,0,0,0,0|1,0,1]=3 551 B10R0.3 CCCC(=O)N\C=C\C(=O)O Amb28057486 [0,1,0,0,0,0|1,0,1]=3 552 B10R0.3 CCCC(C)CCCC(=O)O Amb20669051 [0,1,0,0,0,0|0,0,2]=3 553 B10R0.3 CCCC(C)CCCC(C)=O Amb32668762 [0,1,0,0,0,0|1,0,2]=4 554 B10R0.3 CCCC(C)CCOC(C)=O Amb24087389 [0,1,0,0,0,0|2,0,1]=4 555 B10R0.3 CCCC(S)CCOC(C)=O Amb10071332 [0,1,0,0,0,0|2,0,1]=4 556 B10R0.3 CCNC(C)CC#CC(=O)O Amb33169002 [0,1,0,0,0,0|1,0,2]=4 557 B10R0.3 CCOC(C)CCCC(=O)O Amb33425000 [0,1,0,0,0,0|1,0,2]=4 558 B10R0.3 CSCC(C)N\C=C\C(=O)O Amb28386726 [0,1,0,0,0,0|2,0,0]=3 559 B10R0.3 C\C=C\C(C)C\C=C\C(C)=O Amb26659861 [0,1,0,0,0,0|1,0,2]=4 560 B10R0.4 C#CCCCN\C=C\C(=O)O Amb28387111 [0,1,0,0,0,0|0,0,2]=3 561 B10R0.4 C=C(C)\C=C\CCCCCC Amb22546604 [0,1,0,0,0,0|2,0,0]=3 562 B10R0.4 CC#CCOC\C=C\C(C)=O Amb27673812 [0,1,0,0,0,0|1,0,2]=4 563 B10R0.4 CC(=O)NCCCCCCN Amb5786933 [0,1,0,0,0,0|2,0,1]=4 564 B10R0.4 CC(=O)NCCCCCCO Amb24113372 [0,1,0,0,0,0|2,0,1]=4 565 B10R0.4 CC(=O)OCCCCCCBr Amb24063174 [0,1,0,0,0,0|2,0,1]=4 566 B10R0.4 CC(=O)SCCCCCCN Amb31031026 [0,1,0,0,0,0|2,0,1]=4 567 B10R0.4 CC(=O)SCCCCCCN Amb33276211 [0,1,0,0,0,0|2,0,1]=4 568 B10R0.4 CC(=O)\C=C\C#CCCCCl Amb26421747 [0,1,0,0,0,0|1,0,2]=4 569 B10R0.4 CCC#CCCCCC(=O)O Amb27269519 [0,1,0,0,0,0|0,0,3]=4 570 B10R0.4 CCCC#CCCCC(=O)O Amb27269520 [0,1,0,0,0,0|0,0,3]=4 571 B10R0.4 CCCC#CC\C=C\C(=O)O Amb25991326 [0,1,0,0,0,0|0,0,1]=2 572 B10R0.4 CCCCC#CC#CC(=O)O Amb27401973 [0,1,0,0,0,0|0,0,3]=4 573 B10R0.4 CCCCC#C\C=C\C(C)O Amb27757913 [0,1,0,0,0,0|1,0,2]=4 574 B10R0.4 CCCCC#C\C=C\[C@@H](C)O Amb27980597 [0,1,0,0,0,0|1,0,2]=4 575 B10R0.4 CCCCCC#CCC(=O)Cl Amb27672073 [0,1,0,0,0,0|1,0,2]=4 576 B10R0.4 CCCCCCC#CC(=O)O Amb2780028 [0,1,0,0,0,0|0,0,2]=3 577 B10R0.4 CCCCCCC#CC(C)=O Amb27672631 [0,1,0,0,0,0|1,0,2]=4 578 B10R0.4 CCCCCCCCC(=O)Cl Amb3941485 [0,1,0,0,0,0|1,0,2]=4 579 B10R0.4 CCCCCCCCC(=O)O Amb3940373 [0,1,0,0,0,0|0,0,2]=3 580 B10R0.4 CCCCCCCCC(=O)[O-] Amb22729912 [0,1,0,0,0,0|0,0,3]=4 581 B10R0.4 CCCCCCCCC(C)=O Amb8513861 [0,1,0,0,0,0|1,0,2]=4 582 B10R0.4 CCCCCCCCC(N)=O Amb8999041 [0,1,0,0,0,0|1,0,2]=4 583 B10R0.4 CCCCCCCOC(=O)Cl Amb19886548 [0,1,0,0,0,0|1,0,2]=4 584 B10R0.4 CCCCCCCOC(C)=O Amb6366320 [0,1,0,0,0,0|1,0,2]=4 585 B10R0.4 CCCCCCCOC(N)=O Amb32668733 [0,1,0,0,0,0|1,0,2]=4 586 B10R0.4 CCCCCCNCC(=O)O Amb8827565 [0,1,0,0,0,0|0,0,2]=3 587 B10R0.4 CCCCCCOCC(=O)O Amb7790032 [0,1,0,0,0,0|0,0,2]=3 588 B10R0.4 CCCCCC\C=C\B(O)O Amb2456043 [0,1,0,0,0,0|1,0,1]=3 589 B10R0.4 CCCCCC\C=C\C(=O)O Amb3940553 [0,1,0,0,0,0|0,0,0]=1 590 B10R0.4 CCCCCC\C=C\C(C)=O Amb22052629 [0,1,0,0,0,0|1,0,0]=2 591 B10R0.4 CCCCCC\C=C\C(C)O Amb22641689 [0,1,0,0,0,0|1,0,1]=3 592 B10R0.4 CCCCCNCCC(=O)O Amb7755694 [0,1,0,0,0,0|0,0,2]=3 593 B10R0.4 CCCCC\C=C\C=C(C)C Amb22546758 [0,1,0,0,0,0|2,0,0]=3 594 B10R0.4 CCCCC\C=C\NC(C)=O Amb28080162 [0,1,0,0,0,0|1,0,0]=2 595 B10R0.4 CCCCSCCCC(=O)O Amb9280591 [0,1,0,0,0,0|0,0,2]=3 596 B10R0.4 CCCC\C=C\C#CC(=O)O Amb27433905 [0,1,0,0,0,0|0,0,2]=3 597 B10R0.4 CCCNCCCOC(C)=O Amb18924647 [0,1,0,0,0,0|2,0,1]=4 598 B10R0.4 CCC\C=C\CCCC(=O)O Amb33079428 [0,1,0,0,0,0|0,0,3]=4 599 B10R0.4 CCOCCCCCC(=O)O Amb22234334 [0,1,0,0,0,0|0,0,2]=3 600 B10R0.4 CCOCCOCCC(=O)O Amb6273854 [0,1,0,0,0,0|1,0,2]=4 601 B10R0.4 CC\C=C\CN\C=C\C(=O)O Amb28387904 [0,1,0,0,0,0|0,0,2]=3 602 B10R0.4 CNCCOCCCC(=O)O Amb18106300 [0,1,0,0,0,0|1,0,2]=4 603 B10R0.4 COCCCNCCC(=O)O Amb8841109 [0,1,0,0,0,0|1,0,2]=4 604 B10R0.4 COCCCOCCC(=O)O Amb18180046 [0,1,0,0,0,0|1,0,2]=4 605 B10R0.4 COCCOCCCC(=O)O Amb6271198 [0,1,0,0,0,0|1,0,2]=4 606 B10R0.4 COCCOC\C=C\C(=O)O Amb18182499 [0,1,0,0,0,0|1,0,0]=2 607 B10R0.4 CSCCCCCCC(=O)O Amb28652939 [0,1,0,0,0,0|0,0,2]=3 608 B10R0.4 C\C=C\CCN\C=C\C(=O)O Amb28386735 [0,1,0,0,0,0|0,0,2]=3 609 B10R0.4 NCCCCCCCC(=O)O Amb19929586 [0,1,0,0,0,0|0,0,2]=3 610 B10R0.4 NCCCCCCCC(=O)O Amb1994908 [0,1,0,0,0,0|0,0,2]=3 611 B10R0.4 NCCCCCCNC(=O)O Amb22494605 [0,1,0,0,0,0|1,0,1]=3 612 B10R0.4 NCCCNCCCC(=O)O Amb18183427 [0,1,0,0,0,0|1,0,2]=4 613 B10R0.4 NCCCNCCCC(=O)O Amb33172775 [0,1,0,0,0,0|1,0,2]=4 614 B10R0.4 NCCCOCCCC(=O)O Amb18111568 [0,1,0,0,0,0|1,0,2]=4 615 B10R0.4 NCCCSCCCC(=O)O Amb17500719 [0,1,0,0,0,0|1,0,2]=4 616 B10R0.4 NCCOCCOCC(=O)O Amb10602483 [0,1,0,0,0,0|2,0,1]=4 617 B10R0.4 NCCOCCOCC(=O)O Amb16232535 [0,1,0,0,0,0|2,0,1]=4 618 B10R0.4 O=C(O)CCCCCCCBr Amb3940372 [0,1,0,0,0,0|0,0,2]=3 619 B10R0.4 O=C(O)CCCCCCCO Amb2688777 [0,1,0,0,0,0|0,0,2]=3 620 B10R0.4 O=C(O)CCCCOCCO Amb7782972 [0,1,0,0,0,0|1,0,2]=4 621 B10R0.4 O=C(O)CCCSCCCO Amb17502860 [0,1,0,0,0,0|1,0,2]=4 622 B10R0.4 O=C(O)COCCOCCCl Amb33719367 [0,1,0,0,0,0|2,0,1]=4 623 B10R0.4 O=C(O)COCCOCCO Amb24057830 [0,1,0,0,0,0|2,0,1]=4 624 B10R0.4 O=C([O-])CCCCCCCO Amb33513015 [0,1,0,0,0,0|0,0,3]=4 625 B10R0.6 CC#CCC\C(C)=C/C(=O)O Amb27666778 [0,1,0,0,0,0|0,0,2]=3 626 B10R0.6 CC(=O)\C=C(/C)CCCC#N Amb27672662 [0,1,0,0,0,0|2,0,1]=4 627 B10R0.6 CC(=O)\C=C(/C)NCCCN Amb27672527 [0,1,0,0,0,0|3,0,0]=4 628 B10R0.6 CC(=O)\C=C(/C)NCCCO Amb27673861 [0,1,0,0,0,0|3,0,0]=4 629 B10R0.6 CC(=O)\C=C(\C)NCCCN Amb26660553 [0,1,0,0,0,0|3,0,0]=4 630 B10R0.6 CCCCCC(=O)NC(=N)N Amb25386165 [0,1,0,0,0,0|3,0,0]=4 631 B10R0.6 CCCCCC(=O)NC(N)=S Amb9793620 [0,1,0,0,0,0|2,1,0]=4 632 B10R0.6 CCCCCC(C)CC(=O)O Amb19375410 [0,1,0,0,0,0|0,0,2]=3 633 B10R0.6 CCCCCC(N)CC(=O)O Amb21857987 [0,1,0,0,0,0|0,0,2]=3 634 B10R0.6 CCCCCC(N)CC(=O)O Amb31307614 [0,1,0,0,0,0|0,0,2]=3 635 B10R0.6 CCCCCC(N)CC(N)=O Amb33255748 [0,1,0,0,0,0|1,0,2]=4 636 B10R0.6 CCCCCC(O)CC(=O)O Amb18797787 [0,1,0,0,0,0|0,0,2]=3 637 B10R0.6 CCCCC[C@@H](O)CC(=O)O Amb31308365 [0,1,0,0,0,0|0,0,2]=3 638 B10R0.6 CCCCC[C@H](O)CC(=O)O Amb33872470 [0,1,0,0,0,0|0,0,2]=3 639 B10R0.6 CCCCNC(=N)NC(N)=O Amb28048819 [0,1,0,0,0,0|3,0,0]=4 640 B10R0.6 CCCCNC(=O)CC(C)=O Amb4025888 [0,1,0,0,0,0|2,0,1]=4 641 B10R0.6 CCCCNC(=O)NC(C)=O Amb26601898 [0,1,0,0,0,0|3,0,0]=4 642 B10R0.6 CCCCNC(=S)C=C(C)C Amb27990298 [0,1,0,0,0,0|3,0,0]=4 643 B10R0.6 CCCCN\C(C)=C\C(C)=O Amb27672522 [0,1,0,0,0,0|2,0,0]=3 644 B10R0.6 CCCCOC(=O)CC(C)=O Amb2412117 [0,1,0,0,0,0|2,0,1]=4 645 B10R0.6 CCCCSC(=N)NC(N)=O Amb27990323 [0,1,0,0,0,0|3,0,0]=4 646 B10R0.6 CCCCSC(=O)NC(N)=O Amb27818766 [0,1,0,0,0,0|3,0,0]=4 647 B10R0.6 CCCNCC(=O)NC(C)=O Amb28352092 [0,1,0,0,0,0|3,0,0]=4 648 B10R0.6 CCCSCC(N)CC(=O)O Amb32687888 [0,1,0,0,0,0|1,0,2]=4 649 B10R0.6 CCNCCC(=O)NC(N)=O Amb27491999 [0,1,0,0,0,0|3,0,0]=4 650 B10R0.6 CCOCCC(=O)CC(C)=O Amb18182347 [0,1,0,0,0,0|2,0,1]=4 651 B10R0.6 CCSCCC(=O)NC(N)=O Amb27987451 [0,1,0,0,0,0|3,0,0]=4 652 B10R0.6 CCSCCC(N)CC(=O)O Amb33254745 [0,1,0,0,0,0|1,0,2]=4 653 B10R0.6 CNCCCC(=O)NC(N)=O Amb27492000 [0,1,0,0,0,0|3,0,0]=4 654 B10R0.6 CNCCN\C(C)=C\C(C)=O Amb27990317 [0,1,0,0,0,0|3,0,0]=4 655 B10R0.6 COCCN\C(C)=C/C(C)=O Amb27990279 [0,1,0,0,0,0|3,0,0]=4 656 B10R0.6 CSCCCC(=O)NC(N)=O Amb27271825 [0,1,0,0,0,0|3,0,0]=4 657 B10R0.6 CSCCCC(N)CC(=O)O Amb33308380 [0,1,0,0,0,0|1,0,2]=4 658 B10R0.6 C\C(O)=C/C(C)=N/CCCN Amb27818757 [0,1,0,0,0,0|3,0,0]=4 659 B10R0.6 C\C=C/CC\C(O)=C\C(C)=O Amb27673601 [0,1,0,0,0,0|1,0,2]=4 660 B10R0.6 NCCCCC(=O)NC(N)=O Amb27271665 [0,1,0,0,0,0|3,0,0]=4 661 B10R0.6 NCCCC[C@@H](N)CC(=O)O Amb22746256 [0,1,0,0,0,0|1,0,2]=4 662 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb16184018 [0,1,0,0,0,0|1,0,2]=4 663 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb22369388 [0,1,0,0,0,0|1,0,2]=4 664 B10R0.6 NCCCC[C@H](N)CC(=O)O Amb33929234 [0,1,0,0,0,0|1,0,2]=4 665 B10R0.6 [2H]\C(=C/C(C)C)CCCCC Amb22546752 [0,1,0,0,0,0|2,0,1]=4 666 B10R0.22 CCCCCCCP(=O)(O)O Amb9786420 [0,1,0,0,0,0|1,0,2]=4 667 B10R0.22 CCCCC\C=C\C(C)(C)C Amb22546599 [0,1,0,0,0,0|2,0,1]=4 668 B10R0.55 C#CC(C)NC\C=C\C(=O)O Amb28386741 [0,1,0,0,0,0|1,0,2]=4 669 B10R0.55 CC(CO)CN\C=C\C(=O)O Amb28386710 [0,1,0,0,0,0|2,0,0]=3 670 B10R0.55 CC(\C=C\C=C\C(=O)O)CN Amb27671716 [0,1,0,0,0,0|1,0,2]=4 671 B10R0.55 CCC(=O)CCCCC(=O)O Amb6305227 [0,1,0,0,0,0|0,0,3]=4 672 B10R0.55 CCC(C)CCCCC(=O)O Amb24271145 [0,1,0,0,0,0|0,0,2]=3 673 B10R0.55 CCC(C)CN\C=C\C(=O)O Amb28386709 [0,1,0,0,0,0|1,0,0]=2 674 B10R0.55 CCC(C)NCC#CC(=O)O Amb33168982 [0,1,0,0,0,0|1,0,2]=4 675 B10R0.55 CCC(O)C#C\C=C\C(=O)O Amb27592172 [0,1,0,0,0,0|0,0,2]=3 676 B10R0.55 CCC(O)CN\C=C\C(=O)O Amb28386737 [0,1,0,0,0,0|1,0,0]=2 677 B10R0.55 O=C(O)CCCCC(F)CBr Amb22547639 [0,1,0,0,0,0|1,0,2]=4 678 B10R0.74 C#CCCN\C=C\C(=O)OC Amb28386714 [0,1,0,0,0,0|1,0,2]=4 679 B10R0.74 C=CC(=O)N\C=C\CCCC Amb27673243 [0,1,0,0,0,0|2,0,1]=4 680 B10R0.74 C=CC(C)\C=C/CCCCC Amb22546637 [0,1,0,0,0,0|2,0,1]=4 681 B10R0.74 CCCCC#CCC(=O)OC Amb27673306 [0,1,0,0,0,0|0,0,3]=4 682 B10R0.74 CCCCCC#CC(=O)CF Amb25383110 [0,1,0,0,0,0|1,0,2]=4 683 B10R0.74 CCCCCC#CC(=O)NN Amb24391165 [0,1,0,0,0,0|1,0,2]=4 684 B10R0.74 CCCCCC#CC(=O)OC Amb2721698 [0,1,0,0,0,0|0,0,2]=3 685 B10R0.74 CCCCCCCC(=O)CC Amb6366429 [0,1,0,0,0,0|1,0,2]=4 686 B10R0.74 CCCCCCCC(=O)NN Amb6564834 [0,1,0,0,0,0|1,0,2]=4 687 B10R0.74 CCCCCCCC(=O)NO Amb7764666 [0,1,0,0,0,0|0,0,2]=3 688 B10R0.74 CCCCCCCC(=O)OC Amb8516706 [0,1,0,0,0,0|0,0,2]=3 689 B10R0.74 CCCCCCNC(=O)CBr Amb17331633 [0,1,0,0,0,0|2,0,1]=4 690 B10R0.74 CCCCCCNC(=O)CCl Amb6753822 [0,1,0,0,0,0|2,0,1]=4 691 B10R0.74 CCCCCCNC(=O)CN Amb9279196 [0,1,0,0,0,0|2,0,1]=4 692 B10R0.74 CCCCCCOC(=O)C=O Amb17614962 [0,1,0,0,0,0|1,0,2]=4 693 B10R0.74 CCCCCCOC(=O)CCl Amb9787731 [0,1,0,0,0,0|2,0,1]=4 694 B10R0.74 CCCCCCOC(=O)CN Amb2688622 [0,1,0,0,0,0|2,0,1]=4 695 B10R0.74 CCCCCCOC(=O)CS Amb2778632 [0,1,0,0,0,0|1,1,1]=4 696 B10R0.74 CCCCCC\C=C(\I)CC Amb22641682 [0,1,0,0,0,0|2,0,1]=4 697 B10R0.74 CCCCC\C=C\C(=O)OC Amb24066773 [0,1,0,0,0,0|0,0,0]=1 698 B10R0.74 CCOCCC#CC(=O)OC Amb33168826 [0,1,0,0,0,0|1,0,2]=4 699 B10R0.74 CCOCCOCC(=O)OC Amb9206358 [0,1,0,0,0,0|2,0,1]=4 700 B10R0.74 COC(=O)C#CCCCCBr Amb27672184 [0,1,0,0,0,0|1,0,2]=4 701 B10R0.74 COC(=O)C#CCCCCCl Amb27990063 [0,1,0,0,0,0|1,0,2]=4 702 B10R0.74 COC(=O)CCCCCCBr Amb10604007 [0,1,0,0,0,0|1,0,2]=4 703 B10R0.74 COC(=O)CCCCCCI Amb32410699 [0,1,0,0,0,0|1,0,2]=4 704 B10R0.74 COC(=O)CCCCCCN Amb35747961 [0,1,0,0,0,0|1,0,2]=4 705 B10R0.74 COC(=O)CCCCCCN Amb7762677 [0,1,0,0,0,0|1,0,2]=4 706 B10R0.74 COC(=O)CCCCCCN Amb7969645 [0,1,0,0,0,0|1,0,2]=4 707 B10R0.74 COC(=O)CCCCCCO Amb13887312 [0,1,0,0,0,0|1,0,2]=4 708 B10R0.74 COC(=O)\C=C\C#CCCO Amb28065166 [0,1,0,0,0,0|1,0,2]=4 709 B10R0.74 COCCCNCC(=O)OC Amb9204008 [0,1,0,0,0,0|2,0,1]=4 710 B10R0.74 C\C=C\CN\C=C\C(=O)OC Amb28387914 [0,1,0,0,0,0|1,0,2]=4 711 B10R0.75 C#CCCCNC(=O)C(=O)O Amb28387109 [0,1,0,0,0,0|1,0,2]=4 712 B10R0.75 C#CCCC\C=C(/C)C(C)=O Amb27672669 [0,1,0,0,0,0|1,0,2]=4 713 B10R0.75 CC#CCCNC(=O)C(=O)O Amb27253917 [0,1,0,0,0,0|1,0,2]=4 714 B10R0.75 CC#CCC\C=C(/C)C(=O)O Amb27945435 [0,1,0,0,0,0|0,0,2]=3 715 B10R0.75 CC(SCCCCN)C(=O)O Amb17500920 [0,1,0,0,0,0|2,0,1]=4 716 B10R0.75 CCCCCCC(Br)C(=O)Br Amb24061160 [0,1,0,0,0,0|1,0,2]=4 717 B10R0.75 CCCCCCC(C)C(=O)O Amb10843971 [0,1,0,0,0,0|0,0,2]=3 718 B10R0.75 CCCCCCC(F)C(=O)O Amb32663880 [0,1,0,0,0,0|0,0,2]=3 719 B10R0.75 CCCCCCC(N)C(=O)O Amb2613445 [0,1,0,0,0,0|0,0,2]=3 720 B10R0.75 CCCCCCC(N)C(N)=O Amb18791950 [0,1,0,0,0,0|1,0,2]=4 721 B10R0.75 CCCCCC[C@@H](N)C(=O)O Amb16183913 [0,1,0,0,0,0|0,0,2]=3 722 B10R0.75 CCCCCC[C@H](N)C(=O)O Amb16183914 [0,1,0,0,0,0|0,0,2]=3 723 B10R0.75 CCCC\C=C\C(F)=C(F)F Amb27272463 [0,1,0,0,0,0|2,0,1]=4 724 B10R0.75 CCCOCCC(N)C(=O)O Amb18177730 [0,1,0,0,0,0|1,0,2]=4 725 B10R0.75 CCCOCC[C@@H](N)C(=O)O Amb33036139 [0,1,0,0,0,0|1,0,2]=4 726 B10R0.75 CCCOCC[C@H](N)C(=O)O Amb33065384 [0,1,0,0,0,0|1,0,2]=4 727 B10R0.75 CCC\C=C\CC(=O)C(=O)O Amb33327170 [0,1,0,0,0,0|0,0,3]=4 728 B10R0.75 CCOCCCC(N)C(=O)O Amb33036943 [0,1,0,0,0,0|1,0,2]=4 729 B10R0.75 CCOCCC[C@@H](N)C(=O)O Amb33065544 [0,1,0,0,0,0|1,0,2]=4 730 B10R0.75 CCOCCC[C@H](N)C(=O)O Amb33065515 [0,1,0,0,0,0|1,0,2]=4 731 B10R0.75 CCOCCOC(C)C(=O)O Amb6262432 [0,1,0,0,0,0|2,0,1]=4 732 B10R0.75 CCSCCCC(C)C(=O)O Amb33449009 [0,1,0,0,0,0|1,0,2]=4 733 B10R0.75 CCSCCCC(N)C(=O)O Amb32865930 [0,1,0,0,0,0|1,0,2]=4 734 B10R0.75 CCSCCC[C@@H](N)C(=O)O Amb33066174 [0,1,0,0,0,0|1,0,2]=4 735 B10R0.75 CCSCCC[C@H](N)C(=O)O Amb32937037 [0,1,0,0,0,0|1,0,2]=4 736 B10R0.75 CC\C=C\CNC(=O)C(=O)O Amb28387967 [0,1,0,0,0,0|1,0,2]=4 737 B10R0.75 CNCCCC[C@H](N)C(=O)O Amb33786042 [0,1,0,0,0,0|1,0,2]=4 738 B10R0.75 CNCCSCC(=O)C(=O)O Amb33069826 [0,1,0,0,0,0|2,0,1]=4 739 B10R0.75 COCCCCC(C)C(=O)O Amb32953450 [0,1,0,0,0,0|1,0,2]=4 740 B10R0.75 COCCCCC(N)C(=O)O Amb33066324 [0,1,0,0,0,0|1,0,2]=4 741 B10R0.75 COCCCC[C@@H](N)C(=O)O Amb33308996 [0,1,0,0,0,0|1,0,2]=4 742 B10R0.75 COCCCC[C@H](N)C(=O)O Amb33036987 [0,1,0,0,0,0|1,0,2]=4 743 B10R0.75 CSCCCCC(C)C(=O)O Amb32953968 [0,1,0,0,0,0|1,0,2]=4 744 B10R0.75 C\C=C\CCNC(=O)C(=O)O Amb27988117 [0,1,0,0,0,0|1,0,2]=4 745 B10R0.75 NC(CCCCCF)C(=O)O Amb33036467 [0,1,0,0,0,0|1,0,2]=4 746 B10R0.75 NC(CCCCCO)C(=O)O Amb33037096 [0,1,0,0,0,0|1,0,2]=4 747 B10R0.75 NCCCSCC(=O)C(=O)O Amb33069797 [0,1,0,0,0,0|2,0,1]=4 748 B10R0.75 N[C@@H](CCCCCF)C(=O)O Amb33065721 [0,1,0,0,0,0|1,0,2]=4 749 B10R0.75 N[C@@H](CCCCCO)C(=O)O Amb33308918 [0,1,0,0,0,0|1,0,2]=4 750 B10R0.75 N[C@H](CCCCCF)C(=O)O Amb33036618 [0,1,0,0,0,0|1,0,2]=4 751 B10R0.75 N[C@H](CCCCCO)C(=O)O Amb33065614 [0,1,0,0,0,0|1,0,2]=4 752 B10R0.75 O=C(O)C(=O)CSCCCBr Amb33069767 [0,1,0,0,0,0|2,0,1]=4 753 B10R0.75 O=C(O)C(=O)CSCCCCl Amb33069762 [0,1,0,0,0,0|2,0,1]=4 754 B10R0.75 O=C(O)C(=O)CSCCCO Amb33069718 [0,1,0,0,0,0|2,0,1]=4 755 B10R0.75 O=C(O)C(=O)CSCCCS Amb33069988 [0,1,0,0,0,0|2,0,1]=4 756 B10R0.78 C#CCCC(C)\C=C\C(C)=O Amb24766518 [0,1,0,0,0,0|1,0,2]=4 757 B10R0.78 CCCCC(=O)CCC(=O)O Amb6305230 [0,1,0,0,0,0|0,0,3]=4 758 B10R0.78 CCCCC(=O)NCC(=O)O Amb2794084 [0,1,0,0,0,0|1,0,2]=4 759 B10R0.78 CCCCC(C)C#CC(=O)O Amb27945976 [0,1,0,0,0,0|0,0,2]=3 760 B10R0.78 CCCCC(C)CCC(=O)O Amb2689572 [0,1,0,0,0,0|0,0,2]=3 761 B10R0.78 CCCCC(C)CCC(=O)[O-] Amb33513011 [0,1,0,0,0,0|0,0,3]=4 762 B10R0.78 CCCCC(N)C#CC(=O)O Amb33168917 [0,1,0,0,0,0|0,0,2]=3 763 B10R0.78 CCCCC(N)CCC(=O)O Amb33172614 [0,1,0,0,0,0|0,0,2]=3 764 B10R0.78 CCCCC(O)CCC(=O)O Amb33539237 [0,1,0,0,0,0|0,0,2]=3 765 B10R0.78 CCCCC(O)CCC(=O)[O-] Amb32674867 [0,1,0,0,0,0|0,0,3]=4 766 B10R0.78 CCCCN(C)CCC(=O)O Amb5762149 [0,1,0,0,0,0|1,0,2]=4 767 B10R0.78 CCCNC(=O)\C=C\C(=O)O Amb7174058 [0,1,0,0,0,0|1,0,1]=3 768 B10R0.78 CCNCC(C)C#CC(=O)O Amb33169000 [0,1,0,0,0,0|1,0,2]=4 769 B10R0.78 CCONC(=O)\C=C/C(=O)O Amb28387972 [0,1,0,0,0,0|2,0,1]=4 770 B10R0.78 CCSCC(N)CCC(=O)O Amb33324077 [0,1,0,0,0,0|1,0,2]=4 771 B10R0.78 COCCC(N)C#CC(=O)O Amb33168997 [0,1,0,0,0,0|1,0,2]=4 772 B10R0.78 COCCC(N)CCC(=O)O Amb33377834 [0,1,0,0,0,0|1,0,2]=4 773 B10R0.78 CSCCC(N)CCC(=O)O Amb33199123 [0,1,0,0,0,0|1,0,2]=4 774 B10R0.78 O=C(O)\C=C/C(=O)NCCO Amb17131337 [0,1,0,0,0,0|2,0,1]=4 775 B10R0.97 C=C(C)CCCCCC(=O)O Amb6299589 [0,1,0,0,0,0|0,0,3]=4 776 B10R0.97 CC(=O)CCCCCC(=O)O Amb3939939 [0,1,0,0,0,0|0,0,3]=4 777 B10R0.97 CC(=O)\C=C/CCC=C(C)C Amb27672366 [0,1,0,0,0,0|1,0,2]=4 778 B10R0.97 CC(C)=CCC\C=C\C(=O)O Amb18125771 [0,1,0,0,0,0|0,0,2]=3 779 B10R0.97 CC(C)=CCN\C=C\C(=O)O Amb28365686 [0,1,0,0,0,0|1,0,2]=4 780 B10R0.97 CC(C)=NOC\C=C\C(=O)O Amb27988402 [0,1,0,0,0,0|2,0,1]=4 781 B10R0.97 CC(C)CCCCCC(=O)O Amb16232096 [0,1,0,0,0,0|0,0,2]=3 782 B10R0.97 CC(C)CCCOCC(=O)O Amb7790013 [0,1,0,0,0,0|1,0,1]=3 783 B10R0.97 CC(C)CCNCCC(=O)O Amb1110986 [0,1,0,0,0,0|1,0,2]=4 784 B10R0.97 CC(C)CNCCCC(=O)O Amb6252909 [0,1,0,0,0,0|1,0,2]=4 785 B10R0.97 CC(C)CON\C=C\C(=O)O Amb28386739 [0,1,0,0,0,0|2,0,0]=3 786 B10R0.97 CC(C)C\C=C\C=C/C(=O)O Amb27269203 [0,1,0,0,0,0|0,0,2]=3 787 B10R0.97 CC(C)C\C=C\C=C\C(N)=O Amb27990294 [0,1,0,0,0,0|1,0,2]=4 788 B10R0.97 CC(C)OCCCCC(=O)O Amb9207794 [0,1,0,0,0,0|1,0,2]=4 789 B10R0.97 CC(C)O\C=C\C=C\C(=O)O Amb27990200 [0,1,0,0,0,0|1,0,2]=4 790 B10R0.97 CC(O)CCCCCC(=O)O Amb24117232 [0,1,0,0,0,0|0,0,2]=3 791 B10R0.97 CC(O)CCN\C=C\C(=O)O Amb28386713 [0,1,0,0,0,0|1,0,0]=2 792 B10R0.97 CN(C)CCCCCC(=O)O Amb31307243 [0,1,0,0,0,0|1,0,2]=4 793 B10R0.97 CN(C)CCCCCC(=O)O Amb32410704 [0,1,0,0,0,0|1,0,2]=4 794 B10R0.97 CS(=O)CCN\C=C\C(=O)O Amb28386730 [0,1,0,0,0,0|2,0,0]=3 795 B10R0.97 O=C(O)\C=C\NCCC(F)F Amb27989055 [0,1,0,0,0,0|2,0,0]=3 796 B10R1.10 C=CC[C@@H]1CC=CC(=O)C1 Amb27802475 [0,0,0,1,0,0|1,0,2]=4 797 B10R1.10 CCCC1CC(=O)C=CN1 Amb28250951 [0,0,0,1,0,0|2,0,0]=3 798 B10R1.10 CCCC1CC=CC(=O)N1 Amb27236833 [0,0,0,1,0,0|1,0,0]=2 799 B10R1.10 CCCC1CC=CC(=O)O1 Amb24099235 [0,0,0,1,0,0|0,0,0]=1 800 B10R1.10 CCCC1CCCC(=O)C1 Amb22754799 [0,0,0,1,0,0|1,0,2]=4 801 B10R1.10 CCCC1CCNC(=O)C1 Amb26026704 [0,0,0,1,0,0|2,0,1]=4 802 B10R1.10 CCCC1CCNC(=O)N1 Amb26026362 [0,0,0,1,0,0|2,0,1]=4 803 B10R1.10 CCCC1CNCC(=O)N1 Amb27953604 [0,0,0,1,0,0|2,0,1]=4 804 B10R1.10 CCC[C@@H]1CC(=O)C=CN1 Amb27850175 [0,0,0,1,0,0|2,0,0]=3 805 B10R1.10 CCC[C@H]1C=CCC(=O)N1 Amb28363911 [0,0,0,1,0,0|1,0,2]=4 806 B10R1.10 CCC[C@H]1CCCC(=O)C1 Amb27436290 [0,0,0,1,0,0|1,0,2]=4 807 B10R1.10 CCC[C@H]1CCCC(=O)N1 Amb27770582 [0,0,0,1,0,0|1,0,2]=4 808 B10R1.10 CCC[C@H]1COCC(=O)N1 Amb27473283 [0,0,0,1,0,0|2,0,1]=4 809 B10R1.10 CCCc1cc(O)ccn1 Amb10599775 [0,0,0,1,0,0|2,0,1]=4 810 B10R1.10 CCCc1cccc(O)c1 Amb3941016 [0,0,0,1,0,0|1,0,2]=4 811 B10R1.10 CCCc1cccc(O)n1 Amb10600153 [0,0,0,1,0,0|1,0,2]=4 812 B10R1.10 CCCc1nccc(O)n1 Amb10599370 [0,0,0,1,0,0|2,0,1]=4 813 B10R1.10 CNCC1CC=CC(O)C1 Amb27768742 [0,0,0,1,0,0|2,0,1]=4 814 B10R1.10 COCC1CC(=O)C=CO1 Amb27752309 [0,0,0,1,0,0|3,0,0]=4 815 B10R1.10 N#CCC1CC=CC(=O)C1 Amb27835520 [0,0,0,1,0,0|2,0,1]=4 816 B10R1.10 O=C1CCCC(CCBr)O1 Amb28120676 [0,0,0,1,0,0|1,0,2]=4 817 B10R1.10 O=C1CCCC(CCCl)O1 Amb27234609 [0,0,0,1,0,0|1,0,2]=4 818 B10R1.10 O=C1CCC[C@@H](CCO)O1 Amb28205971 [0,0,0,1,0,0|1,0,2]=4 819 B10R1.10 O=CC[C@@H]1CC=CC(=O)O1 Amb27397557 [0,0,0,1,0,0|1,0,1]=3 820 B10R1.10 O=CC[C@H]1CC=CC(=O)O1 Amb28129526 [0,0,0,1,0,0|1,0,1]=3 821 B10R1.16 BrCCCc1ccc(Br)o1 Amb25234702 [0,0,0,1,0,0|2,0,1]=4 822 B10R1.16 CCCCC1=CCC(=O)S1 Amb27962004 [0,0,0,1,0,0|0,1,2]=4 823 B10R1.16 CCCCC1CC(=O)CO1 Amb35718938 [0,0,0,1,0,0|2,0,1]=4 824 B10R1.16 CCCCC1CC(=O)NN1 Amb29859945 [0,0,0,1,0,0|3,0,0]=4 825 B10R1.16 CCCCC1CCC(=O)O1 Amb8513275 [0,0,0,1,0,0|0,0,2]=3 826 B10R1.16 CCCCC1CNC(=O)C1 Amb26346287 [0,0,0,1,0,0|2,0,1]=4 827 B10R1.16 CCCCC1CNC(=O)O1 Amb27830443 [0,0,0,1,0,0|1,0,1]=3 828 B10R1.16 CCCCC1CNC(O)=N1 Amb27806163 [0,0,0,1,0,0|2,0,1]=4 829 B10R1.16 CCCCC1COC(=O)N1 Amb24482077 [0,0,0,1,0,0|2,0,1]=4 830 B10R1.16 CCCCN1C=CC(=O)N1 Amb32794680 [0,0,0,1,0,0|2,0,0]=3 831 B10R1.16 CCCC[C@@H]1C=CC(=O)C1 Amb28381113 [0,0,0,1,0,0|1,0,0]=2 832 B10R1.16 CCCC[C@@H]1C=C[C@H](O)C1 Amb27851085 [0,0,0,1,0,0|1,0,1]=3 833 B10R1.16 CCCC[C@@H]1CCC(=O)N1 Amb28134882 [0,0,0,1,0,0|1,0,2]=4 834 B10R1.16 CCCC[C@@H]1CNC(=O)C1 Amb27770599 [0,0,0,1,0,0|2,0,1]=4 835 B10R1.16 CCCC[C@@H]1COC(=O)N1 Amb22225366 [0,0,0,1,0,0|2,0,1]=4 836 B10R1.16 CCCCc1ccc(Br)s1 Amb28401526 [0,0,0,1,0,0|1,1,1]=4 837 B10R1.16 CCCCc1ccc(C)o1 Amb4018006 [0,0,0,1,0,0|1,0,1]=3 838 B10R1.16 CCCCc1ccc(C)s1 Amb10807431 [0,0,0,1,0,0|1,1,1]=4 839 B10R1.16 CCCCc1ccc(F)s1 Amb27268693 [0,0,0,1,0,0|1,1,1]=4 840 B10R1.16 CCCCc1cnc(N)o1 Amb33427773 [0,0,0,1,0,0|2,0,1]=4 841 B10R1.16 CCCCc1ncc(Br)o1 Amb27171204 [0,0,0,1,0,0|2,0,1]=4 842 B10R1.16 CCCCc1ncc(N)o1 Amb27494543 [0,0,0,1,0,0|2,0,1]=4 843 B10R1.16 CCCCn1cc(O)cn1 Amb24696313 [0,0,0,1,0,0|3,0,0]=4 844 B10R1.16 CCCCn1ccc(Br)n1 Amb26935152 [0,0,0,1,0,0|3,0,0]=4 845 B10R1.16 CCCCn1ccc(C)n1 Amb6890349 [0,0,0,1,0,0|3,0,0]=4 846 B10R1.16 CCCCn1ccc(N)n1 Amb33534840 [0,0,0,1,0,0|3,0,0]=4 847 B10R1.16 CCCSc1ccc(O)s1 Amb17201955 [0,0,0,1,0,0|1,1,1]=4 848 B10R1.16 CCNCc1ccc(Br)o1 Amb6275503 [0,0,0,1,0,0|2,0,1]=4 849 B10R1.16 CCNCc1ccc(C)o1 Amb21959933 [0,0,0,1,0,0|2,0,1]=4 850 B10R1.16 CCNCc1ccc(C)o1 Amb2592074 [0,0,0,1,0,0|2,0,1]=4 851 B10R1.16 CCNCc1ccc(Cl)o1 Amb18288966 [0,0,0,1,0,0|2,0,1]=4 852 B10R1.16 CCNCc1ccc(I)o1 Amb9621228 [0,0,0,1,0,0|2,0,1]=4 853 B10R1.16 CCNCc1ccc(N)o1 Amb18625539 [0,0,0,1,0,0|2,0,1]=4 854 B10R1.16 CCOCC1COC(=O)O1 Amb27613885 [0,0,0,1,0,0|2,0,1]=4 855 B10R1.16 CCSCC1CNC(=O)O1 Amb33323377 [0,0,0,1,0,0|2,0,1]=4 856 B10R1.16 CCSCc1ccc(Br)o1 Amb27409997 [0,0,0,1,0,0|2,0,1]=4 857 B10R1.16 CNCCc1ccc(Br)o1 Amb26421015 [0,0,0,1,0,0|2,0,1]=4 858 B10R1.16 CNCCc1ccc(C)o1 Amb25130668 [0,0,0,1,0,0|2,0,1]=4 859 B10R1.16 CNCCc1ccc(Cl)o1 Amb26605863 [0,0,0,1,0,0|2,0,1]=4 860 B10R1.16 CNCCc1ccc(F)o1 Amb28195954 [0,0,0,1,0,0|2,0,1]=4 861 B10R1.16 COCCC1CNC(=O)O1 Amb33377305 [0,0,0,1,0,0|2,0,1]=4 862 B10R1.16 COCO[C@@H]1C=CC(=O)C1 Amb28381134 [0,0,0,1,0,0|3,0,0]=4 863 B10R1.16 CSCCC1CNC(=O)O1 Amb33203358 [0,0,0,1,0,0|2,0,1]=4 864 B10R1.16 CSCCc1ccc(C)o1 Amb27185996 [0,0,0,1,0,0|2,0,1]=4 865 B10R1.16 Cc1ccc(CCCBr)o1 Amb26597326 [0,0,0,1,0,0|2,0,1]=4 866 B10R1.16 Cc1ccc(CCCI)o1 Amb27869966 [0,0,0,1,0,0|2,0,1]=4 867 B10R1.16 Cc1ccc(CCCN)o1 Amb17477776 [0,0,0,1,0,0|2,0,1]=4 868 B10R1.16 Cc1ccc(CCCO)o1 Amb17477780 [0,0,0,1,0,0|2,0,1]=4 869 B10R1.16 Cc1ccc(CCCS)o1 Amb28187355 [0,0,0,1,0,0|2,0,1]=4 870 B10R1.16 ClCCCc1ccc(Br)o1 Amb26626518 [0,0,0,1,0,0|2,0,1]=4 871 B10R1.16 Clc1ccc(CCCBr)o1 Amb33335968 [0,0,0,1,0,0|2,0,1]=4 872 B10R1.16 NCCCC1CCC(=O)O1 Amb27776907 [0,0,0,1,0,0|1,0,2]=4 873 B10R1.16 NCCCc1ccc(Br)o1 Amb27165463 [0,0,0,1,0,0|2,0,1]=4 874 B10R1.16 NCCCc1ccc(Cl)o1 Amb24744527 [0,0,0,1,0,0|2,0,1]=4 875 B10R1.16 NCCCc1ccc(F)o1 Amb27813597 [0,0,0,1,0,0|2,0,1]=4 876 B10R1.16 O=C1C=C[C@H](CCCO)O1 Amb27171273 [0,0,0,1,0,0|1,0,0]=2 877 B10R1.16 O=C1CCC(CCCO)O1 Amb27968758 [0,0,0,1,0,0|1,0,2]=4 878 B10R1.16 O=C1CC[C@H](CCCO)O1 Amb27205711 [0,0,0,1,0,0|1,0,2]=4 879 B10R1.16 O=CCCC1C=CC(=O)S1 Amb28245775 [0,0,0,1,0,0|1,1,1]=4 880 B10R1.16 OCCCc1ccc(Br)o1 Amb25800149 [0,0,0,1,0,0|2,0,1]=4 881 B10R1.16 OCCCc1ccc(Cl)o1 Amb26458673 [0,0,0,1,0,0|2,0,1]=4 882 B10R1.16 SCCCc1ccc(Br)o1 Amb33452203 [0,0,0,1,0,0|2,0,1]=4 883 B10R1.16 SCCCc1ccc(Cl)o1 Amb33258686 [0,0,0,1,0,0|2,0,1]=4 884 B10R1.18 CC(=O)C=C1CCCCC1 Amb27974960 [0,0,0,1,0,0|1,0,0]=2 885 B10R1.18 CC(=O)C=C1CCSCC1 Amb27652034 [0,0,0,1,0,0|2,0,0]=3 886 B10R1.18 CC(=O)CC1=CCCCC1 Amb27392965 [0,0,0,1,0,0|1,0,2]=4 887 B10R1.18 CC(=O)CC1CCCCC1 Amb4034580 [0,0,0,1,0,0|1,0,2]=4 888 B10R1.18 CC(=O)CN1CCCCC1 Amb8427989 [0,0,0,1,0,0|2,0,1]=4 889 B10R1.18 CC(=O)NC1=CCCCC1 Amb28126799 [0,0,0,1,0,0|2,0,1]=4 890 B10R1.18 CC(=O)NC1CCCCC1 Amb2237063 [0,0,0,1,0,0|2,0,1]=4 891 B10R1.18 CC(=O)NN1CCCCC1 Amb2125333 [0,0,0,1,0,0|3,0,0]=4 892 B10R1.18 CC(=O)OC1=CCCCC1 Amb9677480 [0,0,0,1,0,0|2,0,1]=4 893 B10R1.18 CC(=O)\C=C1/C=CCCC1 Amb27209037 [0,0,0,1,0,0|1,0,2]=4 894 B10R1.18 CC(=O)\C=C1\CCCCN1 Amb24591348 [0,0,0,1,0,0|2,0,0]=3 895 B10R1.18 CC(C)=CN1CCCCC1 Amb4017521 [0,0,0,1,0,0|3,0,0]=4 896 B10R1.18 CC(C)C=C1CCCCC1 Amb32988220 [0,0,0,1,0,0|2,0,1]=4 897 B10R1.18 CC(O)C=C1CCCCC1 Amb28043220 [0,0,0,1,0,0|1,0,1]=3 898 B10R1.18 CC(O)\C=C1\CCCSC1 Amb27207487 [0,0,0,1,0,0|2,0,1]=4 899 B10R1.18 CS(=O)N=C1CCCCC1 Amb35681702 [0,0,0,1,0,0|3,0,0]=4 900 B10R1.18 C[C@H](O)C=C1CCCCC1 Amb27829700 [0,0,0,1,0,0|1,0,1]=3 901 B10R1.18 C\C(Br)=C/C1CCCCC1 Amb28326007 [0,0,0,1,0,0|2,0,1]=4 902 B10R1.18 N=C(N)N=C1CCCCC1 Amb28456643 [0,0,0,1,0,0|3,0,0]=4 903 B10R1.18 NC(=O)C=C1CCCCC1 Amb24725376 [0,0,0,1,0,0|1,0,0]=2 904 B10R1.18 NC(=O)C=C1CCNCC1 Amb27625168 [0,0,0,1,0,0|2,0,0]=3 905 B10R1.18 NC(=O)C=C1CCOCC1 Amb28348699 [0,0,0,1,0,0|2,0,0]=3 906 B10R1.18 NC(=O)C=C1NCCCN1 Amb27636595 [0,0,0,1,0,0|3,0,0]=4 907 B10R1.18 NC(=O)CC1=CCCCC1 Amb27410664 [0,0,0,1,0,0|1,0,2]=4 908 B10R1.18 NC(=O)CC1CCCCC1 Amb33551594 [0,0,0,1,0,0|1,0,2]=4 909 B10R1.18 NC(=O)CN1CCCCC1 Amb17142861 [0,0,0,1,0,0|2,0,1]=4 910 B10R1.18 NC(=O)NC1CCCCC1 Amb1151266 [0,0,0,1,0,0|2,0,1]=4 911 B10R1.18 NC(=O)OC1CCCCC1 Amb4012086 [0,0,0,1,0,0|2,0,1]=4 912 B10R1.18 NC(=O)SC1CCCCC1 Amb27607116 [0,0,0,1,0,0|2,0,1]=4 913 B10R1.18 O=C(Cl)CC1CCCCC1 Amb33528414 [0,0,0,1,0,0|1,0,2]=4 914 B10R1.18 O=C(Cl)NC1CCCCC1 Amb26068583 [0,0,0,1,0,0|2,0,1]=4 915 B10R1.18 O=C(Cl)NN1CCCCC1 Amb35637108 [0,0,0,1,0,0|3,0,0]=4 916 B10R1.18 O=C(Cl)OC1CCCCC1 Amb8390640 [0,0,0,1,0,0|2,0,1]=4 917 B10R1.18 O=C(Cl)SC1CCCCC1 Amb32679652 [0,0,0,1,0,0|2,0,1]=4 918 B10R1.18 O=C(F)NC1CCCCC1 Amb27242067 [0,0,0,1,0,0|2,0,1]=4 919 B10R1.18 O=C(O)C=C1CCCCC1 Amb2429191 [0,0,0,1,0,0|0,0,0]=1 920 B10R1.18 O=C(O)C=C1CCNCC1 Amb18560139 [0,0,0,1,0,0|1,0,0]=2 921 B10R1.18 O=C(O)C=C1CCOCC1 Amb2700184 [0,0,0,1,0,0|1,0,0]=2 922 B10R1.18 O=C(O)C=C1CCSCC1 Amb26480822 [0,0,0,1,0,0|1,0,0]=2 923 B10R1.18 O=C(O)C=C1NCCCN1 Amb18202633 [0,0,0,1,0,0|2,0,0]=3 924 B10R1.18 O=C(O)CC1=CCCCC1 Amb2721175 [0,0,0,1,0,0|0,0,2]=3 925 B10R1.18 O=C(O)CC1=CCCCO1 Amb27240003 [0,0,0,1,0,0|1,0,2]=4 926 B10R1.18 O=C(O)CC1=CCNCC1 Amb27204262 [0,0,0,1,0,0|1,0,2]=4 927 B10R1.18 O=C(O)CC1=CCOCC1 Amb25986500 [0,0,0,1,0,0|1,0,2]=4 928 B10R1.18 O=C(O)CC1=COCCC1 Amb26871888 [0,0,0,1,0,0|1,0,2]=4 929 B10R1.18 O=C(O)CC1=NCCCS1 Amb27958643 [0,0,0,1,0,0|2,0,1]=4 930 B10R1.18 O=C(O)CC1CCCCC1 Amb3939015 [0,0,0,1,0,0|0,0,2]=3 931 B10R1.18 O=C(O)CC1CCCCN1 Amb10576328 [0,0,0,1,0,0|1,0,2]=4 932 B10R1.18 O=C(O)CC1CCCCN1 Amb1083025 [0,0,0,1,0,0|1,0,2]=4 933 B10R1.18 O=C(O)CC1CCCCN1 Amb22587703 [0,0,0,1,0,0|1,0,2]=4 934 B10R1.18 O=C(O)CC1CCCCO1 Amb1091980 [0,0,0,1,0,0|1,0,2]=4 935 B10R1.18 O=C(O)CC1CCCNC1 Amb13952813 [0,0,0,1,0,0|1,0,2]=4 936 B10R1.18 O=C(O)CC1CCCNC1 Amb2684000 [0,0,0,1,0,0|1,0,2]=4 937 B10R1.18 O=C(O)CC1CCCOC1 Amb33544408 [0,0,0,1,0,0|1,0,2]=4 938 B10R1.18 O=C(O)CC1CCCSC1 Amb18199274 [0,0,0,1,0,0|1,0,2]=4 939 B10R1.18 O=C(O)CC1CCC[NH2+]C1 Amb2695000 [0,0,0,1,0,0|1,0,2]=4 940 B10R1.18 O=C(O)CC1CCNCC1 Amb2683992 [0,0,0,1,0,0|1,0,2]=4 941 B10R1.18 O=C(O)CC1CCNCC1 Amb33544417 [0,0,0,1,0,0|1,0,2]=4 942 B10R1.18 O=C(O)CC1CCOCC1 Amb2684134 [0,0,0,1,0,0|1,0,2]=4 943 B10R1.18 O=C(O)CC1CCSCC1 Amb18283322 [0,0,0,1,0,0|1,0,2]=4 944 B10R1.18 O=C(O)CN1CCCCC1 Amb1098973 [0,0,0,1,0,0|1,0,1]=3 945 B10R1.18 O=C(O)CN1CCCCC1 Amb8503500 [0,0,0,1,0,0|1,0,1]=3 946 B10R1.18 O=C(O)CN1CCNCC1 Amb22728245 [0,0,0,1,0,0|2,0,1]=4 947 B10R1.18 O=C(O)CN1CCNCC1 Amb2700795 [0,0,0,1,0,0|2,0,1]=4 948 B10R1.18 O=C(O)CN1CCOCC1 Amb1099394 [0,0,0,1,0,0|2,0,1]=4 949 B10R1.18 O=C(O)CN1CCOCC1 Amb8513036 [0,0,0,1,0,0|2,0,1]=4 950 B10R1.18 O=C(O)CN1CCSCC1 Amb10072976 [0,0,0,1,0,0|2,0,1]=4 951 B10R1.18 O=C(O)CN1CCSCC1 Amb6307186 [0,0,0,1,0,0|2,0,1]=4 952 B10R1.18 O=C(O)C[C@@H]1CCCCN1 Amb13885774 [0,0,0,1,0,0|1,0,2]=4 953 B10R1.18 O=C(O)C[C@@H]1CCCCN1 Amb33296463 [0,0,0,1,0,0|1,0,2]=4 954 B10R1.18 O=C(O)C[C@@H]1CCCNC1 Amb25889983 [0,0,0,1,0,0|1,0,2]=4 955 B10R1.18 O=C(O)C[C@@H]1CCCNC1 Amb32407008 [0,0,0,1,0,0|1,0,2]=4 956 B10R1.18 O=C(O)C[C@H]1CCCCN1 Amb13885779 [0,0,0,1,0,0|1,0,2]=4 957 B10R1.18 O=C(O)C[C@H]1CCCCN1 Amb33456128 [0,0,0,1,0,0|1,0,2]=4 958 B10R1.18 O=C(O)C[C@H]1CCCNC1 Amb23401360 [0,0,0,1,0,0|1,0,2]=4 959 B10R1.18 O=C(O)C[C@H]1CCCNC1 Amb28077035 [0,0,0,1,0,0|1,0,2]=4 960 B10R1.18 O=C(O)C[NH+]1CCCCC1 Amb4255653 [0,0,0,1,0,0|1,0,1]=3 961 B10R1.18 O=C(O)C[S+]1CCSCC1 Amb27176492 [0,0,0,1,0,0|2,0,1]=4 962 B10R1.18 O=C(O)NC1CCCCC1 Amb22039352 [0,0,0,1,0,0|1,0,1]=3 963 B10R1.18 O=C(O)\C=C1\CCCOC1 Amb27828465 [0,0,0,1,0,0|1,0,0]=2 964 B10R1.18 O=C(O)\C=C1\CCCSC1 Amb18948509 [0,0,0,1,0,0|1,0,0]=2 965 B10R1.18 O=C(O)\C=C1\COCCN1 Amb18831600 [0,0,0,1,0,0|2,0,0]=3 966 B10R1.18 O=C(O)\C=C1\CSCCN1 Amb18199861 [0,0,0,1,0,0|2,0,0]=3 967 B10R1.18 O=S(O)CC1CCCCC1 Amb27452532 [0,0,0,1,0,0|1,0,2]=4 968 B10R1.18 O=[N+]([O-])C=C1CCNCC1 Amb32756001 [0,0,0,1,0,0|2,0,1]=4 969 B10R1.18 O=[N+]([O-])C=C1CCOCC1 Amb25350664 [0,0,0,1,0,0|2,0,1]=4 970 B10R1.18 O=[N+]([O-])\C=C1\CCCCN1 Amb9684095 [0,0,0,1,0,0|2,0,1]=4 971 B10R1.24 O=C1CC(CCCCO)O1 Amb28079077 [0,0,0,1,0,0|1,0,2]=4 972 B10R1.39 C=CC1CCC=C1C(C)=O Amb26998410 [0,0,0,1,0,0|1,0,2]=4 973 B10R1.39 CCC1=C(C(=O)O)CCC1 Amb29864676 [0,0,0,1,0,0|0,0,2]=3 974 B10R1.39 CCC1=C(C(=O)O)CCO1 Amb27207346 [0,0,0,1,0,0|1,0,2]=4 975 B10R1.39 CCC1CCC=C1C(=O)O Amb27788569 [0,0,0,1,0,0|0,0,0]=1 976 B10R1.39 CCC1CCCC1C(=O)O Amb18643940 [0,0,0,1,0,0|0,0,2]=3 977 B10R1.39 CCC1CCCN1C(=O)Cl Amb26053464 [0,0,0,1,0,0|2,0,1]=4 978 B10R1.39 CCC1CCNC1C(=O)O Amb18644001 [0,0,0,1,0,0|1,0,1]=3 979 B10R1.39 CCC1CCNC1C(=O)O Amb32932458 [0,0,0,1,0,0|1,0,1]=3 980 B10R1.39 CCC1CCN[C@@H]1C(=O)O Amb27259157 [0,0,0,1,0,0|1,0,1]=3 981 B10R1.39 CCC1CCOC1C(=O)O Amb32666976 [0,0,0,1,0,0|1,0,1]=3 982 B10R1.39 CCC1CNCC1C(=O)O Amb18831583 [0,0,0,1,0,0|1,0,2]=4 983 B10R1.39 CCC1NCCC1C(=O)O Amb18118150 [0,0,0,1,0,0|1,0,2]=4 984 B10R1.39 CCC1NCCC1C(=O)O Amb28896015 [0,0,0,1,0,0|1,0,2]=4 985 B10R1.39 CCC1OCCC1C(=O)O Amb27238092 [0,0,0,1,0,0|1,0,2]=4 986 B10R1.39 CCN1CCCC1C(=O)O Amb9173743 [0,0,0,1,0,0|1,0,2]=4 987 B10R1.39 CCN1CCC[C@@H]1C(=O)O Amb22587552 [0,0,0,1,0,0|1,0,2]=4 988 B10R1.39 CCN1CCC[C@@H]1C(=O)O Amb23385271 [0,0,0,1,0,0|1,0,2]=4 989 B10R1.39 CCN1CCC[C@H]1C(=O)O Amb19516987 [0,0,0,1,0,0|1,0,2]=4 990 B10R1.39 CC[C@@H]1CCN[C@@H]1C(=O)O Amb27846259 [0,0,0,1,0,0|1,0,1]=3 991 B10R1.39 CC[C@@H]1CCN[C@H]1C(=O)O Amb28428507 [0,0,0,1,0,0|1,0,1]=3 992 B10R1.39 CC[C@@H]1CCO[C@@H]1C(=O)O Amb32667304 [0,0,0,1,0,0|1,0,1]=3 993 B10R1.39 CC[C@@H]1CNC[C@@H]1C(=O)O Amb28057536 [0,0,0,1,0,0|1,0,2]=4 994 B10R1.39 CC[C@@H]1NCC[C@H]1C(=O)O Amb18202480 [0,0,0,1,0,0|1,0,2]=4 995 B10R1.39 CC[C@@H]1OCC[C@H]1C(=O)O Amb32685282 [0,0,0,1,0,0|1,0,2]=4 996 B10R1.39 CC[C@H]1CCC[C@@H]1C(N)=O Amb27786258 [0,0,0,1,0,0|1,0,2]=4 997 B10R1.39 CC[C@H]1CCN[C@@H]1C(=O)O Amb28411335 [0,0,0,1,0,0|1,0,1]=3 998 B10R1.39 CC[C@H]1CCN[C@@H]1C(N)=O Amb27203311 [0,0,0,1,0,0|2,0,1]=4 999 B10R1.39 CCc1cscc1C(=O)O Amb18830769 [0,0,0,1,0,0|1,0,2]=4 1000 B10R1.39 CCc1nocc1C(=O)O Amb18202782 [0,0,0,1,0,0|2,0,1]=4 1001 B10R1.39 CCc1nscc1C(=O)O Amb23440942 [0,0,0,1,0,0|2,0,1]=4 1002 B10R1.39 CCc1occc1C(=O)O Amb18643495 [0,0,0,1,0,0|1,0,2]=4 1003 B10R1.39 CCc1oncc1C(=O)O Amb33526885 [0,0,0,1,0,0|2,0,1]=4 1004 B10R1.39 CCc1sccc1C(=O)O Amb8439411 [0,0,0,1,0,0|1,0,2]=4 1005 B10R1.39 CCn1cccc1C(=O)O Amb33531567 [0,0,0,1,0,0|1,0,2]=4 1006 B10R1.39 CCn1cncc1C(=O)O Amb21954331 [0,0,0,1,0,0|2,0,1]=4 1007 B10R1.39 CCn1cncc1C(=O)O Amb2785212 [0,0,0,1,0,0|2,0,1]=4 1008 B10R1.39 CCn1nccc1C(=O)O Amb1099167 [0,0,0,1,0,0|2,0,1]=4 1009 B10R1.39 CCn1nncc1C(=O)O Amb8009885 [0,0,0,1,0,0|3,0,0]=4 1010 B10R1.39 CNC1CCCC1C(=O)O Amb26637848 [0,0,0,1,0,0|1,0,2]=4 1011 B10R1.39 COC1CCCC1C(=O)O Amb18967397 [0,0,0,1,0,0|1,0,2]=4 1012 B10R1.39 COC1CCNC1C(=O)O Amb18644194 [0,0,0,1,0,0|2,0,1]=4 1013 B10R1.39 CO[C@@H]1CCC[C@@H]1C(=O)O Amb28203935 [0,0,0,1,0,0|1,0,2]=4 1014 B10R1.39 CO[C@H]1CCCC1C(=O)O Amb27947835 [0,0,0,1,0,0|1,0,2]=4 1015 B10R1.39 CO[C@H]1CCC[C@@H]1C(=O)O Amb25956783 [0,0,0,1,0,0|1,0,2]=4 1016 B10R1.39 CO[C@H]1CCC[C@H]1C(=O)O Amb26931198 [0,0,0,1,0,0|1,0,2]=4 1017 B10R1.39 CSC1CCCC1C(=O)O Amb18288540 [0,0,0,1,0,0|1,0,2]=4 1018 B10R1.39 NCC1CCCC1C(=O)O Amb25283657 [0,0,0,1,0,0|1,0,2]=4 1019 B10R1.39 NCC1CCCC1C(=O)O Amb32661245 [0,0,0,1,0,0|1,0,2]=4 1020 B10R1.39 NC[C@@H]1CCC[C@@H]1C(=O)O Amb26903999 [0,0,0,1,0,0|1,0,2]=4 1021 B10R1.39 NC[C@@H]1CCC[C@@H]1C(=O)O Amb33249753 [0,0,0,1,0,0|1,0,2]=4 1022 B10R1.39 NC[C@@H]1CCO[C@@H]1C(=O)O Amb32671492 [0,0,0,1,0,0|2,0,1]=4 1023 B10R1.39 NC[C@@H]1CCO[C@@H]1C(=O)O Amb32992350 [0,0,0,1,0,0|2,0,1]=4 1024 B10R1.39 NC[C@H]1CCC[C@H]1C(=O)O Amb28293248 [0,0,0,1,0,0|1,0,2]=4 1025 B10R1.39 NC[C@H]1CCC[C@H]1C(=O)O Amb28641946 [0,0,0,1,0,0|1,0,2]=4 1026 B10R1.39 O=C(O)C1=C(CO)CCC1 Amb18643827 [0,0,0,1,0,0|1,0,2]=4 1027 B10R1.39 O=C(O)C1CCCC1CBr Amb18130990 [0,0,0,1,0,0|1,0,2]=4 1028 B10R1.39 O=C(O)C1CCCC1CF Amb20668095 [0,0,0,1,0,0|1,0,2]=4 1029 B10R1.39 O=C(O)[C@@H]1CCC[C@H]1CF Amb32721623 [0,0,0,1,0,0|1,0,2]=4 1030 B10R1.39 O=C(O)[C@H]1CCC[C@@H]1CBr Amb27435607 [0,0,0,1,0,0|1,0,2]=4 1031 B10R1.61 CC(=O)C1=C(C)CCCN1 Amb26968313 [0,0,0,1,0,0|2,0,1]=4 1032 B10R1.61 CC(=O)C1=CCCCC1=O Amb17593495 [0,0,0,1,0,0|2,0,1]=4 1033 B10R1.61 CC(=O)C1=CCCCC1C Amb24480506 [0,0,0,1,0,0|1,0,0]=2 1034 B10R1.61 CC(=O)C1=CCCCC1O Amb27425119 [0,0,0,1,0,0|2,0,0]=3 1035 B10R1.61 CC(=O)C1=CCCC[C@H]1O Amb27255579 [0,0,0,1,0,0|2,0,0]=3 1036 B10R1.61 CC(=O)C1=NCCCC1C Amb26972106 [0,0,0,1,0,0|2,0,0]=3 1037 B10R1.61 CC(=O)C1CCCCC1C Amb26021911 [0,0,0,1,0,0|1,0,2]=4 1038 B10R1.61 CC(=O)C1NCCCC1C Amb32410373 [0,0,0,1,0,0|2,0,1]=4 1039 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1C Amb28131403 [0,0,0,1,0,0|1,0,2]=4 1040 B10R1.61 CC(=O)[C@@H]1CCCC[C@H]1C Amb25948878 [0,0,0,1,0,0|1,0,2]=4 1041 B10R1.61 CC(=O)[C@H]1CCCC[C@@H]1C Amb28052336 [0,0,0,1,0,0|1,0,2]=4 1042 B10R1.61 CC(O)C1=CCCCC1O Amb27484812 [0,0,0,1,0,0|2,0,1]=4 1043 B10R1.61 CC1=C(C(=O)O)CCCC1 Amb18643592 [0,0,0,1,0,0|0,0,2]=3 1044 B10R1.61 CC1=C(C(=O)O)CCCO1 Amb2782915 [0,0,0,1,0,0|1,0,2]=4 1045 B10R1.61 CC1=C(C(=O)O)CCCS1 Amb27637653 [0,0,0,1,0,0|1,0,2]=4 1046 B10R1.61 CC1=C(C(=O)O)OCCO1 Amb10607351 [0,0,0,1,0,0|2,0,1]=4 1047 B10R1.61 CC1=C(C(=O)O)SCCO1 Amb3430020 [0,0,0,1,0,0|2,0,1]=4 1048 B10R1.61 CC1CCCC=C1B(O)O Amb27404735 [0,0,0,1,0,0|1,0,1]=3 1049 B10R1.61 CC1CCCC=C1C(=O)O Amb22407010 [0,0,0,1,0,0|0,0,0]=1 1050 B10R1.61 CC1CCCCC1C(=O)Br Amb27635544 [0,0,0,1,0,0|1,0,2]=4 1051 B10R1.61 CC1CCCCC1C(=O)O Amb1923858 [0,0,0,1,0,0|0,0,2]=3 1052 B10R1.61 CC1CCCCC1C(N)=O Amb4035366 [0,0,0,1,0,0|1,0,2]=4 1053 B10R1.61 CC1CCCCC1S(=O)O Amb35683280 [0,0,0,1,0,0|1,0,2]=4 1054 B10R1.61 CC1CCCCN1C(=O)Cl Amb17563085 [0,0,0,1,0,0|2,0,1]=4 1055 B10R1.61 CC1CCCCN1C(O)=S Amb27860338 [0,0,0,1,0,0|1,1,1]=4 1056 B10R1.61 CC1CCCNC1C(=O)O Amb18644006 [0,0,0,1,0,0|1,0,1]=3 1057 B10R1.61 CC1CCCNC1C(=O)O Amb33421964 [0,0,0,1,0,0|1,0,1]=3 1058 B10R1.61 CC1CCCNC1C(N)=O Amb18279452 [0,0,0,1,0,0|2,0,1]=4 1059 B10R1.61 CC1CCNCC1C(=O)O Amb18124644 [0,0,0,1,0,0|1,0,2]=4 1060 B10R1.61 CC1CCNCC1C(=O)O Amb33330563 [0,0,0,1,0,0|1,0,2]=4 1061 B10R1.61 CC1CNCCC1C(=O)O Amb2694911 [0,0,0,1,0,0|1,0,2]=4 1062 B10R1.61 CC1CNCCC1C(=O)O Amb28555510 [0,0,0,1,0,0|1,0,2]=4 1063 B10R1.61 CC1COCCC1C(=O)O Amb27975751 [0,0,0,1,0,0|1,0,2]=4 1064 B10R1.61 CC1CSCCC1C(=O)O Amb27214025 [0,0,0,1,0,0|1,0,2]=4 1065 B10R1.61 CC1NCCCC1C(=O)O Amb18124643 [0,0,0,1,0,0|1,0,2]=4 1066 B10R1.61 CC1NCCCC1C(=O)O Amb33548991 [0,0,0,1,0,0|1,0,2]=4 1067 B10R1.61 CC1NCCNC1C(=O)O Amb27172839 [0,0,0,1,0,0|2,0,1]=4 1068 B10R1.61 CC1OCCCC1C(=O)O Amb26904538 [0,0,0,1,0,0|1,0,2]=4 1069 B10R1.61 CC1OCCNC1C(=O)O Amb18061972 [0,0,0,1,0,0|2,0,1]=4 1070 B10R1.61 CC1OCCNC1C(=O)O Amb32666147 [0,0,0,1,0,0|2,0,1]=4 1071 B10R1.61 CN1CCCCC1C(=O)O Amb1102591 [0,0,0,1,0,0|1,0,2]=4 1072 B10R1.61 CN1CCCCC1C(=O)O Amb2694386 [0,0,0,1,0,0|1,0,2]=4 1073 B10R1.61 CN1CCCC[C@@H]1C(=O)O Amb22744921 [0,0,0,1,0,0|1,0,2]=4 1074 B10R1.61 CN1CCCC[C@@H]1C(=O)O Amb30594706 [0,0,0,1,0,0|1,0,2]=4 1075 B10R1.61 CN1CCCC[C@H]1C(=O)O Amb27171753 [0,0,0,1,0,0|1,0,2]=4 1076 B10R1.61 C[C@@H]1CCCC=C1C(=O)Cl Amb27617097 [0,0,0,1,0,0|1,0,0]=2 1077 B10R1.61 C[C@@H]1CCCCN1C(=O)Cl Amb25349193 [0,0,0,1,0,0|2,0,1]=4 1078 B10R1.61 C[C@@H]1CCCC[C@H]1C(=O)O Amb10843965 [0,0,0,1,0,0|0,0,2]=3 1079 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O Amb13886260 [0,0,0,1,0,0|1,0,1]=3 1080 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)O Amb31177924 [0,0,0,1,0,0|1,0,1]=3 1081 B10R1.61 C[C@@H]1CCCN[C@@H]1C(N)=O Amb24392330 [0,0,0,1,0,0|2,0,1]=4 1082 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O Amb25911818 [0,0,0,1,0,0|1,0,2]=4 1083 B10R1.61 C[C@@H]1CCNC[C@@H]1C(=O)O Amb32967641 [0,0,0,1,0,0|1,0,2]=4 1084 B10R1.61 C[C@@H]1CNCC[C@@H]1C(=O)O Amb33715674 [0,0,0,1,0,0|1,0,2]=4 1085 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O Amb27881535 [0,0,0,1,0,0|1,0,2]=4 1086 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O Amb32656204 [0,0,0,1,0,0|1,0,2]=4 1087 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O Amb18202482 [0,0,0,1,0,0|1,0,2]=4 1088 B10R1.61 C[C@@H]1OCCC[C@@H]1C(=O)O Amb27160030 [0,0,0,1,0,0|1,0,2]=4 1089 B10R1.61 C[C@@H]1OCCN[C@H]1C(=O)O Amb22746793 [0,0,0,1,0,0|2,0,1]=4 1090 B10R1.61 C[C@@H]1OCCN[C@H]1C(=O)O Amb22755786 [0,0,0,1,0,0|2,0,1]=4 1091 B10R1.61 C[C@@H]1OCCO[C@@H]1C(=O)O Amb32666699 [0,0,0,1,0,0|2,0,1]=4 1092 B10R1.61 C[C@H]1CCCN[C@@H]1C(=O)O Amb27814735 [0,0,0,1,0,0|1,0,1]=3 1093 B10R1.61 C[C@H]1CCCN[C@H]1C(=O)O Amb2695237 [0,0,0,1,0,0|1,0,1]=3 1094 B10R1.61 C[C@H]1CCCN[C@H]1C(=O)O Amb28593755 [0,0,0,1,0,0|1,0,1]=3 1095 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O Amb26419672 [0,0,0,1,0,0|1,0,2]=4 1096 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O Amb10608849 [0,0,0,1,0,0|2,0,1]=4 1097 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O Amb28856264 [0,0,0,1,0,0|2,0,1]=4 1098 B10R1.61 NC1CCCCC1C(=O)O Amb20626164 [0,0,0,1,0,0|1,0,2]=4 1099 B10R1.61 NC1CCCCC1C(=O)O Amb2694788 [0,0,0,1,0,0|1,0,2]=4 1100 B10R1.61 NC1CCCNC1C(=O)O Amb35750913 [0,0,0,1,0,0|2,0,1]=4 1101 B10R1.61 NC1CCCNC1C(=O)O Amb35751901 [0,0,0,1,0,0|2,0,1]=4 1102 B10R1.61 NC1CCCOC1C(=O)O Amb18202149 [0,0,0,1,0,0|2,0,1]=4 1103 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O Amb19148605 [0,0,0,1,0,0|1,0,2]=4 1104 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O Amb22224856 [0,0,0,1,0,0|1,0,2]=4 1105 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993721 [0,0,0,1,0,0|1,0,2]=4 1106 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O Amb1993765 [0,0,0,1,0,0|1,0,2]=4 1107 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O Amb22224868 [0,0,0,1,0,0|1,0,2]=4 1108 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb1993720 [0,0,0,1,0,0|1,0,2]=4 1109 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Amb6365686 [0,0,0,1,0,0|1,0,2]=4 1110 B10R1.61 O=C(O)C1=C(Br)CCCC1 Amb18130945 [0,0,0,1,0,0|1,0,2]=4 1111 B10R1.61 O=C(O)C1=C(Cl)CCCC1 Amb1157859 [0,0,0,1,0,0|1,0,2]=4 1112 B10R1.61 O=C(O)C1=CCCCC1O Amb27792988 [0,0,0,1,0,0|1,0,0]=2 1113 B10R1.61 O=C(O)C1CCCCC1Br Amb27425110 [0,0,0,1,0,0|1,0,2]=4 1114 B10R1.61 O=C(O)C1CCCCC1Cl Amb18126348 [0,0,0,1,0,0|1,0,2]=4 1115 B10R1.61 O=C(O)C1CCCCC1F Amb32667613 [0,0,0,1,0,0|1,0,2]=4 1116 B10R1.61 O=C(O)C1CCCCC1O Amb2694762 [0,0,0,1,0,0|1,0,2]=4 1117 B10R1.61 O=C(O)C1NCCCC1O Amb18124725 [0,0,0,1,0,0|2,0,1]=4 1118 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1Cl Amb28288041 [0,0,0,1,0,0|1,0,2]=4 1119 B10R1.61 O=C(O)[C@@H]1CCCC[C@H]1O Amb16204296 [0,0,0,1,0,0|1,0,2]=4 1120 B10R1.61 O=C(O)[C@@H]1NCCC[C@@H]1O Amb25214386 [0,0,0,1,0,0|2,0,1]=4 1121 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O Amb28411494 [0,0,0,1,0,0|2,0,1]=4 1122 B10R1.61 O=C(O)[C@H]1CCCC[C@@H]1Cl Amb27634391 [0,0,0,1,0,0|1,0,2]=4 1123 B10R1.61 O=C(O)[C@H]1CCCC[C@H]1O Amb4022448 [0,0,0,1,0,0|1,0,2]=4 1124 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O Amb25340376 [0,0,0,1,0,0|2,0,1]=4 1125 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O Amb25912162 [0,0,0,1,0,0|2,0,1]=4 1126 B10R1.64 C=C1CCC\C1=C\C(=O)O Amb27948039 [0,0,0,1,0,0|0,0,2]=3 1127 B10R1.64 CC(=O)CC1CCCC1C Amb24480371 [0,0,0,1,0,0|1,0,2]=4 1128 B10R1.64 CC(=O)CN1CCCC1C Amb22292307 [0,0,0,1,0,0|2,0,1]=4 1129 B10R1.64 CC(=O)C[C@@H]1CCC[C@H]1C Amb27768009 [0,0,0,1,0,0|1,0,2]=4 1130 B10R1.64 CC(=O)NC1=C(C)CCC1 Amb28384906 [0,0,0,1,0,0|2,0,1]=4 1131 B10R1.64 CC(=O)NN1CCCC1C Amb27480539 [0,0,0,1,0,0|3,0,0]=4 1132 B10R1.64 CC(=O)\C=C1/CCCN1C Amb25146900 [0,0,0,1,0,0|2,0,0]=3 1133 B10R1.64 CC(=O)\C=C1/COCC1C Amb35616355 [0,0,0,1,0,0|2,0,0]=3 1134 B10R1.64 CC(=O)\C=C1/NCCN1C Amb27768613 [0,0,0,1,0,0|3,0,0]=4 1135 B10R1.64 CC(=O)\C=C1/SCCN1C Amb27854895 [0,0,0,1,0,0|3,0,0]=4 1136 B10R1.64 CC(=O)\C=C1\CCCC1O Amb28246591 [0,0,0,1,0,0|2,0,0]=3 1137 B10R1.64 CC(O)\C=C1\CCCC1C Amb27834361 [0,0,0,1,0,0|1,0,1]=3 1138 B10R1.64 CC(O)\C=C1\CCOC1C Amb27246106 [0,0,0,1,0,0|2,0,1]=4 1139 B10R1.64 CC(O)\C=C1\COCC1C Amb35608160 [0,0,0,1,0,0|2,0,1]=4 1140 B10R1.64 CC1CCCC1CC(=O)O Amb2696312 [0,0,0,1,0,0|0,0,2]=3 1141 B10R1.64 CC1CCCC1CC(N)=O Amb27828187 [0,0,0,1,0,0|1,0,2]=4 1142 B10R1.64 CC1CCCC1NC(=O)Cl Amb35625932 [0,0,0,1,0,0|2,0,1]=4 1143 B10R1.64 CC1CCCN1CC(=O)O Amb18954282 [0,0,0,1,0,0|1,0,1]=3 1144 B10R1.64 CC1CCCN1CC(=O)O Amb32653298 [0,0,0,1,0,0|1,0,1]=3 1145 B10R1.64 CC1CCC\C1=C/C(=O)O Amb20622694 [0,0,0,1,0,0|0,0,0]=1 1146 B10R1.64 CC1CCC\C1=N/S(C)=O Amb35692874 [0,0,0,1,0,0|3,0,0]=4 1147 B10R1.64 CC1CCNC1CC(=O)O Amb28059641 [0,0,0,1,0,0|1,0,2]=4 1148 B10R1.64 CC1CCOC1CC(=O)O Amb33620696 [0,0,0,1,0,0|1,0,2]=4 1149 B10R1.64 CC1CNCC1CC(=O)O Amb27643325 [0,0,0,1,0,0|1,0,2]=4 1150 B10R1.64 CC1CNCC1CC(=O)O Amb32753538 [0,0,0,1,0,0|1,0,2]=4 1151 B10R1.64 CC1COCC1CC(=O)O Amb35736018 [0,0,0,1,0,0|1,0,2]=4 1152 B10R1.64 CC1COC\C1=C/C(=O)O Amb35647041 [0,0,0,1,0,0|1,0,0]=2 1153 B10R1.64 CC1CSCC1CC(=O)O Amb28068257 [0,0,0,1,0,0|1,0,2]=4 1154 B10R1.64 CC1CSC\C1=C/C(=O)O Amb27477097 [0,0,0,1,0,0|1,0,0]=2 1155 B10R1.64 CC1OCC\C1=C/C(=O)O Amb25793839 [0,0,0,1,0,0|1,0,0]=2 1156 B10R1.64 CC1SCCC1CC(=O)O Amb18199391 [0,0,0,1,0,0|1,0,2]=4 1157 B10R1.64 CC1SCC\C1=C\C(=O)O Amb33468656 [0,0,0,1,0,0|1,0,0]=2 1158 B10R1.64 CN1CCCC1CC(=O)O Amb22586774 [0,0,0,1,0,0|1,0,2]=4 1159 B10R1.64 CN1CCCC1CC(=O)O Amb8009896 [0,0,0,1,0,0|1,0,2]=4 1160 B10R1.64 CN1CCC\C1=C/N(=O)=O Amb21955353 [0,0,0,1,0,0|2,0,1]=4 1161 B10R1.64 CN1CCC\C1=N/C(N)=O Amb27765004 [0,0,0,1,0,0|3,0,0]=4 1162 B10R1.64 CN1CCN\C1=C\C(=O)O Amb18202603 [0,0,0,1,0,0|2,0,0]=3 1163 B10R1.64 C[C@@H]1CNC[C@H]1CC(=O)O Amb32683471 [0,0,0,1,0,0|1,0,2]=4 1164 B10R1.64 C[C@@H]1CNC[C@H]1CC(=O)O Amb32684495 [0,0,0,1,0,0|1,0,2]=4 1165 B10R1.64 C[C@@H]1NCC[C@H]1CC(=O)O Amb18202479 [0,0,0,1,0,0|1,0,2]=4 1166 B10R1.64 C[C@H]1NCC[C@@H]1CC(=O)O Amb27782907 [0,0,0,1,0,0|1,0,2]=4 1167 B10R1.64 NC1CCCC1CC(=O)O Amb2694936 [0,0,0,1,0,0|1,0,2]=4 1168 B10R1.64 NC1CCCC1CC(=O)O Amb8630072 [0,0,0,1,0,0|1,0,2]=4 1169 B10R1.64 NC1CCC\C1=C/C(=O)O Amb27630675 [0,0,0,1,0,0|1,0,0]=2 1170 B10R1.64 N[C@@H]1CCC[C@H]1CC(=O)O Amb26580643 [0,0,0,1,0,0|1,0,2]=4 1171 B10R1.64 N[C@@H]1CCC[C@H]1CC(=O)O Amb32664820 [0,0,0,1,0,0|1,0,2]=4 1172 B10R1.64 N[C@H]1CCC[C@@H]1CC(=O)O Amb27461253 [0,0,0,1,0,0|1,0,2]=4 1173 B10R1.64 N[C@H]1CCC[C@H]1CC(=O)O Amb34914988 [0,0,0,1,0,0|1,0,2]=4 1174 B10R1.64 O=C(O)CC1CCCC1O Amb18202404 [0,0,0,1,0,0|1,0,2]=4 1175 B10R1.64 O=C(O)CN1CCC[C@@H]1O Amb10067047 [0,0,0,1,0,0|2,0,1]=4 1176 B10R1.64 O=C(O)C[C@@H]1CCC[C@H]1O Amb25960224 [0,0,0,1,0,0|1,0,2]=4 1177 B10R1.64 O=C(O)C[C@H]1CCC[C@H]1O Amb27489875 [0,0,0,1,0,0|1,0,2]=4 1178 B10R1.64 O=C(O)\C=C1/CCCC1=O Amb22015208 [0,0,0,1,0,0|1,0,1]=3 1179 B10R1.66 CC(=O)C#CC1CCCC1 Amb24383777 [0,0,0,1,0,0|1,0,2]=4 1180 B10R1.66 CC(=O)CCC1CCCC1 Amb19374837 [0,0,0,1,0,0|1,0,2]=4 1181 B10R1.66 CC(=O)CNC1CCCC1 Amb25291662 [0,0,0,1,0,0|2,0,1]=4 1182 B10R1.66 CC(=O)NNC1CCCC1 Amb27165281 [0,0,0,1,0,0|3,0,0]=4 1183 B10R1.66 CC(=O)OCC1CCCC1 Amb27856070 [0,0,0,1,0,0|2,0,1]=4 1184 B10R1.66 CC(=O)SCC1CCCC1 Amb25169354 [0,0,0,1,0,0|2,0,1]=4 1185 B10R1.66 CC(=O)\C=C/N1CCCC1 Amb27617656 [0,0,0,1,0,0|2,0,0]=3 1186 B10R1.66 CC(=O)\C=C\C1=CCCC1 Amb25209541 [0,0,0,1,0,0|1,0,2]=4 1187 B10R1.66 CC(=O)\C=C\C1CCCC1 Amb33359527 [0,0,0,1,0,0|1,0,0]=2 1188 B10R1.66 CC(=O)\C=C\C1CCCO1 Amb25887982 [0,0,0,1,0,0|2,0,0]=3 1189 B10R1.66 CC(=O)\C=C\C1CCCS1 Amb33415401 [0,0,0,1,0,0|2,0,0]=3 1190 B10R1.66 CC(=O)\C=C\C1CCOC1 Amb22264587 [0,0,0,1,0,0|2,0,0]=3 1191 B10R1.66 CC(=O)\C=C\C1CCSC1 Amb33359190 [0,0,0,1,0,0|2,0,0]=3 1192 B10R1.66 CC(Br)\C=C\C1CCCC1 Amb27473003 [0,0,0,1,0,0|2,0,1]=4 1193 B10R1.66 CC(N)\C=C\C1CCCC1 Amb33448394 [0,0,0,1,0,0|2,0,1]=4 1194 B10R1.66 CC(O)\C=C\C1CCSC1 Amb27981818 [0,0,0,1,0,0|2,0,1]=4 1195 B10R1.66 CN(C)\C=C\C1CCCC1 Amb25101861 [0,0,0,1,0,0|3,0,0]=4 1196 B10R1.66 CS(=O)\N=C\C1CCCC1 Amb35693120 [0,0,0,1,0,0|3,0,0]=4 1197 B10R1.66 NC(=O)CCC1CCCC1 Amb3742782 [0,0,0,1,0,0|1,0,2]=4 1198 B10R1.66 NC(=O)CNC1CCCC1 Amb1121300 [0,0,0,1,0,0|2,0,1]=4 1199 B10R1.66 NC(=O)CNC1CCCC1 Amb19373254 [0,0,0,1,0,0|2,0,1]=4 1200 B10R1.66 NC(=O)COC1CCCC1 Amb22523400 [0,0,0,1,0,0|2,0,1]=4 1201 B10R1.66 NC(=O)\C=C\C1=CCCC1 Amb28315908 [0,0,0,1,0,0|1,0,2]=4 1202 B10R1.66 NC(=O)\C=C\C1CCCC1 Amb25975142 [0,0,0,1,0,0|1,0,0]=2 1203 B10R1.66 NC(=O)\C=C\N1CCCC1 Amb27420138 [0,0,0,1,0,0|2,0,0]=3 1204 B10R1.66 NC(=O)\N=C\N1CCCC1 Amb28120519 [0,0,0,1,0,0|3,0,0]=4 1205 B10R1.66 O=C(Cl)CCC1CCCC1 Amb3939147 [0,0,0,1,0,0|1,0,2]=4 1206 B10R1.66 O=C(Cl)NCC1CCCC1 Amb35625671 [0,0,0,1,0,0|2,0,1]=4 1207 B10R1.66 O=C(Cl)OCC1CCCC1 Amb27652154 [0,0,0,1,0,0|2,0,1]=4 1208 B10R1.66 O=C(Cl)\C=C\C1CCCC1 Amb26437917 [0,0,0,1,0,0|1,0,0]=2 1209 B10R1.66 O=C(O)C#CC1CCCC1 Amb26613602 [0,0,0,1,0,0|0,0,2]=3 1210 B10R1.66 O=C(O)C#CC1CCCN1 Amb33168918 [0,0,0,1,0,0|1,0,2]=4 1211 B10R1.66 O=C(O)C#CC1CCCO1 Amb27838922 [0,0,0,1,0,0|1,0,2]=4 1212 B10R1.66 O=C(O)C#CC1CCCS1 Amb33169031 [0,0,0,1,0,0|1,0,2]=4 1213 B10R1.66 O=C(O)C#CC1CCOC1 Amb26411053 [0,0,0,1,0,0|1,0,2]=4 1214 B10R1.66 O=C(O)CCC1CCCC1 Amb2792875 [0,0,0,1,0,0|0,0,2]=3 1215 B10R1.66 O=C(O)CCC1CCCN1 Amb28895981 [0,0,0,1,0,0|1,0,2]=4 1216 B10R1.66 O=C(O)CCC1CCCN1 Amb8630849 [0,0,0,1,0,0|1,0,2]=4 1217 B10R1.66 O=C(O)CCC1CCCO1 Amb9776130 [0,0,0,1,0,0|1,0,2]=4 1218 B10R1.66 O=C(O)CCC1CCCS1 Amb18645411 [0,0,0,1,0,0|1,0,2]=4 1219 B10R1.66 O=C(O)CCC1CCNC1 Amb20668417 [0,0,0,1,0,0|1,0,2]=4 1220 B10R1.66 O=C(O)CCC1CCNC1 Amb22059448 [0,0,0,1,0,0|1,0,2]=4 1221 B10R1.66 O=C(O)CCC1CCOC1 Amb18296305 [0,0,0,1,0,0|1,0,2]=4 1222 B10R1.66 O=C(O)CCC1CCSC1 Amb18199268 [0,0,0,1,0,0|1,0,2]=4 1223 B10R1.66 O=C(O)CCN1CCCC1 Amb15740874 [0,0,0,1,0,0|1,0,2]=4 1224 B10R1.66 O=C(O)CCN1CCCC1 Amb6356101 [0,0,0,1,0,0|1,0,2]=4 1225 B10R1.66 O=C(O)CC[C@@H]1CCCN1 Amb22745695 [0,0,0,1,0,0|1,0,2]=4 1226 B10R1.66 O=C(O)CC[C@@H]1CCCN1 Amb33291298 [0,0,0,1,0,0|1,0,2]=4 1227 B10R1.66 O=C(O)CC[C@H]1CCCN1 Amb26602714 [0,0,0,1,0,0|1,0,2]=4 1228 B10R1.66 O=C(O)CC[C@H]1CCCN1 Amb33868957 [0,0,0,1,0,0|1,0,2]=4 1229 B10R1.66 O=C(O)CC[S+]1CCCC1 Amb27863517 [0,0,0,1,0,0|1,0,2]=4 1230 B10R1.66 O=C(O)CN=C1CCCC1 Amb27624290 [0,0,0,1,0,0|1,0,2]=4 1231 B10R1.66 O=C(O)CNC1CCCC1 Amb1109994 [0,0,0,1,0,0|1,0,1]=3 1232 B10R1.66 O=C(O)CNC1CCCC1 Amb34914964 [0,0,0,1,0,0|1,0,1]=3 1233 B10R1.66 O=C(O)CNC1CCSC1 Amb8827748 [0,0,0,1,0,0|2,0,1]=4 1234 B10R1.66 O=C(O)COC1CCCC1 Amb6258899 [0,0,0,1,0,0|1,0,1]=3 1235 B10R1.66 O=C(O)COC1CCCO1 Amb26609205 [0,0,0,1,0,0|2,0,1]=4 1236 B10R1.66 O=C(O)COC1CCOC1 Amb20623899 [0,0,0,1,0,0|2,0,1]=4 1237 B10R1.66 O=C(O)COC1CCSC1 Amb28436563 [0,0,0,1,0,0|2,0,1]=4 1238 B10R1.66 O=C(O)CO[C@@H]1CCNC1 Amb33330500 [0,0,0,1,0,0|2,0,1]=4 1239 B10R1.66 O=C(O)CO[C@@H]1CCNC1 Amb33339046 [0,0,0,1,0,0|2,0,1]=4 1240 B10R1.66 O=C(O)CO[C@@H]1CCOC1 Amb32946276 [0,0,0,1,0,0|2,0,1]=4 1241 B10R1.66 O=C(O)CO[C@H]1CCNC1 Amb33330499 [0,0,0,1,0,0|2,0,1]=4 1242 B10R1.66 O=C(O)CO[C@H]1CCNC1 Amb33330621 [0,0,0,1,0,0|2,0,1]=4 1243 B10R1.66 O=C(O)CO[C@H]1CCOC1 Amb28252407 [0,0,0,1,0,0|2,0,1]=4 1244 B10R1.66 O=C(O)CSC1CCCC1 Amb6273990 [0,0,0,1,0,0|1,0,1]=3 1245 B10R1.66 O=C(O)\C=C/C1CCCC1 Amb28072852 [0,0,0,1,0,0|0,0,0]=1 1246 B10R1.66 O=C(O)\C=C\C1=CCCC1 Amb18643237 [0,0,0,1,0,0|0,0,2]=3 1247 B10R1.66 O=C(O)\C=C\C1CCCC1 Amb18285121 [0,0,0,1,0,0|0,0,0]=1 1248 B10R1.66 O=C(O)\C=C\C1CCCO1 Amb25330231 [0,0,0,1,0,0|1,0,0]=2 1249 B10R1.66 O=C(O)\C=C\C1CCCS1 Amb33416187 [0,0,0,1,0,0|1,0,0]=2 1250 B10R1.66 O=C(O)\C=C\C1CCOC1 Amb33529972 [0,0,0,1,0,0|1,0,0]=2 1251 B10R1.66 O=C(O)\C=C\C1CCSC1 Amb25890464 [0,0,0,1,0,0|1,0,0]=2 1252 B10R1.66 O=C(O)\C=C\N1CCCC1 Amb27837839 [0,0,0,1,0,0|1,0,0]=2 1253 B10R1.66 O=C(O)\C=N\C1SCCS1 Amb28458348 [0,0,0,1,0,0|3,0,0]=4 1254 B10R1.66 O=[N+]([O-])\C=C\C1CCCC1 Amb4015080 [0,0,0,1,0,0|1,0,1]=3 1255 B10R1.66 O=[N+]([O-])\C=C\C1CCCO1 Amb28186409 [0,0,0,1,0,0|2,0,1]=4 1256 B10R1.66 O=[N+]([O-])\C=C\C1CCCS1 Amb33415838 [0,0,0,1,0,0|2,0,1]=4 1257 B10R1.66 O=[N+]([O-])\C=C\C1CCOC1 Amb33079333 [0,0,0,1,0,0|2,0,1]=4 1258 B10R1.66 O=[N+]([O-])\C=C\C1CCSC1 Amb33448657 [0,0,0,1,0,0|2,0,1]=4 1259 B10R1.66 OB(O)\C=C\C1CCCC1 Amb34915971 [0,0,0,1,0,0|1,0,1]=3 1260 B10R1.73 CC1CC1CCCC(=O)O Amb25921322 [0,0,0,1,0,0|0,0,2]=3 1261 B10R1.73 CC1CC1CNCC(N)=O Amb27164882 [0,0,0,1,0,0|2,0,1]=4 1262 B10R1.73 CC1CC1NCCC(=O)O Amb19025693 [0,0,0,1,0,0|1,0,2]=4 1263 B10R1.73 C[C@@H]1C[C@@H]1CCCC(=O)O Amb27494069 [0,0,0,1,0,0|0,0,2]=3 1264 B10R1.78 BrC1C=CCCCCCC1 Amb24638769 [0,0,0,1,0,0|2,0,1]=4 1265 B10R1.78 C=C1C=CCCCCC=C1 Amb22364880 [0,0,0,1,0,0|2,0,1]=4 1266 B10R1.78 O=C1C#CCCCCCC1 Amb27409529 [0,0,0,1,0,0|1,0,2]=4 1267 B10R1.78 O=C1C=C=CCCCCC1 Amb28253726 [0,0,0,1,0,0|1,0,2]=4 1268 B10R1.78 O=C1C=CC=CCCCC1 Amb22342438 [0,0,0,1,0,0|1,0,2]=4 1269 B10R1.78 O=C1C=CCCCCCC1 Amb22363956 [0,0,0,1,0,0|1,0,0]=2 1270 B10R1.78 O=C1CCCCCCCC1 Amb16185450 [0,0,0,1,0,0|1,0,2]=4 1271 B10R1.78 O=C1CCCCCCCN1 Amb8513494 [0,0,0,1,0,0|1,0,2]=4 1272 B10R1.86 CCCC1CCN1C(N)=O Amb27223621 [0,0,0,1,0,0|2,0,1]=4 1273 B10R1.86 CCCN1CCC1C(=O)O Amb22011891 [0,0,0,1,0,0|1,0,2]=4 1274 B10R1.86 CCCN1CC[C@@H]1C(=O)O Amb30869401 [0,0,0,1,0,0|1,0,2]=4 1275 B10R1.86 CCCN1CC[C@H]1C(=O)O Amb33801596 [0,0,0,1,0,0|1,0,2]=4 1276 B10R1.86 O=C(O)C1CCC1CCF Amb27229342 [0,0,0,1,0,0|1,0,2]=4 1277 B10R1.97 CCCC1CC1NC(=O)Cl Amb35633481 [0,0,0,1,0,0|2,0,1]=4 1278 B10R1.126 CC(=O)CSCCC1CC1 Amb27650340 [0,0,0,1,0,0|2,0,1]=4 1279 B10R1.126 CC(=O)NCCCC1CC1 Amb28060659 [0,0,0,1,0,0|2,0,1]=4 1280 B10R1.126 CC(=O)NOCCC1CC1 Amb28345253 [0,0,0,1,0,0|3,0,0]=4 1281 B10R1.126 CC(=O)SCCCC1CC1 Amb32680259 [0,0,0,1,0,0|2,0,1]=4 1282 B10R1.126 O=C(O)CCCCC1CC1 Amb24480443 [0,0,0,1,0,0|0,0,2]=3 1283 B10R1.126 O=C(O)CCNCC1CC1 Amb7766419 [0,0,0,1,0,0|1,0,2]=4 1284 B10R1.126 O=C(O)CCOCC1CC1 Amb6680907 [0,0,0,1,0,0|1,0,2]=4 1285 B10R1.126 O=C(O)CCSCC1CC1 Amb9422823 [0,0,0,1,0,0|1,0,2]=4 1286 B10R1.127 CC(=O)CSCC1CCC1 Amb27753589 [0,0,0,1,0,0|2,0,1]=4 1287 B10R1.127 CC(=O)OCCC1CCC1 Amb27981998 [0,0,0,1,0,0|2,0,1]=4 1288 B10R1.127 CC(C)=CCCC1CCC1 Amb35582947 [0,0,0,1,0,0|2,0,1]=4 1289 B10R1.127 O=C(Cl)NCCC1CCC1 Amb35633269 [0,0,0,1,0,0|2,0,1]=4 1290 B10R1.127 O=C(O)C#CCC1CCC1 Amb27615169 [0,0,0,1,0,0|0,0,2]=3 1291 B10R1.127 O=C(O)CCCC1CCC1 Amb26345789 [0,0,0,1,0,0|0,0,2]=3 1292 B10R1.127 O=C(O)CCCC1CSC1 Amb27968148 [0,0,0,1,0,0|1,0,2]=4 1293 B10R1.127 O=C(O)COCC1CCC1 Amb24417123 [0,0,0,1,0,0|1,0,1]=3 1294 B10R1.127 O=C(O)COCC1CCN1 Amb27968240 [0,0,0,1,0,0|2,0,1]=4 1295 B10R1.127 O=C(O)COCC1COC1 Amb27621603 [0,0,0,1,0,0|2,0,1]=4 1296 B10R1.127 O=C(O)COCC1CSC1 Amb27638952 [0,0,0,1,0,0|2,0,1]=4 1297 B10R1.127 O=C(O)CSCC1CCC1 Amb28071843 [0,0,0,1,0,0|1,0,1]=3 1298 B10R1.127 O=C(O)\C=C\C=C1COC1 Amb35585361 [0,0,0,1,0,0|1,0,2]=4 1299 B10R1.144 CCCCC1=C[C@@H]1C(=O)O Amb27258425 [0,0,0,1,0,0|0,0,2]=3 1300 B10R1.144 CCCCC1CC1C(=O)O Amb10608641 [0,0,0,1,0,0|0,0,2]=3 1301 B10R1.144 CCCCC1OC1C(C)=O Amb27750786 [0,0,0,1,0,0|2,0,1]=4 1302 B10R1.144 CCCC[C@@H]1C[C@@H]1C(C)=O Amb27619227 [0,0,0,1,0,0|1,0,2]=4 1303 B10R1.144 CCCC[C@@H]1C[C@H]1C(=O)O Amb25960764 [0,0,0,1,0,0|0,0,2]=3 1304 B10R1.144 CCCC[C@@H]1O[C@H]1C(=O)O Amb24585157 [0,0,0,1,0,0|1,0,1]=3 1305 B10R1.144 CCCC[C@@H]1O[C@H]1C(C)=O Amb28244724 [0,0,0,1,0,0|2,0,1]=4 1306 B10R1.144 CCOCC1CC1C(=O)O Amb28071192 [0,0,0,1,0,0|1,0,2]=4 1307 B10R1.144 CCOC[C@@H]1C[C@H]1C(=O)O Amb26947700 [0,0,0,1,0,0|1,0,2]=4 1308 B10R1.144 CCSCC1CC1C(=O)O Amb33324041 [0,0,0,1,0,0|1,0,2]=4 1309 B10R1.144 CCSC[C@@H]1C[C@H]1C(=O)O Amb33324038 [0,0,0,1,0,0|1,0,2]=4 1310 B10R1.144 COCCC1CC1C(=O)O Amb33377829 [0,0,0,1,0,0|1,0,2]=4 1311 B10R1.144 COCC[C@@H]1C[C@H]1C(=O)O Amb33377827 [0,0,0,1,0,0|1,0,2]=4 1312 B10R1.144 CSCCC1CC1C(=O)O Amb33198761 [0,0,0,1,0,0|1,0,2]=4 1313 B10R1.144 CSCC[C@@H]1C[C@H]1C(=O)O Amb33198757 [0,0,0,1,0,0|1,0,2]=4 1314 B10R1.156 C=CC1CC1\C=C\C(=O)O Amb28384533 [0,0,0,1,0,0|0,0,2]=3 1315 B10R1.156 CCC1CC1CNC(=O)Cl Amb35633499 [0,0,0,1,0,0|2,0,1]=4 1316 B10R1.156 CC[C@@H]1C[C@H]1CNC(=O)Cl Amb35636906 [0,0,0,1,0,0|2,0,1]=4 1317 B10R1.156 CC[C@@H]1C[C@H]1CNC(C)=O Amb27471144 [0,0,0,1,0,0|2,0,1]=4 1318 B10R1.156 CC[C@@H]1C[C@H]1CNC(N)=O Amb27228042 [0,0,0,1,0,0|2,0,1]=4 1319 B10R1.156 COC1CC1C#CC(=O)O Amb35671223 [0,0,0,1,0,0|1,0,2]=4 1320 B10R1.162 CCC1CC(O)C=CCO1 Amb27191717 [0,0,0,1,0,0|2,0,1]=4 1321 B10R1.162 CCC1CCCCC(=O)C1 Amb28126018 [0,0,0,1,0,0|1,0,2]=4 1322 B10R1.162 CCC1CCCNC(=O)C1 Amb27627781 [0,0,0,1,0,0|2,0,1]=4 1323 B10R1.162 CC[C@@H]1CCCCC(=O)C1 Amb27236500 [0,0,0,1,0,0|1,0,2]=4 1324 B10R1.162 CC[C@H]1CCCCC(=O)C1 Amb27615128 [0,0,0,1,0,0|1,0,2]=4 1325 B10R1.162 CNC1CCC=CC(O)C1 Amb27259612 [0,0,0,1,0,0|2,0,1]=4 1326 B10R1.162 O=C1CCCCC(CBr)O1 Amb28342313 [0,0,0,1,0,0|1,0,2]=4 1327 B10R1.162 O=C1CCCCC(CO)O1 Amb27663769 [0,0,0,1,0,0|1,0,2]=4 1328 B10R1.173 CCC1CCN1CC(N)=O Amb27835541 [0,0,0,1,0,0|2,0,1]=4 1329 B10R1.173 CCN1CCC1CC(=O)O Amb27238754 [0,0,0,1,0,0|1,0,2]=4 1330 B10R1.348 CC(=O)C1=CC=CCCC1 Amb28351614 [0,0,0,1,0,0|1,0,2]=4 1331 B10R1.348 CC(=O)C1=CCCCCO1 Amb25744240 [0,0,0,1,0,0|2,0,0]=3 1332 B10R1.348 CC(=O)C1=CSCCCC1 Amb26322340 [0,0,0,1,0,0|2,0,0]=3 1333 B10R1.348 CC(=O)C1CCCCCC1 Amb24407172 [0,0,0,1,0,0|1,0,2]=4 1334 B10R1.348 CC(=O)C1CCCCCN1 Amb25169359 [0,0,0,1,0,0|2,0,1]=4 1335 B10R1.348 CC(=O)N1CCCCCC1 Amb6340881 [0,0,0,1,0,0|2,0,1]=4 1336 B10R1.348 CC(C)=C1CCCCCC1 Amb25048552 [0,0,0,1,0,0|2,0,1]=4 1337 B10R1.348 CC(C)C1=CCCCCC1 Amb25146390 [0,0,0,1,0,0|2,0,1]=4 1338 B10R1.348 CC(N)C1=CCCCCC1 Amb18278571 [0,0,0,1,0,0|2,0,1]=4 1339 B10R1.348 NC(=O)C1CCCCCC1 Amb24182051 [0,0,0,1,0,0|1,0,2]=4 1340 B10R1.348 NC(=O)C1CCCCCN1 Amb23596651 [0,0,0,1,0,0|2,0,1]=4 1341 B10R1.348 NC(=O)N1CCCCCC1 Amb1107239 [0,0,0,1,0,0|2,0,1]=4 1342 B10R1.348 O=C(Cl)C1CCCCCC1 Amb18797932 [0,0,0,1,0,0|1,0,2]=4 1343 B10R1.348 O=C(Cl)N1CCCCCC1 Amb17563067 [0,0,0,1,0,0|2,0,1]=4 1344 B10R1.348 O=C(O)C1=CCCCC=C1 Amb27882642 [0,0,0,1,0,0|0,0,2]=3 1345 B10R1.348 O=C(O)C1=CCCCCC1 Amb26605756 [0,0,0,1,0,0|0,0,0]=1 1346 B10R1.348 O=C(O)C1=CCCNCC1 Amb28119954 [0,0,0,1,0,0|1,0,0]=2 1347 B10R1.348 O=C(O)C1=CCCOCC1 Amb27197038 [0,0,0,1,0,0|1,0,0]=2 1348 B10R1.348 O=C(O)C1=CCNCCC1 Amb27254135 [0,0,0,1,0,0|1,0,0]=2 1349 B10R1.348 O=C(O)C1=NCCCCN1 Amb27975697 [0,0,0,1,0,0|2,0,0]=3 1350 B10R1.348 O=C(O)C1CCCCCC1 Amb2721236 [0,0,0,1,0,0|0,0,2]=3 1351 B10R1.348 O=C(O)C1CCCCCN1 Amb542684 [0,0,0,1,0,0|1,0,1]=3 1352 B10R1.348 O=C(O)C1CCCCCN1 Amb8504180 [0,0,0,1,0,0|1,0,1]=3 1353 B10R1.348 O=C(O)C1CCCCCO1 Amb28294213 [0,0,0,1,0,0|1,0,1]=3 1354 B10R1.348 O=C(O)C1CCCCNC1 Amb30586509 [0,0,0,1,0,0|1,0,2]=4 1355 B10R1.348 O=C(O)C1CCCCNC1 Amb8630383 [0,0,0,1,0,0|1,0,2]=4 1356 B10R1.348 O=C(O)C1CCCCNN1 Amb28287718 [0,0,0,1,0,0|2,0,1]=4 1357 B10R1.348 O=C(O)C1CCCNCC1 Amb18831588 [0,0,0,1,0,0|1,0,2]=4 1358 B10R1.348 O=C(O)C1CCCNCC1 Amb33189342 [0,0,0,1,0,0|1,0,2]=4 1359 B10R1.348 O=C(O)C1CCCOCC1 Amb18831505 [0,0,0,1,0,0|1,0,2]=4 1360 B10R1.348 O=C(O)C1CCCSCC1 Amb18199262 [0,0,0,1,0,0|1,0,2]=4 1361 B10R1.348 O=C(O)C1CCNCCO1 Amb27632727 [0,0,0,1,0,0|2,0,1]=4 1362 B10R1.348 O=C(O)C1CNCCCN1 Amb25890339 [0,0,0,1,0,0|2,0,1]=4 1363 B10R1.348 O=C(O)C1CNCCCN1 Amb28896027 [0,0,0,1,0,0|2,0,1]=4 1364 B10R1.348 O=C(O)C1CNCCCO1 Amb17739810 [0,0,0,1,0,0|2,0,1]=4 1365 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb2699229 [0,0,0,1,0,0|1,0,1]=3 1366 B10R1.348 O=C(O)[C@@H]1CCCCCN1 Amb8630384 [0,0,0,1,0,0|1,0,1]=3 1367 B10R1.348 O=C(O)[C@@H]1CCCNCC1 Amb27411309 [0,0,0,1,0,0|1,0,2]=4 1368 B10R1.348 O=C(O)[C@@H]1CCCOCC1 Amb27839414 [0,0,0,1,0,0|1,0,2]=4 1369 B10R1.348 O=C(O)[C@@H]1CSCCCN1 Amb28121128 [0,0,0,1,0,0|2,0,1]=4 1370 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb27770395 [0,0,0,1,0,0|1,0,1]=3 1371 B10R1.348 O=C(O)[C@H]1CCCCCN1 Amb33299452 [0,0,0,1,0,0|1,0,1]=3 1372 B10R1.348 O=C(O)[C@H]1CCCNCC1 Amb24479341 [0,0,0,1,0,0|1,0,2]=4 1373 B10R1.348 O=C(O)[C@H]1CCCOCC1 Amb27604305 [0,0,0,1,0,0|1,0,2]=4 1374 B10R1.348 OB(O)C1=CCCCCC1 Amb10068963 [0,0,0,1,0,0|1,0,1]=3 1375 B10R1.348 OC(O)C1=CCCCCC1 Amb27763520 [0,0,0,1,0,0|0,0,2]=3 1376 B7R0.1 C=C=CCCCCCl Amb27986085 [2,0,0,0,0,0|1,0,1]=4 1377 B7R0.1 C=C=CCCCCO Amb17593159 [2,0,0,0,0,0|1,0,1]=4 1378 B7R0.1 C=CC#CCCCC Amb17673844 [2,0,0,0,0,0|0,0,2]=4 1379 B7R0.1 C=CCCCCCBr Amb16234121 [2,0,0,0,0,0|1,0,1]=4 1380 B7R0.1 C=CCCCCCC Amb3940500 [2,0,0,0,0,0|0,0,1]=3 1381 B7R0.1 C=CCCCCCCl Amb6298878 [2,0,0,0,0,0|1,0,1]=4 1382 B7R0.1 C=CCCCCCI Amb24483139 [2,0,0,0,0,0|1,0,1]=4 1383 B7R0.1 C=CCCCCCN Amb18641754 [2,0,0,0,0,0|1,0,1]=4 1384 B7R0.1 C=CCCCCCO Amb4017321 [2,0,0,0,0,0|1,0,1]=4 1385 B7R0.1 C=CCCCCNC Amb19886674 [2,0,0,0,0,0|1,0,1]=4 1386 B7R0.1 C=CCCCCNC Amb22495849 [2,0,0,0,0,0|1,0,1]=4 1387 B7R0.1 C=CCCCNCC Amb28461005 [2,0,0,0,0,0|1,0,1]=4 1388 B7R0.1 C=CCCCNCC Amb32988644 [2,0,0,0,0,0|1,0,1]=4 1389 B7R0.1 C=CCCCSCC Amb27600986 [2,0,0,0,0,0|1,0,1]=4 1390 B7R0.1 C=CCCNCCC Amb27796644 [2,0,0,0,0,0|1,0,1]=4 1391 B7R0.1 C=CCCSCCC Amb27806215 [2,0,0,0,0,0|1,0,1]=4 1392 B7R0.1 C=CCOCCCC Amb3940494 [2,0,0,0,0,0|1,0,1]=4 1393 B7R0.1 C=COCCCCO Amb8517109 [2,0,0,0,0,0|2,0,0]=4 1394 B7R0.1 C=COCCCOC Amb28063047 [2,0,0,0,0,0|2,0,0]=4 1395 B7R0.1 C=COCCSCC Amb25720739 [2,0,0,0,0,0|2,0,0]=4 1396 B7R0.1 C=CSCCCCC Amb27666051 [2,0,0,0,0,0|1,0,0]=3 1397 B7R0.1 C=C\C=C\CCCC Amb22729011 [2,0,0,0,0,0|0,0,1]=3 1398 B7R0.1 C=C\C=C\CCCCl Amb28132447 [2,0,0,0,0,0|1,0,1]=4 1399 B7R0.1 C=C\C=C\CCNC Amb18641669 [2,0,0,0,0,0|1,0,1]=4 1400 B7R0.1 CC=C=CCCCC Amb28284500 [2,0,0,0,0,0|1,0,1]=4 1401 B7R0.1 CCCCC#CC=O Amb17593134 [2,0,0,0,0,0|0,0,2]=4 1402 B7R0.1 CCCCCCC=O Amb3939948 [2,0,0,0,0,0|0,0,1]=3 1403 B7R0.1 CCCCCCCO Amb6608791 [2,0,0,0,0,0|0,0,2]=4 1404 B7R0.1 CCCCCCNO Amb24591654 [2,0,0,0,0,0|1,0,1]=4 1405 B7R0.1 CCCCCCNO Amb32687464 [2,0,0,0,0,0|1,0,1]=4 1406 B7R0.1 CCCCCN=C=O Amb3939207 [2,0,0,0,0,0|1,0,1]=4 1407 B7R0.1 CCCCCNCO Amb28133981 [2,0,0,0,0,0|1,0,1]=4 1408 B7R0.1 CCCCCON=O Amb17939401 [2,0,0,0,0,0|2,0,0]=4 1409 B7R0.1 CCCCC\C=C\Br Amb27985859 [2,0,0,0,0,0|1,0,0]=3 1410 B7R0.1 CCCCC\C=C\Cl Amb28384465 [2,0,0,0,0,0|1,0,0]=3 1411 B7R0.1 CCCCC\C=C\I Amb22641605 [2,0,0,0,0,0|1,0,0]=3 1412 B7R0.1 CCCCC\C=N\N Amb27837897 [2,0,0,0,0,0|2,0,0]=4 1413 B7R0.1 CCCCC\C=N\O Amb27477089 [2,0,0,0,0,0|1,0,0]=3 1414 B7R0.1 CCCCOCC=O Amb26515709 [2,0,0,0,0,0|1,0,1]=4 1415 B7R0.1 CCCCO\C=C/Cl Amb27777227 [2,0,0,0,0,0|2,0,0]=4 1416 B7R0.1 CCCCO\C=C\Br Amb27858551 [2,0,0,0,0,0|2,0,0]=4 1417 B7R0.1 CCCCSCC=O Amb28189740 [2,0,0,0,0,0|1,0,1]=4 1418 B7R0.1 CCCCS\C=C/Cl Amb28048891 [2,0,0,0,0,0|2,0,0]=4 1419 B7R0.1 CCCC\C=C\C#N Amb18641342 [2,0,0,0,0,0|1,0,1]=4 1420 B7R0.1 CCCC\C=C\C=O Amb2720528 [2,0,0,0,0,0|0,0,0]=2 1421 B7R0.1 CCCC\C=C\CN Amb25175053 [2,0,0,0,0,0|1,0,1]=4 1422 B7R0.1 CCCC\C=C\CO Amb8514979 [2,0,0,0,0,0|0,0,1]=3 1423 B7R0.1 CCCNCCC=O Amb27838403 [2,0,0,0,0,0|1,0,1]=4 1424 B7R0.1 CCCNC\C=C\Cl Amb25340126 [2,0,0,0,0,0|2,0,0]=4 1425 B7R0.1 CCCOC\C=C/Cl Amb27839016 [2,0,0,0,0,0|2,0,0]=4 1426 B7R0.1 CCC\C=C\C=C\Cl Amb27657659 [2,0,0,0,0,0|1,0,1]=4 1427 B7R0.1 CCC\C=C\CC=O Amb32954538 [2,0,0,0,0,0|0,0,2]=4 1428 B7R0.1 CCNCC\C=C\Cl Amb27400178 [2,0,0,0,0,0|2,0,0]=4 1429 B7R0.1 CCNC\C=C/CO Amb28072875 [2,0,0,0,0,0|1,0,1]=4 1430 B7R0.1 CCOCCCC=O Amb27236777 [2,0,0,0,0,0|1,0,1]=4 1431 B7R0.1 CCOC\C=C\CO Amb25221278 [2,0,0,0,0,0|1,0,1]=4 1432 B7R0.1 CCSCCCC=O Amb33323662 [2,0,0,0,0,0|1,0,1]=4 1433 B7R0.1 CCSCCNC=O Amb27752341 [2,0,0,0,0,0|2,0,0]=4 1434 B7R0.1 CCSC\C=C\C=O Amb33323727 [2,0,0,0,0,0|1,0,0]=3 1435 B7R0.1 CCSC\C=C\CO Amb33475304 [2,0,0,0,0,0|1,0,1]=4 1436 B7R0.1 CC\C=C\C=C\C=O Amb8392847 [2,0,0,0,0,0|0,0,2]=4 1437 B7R0.1 CC\C=C\CCCC Amb19930202 [2,0,0,0,0,0|1,0,1]=4 1438 B7R0.1 COCCCCC=O Amb27410175 [2,0,0,0,0,0|1,0,1]=4 1439 B7R0.1 COCC\C=C\C=O Amb33377482 [2,0,0,0,0,0|1,0,0]=3 1440 B7R0.1 COCC\C=C\CO Amb32954125 [2,0,0,0,0,0|1,0,1]=4 1441 B7R0.1 CSCCCCC=O Amb25760866 [2,0,0,0,0,0|1,0,1]=4 1442 B7R0.1 CSCC\C=C\C=O Amb32953448 [2,0,0,0,0,0|1,0,0]=3 1443 B7R0.1 CSCC\C=C\CO Amb33198279 [2,0,0,0,0,0|1,0,1]=4 1444 B7R0.1 C\C=C/CCCCC Amb4035902 [2,0,0,0,0,0|0,0,1]=3 1445 B7R0.1 C\C=C/CCCCO Amb4019856 [2,0,0,0,0,0|1,0,1]=4 1446 B7R0.1 C\C=C\C=C\CCC Amb27493119 [2,0,0,0,0,0|1,0,1]=4 1447 B7R0.1 C\C=C\CCCCC Amb8513437 [2,0,0,0,0,0|0,0,1]=3 1448 B7R0.1 C\C=C\CCCCN Amb27209196 [2,0,0,0,0,0|1,0,1]=4 1449 B7R0.1 C\C=C\CNCCC Amb28127654 [2,0,0,0,0,0|1,0,1]=4 1450 B7R0.1 C\C=C\C\C=C\C=O Amb27202097 [2,0,0,0,0,0|0,0,2]=4 1451 B7R0.1 NCCCCNC=O Amb18641902 [2,0,0,0,0,0|2,0,0]=4 1452 B7R0.1 NCCC\C=C/CO Amb27838308 [2,0,0,0,0,0|1,0,1]=4 1453 B7R0.1 NCCC\C=C\CO Amb24117506 [2,0,0,0,0,0|1,0,1]=4 1454 B7R0.1 NCCC\C=C\CO Amb33734220 [2,0,0,0,0,0|1,0,1]=4 1455 B7R0.1 NCCC\C=C\CO Amb33743765 [2,0,0,0,0,0|1,0,1]=4 1456 B7R0.1 O=CCCCCCBr Amb18127461 [2,0,0,0,0,0|1,0,1]=4 1457 B7R0.1 O=CCCCCCCl Amb16185781 [2,0,0,0,0,0|1,0,1]=4 1458 B7R0.1 O=CCCCCCF Amb24533888 [2,0,0,0,0,0|1,0,1]=4 1459 B7R0.1 O=CCCCCCO Amb18641885 [2,0,0,0,0,0|1,0,1]=4 1460 B7R0.1 O=CNCCCCF Amb27168251 [2,0,0,0,0,0|2,0,0]=4 1461 B7R0.1 O=CNCCCCO Amb28187191 [2,0,0,0,0,0|2,0,0]=4 1462 B7R0.1 O=C\C=C\CCC=O Amb18124241 [2,0,0,0,0,0|1,0,1]=4 1463 B7R0.1 OCCCC\C=N\O Amb22336271 [2,0,0,0,0,0|2,0,0]=4 1464 B7R0.1 OC\C=C/CCCCl Amb27862350 [2,0,0,0,0,0|1,0,1]=4 1465 B7R0.1 OC\C=C\CCCO Amb27205649 [2,0,0,0,0,0|1,0,1]=4 1466 B7R0.1 O\C=C\C=C\CCO Amb27605420 [2,0,0,0,0,0|1,0,1]=4 1467 B7R0.4 C#CCCCC(=O)O Amb2721705 [2,0,0,0,0,0|0,0,2]=4 1468 B7R0.4 C=C(C)CCCCC Amb6298938 [2,0,0,0,0,0|2,0,0]=4 1469 B7R0.4 C=CCCCC(=O)O Amb3941675 [2,0,0,0,0,0|0,0,2]=4 1470 B7R0.4 CC#CCCC(=O)O Amb3987196 [2,0,0,0,0,0|0,0,2]=4 1471 B7R0.4 CC(=O)CCCCBr Amb16234126 [2,0,0,0,0,0|2,0,0]=4 1472 B7R0.4 CC(=O)CCCCCl Amb3941549 [2,0,0,0,0,0|2,0,0]=4 1473 B7R0.4 CC(=O)CCCCF Amb27490855 [2,0,0,0,0,0|2,0,0]=4 1474 B7R0.4 CC(=O)CCCCN Amb27401218 [2,0,0,0,0,0|2,0,0]=4 1475 B7R0.4 CC(=O)CCCCO Amb10603864 [2,0,0,0,0,0|2,0,0]=4 1476 B7R0.4 CC(=O)\C=C\CCF Amb33196081 [2,0,0,0,0,0|2,0,0]=4 1477 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [2,0,0,0,0,0|2,0,0]=4 1478 B7R0.4 CCC#CCC(=O)O Amb26515701 [2,0,0,0,0,0|0,0,2]=4 1479 B7R0.4 CCCC#CC(=O)O Amb2721706 [2,0,0,0,0,0|0,0,2]=4 1480 B7R0.4 CCCCC=C(C)C Amb22228888 [2,0,0,0,0,0|2,0,0]=4 1481 B7R0.4 CCCCCB(O)O Amb2447470 [2,0,0,0,0,0|1,0,1]=4 1482 B7R0.4 CCCCCC(=N)N Amb19890171 [2,0,0,0,0,0|2,0,0]=4 1483 B7R0.4 CCCCCC(=N)N Amb2696574 [2,0,0,0,0,0|2,0,0]=4 1484 B7R0.4 CCCCCC(=N)N Amb35747068 [2,0,0,0,0,0|2,0,0]=4 1485 B7R0.4 CCCCCC(=O)F Amb26061517 [2,0,0,0,0,0|1,0,0]=3 1486 B7R0.4 CCCCCC(=O)O Amb3939846 [2,0,0,0,0,0|0,0,0]=2 1487 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [2,0,0,0,0,0|0,0,1]=3 1488 B7R0.4 CCCCCC(C)=O Amb6608885 [2,0,0,0,0,0|1,0,0]=3 1489 B7R0.4 CCCCCC(C)O Amb8383668 [2,0,0,0,0,0|1,0,1]=4 1490 B7R0.4 CCCCCC(N)=S Amb6246072 [2,0,0,0,0,0|1,1,0]=4 1491 B7R0.4 CCCCCC(O)Cl Amb27232933 [2,0,0,0,0,0|1,0,1]=4 1492 B7R0.4 CCCCCC(O)O Amb25921998 [2,0,0,0,0,0|0,0,2]=4 1493 B7R0.4 CCCCCN(C)O Amb33428427 [2,0,0,0,0,0|2,0,0]=4 1494 B7R0.4 CCCCCS(=O)Cl Amb32720370 [2,0,0,0,0,0|2,0,0]=4 1495 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [2,0,0,0,0,0|1,0,1]=4 1496 B7R0.4 CCCCCS(C)=O Amb27457494 [2,0,0,0,0,0|2,0,0]=4 1497 B7R0.4 CCCCCS(N)=O Amb32720371 [2,0,0,0,0,0|2,0,0]=4 1498 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [2,0,0,0,0,0|1,0,1]=4 1499 B7R0.4 CCCCC[C@H](C)O Amb8395591 [2,0,0,0,0,0|1,0,1]=4 1500 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [2,0,0,0,0,0|1,0,1]=4 1501 B7R0.4 CCCCNC(=O)Cl Amb24574309 [2,0,0,0,0,0|2,0,0]=4 1502 B7R0.4 CCCCNC(C)=O Amb5835711 [2,0,0,0,0,0|2,0,0]=4 1503 B7R0.4 CCCCNC(N)=O Amb6663202 [2,0,0,0,0,0|2,0,0]=4 1504 B7R0.4 CCCCOC(=O)Cl Amb6608833 [2,0,0,0,0,0|2,0,0]=4 1505 B7R0.4 CCCCOC(C)=O Amb6608782 [2,0,0,0,0,0|2,0,0]=4 1506 B7R0.4 CCCCOC(N)=O Amb4136361 [2,0,0,0,0,0|2,0,0]=4 1507 B7R0.4 CCCCO[PH](=O)O Amb26035392 [2,0,0,0,0,0|2,0,0]=4 1508 B7R0.4 CCCCSC(=O)Cl Amb22352826 [2,0,0,0,0,0|2,0,0]=4 1509 B7R0.4 CCCNCC(=O)O Amb10609640 [2,0,0,0,0,0|1,0,0]=3 1510 B7R0.4 CCCNCC(=O)O Amb1110628 [2,0,0,0,0,0|1,0,0]=3 1511 B7R0.4 CCCNCC(C)=O Amb26954588 [2,0,0,0,0,0|2,0,0]=4 1512 B7R0.4 CCCNCC(N)=O Amb1124632 [2,0,0,0,0,0|2,0,0]=4 1513 B7R0.4 CCCNCC(N)=O Amb28934788 [2,0,0,0,0,0|2,0,0]=4 1514 B7R0.4 CCCOCC(=O)Cl Amb27260778 [2,0,0,0,0,0|2,0,0]=4 1515 B7R0.4 CCCOCC(=O)O Amb8874504 [2,0,0,0,0,0|1,0,0]=3 1516 B7R0.4 CCCOCC(N)=O Amb27844884 [2,0,0,0,0,0|2,0,0]=4 1517 B7R0.4 CCCSCC(=O)O Amb1137113 [2,0,0,0,0,0|1,0,0]=3 1518 B7R0.4 CCCSCC(C)=O Amb9668676 [2,0,0,0,0,0|2,0,0]=4 1519 B7R0.4 CCCSCC(N)=O Amb27424658 [2,0,0,0,0,0|2,0,0]=4 1520 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [2,0,0,0,0,0|1,0,0]=3 1521 B7R0.4 CCC\C=C\C(=N)N Amb33358507 [2,0,0,0,0,0|2,0,0]=4 1522 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [2,0,0,0,0,0|1,0,0]=3 1523 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [2,0,0,0,0,0|0,0,0]=2 1524 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [2,0,0,0,0,0|1,0,0]=3 1525 B7R0.4 CCC\C=C\C(C)O Amb25083446 [2,0,0,0,0,0|1,0,1]=4 1526 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [2,0,0,0,0,0|1,0,0]=3 1527 B7R0.4 CCC\C=C\[C@@H](C)O Amb33429966 [2,0,0,0,0,0|1,0,1]=4 1528 B7R0.4 CCC\C=C\[C@H](C)O Amb27857282 [2,0,0,0,0,0|1,0,1]=4 1529 B7R0.4 CCC\C=C\[N+](=O)[O-] Amb24558342 [2,0,0,0,0,0|1,0,1]=4 1530 B7R0.4 CCNCCC(=O)O Amb28934794 [2,0,0,0,0,0|1,0,0]=3 1531 B7R0.4 CCNCCC(=O)O Amb7766402 [2,0,0,0,0,0|1,0,0]=3 1532 B7R0.4 CCNCCC(C)=O Amb18641851 [2,0,0,0,0,0|2,0,0]=4 1533 B7R0.4 CCNCCC(N)=O Amb33533384 [2,0,0,0,0,0|2,0,0]=4 1534 B7R0.4 CCNCCC(N)=O Amb35749820 [2,0,0,0,0,0|2,0,0]=4 1535 B7R0.4 CCNNCC(=O)O Amb28326075 [2,0,0,0,0,0|2,0,0]=4 1536 B7R0.4 CCOCCC(=O)Cl Amb20672027 [2,0,0,0,0,0|2,0,0]=4 1537 B7R0.4 CCOCCC(=O)O Amb3939859 [2,0,0,0,0,0|1,0,0]=3 1538 B7R0.4 CCOCCC(C)=O Amb7764636 [2,0,0,0,0,0|2,0,0]=4 1539 B7R0.4 CCO\C=C\C(=O)Cl Amb33943049 [2,0,0,0,0,0|2,0,0]=4 1540 B7R0.4 CCO\C=C\C(=O)O Amb2725260 [2,0,0,0,0,0|1,0,0]=3 1541 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [2,0,0,0,0,0|2,0,0]=4 1542 B7R0.4 CCO\N=C\C(=O)O Amb27468748 [2,0,0,0,0,0|2,0,0]=4 1543 B7R0.4 CCSCCC(=O)O Amb6273140 [2,0,0,0,0,0|1,0,0]=3 1544 B7R0.4 CCSCCC(C)=O Amb9655821 [2,0,0,0,0,0|2,0,0]=4 1545 B7R0.4 CCSCCC(N)=O Amb27258252 [2,0,0,0,0,0|2,0,0]=4 1546 B7R0.4 CCS\C=C/C(C)=O Amb28122375 [2,0,0,0,0,0|2,0,0]=4 1547 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [2,0,0,0,0,0|0,0,2]=4 1548 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [2,0,0,0,0,0|0,0,2]=4 1549 B7R0.4 CNCCCC(=O)O Amb1153115 [2,0,0,0,0,0|1,0,0]=3 1550 B7R0.4 CNCCCC(=O)O Amb4521435 [2,0,0,0,0,0|1,0,0]=3 1551 B7R0.4 CNCCCC(C)=O Amb27838406 [2,0,0,0,0,0|2,0,0]=4 1552 B7R0.4 CNCCCC(N)=O Amb18303611 [2,0,0,0,0,0|2,0,0]=4 1553 B7R0.4 CNCCCC(N)=O Amb31307731 [2,0,0,0,0,0|2,0,0]=4 1554 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [2,0,0,0,0,0|1,0,0]=3 1555 B7R0.4 COCCCC(=O)O Amb6275629 [2,0,0,0,0,0|1,0,0]=3 1556 B7R0.4 COCCCC(C)=O Amb9031556 [2,0,0,0,0,0|2,0,0]=4 1557 B7R0.4 COCOCC(=O)O Amb28059312 [2,0,0,0,0,0|2,0,0]=4 1558 B7R0.4 COCSCC(=O)O Amb27466837 [2,0,0,0,0,0|2,0,0]=4 1559 B7R0.4 COC\C=C\C(=O)O Amb33986212 [2,0,0,0,0,0|1,0,0]=3 1560 B7R0.4 COC\C=C\C(C)=O Amb33359822 [2,0,0,0,0,0|2,0,0]=4 1561 B7R0.4 CSCCCC(=O)O Amb17503622 [2,0,0,0,0,0|1,0,0]=3 1562 B7R0.4 CSCCCC(C)=O Amb25122381 [2,0,0,0,0,0|2,0,0]=4 1563 B7R0.4 CSCSCC(=O)O Amb27858824 [2,0,0,0,0,0|2,0,0]=4 1564 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [2,0,0,0,0,0|2,0,0]=4 1565 B7R0.4 CSC\C=C\C(C)=O Amb33359530 [2,0,0,0,0,0|2,0,0]=4 1566 B7R0.4 CSSCCC(=O)O Amb26848465 [2,0,0,0,0,0|2,0,0]=4 1567 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [2,0,0,0,0,0|0,0,2]=4 1568 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [2,0,0,0,0,0|0,0,2]=4 1569 B7R0.4 N#CCCCC(=O)O Amb33542831 [2,0,0,0,0,0|1,0,1]=4 1570 B7R0.4 NC(=O)CCCCBr Amb27875083 [2,0,0,0,0,0|2,0,0]=4 1571 B7R0.4 NC(=O)CCCCCl Amb7782532 [2,0,0,0,0,0|2,0,0]=4 1572 B7R0.4 NC(=O)CCCCO Amb3939470 [2,0,0,0,0,0|2,0,0]=4 1573 B7R0.4 NC(=O)CCCCS Amb27839239 [2,0,0,0,0,0|2,0,0]=4 1574 B7R0.4 NCCCCC(=O)Cl Amb26599615 [2,0,0,0,0,0|2,0,0]=4 1575 B7R0.4 NCCCCC(=O)O Amb2780021 [2,0,0,0,0,0|1,0,0]=3 1576 B7R0.4 NCCCCC(=O)O Amb3941646 [2,0,0,0,0,0|1,0,0]=3 1577 B7R0.4 NCCCCC(=O)O Amb9825855 [2,0,0,0,0,0|1,0,0]=3 1578 B7R0.4 NCCCCC(N)=O Amb18641897 [2,0,0,0,0,0|2,0,0]=4 1579 B7R0.4 NCCCCC(N)=O Amb33552086 [2,0,0,0,0,0|2,0,0]=4 1580 B7R0.4 NCCCCS(=O)O Amb27882127 [2,0,0,0,0,0|2,0,0]=4 1581 B7R0.4 NCCCNC(=O)O Amb24093884 [2,0,0,0,0,0|2,0,0]=4 1582 B7R0.4 NCCNCC(=O)O Amb17608063 [2,0,0,0,0,0|2,0,0]=4 1583 B7R0.4 NCCNCC(=O)O Amb33339058 [2,0,0,0,0,0|2,0,0]=4 1584 B7R0.4 NCCOCC(=O)O Amb18630146 [2,0,0,0,0,0|2,0,0]=4 1585 B7R0.4 NCCOCC(=O)O Amb33550947 [2,0,0,0,0,0|2,0,0]=4 1586 B7R0.4 NCCSCC(=O)O Amb17500446 [2,0,0,0,0,0|2,0,0]=4 1587 B7R0.4 NCCSCC(=O)O Amb20622325 [2,0,0,0,0,0|2,0,0]=4 1588 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [2,0,0,0,0,0|1,0,0]=3 1589 B7R0.4 NOCCCC(=O)O Amb10975956 [2,0,0,0,0,0|2,0,0]=4 1590 B7R0.4 NOCCCC(=O)O Amb22011795 [2,0,0,0,0,0|2,0,0]=4 1591 B7R0.4 NOCCCC(=O)O Amb31283653 [2,0,0,0,0,0|2,0,0]=4 1592 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [2,0,0,0,0,0|2,0,0]=4 1593 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [2,0,0,0,0,0|2,0,0]=4 1594 B7R0.4 O=C(Cl)\C=C\CCCl Amb27413542 [2,0,0,0,0,0|2,0,0]=4 1595 B7R0.4 O=C(O)CCCCBr Amb6608763 [2,0,0,0,0,0|1,0,0]=3 1596 B7R0.4 O=C(O)CCCCCl Amb3940369 [2,0,0,0,0,0|1,0,0]=3 1597 B7R0.4 O=C(O)CCCCF Amb26639920 [2,0,0,0,0,0|1,0,0]=3 1598 B7R0.4 O=C(O)CCCCO Amb9214971 [2,0,0,0,0,0|1,0,0]=3 1599 B7R0.4 O=C(O)CCCCS Amb17503767 [2,0,0,0,0,0|1,0,0]=3 1600 B7R0.4 O=C(O)CCCNCl Amb27173950 [2,0,0,0,0,0|2,0,0]=4 1601 B7R0.4 O=C(O)CNCCF Amb28076282 [2,0,0,0,0,0|2,0,0]=4 1602 B7R0.4 O=C(O)CNCCO Amb9325653 [2,0,0,0,0,0|2,0,0]=4 1603 B7R0.4 O=C(O)COCCCl Amb21857870 [2,0,0,0,0,0|2,0,0]=4 1604 B7R0.4 O=C(O)COCCF Amb27866609 [2,0,0,0,0,0|2,0,0]=4 1605 B7R0.4 O=C(O)COCCO Amb6680914 [2,0,0,0,0,0|2,0,0]=4 1606 B7R0.4 O=C(O)CSCCCl Amb18644703 [2,0,0,0,0,0|2,0,0]=4 1607 B7R0.4 O=C(O)\C=C\CCBr Amb25702661 [2,0,0,0,0,0|1,0,0]=3 1608 B7R0.4 O=C(O)\C=C\CCF Amb33196445 [2,0,0,0,0,0|1,0,0]=3 1609 B7R0.4 O=C([O-])CCCCF Amb33527827 [2,0,0,0,0,0|1,0,1]=4 1610 B7R0.4 O=C([O-])CCCCO Amb13952763 [2,0,0,0,0,0|1,0,1]=4 1611 B7R0.4 O=C([O-])CCCCO Amb22749314 [2,0,0,0,0,0|1,0,1]=4 1612 B7R0.4 O=CCCCC(=O)O Amb17593198 [2,0,0,0,0,0|1,0,1]=4 1613 B9R0.5 C#CCCC\C(C)=C\C=O Amb27770379 [1,1,0,0,0,0|0,0,2]=4 1614 B9R0.5 C=CCCC\C(C)=C/C=O Amb27489044 [1,1,0,0,0,0|0,0,2]=4 1615 B9R0.5 C=C\C=C(\C)CCCCN Amb27466086 [1,1,0,0,0,0|2,0,0]=4 1616 B9R0.5 CC#CCC\C(C)=C\C=O Amb28129797 [1,1,0,0,0,0|0,0,2]=4 1617 B9R0.5 CCCC(C)CCCC=O Amb27425021 [1,1,0,0,0,0|0,0,2]=4 1618 B9R0.5 CCCC(O)C\C=C\CO Amb27614990 [1,1,0,0,0,0|0,0,1]=3 1619 B9R0.5 CCCCCC(=O)CCO Amb27627789 [1,1,0,0,0,0|0,0,2]=4 1620 B9R0.5 CCCCCC(=O)\C=C\Cl Amb26411947 [1,1,0,0,0,0|1,0,0]=3 1621 B9R0.5 CCCCCC(=O)\C=C\I Amb26013833 [1,1,0,0,0,0|1,0,0]=3 1622 B9R0.5 CCCCCC(C)CC=O Amb21953169 [1,1,0,0,0,0|0,0,2]=4 1623 B9R0.5 CCCCCC(C)NC=O Amb27615073 [1,1,0,0,0,0|1,0,1]=4 1624 B9R0.5 CCCCCC(S)CC=O Amb27424790 [1,1,0,0,0,0|0,0,2]=4 1625 B9R0.5 CCCCC[C@@H](O)\C=C\I Amb25970920 [1,1,0,0,0,0|1,0,1]=4 1626 B9R0.5 CCCCC[C@H](O)\C=C\I Amb24518537 [1,1,0,0,0,0|1,0,1]=4 1627 B9R0.5 CCCCC\C(C)=C\C#N Amb27476930 [1,1,0,0,0,0|1,0,1]=4 1628 B9R0.5 CCCCC\C(C)=C\C=O Amb27841277 [1,1,0,0,0,0|0,0,0]=2 1629 B9R0.5 CCCCC\C(Cl)=C\CCl Amb27749688 [1,1,0,0,0,0|1,0,1]=4 1630 B9R0.5 CCCCC\C(I)=C\CO Amb4017430 [1,1,0,0,0,0|0,0,1]=3 1631 B9R0.5 CCCCS\C(C)=C\CO Amb27651728 [1,1,0,0,0,0|1,0,1]=4 1632 B9R0.5 CCC[C@H](O)C\C=C\CO Amb27617048 [1,1,0,0,0,0|0,0,1]=3 1633 B9R0.5 CCC\C=C\C(=O)\C=C\O Amb28202126 [1,1,0,0,0,0|0,0,2]=4 1634 B9R0.5 CC\C=C(/C)CCCCC Amb27666327 [1,1,0,0,0,0|1,0,1]=4 1635 B9R0.5 CC\C=C\CC(Br)CCC Amb27488172 [1,1,0,0,0,0|1,0,1]=4 1636 B9R0.5 COCCC\C(C)=C\CO Amb27826189 [1,1,0,0,0,0|1,0,1]=4 1637 B9R0.5 C\C(=C/CO)CCCCCl Amb27254213 [1,1,0,0,0,0|1,0,1]=4 1638 B9R0.5 C\C(=C/CO)CCCCO Amb27594384 [1,1,0,0,0,0|1,0,1]=4 1639 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [1,1,0,0,0,0|1,0,0]=3 1640 B9R0.5 C\C=C\C(=O)CCCCF Amb27652289 [1,1,0,0,0,0|2,0,0]=4 1641 B9R0.5 C\C=C\C(=O)CCCOC Amb27235499 [1,1,0,0,0,0|2,0,0]=4 1642 B9R0.5 C\C=C\C(=O)COCCC Amb28312884 [1,1,0,0,0,0|2,0,0]=4 1643 B9R0.5 C\C=C\C(=O)NCCCC Amb27474050 [1,1,0,0,0,0|2,0,0]=4 1644 B9R0.5 C\C=C\C(=O)OCCCC Amb17940289 [1,1,0,0,0,0|2,0,0]=4 1645 B9R0.5 C\C=C\C(O)CCCCC Amb28139884 [1,1,0,0,0,0|1,0,1]=4 1646 B9R0.5 C\C=C\CC\C(C)=C/C=O Amb27643406 [1,1,0,0,0,0|0,0,2]=4 1647 B9R0.5 C\C=C\CC\C(C)=C\C=O Amb18643316 [1,1,0,0,0,0|0,0,2]=4 1648 B9R0.18 CC=C=CC(O)CCCC Amb27835036 [1,1,0,0,0,0|1,0,1]=4 1649 B9R0.18 CCCCC(=O)\C=C\C=O Amb27252353 [1,1,0,0,0,0|0,0,1]=3 1650 B9R0.18 CCCCC(N)CCC=O Amb33036353 [1,1,0,0,0,0|0,0,2]=4 1651 B9R0.18 CCCCC(O)CCC=O Amb27236595 [1,1,0,0,0,0|0,0,2]=4 1652 B9R0.18 CCCCC(O)\C=C\C=O Amb18643941 [1,1,0,0,0,0|0,0,0]=2 1653 B9R0.18 CCCCC(O)\C=C\CO Amb28050649 [1,1,0,0,0,0|0,0,1]=3 1654 B9R0.18 CCCC[C@@H](C)\C=C\CO Amb28350350 [1,1,0,0,0,0|0,0,1]=3 1655 B9R0.18 CCCC[C@@H](O)\C=C\C#N Amb27770522 [1,1,0,0,0,0|1,0,1]=4 1656 B9R0.18 CCCC[C@H](O)\C=C\CO Amb27213889 [1,1,0,0,0,0|0,0,1]=3 1657 B9R0.18 C\C=C\CC(N)CCCC Amb26501784 [1,1,0,0,0,0|1,0,1]=4 1658 B9R0.18 C\C=C\CC(O)CCCC Amb28457872 [1,1,0,0,0,0|1,0,1]=4 1659 B9R0.18 C\C=C\C[C@H](O)CCCC Amb28050754 [1,1,0,0,0,0|1,0,1]=4 1660 B9R0.18 OC\C=C\[C@@H](O)CCCO Amb28064019 [1,1,0,0,0,0|1,0,1]=4 1661 B9R0.45 C#C\C=C\CCCCCO Amb28050732 [1,1,0,0,0,0|1,0,1]=4 1662 B9R0.45 C=CCCCC\C=C\C=O Amb17593510 [1,1,0,0,0,0|0,0,1]=3 1663 B9R0.45 C=CCCCC\C=C\CO Amb8389620 [1,1,0,0,0,0|0,0,2]=4 1664 B9R0.45 C=CC\C=C/CCCCC Amb27423727 [1,1,0,0,0,0|1,0,0]=3 1665 B9R0.45 C=CC\C=C\CCCCC Amb27629643 [1,1,0,0,0,0|1,0,0]=3 1666 B9R0.45 C=CC\C=C\CCCCO Amb28050717 [1,1,0,0,0,0|2,0,0]=4 1667 B9R0.45 C=C\C=C/CCCCCC Amb22641680 [1,1,0,0,0,0|1,0,0]=3 1668 B9R0.45 C=C\C=C\CCCCCO Amb27242542 [1,1,0,0,0,0|1,0,0]=3 1669 B9R0.45 C=C\C=C\CCNCCC Amb28049583 [1,1,0,0,0,0|1,0,0]=3 1670 B9R0.45 CCCCC#C\C=C\CO Amb28293235 [1,1,0,0,0,0|0,0,2]=4 1671 B9R0.45 CCCCCC=C=CCCl Amb27211387 [1,1,0,0,0,0|1,0,1]=4 1672 B9R0.45 CCCCCCCNC=O Amb27170738 [1,1,0,0,0,0|0,0,2]=4 1673 B9R0.45 CCCCCCCOC=O Amb9787223 [1,1,0,0,0,0|0,0,2]=4 1674 B9R0.45 CCCCCCOCC=O Amb26624223 [1,1,0,0,0,0|0,0,2]=4 1675 B9R0.45 CCCCCCO\C=C/Cl Amb27984890 [1,1,0,0,0,0|1,0,1]=4 1676 B9R0.45 CCCCCC\C=C/CO Amb10807383 [1,1,0,0,0,0|0,0,1]=3 1677 B9R0.45 CCCCCC\C=C\C=O Amb24061310 [1,1,0,0,0,0|0,0,0]=2 1678 B9R0.45 CCCCCC\C=C\CO Amb22168300 [1,1,0,0,0,0|0,0,1]=3 1679 B9R0.45 CCCCCC\C=C\OC Amb30621739 [1,1,0,0,0,0|0,0,1]=3 1680 B9R0.45 CCCCCOCCC=O Amb27628424 [1,1,0,0,0,0|0,0,2]=4 1681 B9R0.45 CCCCC\C=C/CCBr Amb27781314 [1,1,0,0,0,0|1,0,1]=4 1682 B9R0.45 CCCCC\C=C/CCO Amb9825885 [1,1,0,0,0,0|0,0,1]=3 1683 B9R0.45 CCCCC\C=C\CCBr Amb27864879 [1,1,0,0,0,0|1,0,1]=4 1684 B9R0.45 CCCCC\C=C\CCN Amb25123460 [1,1,0,0,0,0|1,0,1]=4 1685 B9R0.45 CCCCC\C=C\CCO Amb27953070 [1,1,0,0,0,0|0,0,1]=3 1686 B9R0.45 CCCCC\C=C\OCC Amb27590195 [1,1,0,0,0,0|1,0,1]=4 1687 B9R0.45 CCCCNC\C=C\CN Amb27391026 [1,1,0,0,0,0|1,0,1]=4 1688 B9R0.45 CCCCOC\C=C/CBr Amb27798436 [1,1,0,0,0,0|1,0,1]=4 1689 B9R0.45 CCCCOC\C=C\CBr Amb28318470 [1,1,0,0,0,0|1,0,1]=4 1690 B9R0.45 CCCCOC\C=C\CN Amb27877410 [1,1,0,0,0,0|1,0,1]=4 1691 B9R0.45 CCCCOC\C=C\CO Amb28453524 [1,1,0,0,0,0|0,0,1]=3 1692 B9R0.45 CCCCOC\C=C\CS Amb27809829 [1,1,0,0,0,0|0,1,1]=4 1693 B9R0.45 CCCCSC\C=C\CO Amb28205928 [1,1,0,0,0,0|0,0,1]=3 1694 B9R0.45 CCCCSC\C=C\CS Amb27632116 [1,1,0,0,0,0|0,1,1]=4 1695 B9R0.45 CCCC\C=C\C=C\CCl Amb27204911 [1,1,0,0,0,0|1,0,1]=4 1696 B9R0.45 CCCC\C=C\C=C\CO Amb27445447 [1,1,0,0,0,0|0,0,1]=3 1697 B9R0.45 CCCC\C=C\CCC=O Amb27966384 [1,1,0,0,0,0|0,0,2]=4 1698 B9R0.45 CCCOCCCNC=O Amb27453700 [1,1,0,0,0,0|1,0,1]=4 1699 B9R0.45 CCC\C=C\C=C\C=N\O Amb27843401 [1,1,0,0,0,0|0,0,2]=4 1700 B9R0.45 CCC\C=C\CCCCC Amb22231673 [1,1,0,0,0,0|1,0,1]=4 1701 B9R0.45 CCC\C=C\C\C=C\C=O Amb27635823 [1,1,0,0,0,0|0,0,1]=3 1702 B9R0.45 CCOCCCCNC=O Amb27634560 [1,1,0,0,0,0|1,0,1]=4 1703 B9R0.45 CC\C=C/CC\C=C\C=O Amb2720527 [1,1,0,0,0,0|0,0,1]=3 1704 B9R0.45 CC\C=C/CC\C=C\CO Amb8515211 [1,1,0,0,0,0|0,0,2]=4 1705 B9R0.45 CC\C=C/C\C=C/CC=O Amb18643319 [1,1,0,0,0,0|0,0,2]=4 1706 B9R0.45 CC\C=C\CCCCCC Amb22231672 [1,1,0,0,0,0|1,0,1]=4 1707 B9R0.45 CC\C=C\CC\C=C\C=O Amb18124509 [1,1,0,0,0,0|0,0,1]=3 1708 B9R0.45 CC\C=C\COCCCC Amb25912010 [1,1,0,0,0,0|1,0,1]=4 1709 B9R0.45 CC\C=C\C\C=C\CC=O Amb28255687 [1,1,0,0,0,0|0,0,2]=4 1710 B9R0.45 CSCCCCCNC=O Amb27165514 [1,1,0,0,0,0|1,0,1]=4 1711 B9R0.45 CSCCCC\C=C\CO Amb27604531 [1,1,0,0,0,0|0,0,1]=3 1712 B9R0.45 C\C=C/C=C\CCCCC Amb22641684 [1,1,0,0,0,0|1,0,0]=3 1713 B9R0.45 C\C=C/CCCCCCC Amb26019969 [1,1,0,0,0,0|1,0,1]=4 1714 B9R0.45 C\C=C\C=C\CCCCBr Amb28137170 [1,1,0,0,0,0|1,0,1]=4 1715 B9R0.45 C\C=C\CCCCCCO Amb27980554 [1,1,0,0,0,0|1,0,1]=4 1716 B9R0.45 C\C=C\CCCCCNC Amb26398871 [1,1,0,0,0,0|1,0,1]=4 1717 B9R0.45 C\C=C\CCNCCCC Amb27789929 [1,1,0,0,0,0|1,0,1]=4 1718 B9R0.45 C\C=C\OCCCCCO Amb28350349 [1,1,0,0,0,0|2,0,0]=4 1719 B9R0.45 N#CCCCC\C=C\CO Amb27770521 [1,1,0,0,0,0|0,0,2]=4 1720 B9R0.45 NCCCCCCNC=O Amb28251393 [1,1,0,0,0,0|1,0,1]=4 1721 B9R0.45 O=CCCCCCCCF Amb25075653 [1,1,0,0,0,0|0,0,2]=4 1722 B9R0.45 O=CCCCCCCCO Amb25765567 [1,1,0,0,0,0|0,0,2]=4 1723 B9R0.45 O=C\C=C/CCCCC=O Amb27168965 [1,1,0,0,0,0|0,0,1]=3 1724 B9R0.45 OC\C=C\CCCCCBr Amb24666213 [1,1,0,0,0,0|0,0,1]=3 1725 B9R0.45 OC\C=C\CCCCCO Amb27204813 [1,1,0,0,0,0|0,0,1]=3 1726 B9R0.46 C=C(C=O)CCCCCC Amb8392631 [1,1,0,0,0,0|0,0,1]=3 1727 B9R0.46 C=C(C=O)CCCCCCl Amb27815104 [1,1,0,0,0,0|1,0,1]=4 1728 B9R0.46 C=CC(=O)CCCCCC Amb27410225 [1,1,0,0,0,0|1,0,1]=4 1729 B9R0.46 C=CC(=O)OCCCCC Amb17933944 [1,1,0,0,0,0|2,0,0]=4 1730 B9R0.46 C=C\C(C)=C/CCNCC Amb28049610 [1,1,0,0,0,0|2,0,0]=4 1731 B9R0.46 C=C\C=C\CCC(C)CBr Amb32691195 [1,1,0,0,0,0|2,0,0]=4 1732 B9R0.46 C=C\C=C\CCC(C)CCl Amb32690998 [1,1,0,0,0,0|2,0,0]=4 1733 B9R0.46 CCC(C)CCCCC=O Amb28077640 [1,1,0,0,0,0|0,0,2]=4 1734 B9R0.46 CCC(C)\C=C\C=C/C=O Amb18643327 [1,1,0,0,0,0|0,0,2]=4 1735 B9R0.46 CCC(C)\C=C\C=C\C=O Amb27754102 [1,1,0,0,0,0|0,0,2]=4 1736 B9R0.46 CCC(O)CCCNC=O Amb27785123 [1,1,0,0,0,0|1,0,1]=4 1737 B9R0.46 CCCCC=C=C(C)C=O Amb28074739 [1,1,0,0,0,0|0,0,2]=4 1738 B9R0.46 CCCCCCC(=N)NO Amb22733338 [1,1,0,0,0,0|1,0,1]=4 1739 B9R0.46 CCCCCCC(=O)C=O Amb28422342 [1,1,0,0,0,0|0,0,1]=3 1740 B9R0.46 CCCCCCC(=O)CO Amb28254622 [1,1,0,0,0,0|0,0,2]=4 1741 B9R0.46 CCCCCCC(=O)NO Amb25146254 [1,1,0,0,0,0|1,0,1]=4 1742 B9R0.46 CCCCCCC(Cl)C=O Amb26493540 [1,1,0,0,0,0|0,0,2]=4 1743 B9R0.46 CCCCCC[C@@H](Cl)C=O Amb27477830 [1,1,0,0,0,0|0,0,2]=4 1744 B9R0.46 CCCCCC\C(C)=C/Cl Amb28076526 [1,1,0,0,0,0|1,0,1]=4 1745 B9R0.46 CCCCCC\C(Cl)=C/Cl Amb28144709 [1,1,0,0,0,0|1,0,1]=4 1746 B9R0.46 CCCCCC\C(Cl)=C\Cl Amb27195843 [1,1,0,0,0,0|1,0,1]=4 1747 B9R0.46 CCCCCC\C(Cl)=N\O Amb27604397 [1,1,0,0,0,0|1,0,1]=4 1748 B9R0.46 CCCCCC\C(F)=C/Cl Amb27791805 [1,1,0,0,0,0|1,0,1]=4 1749 B9R0.46 CCCCCOC(=O)C=O Amb26624671 [1,1,0,0,0,0|1,0,0]=3 1750 B9R0.46 CCCCCOC(=O)CO Amb27839431 [1,1,0,0,0,0|1,0,1]=4 1751 B9R0.46 CCCCC\C=C(/C)C=O Amb18643629 [1,1,0,0,0,0|0,0,0]=2 1752 B9R0.46 CCCCC\C=C(/Cl)C=O Amb27838082 [1,1,0,0,0,0|0,0,0]=2 1753 B9R0.46 CCCCC\C=C(\C)C=O Amb27489308 [1,1,0,0,0,0|0,0,0]=2 1754 B9R0.46 CCCCC\C=C(\C)CN Amb27249901 [1,1,0,0,0,0|1,0,1]=4 1755 B9R0.46 CCCCC\C=C(\Cl)CCl Amb27632425 [1,1,0,0,0,0|1,0,1]=4 1756 B9R0.46 CCCCC\C=C(\F)CO Amb27406000 [1,1,0,0,0,0|0,0,1]=3 1757 B9R0.46 CCCNC\C=C(\C)CO Amb18644033 [1,1,0,0,0,0|1,0,1]=4 1758 B9R0.46 CC[C@@H](C)CCCCC=O Amb28247098 [1,1,0,0,0,0|0,0,2]=4 1759 B9R0.46 CC[C@H](C)CC\C=C\CO Amb27410556 [1,1,0,0,0,0|0,0,1]=3 1760 B9R0.46 CC[C@H](C)\C=C\C=C\C=O Amb27393613 [1,1,0,0,0,0|0,0,2]=4 1761 B9R0.46 CC\C=C/CCC(N)CC Amb27429546 [1,1,0,0,0,0|1,0,1]=4 1762 B9R0.46 COCCC\C=C(/C)C=O Amb28320361 [1,1,0,0,0,0|1,0,0]=3 1763 B9R0.46 C\C=C\C=C\CC(N)CC Amb27843463 [1,1,0,0,0,0|1,0,1]=4 1764 B9R0.46 C\C=C\CCCC(O)CC Amb27969085 [1,1,0,0,0,0|1,0,1]=4 1765 B9R0.1 CC(C#N)C\C=C\C(=O)O Amb24670837 [1,1,0,0,0,0|1,0,1]=4 1766 B9R0.1 CC(CN)CCCC(=O)O Amb27592530 [1,1,0,0,0,0|1,0,1]=4 1767 B9R0.1 CC(CO)N\C=C\C(=O)O Amb27776997 [1,1,0,0,0,0|2,0,0]=4 1768 B9R0.1 CCC(C)CC#CC(=O)O Amb24661749 [1,1,0,0,0,0|0,0,2]=4 1769 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [1,1,0,0,0,0|2,0,0]=4 1770 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [1,1,0,0,0,0|0,0,1]=3 1771 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [1,1,0,0,0,0|1,0,1]=4 1772 B9R0.1 CCC(C)CCOC(C)=O Amb24325171 [1,1,0,0,0,0|2,0,0]=4 1773 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [1,1,0,0,0,0|1,0,1]=4 1774 B9R0.1 CCC(C)OCCC(=O)O Amb27947378 [1,1,0,0,0,0|1,0,1]=4 1775 B9R0.1 CCC(Cl)CCOC(C)=O Amb27984879 [1,1,0,0,0,0|2,0,0]=4 1776 B9R0.1 CCC(N)CCNC(N)=O Amb27842050 [1,1,0,0,0,0|2,0,0]=4 1777 B9R0.1 CCC(O)CC#CC(=O)O Amb27461426 [1,1,0,0,0,0|0,0,2]=4 1778 B9R0.1 CCC(O)CCCC(=O)O Amb18644263 [1,1,0,0,0,0|0,0,1]=3 1779 B9R0.1 CCC(O)CCNC(N)=O Amb27262212 [1,1,0,0,0,0|2,0,0]=4 1780 B9R0.1 CCC(O)CSCC(=O)O Amb18792573 [1,1,0,0,0,0|1,0,1]=4 1781 B9R0.1 CCN(C)C\C=C\C(=O)O Amb19020698 [1,1,0,0,0,0|1,0,0]=3 1782 B9R0.1 CCN(C)C\C=C\C(N)=O Amb26458649 [1,1,0,0,0,0|2,0,0]=4 1783 B9R0.1 CCN(O)CCCC(=O)O Amb27630754 [1,1,0,0,0,0|1,0,1]=4 1784 B9R0.1 CCN(O)C\C=C\C(=O)O Amb27784415 [1,1,0,0,0,0|1,0,0]=3 1785 B9R0.1 CC[C@@H](O)CCC=C(C)C Amb27472423 [1,1,0,0,0,0|2,0,0]=4 1786 B9R0.1 CC[C@@H](O)CCCC(C)=O Amb27227255 [1,1,0,0,0,0|1,0,1]=4 1787 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [1,1,0,0,0,0|0,0,1]=3 1788 B9R0.1 CC[C@H](C)C\C=C/C(=O)O Amb27779551 [1,1,0,0,0,0|0,0,0]=2 1789 B9R0.1 CC[C@H](O)CCC=C(C)C Amb28050675 [1,1,0,0,0,0|2,0,0]=4 1790 B9R0.1 NC(CO)CCCC(=O)O Amb25889148 [1,1,0,0,0,0|1,0,1]=4 1791 B9R0.1 NC[C@@H](N)CCCC(=O)O Amb33756779 [1,1,0,0,0,0|1,0,1]=4 1792 B9R0.1 N[C@H](CO)CCCC(=O)O Amb27751891 [1,1,0,0,0,0|1,0,1]=4 1793 B9R0.1 O=C(O)CCCC(Cl)CCl Amb18649051 [1,1,0,0,0,0|1,0,1]=4 1794 B9R0.4 C=C(CCCC)CC(=O)O Amb18643896 [1,1,0,0,0,0|0,0,1]=3 1795 B9R0.4 C=CCC\C(C)=C/C(=O)O Amb25242614 [1,1,0,0,0,0|0,0,2]=4 1796 B9R0.4 C=CCC\C(C)=C\C(=O)O Amb18643565 [1,1,0,0,0,0|0,0,2]=4 1797 B9R0.4 CC(CCCCl)CC(=O)O Amb18646190 [1,1,0,0,0,0|1,0,1]=4 1798 B9R0.4 CC(CCCO)CC(=O)O Amb28050163 [1,1,0,0,0,0|1,0,1]=4 1799 B9R0.4 CC(CCCS)CC(=O)O Amb27443015 [1,1,0,0,0,0|1,0,1]=4 1800 B9R0.4 CCCCC(=O)C=C(C)C Amb27664643 [1,1,0,0,0,0|2,0,0]=4 1801 B9R0.4 CCCCC(=O)CC(C)=O Amb9775080 [1,1,0,0,0,0|1,0,1]=4 1802 B9R0.4 CCCCC(=O)NC(N)=O Amb28050036 [1,1,0,0,0,0|2,0,0]=4 1803 B9R0.4 CCCCC(=O)OC(C)=O Amb34916560 [1,1,0,0,0,0|2,0,0]=4 1804 B9R0.4 CCCCC(=S)NC(C)=O Amb28341039 [1,1,0,0,0,0|2,0,0]=4 1805 B9R0.4 CCCCC(C)CC(=O)O Amb6740296 [1,1,0,0,0,0|0,0,1]=3 1806 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [1,1,0,0,0,0|1,0,1]=4 1807 B9R0.4 CCCCC(C)NC(C)=O Amb27487886 [1,1,0,0,0,0|2,0,0]=4 1808 B9R0.4 CCCCC(C)OC(=O)Cl Amb32654980 [1,1,0,0,0,0|2,0,0]=4 1809 B9R0.4 CCCCC(C)OC(C)=O Amb27594424 [1,1,0,0,0,0|2,0,0]=4 1810 B9R0.4 CCCCC(C)OC(N)=O Amb28050035 [1,1,0,0,0,0|2,0,0]=4 1811 B9R0.4 CCCCC(N)C=C(C)C Amb27486513 [1,1,0,0,0,0|2,0,0]=4 1812 B9R0.4 CCCCC(N)CC(=O)O Amb1993866 [1,1,0,0,0,0|0,0,1]=3 1813 B9R0.4 CCCCC(N)CC(=O)O Amb31307613 [1,1,0,0,0,0|0,0,1]=3 1814 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [1,1,0,0,0,0|1,0,1]=4 1815 B9R0.4 CCCCC(O)C=C(Cl)Cl Amb27394754 [1,1,0,0,0,0|2,0,0]=4 1816 B9R0.4 CCCCC(O)CC(=O)O Amb22388888 [1,1,0,0,0,0|0,0,1]=3 1817 B9R0.4 CCCCC(O)CC(C)=O Amb28325992 [1,1,0,0,0,0|1,0,1]=4 1818 B9R0.4 CCCCN(C)CC(=O)O Amb5774355 [1,1,0,0,0,0|1,0,1]=4 1819 B9R0.4 CCCCS(=O)CC(=O)O Amb18792577 [1,1,0,0,0,0|1,0,1]=4 1820 B9R0.4 CCCC[C@@H](C)CC(=O)O Amb25887593 [1,1,0,0,0,0|0,0,1]=3 1821 B9R0.4 CCCC[C@@H](C)CC(C)=O Amb27589814 [1,1,0,0,0,0|1,0,1]=4 1822 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb26612752 [1,1,0,0,0,0|0,0,1]=3 1823 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb32663769 [1,1,0,0,0,0|0,0,1]=3 1824 B9R0.4 CCCC[C@@H](O)C=C(C)C Amb27650406 [1,1,0,0,0,0|2,0,0]=4 1825 B9R0.4 CCCC[C@@H](O)CC(=O)O Amb24350627 [1,1,0,0,0,0|0,0,1]=3 1826 B9R0.4 CCCC[C@H](C)CC(=O)O Amb27424971 [1,1,0,0,0,0|0,0,1]=3 1827 B9R0.4 CCCC[C@H](C)CC(C)=O Amb28253626 [1,1,0,0,0,0|1,0,1]=4 1828 B9R0.4 CCCC[C@H](C)CC(N)=O Amb28461273 [1,1,0,0,0,0|1,0,1]=4 1829 B9R0.4 CCCC[C@H](C)NC(C)=O Amb27173638 [1,1,0,0,0,0|2,0,0]=4 1830 B9R0.4 CCCC[C@H](N)CC(=O)O Amb27154618 [1,1,0,0,0,0|0,0,1]=3 1831 B9R0.4 CCCC\C(Br)=C/C(=O)O Amb27622154 [1,1,0,0,0,0|0,0,0]=2 1832 B9R0.4 CCCC\C(C)=C\B(O)O Amb27655902 [1,1,0,0,0,0|1,0,1]=4 1833 B9R0.4 CCCC\C(C)=C\C(=O)O Amb25929028 [1,1,0,0,0,0|0,0,0]=2 1834 B9R0.4 CCCC\C(C)=C\C(C)O Amb27977773 [1,1,0,0,0,0|1,0,1]=4 1835 B9R0.4 CCCC\C(C)=C\[C@H](C)O Amb27766553 [1,1,0,0,0,0|1,0,1]=4 1836 B9R0.4 CCCC\C(C)=N\C(N)=O Amb27645991 [1,1,0,0,0,0|2,0,0]=4 1837 B9R0.4 CCCC\C(N)=C\C(N)=S Amb28248133 [1,1,0,0,0,0|1,1,0]=4 1838 B9R0.4 CCCC\C(O)=C/C(C)=O Amb28184671 [1,1,0,0,0,0|1,0,0]=3 1839 B9R0.4 CCCC\C(O)=C\C(C)=O Amb27432598 [1,1,0,0,0,0|1,0,0]=3 1840 B9R0.4 CCCNC(=O)CC(=O)O Amb17399888 [1,1,0,0,0,0|1,0,1]=4 1841 B9R0.4 CCCN\C(C)=C/C(C)=O Amb27410248 [1,1,0,0,0,0|2,0,0]=4 1842 B9R0.4 CCCOC(=O)CC(=O)O Amb27254303 [1,1,0,0,0,0|1,0,1]=4 1843 B9R0.4 CCCS\C(N)=C\C(C)=O Amb27201303 [1,1,0,0,0,0|2,0,0]=4 1844 B9R0.4 CCC\C=C(\C)CC(=O)O Amb25947471 [1,1,0,0,0,0|0,0,2]=4 1845 B9R0.4 CCNCC(C)CC(=O)O Amb27602707 [1,1,0,0,0,0|1,0,1]=4 1846 B9R0.4 CCOCC(O)CC(=O)O Amb28340917 [1,1,0,0,0,0|1,0,1]=4 1847 B9R0.4 CCSCC(C)CC(=O)O Amb33324046 [1,1,0,0,0,0|1,0,1]=4 1848 B9R0.4 CCSCC(N)CC(=O)O Amb27233388 [1,1,0,0,0,0|1,0,1]=4 1849 B9R0.4 CCSCC(O)CC(=O)O Amb26062529 [1,1,0,0,0,0|1,0,1]=4 1850 B9R0.4 CCSC[C@@H](O)CC(=O)O Amb33324012 [1,1,0,0,0,0|1,0,1]=4 1851 B9R0.4 CCSC[C@H](O)CC(=O)O Amb33324011 [1,1,0,0,0,0|1,0,1]=4 1852 B9R0.4 CC\C=C\C(C)=C\C(=O)O Amb35734787 [1,1,0,0,0,0|0,0,2]=4 1853 B9R0.4 CNCC[C@@H](N)CC(=O)O Amb24117036 [1,1,0,0,0,0|1,0,1]=4 1854 B9R0.4 COCCC(C)CC(=O)O Amb27973352 [1,1,0,0,0,0|1,0,1]=4 1855 B9R0.4 COCCC(N)CC(=O)O Amb32687893 [1,1,0,0,0,0|1,0,1]=4 1856 B9R0.4 COCCC(O)CC(=O)O Amb33377806 [1,1,0,0,0,0|1,0,1]=4 1857 B9R0.4 COCC[C@@H](O)CC(=O)O Amb33377805 [1,1,0,0,0,0|1,0,1]=4 1858 B9R0.4 COCC[C@H](O)CC(=O)O Amb33377804 [1,1,0,0,0,0|1,0,1]=4 1859 B9R0.4 COCO\C(C)=C\C(=O)O Amb28203934 [1,1,0,0,0,0|2,0,0]=4 1860 B9R0.4 CONC\C(C)=C\C(=O)O Amb27758465 [1,1,0,0,0,0|2,0,0]=4 1861 B9R0.4 CSCCC(C)CC(=O)O Amb26651819 [1,1,0,0,0,0|1,0,1]=4 1862 B9R0.4 CSCCC(N)CC(=O)O Amb22353181 [1,1,0,0,0,0|1,0,1]=4 1863 B9R0.4 CSCCC(N)CC(=O)O Amb30666600 [1,1,0,0,0,0|1,0,1]=4 1864 B9R0.4 CSCCC(O)CC(=O)O Amb18798349 [1,1,0,0,0,0|1,0,1]=4 1865 B9R0.4 CSCC[C@@H](N)CC(=O)O Amb26930581 [1,1,0,0,0,0|1,0,1]=4 1866 B9R0.4 CSCC[C@@H](O)CC(=O)O Amb33198734 [1,1,0,0,0,0|1,0,1]=4 1867 B9R0.4 CSCC[C@H](N)CC(=O)O Amb16184019 [1,1,0,0,0,0|1,0,1]=4 1868 B9R0.4 CSCC[C@H](O)CC(=O)O Amb33198733 [1,1,0,0,0,0|1,0,1]=4 1869 B9R0.4 C\C(=C/C(=O)O)CCCBr Amb27801009 [1,1,0,0,0,0|1,0,0]=3 1870 B9R0.4 C\C(=C\C(=O)O)CCCCl Amb18126354 [1,1,0,0,0,0|1,0,0]=3 1871 B9R0.4 NCCCC(N)CC(=O)O Amb18644278 [1,1,0,0,0,0|1,0,1]=4 1872 B9R0.4 NCCCC(N)CC(=O)O Amb32753541 [1,1,0,0,0,0|1,0,1]=4 1873 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117039 [1,1,0,0,0,0|1,0,1]=4 1874 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117927 [1,1,0,0,0,0|1,0,1]=4 1875 B9R0.4 NCCC[C@H](N)CC(=O)O Amb25757485 [1,1,0,0,0,0|1,0,1]=4 1876 B9R0.4 NCCC[C@H](N)CC(=O)O Amb32684506 [1,1,0,0,0,0|1,0,1]=4 1877 B9R0.38 CCCCCCP(=O)(O)O Amb3371952 [1,1,0,0,0,0|1,0,1]=4 1878 B9R0.38 CCCCCCS(=O)(=O)O Amb25138206 [1,1,0,0,0,0|1,0,1]=4 1879 B9R0.38 CCCCCOP(=O)(O)O Amb22168445 [1,1,0,0,0,0|2,0,0]=4 1880 B9R0.47 C=C(CCCC#N)C(=O)O Amb27413507 [1,1,0,0,0,0|1,0,1]=4 1881 B9R0.47 C=C(CCCCC)[C@H](C)O Amb27406775 [1,1,0,0,0,0|1,0,1]=4 1882 B9R0.47 C=C(CCCNC)C(=O)O Amb28050053 [1,1,0,0,0,0|1,0,0]=3 1883 B9R0.47 C=C(CNCCN)C(=O)O Amb27875593 [1,1,0,0,0,0|2,0,0]=4 1884 B9R0.47 C=C(CSCCO)C(=O)O Amb27856969 [1,1,0,0,0,0|2,0,0]=4 1885 B9R0.47 C=C(\C=C\CCC)C(=O)O Amb33424829 [1,1,0,0,0,0|0,0,1]=3 1886 B9R0.47 CC#CCCC(=O)C(=O)O Amb27867548 [1,1,0,0,0,0|0,0,2]=4 1887 B9R0.47 CC(CCCCBr)C(=O)O Amb27790626 [1,1,0,0,0,0|1,0,1]=4 1888 B9R0.47 CC(CCCCF)C(=O)O Amb24370978 [1,1,0,0,0,0|1,0,1]=4 1889 B9R0.47 CC(CCCCN)C(=O)O Amb31031269 [1,1,0,0,0,0|1,0,1]=4 1890 B9R0.47 CC(CCCCO)C(=O)O Amb28040862 [1,1,0,0,0,0|1,0,1]=4 1891 B9R0.47 CCCC#CC(=O)C(=O)O Amb28050126 [1,1,0,0,0,0|0,0,2]=4 1892 B9R0.47 CCCCCC(=O)C(=O)Cl Amb24647840 [1,1,0,0,0,0|1,0,0]=3 1893 B9R0.47 CCCCCC(=O)C(=O)O Amb18644122 [1,1,0,0,0,0|0,0,0]=2 1894 B9R0.47 CCCCCC(Br)C(=O)O Amb18130346 [1,1,0,0,0,0|0,0,1]=3 1895 B9R0.47 CCCCCC(Br)C(C)=O Amb26057111 [1,1,0,0,0,0|1,0,1]=4 1896 B9R0.47 CCCCCC(C)=C(C)C Amb22228299 [1,1,0,0,0,0|2,0,0]=4 1897 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [1,1,0,0,0,0|1,0,1]=4 1898 B9R0.47 CCCCCC(Cl)C(=O)Cl Amb27845364 [1,1,0,0,0,0|1,0,1]=4 1899 B9R0.47 CCCCCC(F)C(=O)O Amb17593693 [1,1,0,0,0,0|0,0,1]=3 1900 B9R0.47 CCCCCC(N)C(=O)O Amb4134810 [1,1,0,0,0,0|0,0,1]=3 1901 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [1,1,0,0,0,0|1,0,1]=4 1902 B9R0.47 CCCCCC(N)[PH](=O)O Amb28421761 [1,1,0,0,0,0|1,0,1]=4 1903 B9R0.47 CCCCCC(O)C(=O)O Amb17778103 [1,1,0,0,0,0|0,0,1]=3 1904 B9R0.47 CCCCCC(O)C(C)=O Amb27658218 [1,1,0,0,0,0|1,0,1]=4 1905 B9R0.47 CCCCCC(S)C(=O)O Amb27657706 [1,1,0,0,0,0|0,0,1]=3 1906 B9R0.47 CCCCC[C@@H](Br)C(=O)O Amb27234856 [1,1,0,0,0,0|0,0,1]=3 1907 B9R0.47 CCCCC[C@@H](C)C(C)=O Amb28202105 [1,1,0,0,0,0|1,0,1]=4 1908 B9R0.47 CCCCC[C@@H](N)C(=O)O Amb22745982 [1,1,0,0,0,0|0,0,1]=3 1909 B9R0.47 CCCCC[C@@H](O)C(=O)O Amb28050131 [1,1,0,0,0,0|0,0,1]=3 1910 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [1,1,0,0,0,0|1,0,1]=4 1911 B9R0.47 CCCCC[C@H](Br)C(=O)O Amb28287684 [1,1,0,0,0,0|0,0,1]=3 1912 B9R0.47 CCCCC[C@H](C)C(=O)O Amb10844510 [1,1,0,0,0,0|0,0,1]=3 1913 B9R0.47 CCCCC[C@H](F)C(=O)O Amb27784296 [1,1,0,0,0,0|0,0,1]=3 1914 B9R0.47 CCCCC[C@H](N)C(=O)O Amb17943098 [1,1,0,0,0,0|0,0,1]=3 1915 B9R0.47 CCCCNC(=O)C(=O)O Amb9303865 [1,1,0,0,0,0|1,0,0]=3 1916 B9R0.47 CCCCNC(=O)C(C)=O Amb17399878 [1,1,0,0,0,0|2,0,0]=4 1917 B9R0.47 CCCCNC(=O)C(N)=O Amb28050037 [1,1,0,0,0,0|2,0,0]=4 1918 B9R0.47 CCCCNC(=S)C(=O)O Amb27657804 [1,1,0,0,0,0|1,0,0]=3 1919 B9R0.47 CCCCNC(C)C(=O)O Amb9326961 [1,1,0,0,0,0|1,0,1]=4 1920 B9R0.47 CCCCN[C@@H](C)C(=O)O Amb27192156 [1,1,0,0,0,0|1,0,1]=4 1921 B9R0.47 CCCCN[C@H](C)C(=O)O Amb27461559 [1,1,0,0,0,0|1,0,1]=4 1922 B9R0.47 CCCCOC(=O)C(=O)O Amb26367223 [1,1,0,0,0,0|1,0,0]=3 1923 B9R0.47 CCCCOC(C)C(=O)O Amb8894957 [1,1,0,0,0,0|1,0,1]=4 1924 B9R0.47 CCCCOC(F)C(=O)O Amb27174586 [1,1,0,0,0,0|1,0,1]=4 1925 B9R0.47 CCCCO[C@@H](C)C(=O)O Amb27216767 [1,1,0,0,0,0|1,0,1]=4 1926 B9R0.47 CCCCSC(C)C(=O)O Amb6273551 [1,1,0,0,0,0|1,0,1]=4 1927 B9R0.47 CCCCSC(F)C(=O)O Amb27850941 [1,1,0,0,0,0|1,0,1]=4 1928 B9R0.47 CCCCSC(N)C(=O)O Amb27760526 [1,1,0,0,0,0|1,0,1]=4 1929 B9R0.47 CCCCS[C@@H](C)C(=O)O Amb27408996 [1,1,0,0,0,0|1,0,1]=4 1930 B9R0.47 CCCC\C=C(/Br)C(=O)O Amb27615132 [1,1,0,0,0,0|0,0,0]=2 1931 B9R0.47 CCCC\C=C(/C)B(O)O Amb27449318 [1,1,0,0,0,0|1,0,1]=4 1932 B9R0.47 CCCC\C=C(/Cl)C(C)=O Amb27822638 [1,1,0,0,0,0|1,0,0]=3 1933 B9R0.47 CCCC\C=C(\C)C(=O)O Amb27637394 [1,1,0,0,0,0|0,0,0]=2 1934 B9R0.47 CCCC\C=C(\F)C(=O)O Amb28197633 [1,1,0,0,0,0|0,0,0]=2 1935 B9R0.47 CCCC\C=C(\N)C(N)=O Amb27473333 [1,1,0,0,0,0|1,0,0]=3 1936 B9R0.47 CCCC\N=C(/Cl)C(C)=O Amb27861098 [1,1,0,0,0,0|2,0,0]=4 1937 B9R0.47 CCCN\C=C(/O)C(C)=O Amb27259606 [1,1,0,0,0,0|2,0,0]=4 1938 B9R0.47 CCCN\C=C(\C)C(C)=O Amb25244710 [1,1,0,0,0,0|2,0,0]=4 1939 B9R0.47 CCCN\N=C(/C)C(=O)O Amb27495222 [1,1,0,0,0,0|2,0,0]=4 1940 B9R0.47 CCCOCC(=O)C(=O)O Amb27787004 [1,1,0,0,0,0|1,0,0]=3 1941 B9R0.47 CCCOCC(Br)C(=O)O Amb27625667 [1,1,0,0,0,0|1,0,1]=4 1942 B9R0.47 CCCOCC(N)C(=O)O Amb24621740 [1,1,0,0,0,0|1,0,1]=4 1943 B9R0.47 CCCOC[C@@H](N)C(=O)O Amb27480715 [1,1,0,0,0,0|1,0,1]=4 1944 B9R0.47 CCCOC[C@H](N)C(=O)O Amb27223143 [1,1,0,0,0,0|1,0,1]=4 1945 B9R0.47 CCCO\C=C(\C)C(N)=O Amb27950360 [1,1,0,0,0,0|2,0,0]=4 1946 B9R0.47 CCCSCC(N)C(=O)O Amb6265881 [1,1,0,0,0,0|1,0,1]=4 1947 B9R0.47 CCCSCC(N)C(=O)O Amb9176295 [1,1,0,0,0,0|1,0,1]=4 1948 B9R0.47 CCCSC[C@H](N)C(=O)O Amb27471340 [1,1,0,0,0,0|1,0,1]=4 1949 B9R0.47 CCC\C=C\C(=O)C(C)=O Amb25255453 [1,1,0,0,0,0|1,0,1]=4 1950 B9R0.47 CCC\C=C\C(C)C(=O)O Amb33449140 [1,1,0,0,0,0|0,0,2]=4 1951 B9R0.47 CCC\C=C\C(O)C(=O)O Amb32668856 [1,1,0,0,0,0|0,0,2]=4 1952 B9R0.47 CCC\C=C\[C@@H](N)C(=O)O Amb27230868 [1,1,0,0,0,0|0,0,2]=4 1953 B9R0.47 CCNCCC(C)C(=O)O Amb27473572 [1,1,0,0,0,0|1,0,1]=4 1954 B9R0.47 CCNCCC(N)C(=O)O Amb932772 [1,1,0,0,0,0|1,0,1]=4 1955 B9R0.47 CCNCC[C@@H](N)C(=O)O Amb28520031 [1,1,0,0,0,0|1,0,1]=4 1956 B9R0.47 CCNC\C=C(\C)C(=O)O Amb27630213 [1,1,0,0,0,0|1,0,0]=3 1957 B9R0.47 CCOCCC(=O)C(=O)Cl Amb24649864 [1,1,0,0,0,0|2,0,0]=4 1958 B9R0.47 CCOCCC(N)C(=O)O Amb32671298 [1,1,0,0,0,0|1,0,1]=4 1959 B9R0.47 CCOCCC(N)C(=O)O Amb9316664 [1,1,0,0,0,0|1,0,1]=4 1960 B9R0.47 CCOCC[C@@H](N)C(=O)O Amb28187742 [1,1,0,0,0,0|1,0,1]=4 1961 B9R0.47 CCOCC[C@H](N)C(=O)O Amb26612670 [1,1,0,0,0,0|1,0,1]=4 1962 B9R0.47 CCOC\C=C(\C)C(=O)O Amb27877295 [1,1,0,0,0,0|1,0,0]=3 1963 B9R0.47 CCSCCC(=O)C(=O)O Amb26652044 [1,1,0,0,0,0|1,0,0]=3 1964 B9R0.47 CCSCCC(C)C(=O)O Amb10844082 [1,1,0,0,0,0|1,0,1]=4 1965 B9R0.47 CCSCCC(N)C(=O)O Amb2137050 [1,1,0,0,0,0|1,0,1]=4 1966 B9R0.47 CCSCCC(O)C(=O)O Amb24482157 [1,1,0,0,0,0|1,0,1]=4 1967 B9R0.47 CCSCC[C@@H](N)C(=O)O Amb17613843 [1,1,0,0,0,0|1,0,1]=4 1968 B9R0.47 CCSCC[C@H](N)C(=O)O Amb17613844 [1,1,0,0,0,0|1,0,1]=4 1969 B9R0.47 CC\C=C\C=C(/C)C(=O)O Amb27191513 [1,1,0,0,0,0|0,0,2]=4 1970 B9R0.47 CC\C=C\CC(=O)C(=O)O Amb33268699 [1,1,0,0,0,0|0,0,2]=4 1971 B9R0.47 CNCCCC(N)C(=O)O Amb18644279 [1,1,0,0,0,0|1,0,1]=4 1972 B9R0.47 CNCCNC(=O)C(=O)O Amb18644254 [1,1,0,0,0,0|2,0,0]=4 1973 B9R0.47 COCCCC(=O)C(=O)O Amb28050154 [1,1,0,0,0,0|1,0,0]=3 1974 B9R0.47 COCCCC(C)C(=O)O Amb26653888 [1,1,0,0,0,0|1,0,1]=4 1975 B9R0.47 COCCCC(N)C(=O)O Amb22058809 [1,1,0,0,0,0|1,0,1]=4 1976 B9R0.47 COCCCC(N)C(=O)O Amb33549526 [1,1,0,0,0,0|1,0,1]=4 1977 B9R0.47 COCCCC(O)C(=O)O Amb28050541 [1,1,0,0,0,0|1,0,1]=4 1978 B9R0.47 COCCC[C@@H](N)C(=O)O Amb25081508 [1,1,0,0,0,0|1,0,1]=4 1979 B9R0.47 COCCC[C@H](N)C(=O)O Amb25378737 [1,1,0,0,0,0|1,0,1]=4 1980 B9R0.47 COCCNC(=O)C(=O)O Amb9303795 [1,1,0,0,0,0|2,0,0]=4 1981 B9R0.47 CONC\C=C(\C)C(=O)O Amb27403129 [1,1,0,0,0,0|2,0,0]=4 1982 B9R0.47 CSCCCC(=O)C(=O)O Amb27490899 [1,1,0,0,0,0|1,0,0]=3 1983 B9R0.47 CSCCCC(C)C(=O)O Amb25888073 [1,1,0,0,0,0|1,0,1]=4 1984 B9R0.47 CSCCCC(N)C(=O)O Amb17594057 [1,1,0,0,0,0|1,0,1]=4 1985 B9R0.47 CSCCCC(N)C(=O)O Amb35789017 [1,1,0,0,0,0|1,0,1]=4 1986 B9R0.47 CSCCCC(O)C(=O)O Amb25169340 [1,1,0,0,0,0|1,0,1]=4 1987 B9R0.47 CSCCC[C@@H](N)C(=O)O Amb27233529 [1,1,0,0,0,0|1,0,1]=4 1988 B9R0.47 CSCCC[C@H](N)C(=O)O Amb27858783 [1,1,0,0,0,0|1,0,1]=4 1989 B9R0.47 CSCCNC(=O)C(=O)O Amb27402874 [1,1,0,0,0,0|2,0,0]=4 1990 B9R0.47 CSCC\C=C(\C)C(=O)O Amb27449576 [1,1,0,0,0,0|1,0,0]=3 1991 B9R0.47 C[C@@H](CCCCBr)C(=O)O Amb27794794 [1,1,0,0,0,0|1,0,1]=4 1992 B9R0.47 C\C(=C/CCC#N)C(=O)O Amb27784613 [1,1,0,0,0,0|1,0,1]=4 1993 B9R0.47 C\C(=C/CCCCl)C(=O)O Amb27203326 [1,1,0,0,0,0|1,0,0]=3 1994 B9R0.47 NC(CCCCF)C(=O)O Amb28193271 [1,1,0,0,0,0|1,0,1]=4 1995 B9R0.47 NC(CCCCO)C(=O)O Amb2699159 [1,1,0,0,0,0|1,0,1]=4 1996 B9R0.47 NCCCCC(=O)C(=O)O Amb33756866 [1,1,0,0,0,0|1,0,0]=3 1997 B9R0.47 NCCCCC(N)C(=O)O Amb22349470 [1,1,0,0,0,0|1,0,1]=4 1998 B9R0.47 NCCCCC(N)C(=O)O Amb22489521 [1,1,0,0,0,0|1,0,1]=4 1999 B9R0.47 NCCCCC(N)C(=O)O Amb3940540 [1,1,0,0,0,0|1,0,1]=4 2000 B9R0.47 NCCCCC(N)C(=O)O Amb8516470 [1,1,0,0,0,0|1,0,1]=4 2001 B9R0.47 NCCCCC(N)C(=O)O Amb8516682 [1,1,0,0,0,0|1,0,1]=4 2002 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb22750565 [1,1,0,0,0,0|1,0,1]=4 2003 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb2720180 [1,1,0,0,0,0|1,0,1]=4 2004 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb30621835 [1,1,0,0,0,0|1,0,1]=4 2005 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb3940874 [1,1,0,0,0,0|1,0,1]=4 2006 B9R0.47 NCCCC[C@H](N)C(=O)O Amb2720055 [1,1,0,0,0,0|1,0,1]=4 2007 B9R0.47 NCCCC[C@H](N)C(=O)O Amb3940762 [1,1,0,0,0,0|1,0,1]=4 2008 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8395455 [1,1,0,0,0,0|1,0,1]=4 2009 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8513720 [1,1,0,0,0,0|1,0,1]=4 2010 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628529 [1,1,0,0,0,0|1,0,1]=4 2011 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628598 [1,1,0,0,0,0|1,0,1]=4 2012 B9R0.47 NCCSCC(=O)C(=O)O Amb33069793 [1,1,0,0,0,0|2,0,0]=4 2013 B9R0.47 N[C@@H](CCCCBr)C(=O)O Amb28208462 [1,1,0,0,0,0|1,0,1]=4 2014 B9R0.47 N[C@@H](CCCCCl)C(=O)O Amb27267870 [1,1,0,0,0,0|1,0,1]=4 2015 B9R0.47 N[C@@H](CCCCF)C(=O)O Amb27945388 [1,1,0,0,0,0|1,0,1]=4 2016 B9R0.47 N[C@@H](CCCCO)C(=O)O Amb2695139 [1,1,0,0,0,0|1,0,1]=4 2017 B9R0.47 N[C@@H](CCCCS)C(=O)O Amb25729289 [1,1,0,0,0,0|1,0,1]=4 2018 B9R0.47 N[C@H](CCCCF)C(=O)O Amb26370180 [1,1,0,0,0,0|1,0,1]=4 2019 B9R0.47 N[C@H](CCCCO)C(=O)O Amb26969244 [1,1,0,0,0,0|1,0,1]=4 2020 B9R0.47 O=C(O)C(=O)CCCCBr Amb27654991 [1,1,0,0,0,0|1,0,0]=3 2021 B9R0.47 O=C(O)C(=O)CCCCO Amb27626027 [1,1,0,0,0,0|1,0,0]=3 2022 B9R0.47 O=C(O)C(=O)CSCCBr Amb33069761 [1,1,0,0,0,0|2,0,0]=4 2023 B9R0.47 O=C(O)C(=O)CSCCCl Amb33069754 [1,1,0,0,0,0|2,0,0]=4 2024 B9R0.47 O=C(O)C(=O)CSCCO Amb33069731 [1,1,0,0,0,0|2,0,0]=4 2025 B9R0.47 O=C(O)C(=O)CSCCS Amb33069996 [1,1,0,0,0,0|2,0,0]=4 2026 B9R0.47 O=C(O)C(O)CCCCO Amb18644356 [1,1,0,0,0,0|1,0,1]=4 2027 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [1,1,0,0,0,0|0,0,2]=4 2028 B9R0.48 C=CCC(O)\C=C\C(=O)O Amb27620632 [1,1,0,0,0,0|0,0,2]=4 2029 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [1,1,0,0,0,0|1,0,1]=4 2030 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [1,1,0,0,0,0|1,0,1]=4 2031 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [1,1,0,0,0,0|1,0,1]=4 2032 B9R0.48 CC(\C=C\C(=O)O)CCO Amb27646330 [1,1,0,0,0,0|1,0,0]=3 2033 B9R0.48 CCCC(Br)CNC(C)=O Amb28146730 [1,1,0,0,0,0|2,0,0]=4 2034 B9R0.48 CCCC(Br)\C=C\C(C)=O Amb27463361 [1,1,0,0,0,0|1,0,0]=3 2035 B9R0.48 CCCC(C)C#CC(=O)O Amb27981033 [1,1,0,0,0,0|0,0,2]=4 2036 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [1,1,0,0,0,0|0,0,1]=3 2037 B9R0.48 CCCC(C)CCC(C)=O Amb10807385 [1,1,0,0,0,0|1,0,1]=4 2038 B9R0.48 CCCC(C)COC(C)=O Amb22735194 [1,1,0,0,0,0|2,0,0]=4 2039 B9R0.48 CCCC(C)OCC(=O)O Amb18124782 [1,1,0,0,0,0|1,0,1]=4 2040 B9R0.48 CCCC(C)\C=C\C(=O)O Amb33474963 [1,1,0,0,0,0|0,0,0]=2 2041 B9R0.48 CCCC(C)\C=C\C(C)=O Amb24686480 [1,1,0,0,0,0|1,0,0]=3 2042 B9R0.48 CCCC(C)\C=C\C(C)O Amb27262557 [1,1,0,0,0,0|1,0,1]=4 2043 B9R0.48 CCCC(C)\C=C\[N+](=O)[O-] Amb27472221 [1,1,0,0,0,0|1,0,1]=4 2044 B9R0.48 CCCC(Cl)CCC(=O)Cl Amb27831367 [1,1,0,0,0,0|1,0,1]=4 2045 B9R0.48 CCCC(N)C#CC(=O)O Amb33168957 [1,1,0,0,0,0|0,0,2]=4 2046 B9R0.48 CCCC(N)CCC(=O)O Amb1014101 [1,1,0,0,0,0|0,0,1]=3 2047 B9R0.48 CCCC(O)CCC(=O)O Amb17689110 [1,1,0,0,0,0|0,0,1]=3 2048 B9R0.48 CCCC(O)CCC(=O)[O-] Amb17778117 [1,1,0,0,0,0|0,0,2]=4 2049 B9R0.48 CCCC(O)CCC(=O)[O-] Amb2386295 [1,1,0,0,0,0|0,0,2]=4 2050 B9R0.48 CCCC(O)COC(C)=O Amb27945320 [1,1,0,0,0,0|2,0,0]=4 2051 B9R0.48 CCCC(O)\C=C\C(=O)O Amb27790698 [1,1,0,0,0,0|0,0,0]=2 2052 B9R0.48 CCCN(C)CCC(=O)O Amb33546079 [1,1,0,0,0,0|1,0,1]=4 2053 B9R0.48 CCCN(C)CCC(=O)O Amb8899165 [1,1,0,0,0,0|1,0,1]=4 2054 B9R0.48 CCCN(O)CCC(=O)O Amb27196070 [1,1,0,0,0,0|1,0,1]=4 2055 B9R0.48 CCCS(=O)CCC(=O)O Amb18792575 [1,1,0,0,0,0|1,0,1]=4 2056 B9R0.48 CCC[C@@H](O)CCC(=O)O Amb28050107 [1,1,0,0,0,0|0,0,1]=3 2057 B9R0.48 CCC[C@@H](O)\C=C\C(=O)O Amb27961045 [1,1,0,0,0,0|0,0,0]=2 2058 B9R0.48 CCC[C@@H](O)\C=C\S(C)=O Amb27833711 [1,1,0,0,0,0|2,0,0]=4 2059 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [1,1,0,0,0,0|0,0,1]=3 2060 B9R0.48 CCC[C@H](O)CCC(=O)O Amb27618330 [1,1,0,0,0,0|0,0,1]=3 2061 B9R0.48 CCC[C@H](O)CCC(N)=O Amb27765010 [1,1,0,0,0,0|1,0,1]=4 2062 B9R0.48 CCNC(=O)\C=C/C(=O)O Amb1235096 [1,1,0,0,0,0|1,0,1]=4 2063 B9R0.48 CCNC(=O)\C=C\C(=O)O Amb9251696 [1,1,0,0,0,0|1,0,1]=4 2064 B9R0.48 CCOC(=O)\C=C/C(=O)O Amb24462678 [1,1,0,0,0,0|1,0,1]=4 2065 B9R0.48 CCOC(=O)\C=C\C(=O)O Amb2189151 [1,1,0,0,0,0|1,0,1]=4 2066 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [1,1,0,0,0,0|1,0,1]=4 2067 B9R0.48 CCOC(C)\C=C\C(=O)O Amb33425399 [1,1,0,0,0,0|1,0,0]=3 2068 B9R0.48 CCOC(C)\C=C\C(C)=O Amb33424994 [1,1,0,0,0,0|2,0,0]=4 2069 B9R0.48 COCC(Cl)CCC(=O)O Amb27456486 [1,1,0,0,0,0|1,0,1]=4 2070 B9R0.48 COCC(N)CCC(=O)O Amb33036364 [1,1,0,0,0,0|1,0,1]=4 2071 B9R0.48 COCC(O)CCC(=O)O Amb33036250 [1,1,0,0,0,0|1,0,1]=4 2072 B9R0.48 CSCC(N)CCC(=O)O Amb33272065 [1,1,0,0,0,0|1,0,1]=4 2073 B9R0.48 CSCC(O)CCC(=O)O Amb27490998 [1,1,0,0,0,0|1,0,1]=4 2074 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [1,1,0,0,0,0|1,0,1]=4 2075 B9R0.48 C[C@H](\C=C\C(=O)O)CCO Amb28050109 [1,1,0,0,0,0|1,0,0]=3 2076 B9R0.48 C\C=C\C(C)\C=C/C(=O)O Amb27468642 [1,1,0,0,0,0|0,0,2]=4 2077 B9R0.48 NC(CCF)CCC(=O)O Amb33480872 [1,1,0,0,0,0|1,0,1]=4 2078 B9R0.48 NCCC(N)CCC(=O)O Amb27390542 [1,1,0,0,0,0|1,0,1]=4 2079 B9R0.48 N[C@H](CCS)CCC(=O)O Amb27857300 [1,1,0,0,0,0|1,0,1]=4 2080 B9R0.48 O=C(O)CCC(O)CCO Amb28121295 [1,1,0,0,0,0|1,0,1]=4 2081 B9R0.55 C=C(C)CC\C=C\C(=O)O Amb27253611 [1,1,0,0,0,0|0,0,1]=3 2082 B9R0.55 C=C(C)CO\C=C\C(=O)O Amb18643826 [1,1,0,0,0,0|1,0,1]=4 2083 B9R0.55 CC(=O)CCCCC(=O)O Amb3939946 [1,1,0,0,0,0|0,0,2]=4 2084 B9R0.55 CC(=O)CCCCC(C)O Amb27838002 [1,1,0,0,0,0|1,0,1]=4 2085 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [1,1,0,0,0,0|0,0,1]=3 2086 B9R0.55 CC(=O)NCCCC(C)O Amb28076577 [1,1,0,0,0,0|2,0,0]=4 2087 B9R0.55 CC(=O)NC\C=C\C(=O)O Amb27259093 [1,1,0,0,0,0|1,0,1]=4 2088 B9R0.55 CC(=O)OCCCC(C)Br Amb27643403 [1,1,0,0,0,0|2,0,0]=4 2089 B9R0.55 CC(=O)OCCCC(C)Cl Amb27645429 [1,1,0,0,0,0|2,0,0]=4 2090 B9R0.55 CC(=O)OCCC[C@@H](C)O Amb27775430 [1,1,0,0,0,0|2,0,0]=4 2091 B9R0.55 CC(=O)OC\C=C\C(=O)O Amb24454652 [1,1,0,0,0,0|1,0,1]=4 2092 B9R0.55 CC(=O)\C=C/NCC(C)C Amb26887251 [1,1,0,0,0,0|2,0,0]=4 2093 B9R0.55 CC(=O)\C=C\CCC(C)C Amb25111718 [1,1,0,0,0,0|1,0,0]=3 2094 B9R0.55 CC(=O)\C=C\CCN(C)C Amb33271941 [1,1,0,0,0,0|2,0,0]=4 2095 B9R0.55 CC(=O)\C=C\COC(C)C Amb33274083 [1,1,0,0,0,0|2,0,0]=4 2096 B9R0.55 CC(=O)\C=C\NCC(C)C Amb25961808 [1,1,0,0,0,0|2,0,0]=4 2097 B9R0.55 CC(Br)COCCC(=O)O Amb28255646 [1,1,0,0,0,0|1,0,1]=4 2098 B9R0.55 CC(C)C#C\C=C/C(=O)O Amb27392234 [1,1,0,0,0,0|0,0,2]=4 2099 B9R0.55 CC(C)CCC#CC(=O)O Amb27494024 [1,1,0,0,0,0|0,0,2]=4 2100 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [1,1,0,0,0,0|1,0,1]=4 2101 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [1,1,0,0,0,0|0,0,1]=3 2102 B9R0.55 CC(C)CCCCC(N)=O Amb2613088 [1,1,0,0,0,0|1,0,1]=4 2103 B9R0.55 CC(C)CCCOC(=O)Cl Amb25885760 [1,1,0,0,0,0|2,0,0]=4 2104 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [1,1,0,0,0,0|1,0,1]=4 2105 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [1,1,0,0,0,0|1,0,1]=4 2106 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [1,1,0,0,0,0|1,0,1]=4 2107 B9R0.55 CC(C)CC\C=C\B(O)O Amb22168996 [1,1,0,0,0,0|1,0,1]=4 2108 B9R0.55 CC(C)CC\C=C\C(=O)O Amb17593603 [1,1,0,0,0,0|0,0,0]=2 2109 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [1,1,0,0,0,0|1,0,1]=4 2110 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [1,1,0,0,0,0|1,0,1]=4 2111 B9R0.55 CC(C)COCCC(=O)O Amb6280020 [1,1,0,0,0,0|1,0,1]=4 2112 B9R0.55 CC(C)CSCCC(=O)O Amb6278798 [1,1,0,0,0,0|1,0,1]=4 2113 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [1,1,0,0,0,0|1,0,1]=4 2114 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [1,1,0,0,0,0|1,0,1]=4 2115 B9R0.55 CC(C)NC\C=C\C(=O)O Amb27601688 [1,1,0,0,0,0|1,0,0]=3 2116 B9R0.55 CC(C)OCCCC(=O)O Amb6274334 [1,1,0,0,0,0|1,0,1]=4 2117 B9R0.55 CC(C)OC\C=C\C(=O)O Amb33475206 [1,1,0,0,0,0|1,0,0]=3 2118 B9R0.55 CC(C)SCCCC(=O)O Amb17503621 [1,1,0,0,0,0|1,0,1]=4 2119 B9R0.55 CC(C)SC\C=C\C(=O)O Amb19020662 [1,1,0,0,0,0|1,0,0]=3 2120 B9R0.55 CC(C)\C=C\C=C\C(=O)O Amb25367977 [1,1,0,0,0,0|0,0,2]=4 2121 B9R0.55 CC(F)CCOCC(=O)O Amb27613091 [1,1,0,0,0,0|1,0,1]=4 2122 B9R0.55 CC(F)CCSCC(=O)O Amb27777659 [1,1,0,0,0,0|1,0,1]=4 2123 B9R0.55 CC(N)CCC#CC(=O)O Amb33169012 [1,1,0,0,0,0|0,0,2]=4 2124 B9R0.55 CC(N)CCCCC(=O)O Amb18644199 [1,1,0,0,0,0|0,0,1]=3 2125 B9R0.55 CC(N)CCCCC(=O)O Amb19515386 [1,1,0,0,0,0|0,0,1]=3 2126 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [1,1,0,0,0,0|1,0,1]=4 2127 B9R0.55 CC(N)CCSCC(=O)O Amb27436369 [1,1,0,0,0,0|1,0,1]=4 2128 B9R0.55 CC(N)CS\C=C\C(=O)O Amb27772740 [1,1,0,0,0,0|1,0,0]=3 2129 B9R0.55 CC(O)C#C\C=C\C(=O)O Amb27961415 [1,1,0,0,0,0|0,0,2]=4 2130 B9R0.55 CC(O)CC\C=C\B(O)O Amb27234901 [1,1,0,0,0,0|1,0,1]=4 2131 B9R0.55 CC(O)CSCCC(=O)O Amb18792572 [1,1,0,0,0,0|1,0,1]=4 2132 B9R0.55 CN(C)CCCCC(=O)O Amb19275569 [1,1,0,0,0,0|1,0,1]=4 2133 B9R0.55 CN(C)CCCCC(=O)O Amb7783201 [1,1,0,0,0,0|1,0,1]=4 2134 B9R0.55 CN(C)CC\C=C/C(=O)O Amb27815066 [1,1,0,0,0,0|1,0,0]=3 2135 B9R0.55 CN(C)CC\C=C\C(=O)O Amb32954654 [1,1,0,0,0,0|1,0,0]=3 2136 B9R0.55 CS(=O)CCCCC(=O)O Amb18788305 [1,1,0,0,0,0|1,0,1]=4 2137 B9R0.55 CS(=O)NC\C=C\C(=O)O Amb28195221 [1,1,0,0,0,0|2,0,0]=4 2138 B9R0.55 C[C@@H](N)CCCCC(=O)O Amb25877255 [1,1,0,0,0,0|0,0,1]=3 2139 B9R0.55 O=C(O)CCCCC(O)O Amb28143854 [1,1,0,0,0,0|1,0,1]=4 2140 B9R0.55 O=C(O)\C=C\CCC(=O)O Amb20622952 [1,1,0,0,0,0|1,0,1]=4 2141 B11R0.1 CCCC(=O)N\C(C)=C\C(=O)O Amb28051882 [0,2,0,0,0,0|1,0,1]=4 2142 B11R0.1 CCCC(N)CC(C)CC(=O)O Amb32669799 [0,2,0,0,0,0|0,0,2]=4 2143 B11R0.6 CC(C)=CCC\C(C)=C/C(=O)O Amb30666639 [0,2,0,0,0,0|0,0,2]=4 2144 B11R0.6 CC(C)CCCC(C)CC(=O)O Amb32412878 [0,2,0,0,0,0|0,0,2]=4 2145 B11R0.59 CCCC(C)C(N)CCC(=O)O Amb33324100 [0,2,0,0,0,0|0,0,2]=4 2146 B11R0.141 CCCC(C)CCC(C)C(=O)O Amb33079033 [0,2,0,0,0,0|0,0,2]=4 2147 B11R0.147 CCCCC(=O)CCCC(=O)O Amb6305231 [0,2,0,0,0,0|0,0,2]=4 2148 B11R0.2 CCCCCCC(C)CC(=O)O Amb4001745 [0,2,0,0,0,0|0,0,2]=4 2149 B11R0.2 CCCCCCC(N)CC(=O)O Amb2229636 [0,2,0,0,0,0|0,0,2]=4 2150 B11R0.2 CCCCCCC(N)CC(=O)O Amb31307615 [0,2,0,0,0,0|0,0,2]=4 2151 B11R0.2 CCCCCCC(O)CC(=O)O Amb18803982 [0,2,0,0,0,0|0,0,2]=4 2152 B11R0.2 CCCCCCN(C)CC(=O)O Amb33552686 [0,2,0,0,0,0|0,0,2]=4 2153 B11R0.2 CCCCCOC(=O)CC(C)=O Amb22734938 [0,2,0,0,0,0|1,0,1]=4 2154 B11R0.2 COCCOC\C(C)=C\C(=O)O Amb32664148 [0,2,0,0,0,0|1,0,0]=3 2155 B11R0.30 CC(=O)CCCCCCC(=O)O Amb28653044 [0,2,0,0,0,0|0,0,2]=4 2156 B11R0.30 CC(C)CCNCCCC(=O)O Amb24271192 [0,2,0,0,0,0|0,0,2]=4 2157 B11R0.30 CC(C)CCNCCCC(=O)O Amb9208916 [0,2,0,0,0,0|0,0,2]=4 2158 B11R0.30 CC(C)COCCCCC(=O)O Amb9207793 [0,2,0,0,0,0|0,0,2]=4 2159 B11R0.40 CCCCCCC#CC(=O)OC Amb2725482 [0,2,0,0,0,0|0,0,2]=4 2160 B11R0.40 CCCCCCCCC(=O)OC Amb8517582 [0,2,0,0,0,0|0,0,2]=4 2161 B11R0.40 CCCCCC\C=C\C(=O)OC Amb33513079 [0,2,0,0,0,0|0,0,0]=2 2162 B11R0.40 COC(=O)CCCCCCCBr Amb24063235 [0,2,0,0,0,0|0,0,2]=4 2163 B11R0.40 COC(=O)CCCCCCCN Amb20669115 [0,2,0,0,0,0|0,0,2]=4 2164 B11R0.40 COC(=O)CCCCCCCN Amb24331924 [0,2,0,0,0,0|0,0,2]=4 2165 B11R0.40 COC(=O)NCCCCCCO Amb24095886 [0,2,0,0,0,0|1,0,1]=4 2166 B11R0.42 CCCCC#C\C=C(\C)C(=O)O Amb27484014 [0,2,0,0,0,0|0,0,1]=3 2167 B11R0.42 CCCCCCCC(=O)C(=O)O Amb22904309 [0,2,0,0,0,0|0,0,1]=3 2168 B11R0.42 CCCCCCCC(N)C(=O)O Amb2229635 [0,2,0,0,0,0|0,0,2]=4 2169 B11R0.42 CCCCCCC[C@@H](N)C(=O)O Amb22747720 [0,2,0,0,0,0|0,0,2]=4 2170 B11R0.42 CCCCCCC[C@H](N)C(=O)O Amb33308889 [0,2,0,0,0,0|0,0,2]=4 2171 B11R0.42 CCCCCCOC(C)C(=O)O Amb7790036 [0,2,0,0,0,0|0,0,2]=4 2172 B11R0.42 CCCCCC\C=C(/C)C(C)O Amb22546750 [0,2,0,0,0,0|1,0,1]=4 2173 B11R0.42 CCCCOCCC(N)C(=O)O Amb18795636 [0,2,0,0,0,0|0,0,2]=4 2174 B11R0.42 CCCCOCC[C@@H](N)C(=O)O Amb33065700 [0,2,0,0,0,0|0,0,2]=4 2175 B11R0.42 CCCCOCC[C@H](N)C(=O)O Amb32789517 [0,2,0,0,0,0|0,0,2]=4 2176 B11R0.42 CCNCCSCC(=O)C(=O)O Amb33069823 [0,2,0,0,0,0|1,0,1]=4 2177 B11R0.42 CNCCCSCC(=O)C(=O)O Amb33069830 [0,2,0,0,0,0|1,0,1]=4 2178 B11R0.42 NC(CCCCCCO)C(=O)O Amb32937041 [0,2,0,0,0,0|0,0,2]=4 2179 B11R0.42 NCCCCSCC(=O)C(=O)O Amb33069798 [0,2,0,0,0,0|1,0,1]=4 2180 B11R0.42 N[C@@H](CCCCCCO)C(=O)O Amb33033601 [0,2,0,0,0,0|0,0,2]=4 2181 B11R0.42 N[C@H](CCCCCCO)C(=O)O Amb33069952 [0,2,0,0,0,0|0,0,2]=4 2182 B11R0.42 O=C(O)C(=O)CSCCCCBr Amb33069755 [0,2,0,0,0,0|1,0,1]=4 2183 B11R0.42 O=C(O)C(=O)CSCCCCCl Amb33069747 [0,2,0,0,0,0|1,0,1]=4 2184 B11R0.42 O=C(O)C(=O)CSCCCCO Amb33069725 [0,2,0,0,0,0|1,0,1]=4 2185 B11R0.42 O=C(O)C(=O)CSCCCCS Amb33069995 [0,2,0,0,0,0|1,0,1]=4 2186 B11R0.46 C=CCCCN(C)\C=C\C(=O)O Amb33033541 [0,2,0,0,0,0|0,0,2]=4 2187 B11R0.46 CCCCCC(=O)CCC(=O)O Amb4330519 [0,2,0,0,0,0|0,0,1]=3 2188 B11R0.46 CCCCCC(=O)NCC(=O)O Amb4306505 [0,2,0,0,0,0|0,0,1]=3 2189 B11R0.46 CCCCCC(C)CCC(=O)O Amb10807482 [0,2,0,0,0,0|0,0,2]=4 2190 B11R0.46 CCCCCN(C)CCC(=O)O Amb8392952 [0,2,0,0,0,0|0,0,2]=4 2191 B11R0.46 CCCCCN(C)CCC(=O)O Amb8925855 [0,2,0,0,0,0|0,0,2]=4 2192 B11R0.46 CCCCNC(=O)CCC(=O)O Amb1785994 [0,2,0,0,0,0|1,0,1]=4 2193 B11R0.46 CCCCNC(=O)\C=C\C(=O)O Amb1234975 [0,2,0,0,0,0|0,0,1]=3 2194 B11R0.46 CCCCOC(=O)CCC(=O)O Amb19888684 [0,2,0,0,0,0|1,0,1]=4 2195 B11R0.46 CCCCOC(=O)\C=C\C(=O)O Amb6891964 [0,2,0,0,0,0|0,0,1]=3 2196 B11R0.46 COCCNC(=O)\C=C/C(=O)O Amb2580803 [0,2,0,0,0,0|1,0,1]=4 2197 B11R0.111 CCC(=O)CCCCCC(=O)O Amb6305228 [0,2,0,0,0,0|0,0,2]=4 2198 B11R0.111 O=C(O)CCCCCC(F)CBr Amb22547633 [0,2,0,0,0,0|0,0,2]=4 2199 B11R0.148 C#CCCCCCCCC(=O)O Amb22388895 [0,2,0,0,0,0|0,0,2]=4 2200 B11R0.148 C#CCCCCC\C=C\C(=O)O Amb2609438 [0,2,0,0,0,0|0,0,0]=2 2201 B11R0.148 C=CCCCCCCCC(=O)O Amb2686677 [0,2,0,0,0,0|0,0,2]=4 2202 B11R0.148 CCCC#CC#C\C=C\C(=O)O Amb26925970 [0,2,0,0,0,0|0,0,2]=4 2203 B11R0.148 CCCC#CCCC#CC(=O)O Amb28127282 [0,2,0,0,0,0|0,0,2]=4 2204 B11R0.148 CCCCCCCCCC(=O)O Amb5718031 [0,2,0,0,0,0|0,0,2]=4 2205 B11R0.148 CCCCCCCNCC(=O)O Amb19373457 [0,2,0,0,0,0|0,0,2]=4 2206 B11R0.148 CCCCCCCNCC(=O)O Amb8827566 [0,2,0,0,0,0|0,0,2]=4 2207 B11R0.148 CCCCCCC\C=C\B(O)O Amb33513070 [0,2,0,0,0,0|1,0,1]=4 2208 B11R0.148 CCCCCCC\C=C\C(=O)O Amb6336657 [0,2,0,0,0,0|0,0,0]=2 2209 B11R0.148 CCCCCCNCCC(=O)O Amb8830823 [0,2,0,0,0,0|0,0,2]=4 2210 B11R0.148 CCCCCC\C=C/C=C(C)C Amb22546455 [0,2,0,0,0,0|2,0,0]=4 2211 B11R0.148 CCCCC\C=C\CCC(=O)O Amb24079160 [0,2,0,0,0,0|0,0,0]=2 2212 B11R0.148 CCCCC\C=C\COC(C)=O Amb30988128 [0,2,0,0,0,0|1,0,0]=3 2213 B11R0.148 CCCCOCCOCC(=O)O Amb9204477 [0,2,0,0,0,0|0,0,2]=4 2214 B11R0.148 CCCCSCCCCC(=O)O Amb1032990 [0,2,0,0,0,0|0,0,2]=4 2215 B11R0.148 CCC\C=C\CCCCC(=O)O Amb24063196 [0,2,0,0,0,0|0,0,2]=4 2216 B11R0.148 CCNCCOCCCC(=O)O Amb18110845 [0,2,0,0,0,0|0,0,2]=4 2217 B11R0.148 CCOCCOCCCC(=O)O Amb6262117 [0,2,0,0,0,0|0,0,2]=4 2218 B11R0.148 CNCCCNCCCC(=O)O Amb28963363 [0,2,0,0,0,0|0,0,2]=4 2219 B11R0.148 CNCCCNCCCC(=O)O Amb33470189 [0,2,0,0,0,0|0,0,2]=4 2220 B11R0.148 COCCOCCC#CC(=O)O Amb33168990 [0,2,0,0,0,0|0,0,2]=4 2221 B11R0.148 COCCOCCCCC(=O)O Amb9207792 [0,2,0,0,0,0|0,0,2]=4 2222 B11R0.148 COCCOCCOCC(=O)O Amb3940728 [0,2,0,0,0,0|1,0,1]=4 2223 B11R0.148 NCCCCSCCCC(=O)O Amb17500972 [0,2,0,0,0,0|0,0,2]=4 2224 B11R0.148 O=C(O)CCCCCCCCBr Amb8631538 [0,2,0,0,0,0|0,0,2]=4 2225 B11R0.148 O=C(O)CCCCCCCCO Amb3372037 [0,2,0,0,0,0|0,0,2]=4 2226 B11R0.176 CCCC(=O)CCCCC(=O)O Amb6305241 [0,2,0,0,0,0|0,0,2]=4 2227 B11R0.176 O=C(O)CCCC[C@@H](S)CCS Amb24099064 [0,2,0,0,0,0|0,0,2]=4 2228 B11R0.107 CCC(C)CCC(O)CC(=O)O Amb33362284 [0,2,0,0,0,0|0,0,2]=4 2229 B11R0.139 CCCCCC(=O)C(C)C(C)=O Amb17594265 [0,2,0,0,0,0|1,0,1]=4 2230 B11R0.154 CCCCCC(=O)CC(=O)OC Amb19515873 [0,2,0,0,0,0|0,0,1]=3 2231 B11R0.154 CCCCCC(N)CC(=O)OC Amb33254856 [0,2,0,0,0,0|0,0,2]=4 2232 B11R0.154 CCCCCC(O)CC(=O)OC Amb21928835 [0,2,0,0,0,0|0,0,2]=4 2233 B11R0.154 CCCCC[C@@H](O)CC(=O)OC Amb31308366 [0,2,0,0,0,0|0,0,2]=4 2234 B11R0.154 CCCCC[C@H](O)CC(=O)OC Amb33872469 [0,2,0,0,0,0|0,0,2]=4 2235 B11R0.154 CCCCC\C(C)=C\C(=O)OC Amb33472157 [0,2,0,0,0,0|0,0,0]=2 2236 B11R0.154 CCOCCC(=O)CC(=O)OC Amb32729435 [0,2,0,0,0,0|1,0,1]=4 2237 B11R0.324 CCCCCC(C)(N)CC(=O)O Amb33308272 [0,2,0,0,0,0|0,0,2]=4 2238 B11R0.324 CCCCCS(=O)(=O)CC(=O)O Amb6269488 [0,2,0,0,0,0|1,0,1]=4 2239 B11R0.31 CC(C)(C)CCCCCC(=O)O Amb3941402 [0,2,0,0,0,0|0,0,2]=4 2240 B11R0.31 O=C(O)\C=C\COCC(F)(F)F Amb19068653 [0,2,0,0,0,0|2,0,0]=4 2241 B11R0.29 CC(=O)\C=C\CCN(C)C(C)C Amb33273324 [0,2,0,0,0,0|2,0,0]=4 2242 B11R0.29 CC(C)N(C)CC\C=C\C(=O)O Amb33273826 [0,2,0,0,0,0|1,0,0]=3 2243 B11R0.29 CC(N)CCSCC(=O)C(=O)O Amb33069817 [0,2,0,0,0,0|1,0,1]=4 2244 B11R0.29 CC(O)CCSCC(=O)C(=O)O Amb33069719 [0,2,0,0,0,0|1,0,1]=4 2245 B11R0.29 NC(CC\C=C\C(=O)O)C(=O)O Amb32686887 [0,2,0,0,0,0|1,0,1]=4 2246 B11R0.29 NC(CC\C=C\C(=O)O)C(=O)O Amb33470155 [0,2,0,0,0,0|1,0,1]=4 2247 B11R0.106 CCC(C)CCCCC(=O)OC Amb22489983 [0,2,0,0,0,0|0,0,2]=4 2248 B11R0.109 CCC(N)CSCC(=O)C(=O)O Amb33069825 [0,2,0,0,0,0|1,0,1]=4 2249 B11R0.109 CCC(O)CSCC(=O)C(=O)O Amb33069737 [0,2,0,0,0,0|1,0,1]=4 2250 B11R0.109 CC[C@@H](O)CSCC(=O)C(=O)O Amb33069734 [0,2,0,0,0,0|1,0,1]=4 2251 B11R0.109 CC[C@H](O)CSCC(=O)C(=O)O Amb33069732 [0,2,0,0,0,0|1,0,1]=4 2252 B11R0.4 C=COC(=O)CCCCCCC Amb17672562 [0,2,0,0,0,0|0,0,2]=4 2253 B11R0.4 CCCCCC#CC(=O)OCC Amb2721498 [0,2,0,0,0,0|0,0,2]=4 2254 B11R0.4 CCCCCCCC(=O)OCC Amb6608755 [0,2,0,0,0,0|0,0,2]=4 2255 B11R0.4 CCCCCCOC(=O)OCCl Amb32413740 [0,2,0,0,0,0|1,0,1]=4 2256 B11R0.4 CCCCC\C=C\C(=O)OCC Amb33986022 [0,2,0,0,0,0|0,0,0]=2 2257 B11R0.4 CCOC(=O)\C=C\CCCCCl Amb8631721 [0,2,0,0,0,0|1,0,0]=3 2258 B11R0.70 CCCCC(C)C#CC(=O)OC Amb33168813 [0,2,0,0,0,0|0,0,2]=4 2259 B11R0.70 CCCCC(N)C#CC(=O)OC Amb33168791 [0,2,0,0,0,0|0,0,2]=4 2260 B11R0.70 CCCCC(N)CCC(=O)OC Amb33372313 [0,2,0,0,0,0|0,0,2]=4 2261 B11R0.142 C=C(CCCCCC)C(=O)OC Amb33038210 [0,2,0,0,0,0|0,0,1]=3 2262 B11R0.142 CCCCCCC(N)C(=O)OC Amb18794902 [0,2,0,0,0,0|0,0,2]=4 2263 B11R0.142 CCCCCC[C@H](N)C(=O)OC Amb34157713 [0,2,0,0,0,0|0,0,2]=4 2264 B11R0.76 CCCCCCC(CC)C(=O)O Amb18794406 [0,2,0,0,0,0|0,0,2]=4 2265 B11R0.76 CCCCCCC(NC)C(=O)O Amb9619840 [0,2,0,0,0,0|0,0,2]=4 2266 B11R0.125 CCCCCCC(C)(N)C(=O)O Amb7795642 [0,2,0,0,0,0|0,0,2]=4 2267 B11R0.85 CC(C)CNC(=O)\C=C\C(=O)O Amb7174059 [0,2,0,0,0,0|1,0,1]=4 2268 B11R0.164 CCCCC(CC)CCC(=O)O Amb10807481 [0,2,0,0,0,0|0,0,2]=4 2269 B9R1.5 CC1CCCC=CC1=O Amb27838624 [1,0,0,1,0,0|0,0,0]=2 2270 B9R1.5 CC1CCCCCC1=O Amb26348270 [1,0,0,1,0,0|0,0,2]=4 2271 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [1,0,0,1,0,0|1,0,1]=4 2272 B9R1.5 NC1CCCC=CC1O Amb27209173 [1,0,0,1,0,0|1,0,1]=4 2273 B9R1.5 O=C1C=CCCCC1O Amb27838742 [1,0,0,1,0,0|1,0,0]=3 2274 B9R1.5 O[C@@H]1C=CCCC[C@H]1O Amb27184263 [1,0,0,1,0,0|1,0,1]=4 2275 B9R1.5 O[C@H]1C=CCCC[C@@H]1O Amb28428672 [1,0,0,1,0,0|1,0,1]=4 2276 B9R1.8 BrC=C=C1CCCCC1 Amb27796378 [1,0,0,1,0,0|1,0,1]=4 2277 B9R1.8 BrCC=C1CCCCC1 Amb27841870 [1,0,0,1,0,0|1,0,1]=4 2278 B9R1.8 Br\C=C\C1CCCCC1 Amb27666335 [1,0,0,1,0,0|1,0,1]=4 2279 B9R1.8 Br\C=C\N1CCCCC1 Amb27985247 [1,0,0,1,0,0|2,0,0]=4 2280 B9R1.8 C=CC=C1CCCCC1 Amb27945364 [1,0,0,1,0,0|1,0,0]=3 2281 B9R1.8 C=CC=C1CCNCC1 Amb27253934 [1,0,0,1,0,0|2,0,0]=4 2282 B9R1.8 CCCC1CC=CCN1 Amb27195040 [1,0,0,1,0,0|1,0,1]=4 2283 B9R1.8 CCCC1CCC=CO1 Amb27423642 [1,0,0,1,0,0|0,0,1]=3 2284 B9R1.8 CCOC1CCC=CO1 Amb6600548 [1,0,0,1,0,0|1,0,1]=4 2285 B9R1.8 C\C=C\C1=NCCCC1 Amb27435806 [1,0,0,1,0,0|2,0,0]=4 2286 B9R1.8 C\C=C\C1CCCCC1 Amb34915057 [1,0,0,1,0,0|1,0,1]=4 2287 B9R1.8 N#CC=C1CCCCC1 Amb16233597 [1,0,0,1,0,0|1,0,1]=4 2288 B9R1.8 NCC=C1CCCCC1 Amb17605580 [1,0,0,1,0,0|1,0,1]=4 2289 B9R1.8 NCCC1CCC=CO1 Amb25743698 [1,0,0,1,0,0|1,0,1]=4 2290 B9R1.8 O=CC=C1CCCCC1 Amb17593282 [1,0,0,1,0,0|0,0,0]=2 2291 B9R1.8 O=CC=C1CCSCC1 Amb27180593 [1,0,0,1,0,0|1,0,0]=3 2292 B9R1.8 O=CCC1=CCCCC1 Amb17593283 [1,0,0,1,0,0|0,0,2]=4 2293 B9R1.8 O=CCC1CCCCC1 Amb10070777 [1,0,0,1,0,0|0,0,2]=4 2294 B9R1.8 O=CCN1CCCCC1 Amb20248700 [1,0,0,1,0,0|1,0,1]=4 2295 B9R1.8 O=CCN1CCCCC1 Amb32409629 [1,0,0,1,0,0|1,0,1]=4 2296 B9R1.8 O=CNC1=CCCCC1 Amb16192555 [1,0,0,1,0,0|1,0,1]=4 2297 B9R1.8 O=CNN1CCCCC1 Amb27985557 [1,0,0,1,0,0|2,0,0]=4 2298 B9R1.8 OCC=C1CCCCC1 Amb25783847 [1,0,0,1,0,0|0,0,1]=3 2299 B9R1.8 OCC=C1CCNCC1 Amb33465522 [1,0,0,1,0,0|1,0,1]=4 2300 B9R1.8 OCC=C1CCNCC1 Amb33465523 [1,0,0,1,0,0|1,0,1]=4 2301 B9R1.8 OCC=C1CCOCC1 Amb25994306 [1,0,0,1,0,0|1,0,1]=4 2302 B9R1.8 OCCC1CCC=CO1 Amb24481996 [1,0,0,1,0,0|1,0,1]=4 2303 B9R1.8 O\N=C\C1CCCCC1 Amb27771827 [1,0,0,1,0,0|1,0,1]=4 2304 B9R1.12 BrCCCc1ccco1 Amb17104550 [1,0,0,1,0,0|1,0,1]=4 2305 B9R1.12 BrC\C=C\C1CCCC1 Amb28057257 [1,0,0,1,0,0|1,0,1]=4 2306 B9R1.12 CCCCC1C=CCN1 Amb10608225 [1,0,0,1,0,0|1,0,1]=4 2307 B9R1.12 CCCCC1C=CCN1 Amb22587190 [1,0,0,1,0,0|1,0,1]=4 2308 B9R1.12 CCCCC1CC=CC1 Amb30032420 [1,0,0,1,0,0|1,0,1]=4 2309 B9R1.12 CCCCc1ccco1 Amb10070290 [1,0,0,1,0,0|0,0,1]=3 2310 B9R1.12 CCCCc1cccs1 Amb4477470 [1,0,0,1,0,0|0,1,1]=4 2311 B9R1.12 CCCCc1cnco1 Amb35647888 [1,0,0,1,0,0|1,0,1]=4 2312 B9R1.12 CCCCn1cccn1 Amb27830053 [1,0,0,1,0,0|2,0,0]=4 2313 B9R1.12 CCNCc1ccco1 Amb1137312 [1,0,0,1,0,0|1,0,1]=4 2314 B9R1.12 CCNCc1ccco1 Amb8191019 [1,0,0,1,0,0|1,0,1]=4 2315 B9R1.12 CCOCc1ccco1 Amb22234292 [1,0,0,1,0,0|1,0,1]=4 2316 B9R1.12 CCSCc1ccco1 Amb26949169 [1,0,0,1,0,0|1,0,1]=4 2317 B9R1.12 CC\C=C\C1CCCC1 Amb27267419 [1,0,0,1,0,0|1,0,1]=4 2318 B9R1.12 CNCCc1ccco1 Amb17399803 [1,0,0,1,0,0|1,0,1]=4 2319 B9R1.12 CSCCc1ccco1 Amb27438612 [1,0,0,1,0,0|1,0,1]=4 2320 B9R1.12 ClCCCc1ccco1 Amb8860563 [1,0,0,1,0,0|1,0,1]=4 2321 B9R1.12 ClC\C=C\C1CCCC1 Amb27410192 [1,0,0,1,0,0|1,0,1]=4 2322 B9R1.12 N#C\C=C\C1CCCC1 Amb13890295 [1,0,0,1,0,0|1,0,1]=4 2323 B9R1.12 NCCCc1ccco1 Amb534785 [1,0,0,1,0,0|1,0,1]=4 2324 B9R1.12 NC\C=C\C1CCCC1 Amb27869342 [1,0,0,1,0,0|1,0,1]=4 2325 B9R1.12 O=CCCC1CCCC1 Amb8009615 [1,0,0,1,0,0|0,0,2]=4 2326 B9R1.12 O=CCOC1CCCC1 Amb27169387 [1,0,0,1,0,0|1,0,1]=4 2327 B9R1.12 O=CNOC1CCCC1 Amb27787363 [1,0,0,1,0,0|2,0,0]=4 2328 B9R1.12 O=C\C=C\C1CCCC1 Amb33380761 [1,0,0,1,0,0|0,0,0]=2 2329 B9R1.12 O=C\C=C\C1CCCO1 Amb26992295 [1,0,0,1,0,0|1,0,0]=3 2330 B9R1.12 O=C\C=C\C1CCCS1 Amb33416822 [1,0,0,1,0,0|1,0,0]=3 2331 B9R1.12 O=C\C=C\C1CCOC1 Amb33079631 [1,0,0,1,0,0|1,0,0]=3 2332 B9R1.12 O=C\C=C\C1CCSC1 Amb27478226 [1,0,0,1,0,0|1,0,0]=3 2333 B9R1.12 OCCCc1ccco1 Amb8860560 [1,0,0,1,0,0|1,0,1]=4 2334 B9R1.12 OC\C=C\C1CCCC1 Amb33428704 [1,0,0,1,0,0|0,0,1]=3 2335 B9R1.12 OC\C=C\C1CCCO1 Amb33226990 [1,0,0,1,0,0|1,0,1]=4 2336 B9R1.12 OC\C=C\C1CCCS1 Amb33414579 [1,0,0,1,0,0|1,0,1]=4 2337 B9R1.12 OC\C=C\C1CCOC1 Amb33359633 [1,0,0,1,0,0|1,0,1]=4 2338 B9R1.12 OC\C=C\C1CCSC1 Amb32953834 [1,0,0,1,0,0|1,0,1]=4 2339 B9R1.12 O\N=C\CC1CCCC1 Amb27618400 [1,0,0,1,0,0|1,0,1]=4 2340 B9R1.12 SCCCc1ccco1 Amb17399874 [1,0,0,1,0,0|1,0,1]=4 2341 B9R1.14 CCC1CCC=C1CO Amb28049264 [1,0,0,1,0,0|0,0,1]=3 2342 B9R1.14 CCN1CCN=C1C=O Amb20248622 [1,0,0,1,0,0|2,0,0]=4 2343 B9R1.15 CC1CCCCC1C=O Amb18642449 [1,0,0,1,0,0|0,0,2]=4 2344 B9R1.15 CC1CCCC\C1=N\O Amb19650930 [1,0,0,1,0,0|1,0,1]=4 2345 B9R1.15 CCC1C=NC=CC1=O Amb27838782 [1,0,0,1,0,0|1,0,1]=4 2346 B9R1.15 CCC1CCCCC1=O Amb22002104 [1,0,0,1,0,0|0,0,2]=4 2347 B9R1.15 CCC1CCCNC1=O Amb22276357 [1,0,0,1,0,0|1,0,1]=4 2348 B9R1.15 CCC1CCOCC1=O Amb33295409 [1,0,0,1,0,0|1,0,1]=4 2349 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [1,0,0,1,0,0|0,0,2]=4 2350 B9R1.15 CC[C@@H]1CCCNC1=O Amb28436118 [1,0,0,1,0,0|1,0,1]=4 2351 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [1,0,0,1,0,0|1,0,1]=4 2352 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [1,0,0,1,0,0|1,0,1]=4 2353 B9R1.15 CSC1CCC=CC1=O Amb28074788 [1,0,0,1,0,0|1,0,0]=3 2354 B9R1.15 C[C@@H]1CCCC[C@H]1C=O Amb28248314 [1,0,0,1,0,0|0,0,2]=4 2355 B9R1.15 C[C@@H]1CCCO[C@H]1C=O Amb28255632 [1,0,0,1,0,0|1,0,1]=4 2356 B9R1.15 O=CC1=CCCOC1Br Amb27879745 [1,0,0,1,0,0|2,0,0]=4 2357 B9R1.15 OC[C@@H]1CCC=C[C@@H]1O Amb27215271 [1,0,0,1,0,0|1,0,1]=4 2358 B9R1.15 OC[C@H]1CCC=C[C@H]1O Amb27218905 [1,0,0,1,0,0|1,0,1]=4 2359 B9R1.16 CC1CC1CCCC=O Amb33143871 [1,0,0,1,0,0|0,0,2]=4 2360 B9R1.17 O=CCCCC1CCC1 Amb33197139 [1,0,0,1,0,0|0,0,2]=4 2361 B9R1.17 O=CNOCC1CCC1 Amb35636972 [1,0,0,1,0,0|2,0,0]=4 2362 B9R1.20 C=CC1CC1\C=C\C=O Amb25371821 [1,0,0,1,0,0|0,0,2]=4 2363 B9R1.20 C=C[C@@H]1C[C@H]1\C=C/C=O Amb27636913 [1,0,0,1,0,0|0,0,2]=4 2364 B9R1.20 C=C\C=C\C1CC1CO Amb27164470 [1,0,0,1,0,0|2,0,0]=4 2365 B9R1.20 CCCCC1OC1C=O Amb26852359 [1,0,0,1,0,0|1,0,1]=4 2366 B9R1.20 CCCC[C@@H]1C[C@H]1C=O Amb27971394 [1,0,0,1,0,0|0,0,2]=4 2367 B9R1.33 C=CCC1CC=CC1=O Amb25834342 [1,0,0,1,0,0|0,0,2]=4 2368 B9R1.33 C=CC[C@H]1CC=CC1=O Amb28054406 [1,0,0,1,0,0|0,0,2]=4 2369 B9R1.33 CC1CCCC1NC=O Amb28430376 [1,0,0,1,0,0|1,0,1]=4 2370 B9R1.33 CC1CCC\C1=C/CN Amb27185789 [1,0,0,1,0,0|1,0,1]=4 2371 B9R1.33 CCCC1CC=CC1=O Amb27838711 [1,0,0,1,0,0|0,0,0]=2 2372 B9R1.33 CCCC1CCCC1=O Amb8503562 [1,0,0,1,0,0|0,0,2]=4 2373 B9R1.33 CCCC1COCC1=O Amb35639022 [1,0,0,1,0,0|1,0,1]=4 2374 B9R1.33 CCC[C@@H]1CCCC1=O Amb28054357 [1,0,0,1,0,0|0,0,2]=4 2375 B9R1.33 CCC[C@H]1CCNC1=O Amb27624920 [1,0,0,1,0,0|1,0,1]=4 2376 B9R1.33 CCCn1nccc1O Amb24644797 [1,0,0,1,0,0|2,0,0]=4 2377 B9R1.33 CC\C=C1/CC=CC1=O Amb28144042 [1,0,0,1,0,0|0,0,2]=4 2378 B9R1.33 CN1CCC\C1=C/C=O Amb27480456 [1,0,0,1,0,0|1,0,0]=3 2379 B9R1.33 O=C1C=CCC1CCO Amb27260839 [1,0,0,1,0,0|1,0,0]=3 2380 B9R1.33 OCC[C@H]1CC=C[C@H]1O Amb27218968 [1,0,0,1,0,0|1,0,1]=4 2381 B9R1.50 BrC1=CCCCCCC1 Amb23590920 [1,0,0,1,0,0|1,0,1]=4 2382 B9R1.50 BrC1C=CCCCCC1 Amb24480205 [1,0,0,1,0,0|1,0,1]=4 2383 B9R1.50 ClC1C=CCCCCC1 Amb27484094 [1,0,0,1,0,0|1,0,1]=4 2384 B9R1.50 NC1C=CC=CCCC1 Amb27181161 [1,0,0,1,0,0|2,0,0]=4 2385 B9R1.50 NC1C=CCCCCC1 Amb22410845 [1,0,0,1,0,0|1,0,1]=4 2386 B9R1.50 NC1C=CCCCCC1 Amb32652668 [1,0,0,1,0,0|1,0,1]=4 2387 B9R1.50 N[C@@H]1C=CCCCCC1 Amb27423065 [1,0,0,1,0,0|1,0,1]=4 2388 B9R1.50 O=C1C=CC=CCCC1 Amb27164621 [1,0,0,1,0,0|0,0,2]=4 2389 B9R1.50 O=C1C=CCC=CCC1 Amb28207621 [1,0,0,1,0,0|0,0,2]=4 2390 B9R1.50 O=C1C=CCCC=CC1 Amb22365234 [1,0,0,1,0,0|0,0,2]=4 2391 B9R1.50 O=C1C=CCCCC=C1 Amb22364780 [1,0,0,1,0,0|0,0,2]=4 2392 B9R1.50 O=C1C=CCCCCC1 Amb3987503 [1,0,0,1,0,0|0,0,0]=2 2393 B9R1.50 O=C1C=CCCCCN1 Amb24469221 [1,0,0,1,0,0|1,0,0]=3 2394 B9R1.50 O=C1C=CCCOCC1 Amb27838783 [1,0,0,1,0,0|1,0,0]=3 2395 B9R1.50 O=C1CCCCCCC1 Amb2721546 [1,0,0,1,0,0|0,0,2]=4 2396 B9R1.50 O=C1CCCCCCN1 Amb2780498 [1,0,0,1,0,0|1,0,1]=4 2397 B9R1.50 O=C1CCCCCCO1 Amb27468239 [1,0,0,1,0,0|1,0,1]=4 2398 B9R1.50 OC1C=CCCCCC1 Amb22364937 [1,0,0,1,0,0|0,0,1]=3 2399 B9R1.50 OC1C=CCCCOC1 Amb27452486 [1,0,0,1,0,0|1,0,1]=4 2400 B9R1.50 O[C@@H]1C=CC=CCCC1 Amb27841912 [1,0,0,1,0,0|2,0,0]=4 2401 B9R1.50 O[C@@H]1C=CCCCCC1 Amb27826413 [1,0,0,1,0,0|0,0,1]=3 2402 B9R1.50 O[C@H]1C=CC=CCCC1 Amb28315480 [1,0,0,1,0,0|2,0,0]=4 2403 B9R1.83 CCCCCCC1=CC1 Amb27793496 [1,0,0,1,0,0|1,0,1]=4 2404 B9R1.83 O=CCCCCC1CC1 Amb33361884 [1,0,0,1,0,0|0,0,2]=4 2405 B9R1.83 O=CCOCCC1CC1 Amb28049211 [1,0,0,1,0,0|1,0,1]=4 2406 B9R1.89 C#CC1=CCCCCC1 Amb17689256 [1,0,0,1,0,0|1,0,1]=4 2407 B9R1.89 C=CC1=CCCCCC1 Amb28245546 [1,0,0,1,0,0|1,0,0]=3 2408 B9R1.89 COC1=CCCCCC1 Amb26014503 [1,0,0,1,0,0|2,0,0]=4 2409 B9R1.89 N#CC1=CCCCCC1 Amb4016990 [1,0,0,1,0,0|1,0,1]=4 2410 B9R1.89 NCC1=CCCCCC1 Amb27403312 [1,0,0,1,0,0|1,0,1]=4 2411 B9R1.89 O=CC1=CCCCCC1 Amb9790320 [1,0,0,1,0,0|0,0,0]=2 2412 B9R1.89 O=CC1=CSCCCS1 Amb28197267 [1,0,0,1,0,0|2,0,0]=4 2413 B9R1.89 O=CC1CCCCCC1 Amb9786985 [1,0,0,1,0,0|0,0,2]=4 2414 B9R1.89 O=S=C1CCCCCN1 Amb28313706 [1,0,0,1,0,0|2,0,0]=4 2415 B9R1.89 OCC1=CCCCCC1 Amb27424682 [1,0,0,1,0,0|0,0,1]=3 2416 B9R1.89 ON=C1CCCCCC1 Amb7969725 [1,0,0,1,0,0|1,0,1]=4 2417 B9R1.89 O\N=C1/CCCCCN1 Amb19894798 [1,0,0,1,0,0|2,0,0]=4 2418 B9R1.89 O\N=C1\CCCCCN1 Amb1107240 [1,0,0,1,0,0|2,0,0]=4 2419 B9R1.103 C1=CCOCCCCC1 Amb29838311 [1,0,0,1,0,0|0,0,1]=3 2420 B9R1.2 CCC1CC(=O)C=CN1 Amb28285113 [1,0,0,1,0,0|2,0,0]=4 2421 B9R1.2 CCC1CC(=O)C=CO1 Amb28076224 [1,0,0,1,0,0|2,0,0]=4 2422 B9R1.2 CCC1CC=CC(=O)O1 Amb27480728 [1,0,0,1,0,0|0,0,0]=2 2423 B9R1.2 CCC1CCCC(=O)C1 Amb19335038 [1,0,0,1,0,0|1,0,1]=4 2424 B9R1.2 CCC1CCCC(=O)N1 Amb13883424 [1,0,0,1,0,0|1,0,1]=4 2425 B9R1.2 CCC1CCCC(=O)O1 Amb27242548 [1,0,0,1,0,0|0,0,1]=3 2426 B9R1.2 CCC1CCNC(=O)C1 Amb25791122 [1,0,0,1,0,0|2,0,0]=4 2427 B9R1.2 CCC1CCNC(O)=N1 Amb24481964 [1,0,0,1,0,0|2,0,0]=4 2428 B9R1.2 CC[C@@H]1CC=CC(=O)C1 Amb27828949 [1,0,0,1,0,0|1,0,0]=3 2429 B9R1.2 CC[C@H]1CC=CC(=O)C1 Amb28461147 [1,0,0,1,0,0|1,0,0]=3 2430 B9R1.2 CC[C@H]1CCCC(=O)N1 Amb28049339 [1,0,0,1,0,0|1,0,1]=4 2431 B9R1.2 O=C1C=CCC(CCl)O1 Amb24432531 [1,0,0,1,0,0|1,0,0]=3 2432 B9R1.2 O=C1C=CCC(CO)O1 Amb28049087 [1,0,0,1,0,0|1,0,0]=3 2433 B9R1.2 O=C1C=CC[C@@H](CCl)O1 Amb22226720 [1,0,0,1,0,0|1,0,0]=3 2434 B9R1.2 O=C1CCCC(CBr)O1 Amb28325542 [1,0,0,1,0,0|1,0,1]=4 2435 B9R1.2 O=C1CCCC(CO)O1 Amb27980552 [1,0,0,1,0,0|1,0,1]=4 2436 B9R1.2 O=CC1CC=CC(=O)O1 Amb18642367 [1,0,0,1,0,0|1,0,1]=4 2437 B9R1.6 CC(=O)C1=CCCCC1 Amb8513050 [1,0,0,1,0,0|1,0,0]=3 2438 B9R1.6 CC(=O)C1=CCCCN1 Amb27234616 [1,0,0,1,0,0|2,0,0]=4 2439 B9R1.6 CC(=O)C1=CCNCC1 Amb28188537 [1,0,0,1,0,0|2,0,0]=4 2440 B9R1.6 CC(=O)C1=CCOCC1 Amb26054193 [1,0,0,1,0,0|2,0,0]=4 2441 B9R1.6 CC(=O)C1=CNCCC1 Amb1162825 [1,0,0,1,0,0|2,0,0]=4 2442 B9R1.6 CC(=O)C1=COCCC1 Amb26337589 [1,0,0,1,0,0|2,0,0]=4 2443 B9R1.6 CC(=O)C1=CSCCC1 Amb27803691 [1,0,0,1,0,0|2,0,0]=4 2444 B9R1.6 CC(=O)C1CCCCC1 Amb4037310 [1,0,0,1,0,0|1,0,1]=4 2445 B9R1.6 CC(=O)N1CCCCC1 Amb2694530 [1,0,0,1,0,0|2,0,0]=4 2446 B9R1.6 CC(O)C1=CCCCC1 Amb25747240 [1,0,0,1,0,0|1,0,1]=4 2447 B9R1.6 FC(Br)=C1CCCCC1 Amb32993478 [1,0,0,1,0,0|2,0,0]=4 2448 B9R1.6 NC(=O)C1=CCCCC1 Amb27878423 [1,0,0,1,0,0|1,0,0]=3 2449 B9R1.6 NC(=O)C1=CCCSC1 Amb27980042 [1,0,0,1,0,0|2,0,0]=4 2450 B9R1.6 NC(=O)C1=CNCCC1 Amb2779121 [1,0,0,1,0,0|2,0,0]=4 2451 B9R1.6 NC(=O)C1=COCCC1 Amb20665861 [1,0,0,1,0,0|2,0,0]=4 2452 B9R1.6 NC(=O)C1CCCCC1 Amb6335833 [1,0,0,1,0,0|1,0,1]=4 2453 B9R1.6 NC(=O)N1CCCCC1 Amb1151731 [1,0,0,1,0,0|2,0,0]=4 2454 B9R1.6 O=C(Cl)C1=CCCCC1 Amb21961756 [1,0,0,1,0,0|1,0,0]=3 2455 B9R1.6 O=C(Cl)C1=CCCOC1 Amb26843141 [1,0,0,1,0,0|2,0,0]=4 2456 B9R1.6 O=C(Cl)C1=CCOCC1 Amb25714177 [1,0,0,1,0,0|2,0,0]=4 2457 B9R1.6 O=C(Cl)C1=COCCC1 Amb27855704 [1,0,0,1,0,0|2,0,0]=4 2458 B9R1.6 O=C(Cl)C1CCCCC1 Amb2792904 [1,0,0,1,0,0|1,0,1]=4 2459 B9R1.6 O=C(Cl)N1CCCCC1 Amb17563099 [1,0,0,1,0,0|2,0,0]=4 2460 B9R1.6 O=C(O)C1=CCCCC1 Amb2720517 [1,0,0,1,0,0|0,0,0]=2 2461 B9R1.6 O=C(O)C1=CCCCN1 Amb23585365 [1,0,0,1,0,0|1,0,0]=3 2462 B9R1.6 O=C(O)C1=CCCCO1 Amb2700341 [1,0,0,1,0,0|1,0,0]=3 2463 B9R1.6 O=C(O)C1=CCCNC1 Amb10608557 [1,0,0,1,0,0|1,0,0]=3 2464 B9R1.6 O=C(O)C1=CCCNC1 Amb8503496 [1,0,0,1,0,0|1,0,0]=3 2465 B9R1.6 O=C(O)C1=CCCOC1 Amb19958529 [1,0,0,1,0,0|1,0,0]=3 2466 B9R1.6 O=C(O)C1=CCCSC1 Amb19515066 [1,0,0,1,0,0|1,0,0]=3 2467 B9R1.6 O=C(O)C1=CCNCC1 Amb10843904 [1,0,0,1,0,0|1,0,0]=3 2468 B9R1.6 O=C(O)C1=CCNCC1 Amb2698151 [1,0,0,1,0,0|1,0,0]=3 2469 B9R1.6 O=C(O)C1=CCOCC1 Amb18642574 [1,0,0,1,0,0|1,0,0]=3 2470 B9R1.6 O=C(O)C1=COCCC1 Amb18642576 [1,0,0,1,0,0|1,0,0]=3 2471 B9R1.6 O=C(O)C1=COCCO1 Amb1106470 [1,0,0,1,0,0|2,0,0]=4 2472 B9R1.6 O=C(O)C1=CSCCO1 Amb20455323 [1,0,0,1,0,0|2,0,0]=4 2473 B9R1.6 O=C(O)C1=NCCCC1 Amb24597785 [1,0,0,1,0,0|1,0,0]=3 2474 B9R1.6 O=C(O)C1=NCCCN1 Amb25379456 [1,0,0,1,0,0|2,0,0]=4 2475 B9R1.6 O=C(O)C1=NCCOC1 Amb28398697 [1,0,0,1,0,0|2,0,0]=4 2476 B9R1.6 O=C(O)C1=NNCCC1 Amb18642590 [1,0,0,1,0,0|2,0,0]=4 2477 B9R1.6 O=C(O)C1C=CCCC1 Amb18642396 [1,0,0,1,0,0|0,0,2]=4 2478 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [1,0,0,1,0,0|0,0,1]=3 2479 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [1,0,0,1,0,0|1,0,1]=4 2480 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [1,0,0,1,0,0|1,0,1]=4 2481 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [1,0,0,1,0,0|1,0,1]=4 2482 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [1,0,0,1,0,0|1,0,1]=4 2483 B9R1.6 O=C(O)C1CCCNC1 Amb6239367 [1,0,0,1,0,0|1,0,1]=4 2484 B9R1.6 O=C(O)C1CCCNC1 Amb9703145 [1,0,0,1,0,0|1,0,1]=4 2485 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [1,0,0,1,0,0|1,0,1]=4 2486 B9R1.6 O=C(O)C1CCCSC1 Amb33545067 [1,0,0,1,0,0|1,0,1]=4 2487 B9R1.6 O=C(O)C1CCNCC1 Amb2720245 [1,0,0,1,0,0|1,0,1]=4 2488 B9R1.6 O=C(O)C1CCNCC1 Amb932842 [1,0,0,1,0,0|1,0,1]=4 2489 B9R1.6 O=C(O)C1CCOCC1 Amb426862 [1,0,0,1,0,0|1,0,1]=4 2490 B9R1.6 O=C(O)C1CCSCC1 Amb6572253 [1,0,0,1,0,0|1,0,1]=4 2491 B9R1.6 O=C(O)N1CCCCC1 Amb20242677 [1,0,0,1,0,0|1,0,0]=3 2492 B9R1.6 O=C(O)N1CCCCC1 Amb35825557 [1,0,0,1,0,0|1,0,0]=3 2493 B9R1.6 O=C(O)N1CCSCC1 Amb24099831 [1,0,0,1,0,0|2,0,0]=4 2494 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [1,0,0,1,0,0|1,0,1]=4 2495 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [1,0,0,1,0,0|1,0,1]=4 2496 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [1,0,0,1,0,0|1,0,1]=4 2497 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb16232354 [1,0,0,1,0,0|1,0,1]=4 2498 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb8628966 [1,0,0,1,0,0|1,0,1]=4 2499 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [1,0,0,1,0,0|1,0,1]=4 2500 B9R1.6 O=C(O)[C@@H]1CCCSC1 Amb27826589 [1,0,0,1,0,0|1,0,1]=4 2501 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [1,0,0,1,0,0|1,0,1]=4 2502 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [1,0,0,1,0,0|1,0,1]=4 2503 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [1,0,0,1,0,0|1,0,1]=4 2504 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8384271 [1,0,0,1,0,0|1,0,1]=4 2505 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8389307 [1,0,0,1,0,0|1,0,1]=4 2506 B9R1.6 O=C(O)[C@H]1CCCSC1 Amb27809148 [1,0,0,1,0,0|1,0,1]=4 2507 B9R1.6 O=C([O-])C1=CCCCN1 Amb32675115 [1,0,0,1,0,0|1,0,1]=4 2508 B9R1.6 O=S(O)C1CCCCC1 Amb24603074 [1,0,0,1,0,0|1,0,1]=4 2509 B9R1.6 O=[N+]([O-])C1=CCCCC1 Amb22347895 [1,0,0,1,0,0|1,0,1]=4 2510 B9R1.6 O=[PH](O)C1=CCNCC1 Amb27469692 [1,0,0,1,0,0|2,0,0]=4 2511 B9R1.6 OB(O)C1=CCCCC1 Amb2455978 [1,0,0,1,0,0|1,0,1]=4 2512 B9R1.7 C=CCC1C=CC(=O)O1 Amb27453658 [1,0,0,1,0,0|0,0,2]=4 2513 B9R1.7 CCCC1C=CC(=O)N1 Amb27752029 [1,0,0,1,0,0|1,0,0]=3 2514 B9R1.7 CCCC1C=CC(=O)O1 Amb25793308 [1,0,0,1,0,0|0,0,0]=2 2515 B9R1.7 CCCC1CCC(=O)C1 Amb24087435 [1,0,0,1,0,0|1,0,1]=4 2516 B9R1.7 CCCC1CCC(=O)O1 Amb8517544 [1,0,0,1,0,0|0,0,1]=3 2517 B9R1.7 CCCC1CNC(=O)C1 Amb16186658 [1,0,0,1,0,0|2,0,0]=4 2518 B9R1.7 CCCC1CNC(=O)O1 Amb26947821 [1,0,0,1,0,0|1,0,0]=3 2519 B9R1.7 CCCC1CNC(=S)O1 Amb28347971 [1,0,0,1,0,0|1,1,0]=4 2520 B9R1.7 CCCC1CNC(O)=N1 Amb26898870 [1,0,0,1,0,0|2,0,0]=4 2521 B9R1.7 CCCC1COC(=O)C1 Amb26560581 [1,0,0,1,0,0|2,0,0]=4 2522 B9R1.7 CCCC1COC(=O)N1 Amb26628895 [1,0,0,1,0,0|2,0,0]=4 2523 B9R1.7 CCC[C@@H]1C=CC(=O)N1 Amb27876443 [1,0,0,1,0,0|1,0,0]=3 2524 B9R1.7 CCC[C@@H]1COC(=O)N1 Amb28133695 [1,0,0,1,0,0|2,0,0]=4 2525 B9R1.7 CCC[C@H]1CCC(=O)O1 Amb28397464 [1,0,0,1,0,0|0,0,1]=3 2526 B9R1.7 CCC[C@H]1CNC(=O)C1 Amb25146172 [1,0,0,1,0,0|2,0,0]=4 2527 B9R1.7 CCC[C@H]1COC(=O)C1 Amb33725639 [1,0,0,1,0,0|2,0,0]=4 2528 B9R1.7 CCC[C@H]1COC(=O)N1 Amb27484954 [1,0,0,1,0,0|2,0,0]=4 2529 B9R1.7 CCCc1ccc(Br)o1 Amb24318772 [1,0,0,1,0,0|1,0,1]=4 2530 B9R1.7 CCCc1ccc(C)o1 Amb22339463 [1,0,0,1,0,0|1,0,1]=4 2531 B9R1.7 CCCc1ccc(O)s1 Amb33267047 [1,0,0,1,0,0|0,1,1]=4 2532 B9R1.7 CCCn1ccc(O)n1 Amb32701222 [1,0,0,1,0,0|2,0,0]=4 2533 B9R1.7 CCOC1CCC(=O)O1 Amb24117269 [1,0,0,1,0,0|1,0,1]=4 2534 B9R1.7 CCSC1CNC(=O)O1 Amb27174206 [1,0,0,1,0,0|2,0,0]=4 2535 B9R1.7 CC\C=C1/C=CC(=O)O1 Amb27185841 [1,0,0,1,0,0|0,0,2]=4 2536 B9R1.7 CC\N=C1\C=CC(=O)O1 Amb27760317 [1,0,0,1,0,0|1,0,1]=4 2537 B9R1.7 CNCC1CCC(=O)O1 Amb28326084 [1,0,0,1,0,0|1,0,1]=4 2538 B9R1.7 CNCC1CNC(=O)O1 Amb17506101 [1,0,0,1,0,0|2,0,0]=4 2539 B9R1.7 CNCC1COC(=O)O1 Amb27619965 [1,0,0,1,0,0|2,0,0]=4 2540 B9R1.7 CNC[C@@H]1CCC(=O)O1 Amb27848226 [1,0,0,1,0,0|1,0,1]=4 2541 B9R1.7 CNC[C@@H]1CNC(=O)O1 Amb27631362 [1,0,0,1,0,0|2,0,0]=4 2542 B9R1.7 COCC1C=CC(=O)O1 Amb28370301 [1,0,0,1,0,0|1,0,0]=3 2543 B9R1.7 COCC1C=NC(=O)O1 Amb27962493 [1,0,0,1,0,0|2,0,0]=4 2544 B9R1.7 COCC1CCC(=O)O1 Amb26558471 [1,0,0,1,0,0|1,0,1]=4 2545 B9R1.7 COCC1CNC(=O)O1 Amb27794676 [1,0,0,1,0,0|2,0,0]=4 2546 B9R1.7 COCC1COC(=O)O1 Amb26318830 [1,0,0,1,0,0|2,0,0]=4 2547 B9R1.7 COC[C@@H]1CNC(=O)O1 Amb22746095 [1,0,0,1,0,0|2,0,0]=4 2548 B9R1.7 COC[C@H]1CNC(=O)O1 Amb22225377 [1,0,0,1,0,0|2,0,0]=4 2549 B9R1.7 COC[C@H]1COC(=O)O1 Amb22226690 [1,0,0,1,0,0|2,0,0]=4 2550 B9R1.7 CSCC1CNC(=O)O1 Amb28193245 [1,0,0,1,0,0|2,0,0]=4 2551 B9R1.7 C[NH2+]C[C@@H]1CCC(=O)O1 Amb28464027 [1,0,0,1,0,0|1,0,1]=4 2552 B9R1.7 C\C=C\C1C=CC(=O)O1 Amb25238033 [1,0,0,1,0,0|0,0,2]=4 2553 B9R1.7 NCCC1CNC(=O)O1 Amb27628589 [1,0,0,1,0,0|2,0,0]=4 2554 B9R1.7 O=C1C=CC(CCO)C1 Amb27256296 [1,0,0,1,0,0|2,0,0]=4 2555 B9R1.7 O=C1C=CC(CCO)O1 Amb18832646 [1,0,0,1,0,0|1,0,0]=3 2556 B9R1.7 O=C1C=CC(CCO)S1 Amb28143598 [1,0,0,1,0,0|1,1,0]=4 2557 B9R1.7 O=C1C=C[C@H](CCO)O1 Amb27486246 [1,0,0,1,0,0|1,0,0]=3 2558 B9R1.7 O=C1CCC(CCBr)O1 Amb27657784 [1,0,0,1,0,0|1,0,1]=4 2559 B9R1.7 O=C1CCC(CCS)O1 Amb28285189 [1,0,0,1,0,0|1,0,1]=4 2560 B9R1.7 O=C1CC[C@H](CCBr)O1 Amb27791548 [1,0,0,1,0,0|1,0,1]=4 2561 B9R1.7 O=C1NCC(CCF)O1 Amb33195802 [1,0,0,1,0,0|2,0,0]=4 2562 B9R1.9 CCCCC1=CC(=O)C1 Amb28199849 [1,0,0,1,0,0|1,0,0]=3 2563 B9R1.9 CCCC[C@H]1CC(=O)N1 Amb27627588 [1,0,0,1,0,0|1,0,1]=4 2564 B9R1.13 BrC(Br)=CC1CCCC1 Amb27162089 [1,0,0,1,0,0|2,0,0]=4 2565 B9R1.13 CC(=O)C=C1CCCC1 Amb2699510 [1,0,0,1,0,0|1,0,0]=3 2566 B9R1.13 CC(=O)CC1CCCC1 Amb2721149 [1,0,0,1,0,0|1,0,1]=4 2567 B9R1.13 CC(=O)NC1CCCC1 Amb3367351 [1,0,0,1,0,0|2,0,0]=4 2568 B9R1.13 CC(=O)SC1CCCC1 Amb22337902 [1,0,0,1,0,0|2,0,0]=4 2569 B9R1.13 CC(=O)\C=C1\CCCN1 Amb17593301 [1,0,0,1,0,0|2,0,0]=4 2570 B9R1.13 CC(=O)\C=C1\CCCO1 Amb25241353 [1,0,0,1,0,0|2,0,0]=4 2571 B9R1.13 NC(=O)C=C1CCCC1 Amb20622621 [1,0,0,1,0,0|1,0,0]=3 2572 B9R1.13 NC(=O)CC1CCCC1 Amb6892422 [1,0,0,1,0,0|1,0,1]=4 2573 B9R1.13 NC(=O)NC1CCCC1 Amb1151267 [1,0,0,1,0,0|2,0,0]=4 2574 B9R1.13 NC(=O)OC1CCCC1 Amb2617542 [1,0,0,1,0,0|2,0,0]=4 2575 B9R1.13 O=C(Cl)CC1CCCC1 Amb3939570 [1,0,0,1,0,0|1,0,1]=4 2576 B9R1.13 O=C(Cl)NC1CCCC1 Amb35637068 [1,0,0,1,0,0|2,0,0]=4 2577 B9R1.13 O=C(Cl)OC1CCCC1 Amb10070029 [1,0,0,1,0,0|2,0,0]=4 2578 B9R1.13 O=C(O)C=C1CCCC1 Amb4036043 [1,0,0,1,0,0|0,0,0]=2 2579 B9R1.13 O=C(O)C=C1NCCN1 Amb18832637 [1,0,0,1,0,0|2,0,0]=4 2580 B9R1.13 O=C(O)CC1=CCCC1 Amb18642404 [1,0,0,1,0,0|0,0,2]=4 2581 B9R1.13 O=C(O)CC1CCCC1 Amb16192937 [1,0,0,1,0,0|0,0,1]=3 2582 B9R1.13 O=C(O)CC1CCCC1 Amb3939847 [1,0,0,1,0,0|0,0,1]=3 2583 B9R1.13 O=C(O)CC1CCCN1 Amb20668514 [1,0,0,1,0,0|1,0,1]=4 2584 B9R1.13 O=C(O)CC1CCCN1 Amb8387921 [1,0,0,1,0,0|1,0,1]=4 2585 B9R1.13 O=C(O)CC1CCCO1 Amb9713389 [1,0,0,1,0,0|1,0,1]=4 2586 B9R1.13 O=C(O)CC1CCNC1 Amb2695002 [1,0,0,1,0,0|1,0,1]=4 2587 B9R1.13 O=C(O)CC1CCNC1 Amb33549788 [1,0,0,1,0,0|1,0,1]=4 2588 B9R1.13 O=C(O)CC1CCOC1 Amb2696440 [1,0,0,1,0,0|1,0,1]=4 2589 B9R1.13 O=C(O)CC1CCSC1 Amb18202318 [1,0,0,1,0,0|1,0,1]=4 2590 B9R1.13 O=C(O)CN1CCCC1 Amb535912 [1,0,0,1,0,0|1,0,1]=4 2591 B9R1.13 O=C(O)CN1CCCC1 Amb9677391 [1,0,0,1,0,0|1,0,1]=4 2592 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb13891876 [1,0,0,1,0,0|1,0,1]=4 2593 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb8630792 [1,0,0,1,0,0|1,0,1]=4 2594 B9R1.13 O=C(O)C[C@@H]1CCCO1 Amb24271115 [1,0,0,1,0,0|1,0,1]=4 2595 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb10067024 [1,0,0,1,0,0|1,0,1]=4 2596 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb26948232 [1,0,0,1,0,0|1,0,1]=4 2597 B9R1.13 O=C(O)C[C@@H]1CCOC1 Amb25887272 [1,0,0,1,0,0|1,0,1]=4 2598 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb16184011 [1,0,0,1,0,0|1,0,1]=4 2599 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb33295230 [1,0,0,1,0,0|1,0,1]=4 2600 B9R1.13 O=C(O)C[C@H]1CCCO1 Amb24271109 [1,0,0,1,0,0|1,0,1]=4 2601 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb2696648 [1,0,0,1,0,0|1,0,1]=4 2602 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb8384306 [1,0,0,1,0,0|1,0,1]=4 2603 B9R1.13 O=C(O)C[C@H]1CCOC1 Amb23401495 [1,0,0,1,0,0|1,0,1]=4 2604 B9R1.13 O=C(O)\C=C1\CCNC1 Amb21953701 [1,0,0,1,0,0|1,0,0]=3 2605 B9R1.13 O=C(O)\C=C1\CCOC1 Amb27837480 [1,0,0,1,0,0|1,0,0]=3 2606 B9R1.13 O=C(O)\C=C1\CCSC1 Amb26390862 [1,0,0,1,0,0|1,0,0]=3 2607 B9R1.13 O=[N+]([O-])C=C1CCCC1 Amb32755996 [1,0,0,1,0,0|1,0,1]=4 2608 B9R1.41 CC(=O)C1=C(C)CCC1 Amb27602304 [1,0,0,1,0,0|1,0,1]=4 2609 B9R1.41 CC(=O)C1=CCCC1O Amb27634181 [1,0,0,1,0,0|2,0,0]=4 2610 B9R1.41 CC(=O)C1=CCC[C@@H]1C Amb27668819 [1,0,0,1,0,0|1,0,0]=3 2611 B9R1.41 CC(=O)N1CCCC1C Amb26494370 [1,0,0,1,0,0|2,0,0]=4 2612 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1C Amb24692616 [1,0,0,1,0,0|1,0,1]=4 2613 B9R1.41 CC(=O)[C@H]1CCC[C@H]1C Amb27428390 [1,0,0,1,0,0|1,0,1]=4 2614 B9R1.41 CC1=C(C(=O)O)CCC1 Amb4021851 [1,0,0,1,0,0|0,0,1]=3 2615 B9R1.41 CC1=C(C(=O)O)CCN1 Amb32672006 [1,0,0,1,0,0|1,0,1]=4 2616 B9R1.41 CC1=C(C(=O)O)CCO1 Amb26326654 [1,0,0,1,0,0|1,0,1]=4 2617 B9R1.41 CC1=C(C(=O)O)CCS1 Amb24750254 [1,0,0,1,0,0|1,0,1]=4 2618 B9R1.41 CC1=C(C(=O)O)CNC1 Amb28188857 [1,0,0,1,0,0|1,0,1]=4 2619 B9R1.41 CC1CCCC1C(=O)Cl Amb26447682 [1,0,0,1,0,0|1,0,1]=4 2620 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [1,0,0,1,0,0|0,0,1]=3 2621 B9R1.41 CC1CCCN1C(=O)Cl Amb25131803 [1,0,0,1,0,0|2,0,0]=4 2622 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [1,0,0,1,0,0|1,0,1]=4 2623 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [1,0,0,1,0,0|1,0,1]=4 2624 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [1,0,0,1,0,0|1,0,1]=4 2625 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [1,0,0,1,0,0|1,0,1]=4 2626 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [1,0,0,1,0,0|1,0,1]=4 2627 B9R1.41 CC1CNCC1C(=O)O Amb2695368 [1,0,0,1,0,0|1,0,1]=4 2628 B9R1.41 CC1CNCC1C(=O)O Amb32665482 [1,0,0,1,0,0|1,0,1]=4 2629 B9R1.41 CC1NCC=C1C(=O)O Amb27603549 [1,0,0,1,0,0|1,0,0]=3 2630 B9R1.41 CC1NCCC1C(=O)O Amb18118138 [1,0,0,1,0,0|1,0,1]=4 2631 B9R1.41 CC1NCCC1C(=O)O Amb28555367 [1,0,0,1,0,0|1,0,1]=4 2632 B9R1.41 CC1OCCC1C(=O)O Amb33548509 [1,0,0,1,0,0|1,0,1]=4 2633 B9R1.41 CN1CCCC1C(=O)O Amb33545070 [1,0,0,1,0,0|1,0,1]=4 2634 B9R1.41 CN1CCCC1C(=O)O Amb8559038 [1,0,0,1,0,0|1,0,1]=4 2635 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb17935722 [1,0,0,1,0,0|1,0,1]=4 2636 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb18559228 [1,0,0,1,0,0|1,0,1]=4 2637 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb22748316 [1,0,0,1,0,0|1,0,1]=4 2638 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [1,0,0,1,0,0|1,0,1]=4 2639 B9R1.41 CN1CCC[C@H]1C(=O)O Amb22587172 [1,0,0,1,0,0|1,0,1]=4 2640 B9R1.41 CN1CCC[C@H]1C(=O)O Amb9825903 [1,0,0,1,0,0|1,0,1]=4 2641 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [1,0,0,1,0,0|0,0,1]=3 2642 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [1,0,0,1,0,0|0,0,1]=3 2643 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [1,0,0,1,0,0|0,0,1]=3 2644 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [1,0,0,1,0,0|1,0,1]=4 2645 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [1,0,0,1,0,0|1,0,1]=4 2646 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [1,0,0,1,0,0|1,0,1]=4 2647 B9R1.41 C[C@@H]1CNC[C@@H]1C(=O)O Amb27440055 [1,0,0,1,0,0|1,0,1]=4 2648 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb26442159 [1,0,0,1,0,0|1,0,1]=4 2649 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb32664837 [1,0,0,1,0,0|1,0,1]=4 2650 B9R1.41 C[C@@H]1COC[C@H]1C(=O)O Amb28286229 [1,0,0,1,0,0|1,0,1]=4 2651 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O Amb27969130 [1,0,0,1,0,0|1,0,1]=4 2652 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O Amb18832568 [1,0,0,1,0,0|1,0,1]=4 2653 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O Amb22886528 [1,0,0,1,0,0|1,0,1]=4 2654 B9R1.41 C[C@@H]1OCC[C@H]1C(=O)O Amb25992190 [1,0,0,1,0,0|1,0,1]=4 2655 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [1,0,0,1,0,0|0,0,1]=3 2656 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [1,0,0,1,0,0|0,0,1]=3 2657 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [1,0,0,1,0,0|1,0,1]=4 2658 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Amb27217270 [1,0,0,1,0,0|1,0,1]=4 2659 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O Amb27655604 [1,0,0,1,0,0|1,0,1]=4 2660 B9R1.41 C[C@H]1OCC[C@H]1C(=O)O Amb25253338 [1,0,0,1,0,0|1,0,1]=4 2661 B9R1.41 NC1=C(C(=O)O)CCC1 Amb20240586 [1,0,0,1,0,0|1,0,1]=4 2662 B9R1.41 NC1CCCC1C(=O)O Amb2697364 [1,0,0,1,0,0|1,0,1]=4 2663 B9R1.41 NC1CCCC1C(=O)O Amb8630257 [1,0,0,1,0,0|1,0,1]=4 2664 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8387462 [1,0,0,1,0,0|1,0,1]=4 2665 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8516030 [1,0,0,1,0,0|1,0,1]=4 2666 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb20241297 [1,0,0,1,0,0|1,0,1]=4 2667 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb33524005 [1,0,0,1,0,0|1,0,1]=4 2668 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb20241298 [1,0,0,1,0,0|1,0,1]=4 2669 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb22224860 [1,0,0,1,0,0|1,0,1]=4 2670 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [1,0,0,1,0,0|1,0,1]=4 2671 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [1,0,0,1,0,0|1,0,1]=4 2672 B9R1.41 O=C(O)C1=C(Cl)CCC1 Amb2612728 [1,0,0,1,0,0|1,0,1]=4 2673 B9R1.41 O=C(O)C1=C(S)CCC1 Amb27815303 [1,0,0,1,0,0|1,0,1]=4 2674 B9R1.41 O=C(O)C1=CCCC1O Amb27251744 [1,0,0,1,0,0|1,0,0]=3 2675 B9R1.41 O=C(O)C1=NCCC1O Amb28137087 [1,0,0,1,0,0|2,0,0]=4 2676 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [1,0,0,1,0,0|1,0,1]=4 2677 B9R1.41 O=C(O)C1CCCC1S Amb18280971 [1,0,0,1,0,0|1,0,1]=4 2678 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [1,0,0,1,0,0|1,0,1]=4 2679 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [1,0,0,1,0,0|1,0,1]=4 2680 B9R1.46 CC(=O)CCC1CC1C Amb25873753 [1,0,0,1,0,0|1,0,1]=4 2681 B9R1.46 CC(=O)OCC1CC1C Amb27836351 [1,0,0,1,0,0|2,0,0]=4 2682 B9R1.46 CC(=O)SCC1CC1C Amb27965313 [1,0,0,1,0,0|2,0,0]=4 2683 B9R1.46 CC(=O)\C=C\C1CC1C Amb33143910 [1,0,0,1,0,0|1,0,0]=3 2684 B9R1.46 CC(=O)\C=C\[C@@H]1O[C@H]1C Amb26924328 [1,0,0,1,0,0|2,0,0]=4 2685 B9R1.46 CC1CC1C#CC(=O)O Amb24390173 [1,0,0,1,0,0|0,0,2]=4 2686 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [1,0,0,1,0,0|0,0,1]=3 2687 B9R1.46 CC1CC1CNC(=O)Cl Amb35625728 [1,0,0,1,0,0|2,0,0]=4 2688 B9R1.46 CC1CC1COC(=O)Cl Amb33296958 [1,0,0,1,0,0|2,0,0]=4 2689 B9R1.46 CC1CC1OCC(=O)O Amb33144889 [1,0,0,1,0,0|1,0,1]=4 2690 B9R1.46 CC1CC1\C=C\C(=O)O Amb33226425 [1,0,0,1,0,0|0,0,0]=2 2691 B9R1.46 CC1CC1\C=C\[N+](=O)[O-] Amb33144896 [1,0,0,1,0,0|1,0,1]=4 2692 B9R1.46 C[C@@H]1O[C@H]1\C=C\C(=O)O Amb27191995 [1,0,0,1,0,0|1,0,0]=3 2693 B9R1.46 C[C@H]1O[C@H]1\C=C\C(=O)O Amb27614487 [1,0,0,1,0,0|1,0,0]=3 2694 B9R1.48 CC1CCC=CC(=O)C1 Amb28460736 [1,0,0,1,0,0|1,0,0]=3 2695 B9R1.48 CC1CCC=CC(O)C1 Amb28400665 [1,0,0,1,0,0|1,0,1]=4 2696 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [1,0,0,1,0,0|1,0,1]=4 2697 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [1,0,0,1,0,0|1,0,1]=4 2698 B9R1.48 CC1CCCCC(=O)O1 Amb27792220 [1,0,0,1,0,0|0,0,1]=3 2699 B9R1.48 CC1CCCNC(=O)C1 Amb28364919 [1,0,0,1,0,0|2,0,0]=4 2700 B9R1.48 C[C@@H]1CCCCC(=O)C1 Amb26030783 [1,0,0,1,0,0|1,0,1]=4 2701 B9R1.48 C[C@@H]1CCCNC(=O)C1 Amb28241573 [1,0,0,1,0,0|2,0,0]=4 2702 B9R1.48 C[C@H]1CCCNC(=O)C1 Amb27174761 [1,0,0,1,0,0|2,0,0]=4 2703 B9R1.48 O=C1C=CCC[C@H](O)C1 Amb27838758 [1,0,0,1,0,0|2,0,0]=4 2704 B9R1.48 O=C1CCCCC(O)O1 Amb27424648 [1,0,0,1,0,0|1,0,1]=4 2705 B9R1.59 CCCC1CC1C(=O)O Amb19001459 [1,0,0,1,0,0|0,0,1]=3 2706 B9R1.59 CCCC1OC1C(=O)O Amb24561183 [1,0,0,1,0,0|1,0,1]=4 2707 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O Amb9901777 [1,0,0,1,0,0|0,0,1]=3 2708 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O Amb25368727 [1,0,0,1,0,0|0,0,1]=3 2709 B9R1.59 CCC[C@@H]1C[C@H]1C(N)=O Amb27837259 [1,0,0,1,0,0|1,0,1]=4 2710 B9R1.59 CCC[C@@H]1O[C@H]1C(=O)O Amb27422047 [1,0,0,1,0,0|1,0,1]=4 2711 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O Amb27782329 [1,0,0,1,0,0|0,0,1]=3 2712 B9R1.59 CCC[C@H]1O[C@@H]1C(=O)O Amb27625884 [1,0,0,1,0,0|1,0,1]=4 2713 B9R1.59 CCOC1CC1C(=O)O Amb9677563 [1,0,0,1,0,0|1,0,1]=4 2714 B9R1.59 CCO[C@@H]1C[C@@H]1C(=O)O Amb27818165 [1,0,0,1,0,0|1,0,1]=4 2715 B9R1.59 CCO[C@@H]1C[C@H]1C(=O)O Amb25959626 [1,0,0,1,0,0|1,0,1]=4 2716 B9R1.59 COCC1CC1C(=O)O Amb27404704 [1,0,0,1,0,0|1,0,1]=4 2717 B9R1.59 COC[C@@H]1C[C@H]1C(=O)O Amb33098418 [1,0,0,1,0,0|1,0,1]=4 2718 B9R1.59 COC[C@H]1C[C@H]1C(=O)O Amb33098416 [1,0,0,1,0,0|1,0,1]=4 2719 B9R1.59 CSCC1CC1C(=O)O Amb33272939 [1,0,0,1,0,0|1,0,1]=4 2720 B9R1.59 CSC[C@@H]1C[C@H]1C(=O)O Amb33272937 [1,0,0,1,0,0|1,0,1]=4 2721 B9R1.59 O=C(O)C1CC1CCF Amb33196442 [1,0,0,1,0,0|1,0,1]=4 2722 B9R1.59 O=C(O)[C@@H]1C[C@H]1CCF Amb33196453 [1,0,0,1,0,0|1,0,1]=4 2723 B9R1.67 CC(=O)\C=C1/CCC1C Amb28251863 [1,0,0,1,0,0|1,0,0]=3 2724 B9R1.67 CC1CCC1NC(=O)Cl Amb35633330 [1,0,0,1,0,0|2,0,0]=4 2725 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [1,0,0,1,0,0|1,0,1]=4 2726 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [1,0,0,1,0,0|1,0,1]=4 2727 B9R1.67 O=C(O)CC1CCC1F Amb33351668 [1,0,0,1,0,0|1,0,1]=4 2728 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [1,0,0,1,0,0|1,0,1]=4 2729 B9R1.84 CC(=O)OCC1CCC1 Amb27980327 [1,0,0,1,0,0|2,0,0]=4 2730 B9R1.84 CC(=O)\C=C\C1CCC1 Amb33448508 [1,0,0,1,0,0|1,0,0]=3 2731 B9R1.84 CC(O)\C=C\C1CCC1 Amb27645263 [1,0,0,1,0,0|1,0,1]=4 2732 B9R1.84 NC(=O)CCC1CCC1 Amb27196680 [1,0,0,1,0,0|1,0,1]=4 2733 B9R1.84 NC(=O)\C=C\C1CCC1 Amb27615014 [1,0,0,1,0,0|1,0,0]=3 2734 B9R1.84 O=C(Cl)NCC1CCC1 Amb35625731 [1,0,0,1,0,0|2,0,0]=4 2735 B9R1.84 O=C(Cl)OCC1CCC1 Amb24551352 [1,0,0,1,0,0|2,0,0]=4 2736 B9R1.84 O=C(O)C#CC1CCC1 Amb26413119 [1,0,0,1,0,0|0,0,2]=4 2737 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [1,0,0,1,0,0|0,0,1]=3 2738 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [1,0,0,1,0,0|1,0,1]=4 2739 B9R1.84 O=C(O)CCN1CCC1 Amb22292346 [1,0,0,1,0,0|1,0,1]=4 2740 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [1,0,0,1,0,0|1,0,1]=4 2741 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [1,0,0,1,0,0|1,0,1]=4 2742 B9R1.84 O=C(O)COC1CCC1 Amb18295877 [1,0,0,1,0,0|1,0,1]=4 2743 B9R1.84 O=C(O)\C=C\C1CCC1 Amb20624021 [1,0,0,1,0,0|0,0,0]=2 2744 B9R1.84 O=C(O)\C=C\N1CCC1 Amb27494371 [1,0,0,1,0,0|1,0,0]=3 2745 B9R1.84 O=[N+]([O-])\C=C\C1CCC1 Amb32953886 [1,0,0,1,0,0|1,0,1]=4 2746 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [1,0,0,1,0,0|1,0,1]=4 2747 B9R1.85 CC(=O)\C=C\CC1CC1 Amb33361179 [1,0,0,1,0,0|1,0,0]=3 2748 B9R1.85 CC(C)=CCCC1CC1 Amb30023883 [1,0,0,1,0,0|2,0,0]=4 2749 B9R1.85 NC(=O)CCCC1CC1 Amb28193047 [1,0,0,1,0,0|1,0,1]=4 2750 B9R1.85 O=C(Cl)NCCC1CC1 Amb35633396 [1,0,0,1,0,0|2,0,0]=4 2751 B9R1.85 O=C(Cl)OCCC1CC1 Amb27162058 [1,0,0,1,0,0|2,0,0]=4 2752 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [1,0,0,1,0,0|0,0,1]=3 2753 B9R1.85 O=C(O)CCCC1CO1 Amb28453878 [1,0,0,1,0,0|1,0,1]=4 2754 B9R1.85 O=C(O)CCC[C@@H]1CO1 Amb27257665 [1,0,0,1,0,0|1,0,1]=4 2755 B9R1.85 O=C(O)CCNC1CC1 Amb1106410 [1,0,0,1,0,0|1,0,1]=4 2756 B9R1.85 O=C(O)CCNC1CC1 Amb532234 [1,0,0,1,0,0|1,0,1]=4 2757 B9R1.85 O=C(O)CCOC1CC1 Amb25926315 [1,0,0,1,0,0|1,0,1]=4 2758 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [1,0,0,1,0,0|1,0,1]=4 2759 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [1,0,0,1,0,0|1,0,1]=4 2760 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [1,0,0,1,0,0|1,0,1]=4 2761 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [1,0,0,1,0,0|1,0,1]=4 2762 B9R1.85 O=C(O)\C=C\CC1CC1 Amb33362399 [1,0,0,1,0,0|0,0,0]=2 2763 B9R1.85 O=C(O)\C=C\NC1CC1 Amb22363623 [1,0,0,1,0,0|1,0,0]=3 2764 B9R1.85 O=C(O)\C=N\OC1CC1 Amb26008284 [1,0,0,1,0,0|2,0,0]=4 2765 B9R1.85 O=[N+]([O-])\C=C\CC1CC1 Amb33361207 [1,0,0,1,0,0|1,0,1]=4 2766 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [1,0,0,1,0,0|0,0,1]=3 2767 B9R1.86 CCC1CC1NC(=O)Cl Amb35633240 [1,0,0,1,0,0|2,0,0]=4 2768 B9R1.86 CC[C@@H]1C[C@H]1NC(C)=O Amb28190147 [1,0,0,1,0,0|2,0,0]=4 2769 B9R1.86 CC[C@@H]1C[C@H]1NC(N)=O Amb28455899 [1,0,0,1,0,0|2,0,0]=4 2770 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [1,0,0,1,0,0|1,0,1]=4 2771 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [1,0,0,1,0,0|0,0,1]=3 2772 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [1,0,0,1,0,0|1,0,1]=4 2773 B9R1.96 CCN1CCC1C(=O)O Amb22011877 [1,0,0,1,0,0|1,0,1]=4 2774 B9R1.96 CCN1CC[C@@H]1C(=O)O Amb24634744 [1,0,0,1,0,0|1,0,1]=4 2775 B9R1.96 CCN1CC[C@H]1C(=O)O Amb25347394 [1,0,0,1,0,0|1,0,1]=4 2776 B9R1.96 COC1CCC1C(=O)O Amb26516125 [1,0,0,1,0,0|1,0,1]=4 2777 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O Amb34912847 [1,0,0,1,0,0|1,0,1]=4 2778 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O Amb26636288 [1,0,0,1,0,0|1,0,1]=4 2779 B9R1.96 NC[C@@H]1CC[C@H]1C(=O)O Amb27259838 [1,0,0,1,0,0|1,0,1]=4 2780 B9R1.96 O=C(O)C1CCC1CF Amb20667674 [1,0,0,1,0,0|1,0,1]=4 2781 B9R1.96 O=C(O)C1CCC1CO Amb24340315 [1,0,0,1,0,0|1,0,1]=4 2782 B9R1.96 O=C(O)N1CCC1CO Amb22756926 [1,0,0,1,0,0|2,0,0]=4 2783 B11R1.15 CCCC(C)C1CNC(=O)O1 Amb26501463 [0,1,0,1,0,0|1,0,1]=4 2784 B11R1.15 CCCC(N)c1ccc(Br)o1 Amb27398949 [0,1,0,1,0,0|1,0,1]=4 2785 B11R1.15 CCCC(N)c1ccc(C)o1 Amb18293648 [0,1,0,1,0,0|1,0,1]=4 2786 B11R1.15 CCCC(N)c1ccc(Cl)o1 Amb27404607 [0,1,0,1,0,0|1,0,1]=4 2787 B11R1.15 CCCC(O)C1C=CC(=O)O1 Amb28042330 [0,1,0,1,0,0|0,0,0]=2 2788 B11R1.15 CCC[C@@H](N)c1ccc(C)o1 Amb27592440 [0,1,0,1,0,0|1,0,1]=4 2789 B11R1.15 CCC[C@@H](O)[C@@H]1CCC(=O)O1 Amb27980571 [0,1,0,1,0,0|0,0,2]=4 2790 B11R1.15 CCC[C@@H](O)[C@@H]1COC(=O)O1 Amb27651732 [0,1,0,1,0,0|1,0,1]=4 2791 B11R1.15 CCC[C@@H](O)[C@H]1CCC(=O)O1 Amb28064044 [0,1,0,1,0,0|0,0,2]=4 2792 B11R1.15 CCC[C@H](N)c1ccc(C)o1 Amb27874045 [0,1,0,1,0,0|1,0,1]=4 2793 B11R1.15 CCC[C@H](N)c1ccc(Cl)o1 Amb28423474 [0,1,0,1,0,0|1,0,1]=4 2794 B11R1.15 C[C@H](CC=O)[C@@H]1C=CC(=O)O1 Amb27799812 [0,1,0,1,0,0|1,0,1]=4 2795 B11R1.15 C\C=C\[C@@H](O)[C@@H]1C=CC(=O)O1 Amb27219013 [0,1,0,1,0,0|0,0,2]=4 2796 B11R1.15 C\C=C\[C@H](O)C1C=CC(=O)O1 Amb27970588 [0,1,0,1,0,0|0,0,2]=4 2797 B11R1.15 C\C=C\[C@H](O)[C@H]1C=CC(=O)O1 Amb27427713 [0,1,0,1,0,0|0,0,2]=4 2798 B11R1.90 CC(=O)N\N=C1/CCCC1C Amb28063730 [0,1,0,1,0,0|2,0,0]=4 2799 B11R1.90 CC(=O)\C=C\C1CCOC1C Amb33426816 [0,1,0,1,0,0|1,0,0]=3 2800 B11R1.90 CC1CCCN1\C=C\C(=O)O Amb27644330 [0,1,0,1,0,0|0,0,0]=2 2801 B11R1.90 CC1CCNC1C#CC(=O)O Amb33169032 [0,1,0,1,0,0|0,0,2]=4 2802 B11R1.90 CC1COCC1NCC(=O)O Amb35632271 [0,1,0,1,0,0|1,0,1]=4 2803 B11R1.90 CC1CSCC1NCC(=O)O Amb27652020 [0,1,0,1,0,0|1,0,1]=4 2804 B11R1.90 CC1NCCC1C#CC(=O)O Amb33169066 [0,1,0,1,0,0|0,0,2]=4 2805 B11R1.90 CC1OCCC1C#CC(=O)O Amb28182482 [0,1,0,1,0,0|0,0,2]=4 2806 B11R1.90 CC1OCCC1CCC(=O)O Amb33427953 [0,1,0,1,0,0|0,0,2]=4 2807 B11R1.90 CC1OCCC1OCC(=O)O Amb33426781 [0,1,0,1,0,0|1,0,1]=4 2808 B11R1.90 CC1OCCC1\C=C\C(=O)O Amb33427648 [0,1,0,1,0,0|0,0,0]=2 2809 B11R1.90 CC1OCCC1\C=C\[N+](=O)[O-] Amb33427186 [0,1,0,1,0,0|1,0,1]=4 2810 B11R1.90 CN1CCCC1C#CC(=O)O Amb33168996 [0,1,0,1,0,0|0,0,2]=4 2811 B11R1.90 CN1CCCC1CCC(=O)O Amb17504569 [0,1,0,1,0,0|0,0,2]=4 2812 B11R1.90 CN1CCCC1CCC(=O)O Amb28872305 [0,1,0,1,0,0|0,0,2]=4 2813 B11R1.90 CN1CCC[C@@H]1\C=C\C(=O)O Amb33714876 [0,1,0,1,0,0|0,0,0]=2 2814 B11R1.90 C[C@H]1CCC[C@@H]1CCC(=O)O Amb28455731 [0,1,0,1,0,0|0,0,2]=4 2815 B11R1.90 N[C@@H]1CCC[C@H]1CCC(=O)O Amb28244799 [0,1,0,1,0,0|0,0,2]=4 2816 B11R1.90 O=C(O)CCC1CCCC1F Amb27623706 [0,1,0,1,0,0|0,0,2]=4 2817 B11R1.90 O=C(O)CSC1CCCC1O Amb18292041 [0,1,0,1,0,0|1,0,1]=4 2818 B11R1.120 CCCC1CC(CC(=O)O)C1 Amb25384948 [0,1,0,1,0,0|0,0,2]=4 2819 B11R1.120 CCOC1CC(=CC(C)=O)C1 Amb28280502 [0,1,0,1,0,0|2,0,0]=4 2820 B11R1.124 CCCC1CCC(C(=O)O)O1 Amb27857074 [0,1,0,1,0,0|0,0,2]=4 2821 B11R1.124 CCCC1CC[C@@H](C(=O)O)N1 Amb27478099 [0,1,0,1,0,0|0,0,2]=4 2822 B11R1.124 CCCC1CN[C@H](C(=O)O)C1 Amb24487717 [0,1,0,1,0,0|1,0,1]=4 2823 B11R1.124 CCC[C@@H]1CC[C@@H](C(=O)O)N1 Amb28400213 [0,1,0,1,0,0|0,0,2]=4 2824 B11R1.124 CCC[C@H]1CN[C@H](C(=O)O)C1 Amb26636529 [0,1,0,1,0,0|1,0,1]=4 2825 B11R1.124 CCCc1cc(C(=O)O)co1 Amb27231823 [0,1,0,1,0,0|1,0,1]=4 2826 B11R1.124 CCCc1cc(C(=O)O)cs1 Amb2154727 [0,1,0,1,0,0|1,0,1]=4 2827 B11R1.124 CCCc1ccc(C(=O)O)o1 Amb1074343 [0,1,0,1,0,0|0,0,2]=4 2828 B11R1.124 CCCc1ccc(C(=O)O)s1 Amb2721770 [0,1,0,1,0,0|0,0,2]=4 2829 B11R1.124 CCCc1nc(C(=O)O)co1 Amb18296164 [0,1,0,1,0,0|1,0,1]=4 2830 B11R1.124 CCCc1nc(C(=O)O)cs1 Amb33532474 [0,1,0,1,0,0|1,0,1]=4 2831 B11R1.124 CCCc1ncc(C(=O)O)s1 Amb33532475 [0,1,0,1,0,0|1,0,1]=4 2832 B11R1.124 CCCn1cc(C(=O)O)cn1 Amb33531904 [0,1,0,1,0,0|2,0,0]=4 2833 B11R1.124 CCCn1ccc(C(=O)O)n1 Amb2692981 [0,1,0,1,0,0|1,0,1]=4 2834 B11R1.130 CCOC1CC1C#CC(=O)O Amb35671227 [0,1,0,1,0,0|0,0,2]=4 2835 B11R1.154 C=C1CN(C\C=C\C(=O)O)C1 Amb35605512 [0,1,0,1,0,0|1,0,1]=4 2836 B11R1.154 CC1CC(N\C=C\C(=O)O)C1 Amb27495128 [0,1,0,1,0,0|1,0,0]=3 2837 B11R1.154 O=C(O)\C=C\CN1CC(F)C1 Amb27618834 [0,1,0,1,0,0|1,0,0]=3 2838 B11R1.154 O=C(O)\C=C\NC1CC(O)C1 Amb27406190 [0,1,0,1,0,0|1,0,0]=3 2839 B11R1.157 C=C(C)\C=C1\CCCC(N)C1 Amb28197088 [0,1,0,1,0,0|2,0,0]=4 2840 B11R1.157 CC(=O)CC1CC=CC(=O)C1 Amb27785422 [0,1,0,1,0,0|1,0,1]=4 2841 B11R1.157 CC(=O)\C=C1/CCCC(C)C1 Amb28284820 [0,1,0,1,0,0|1,0,0]=3 2842 B11R1.157 CC(=O)\C=C1/CCCC(C)N1 Amb27446720 [0,1,0,1,0,0|1,0,0]=3 2843 B11R1.157 CC(C)CC1CC=CC(=O)O1 Amb27172421 [0,1,0,1,0,0|0,0,0]=2 2844 B11R1.157 CC(C)CC1CC=CC(=S)N1 Amb28255431 [0,1,0,1,0,0|1,1,0]=4 2845 B11R1.157 CC(O)CC1CCCC(=O)O1 Amb28065238 [0,1,0,1,0,0|0,0,2]=4 2846 B11R1.157 CC1=C\C(=C\C(=O)O)CCC1 Amb27433953 [0,1,0,1,0,0|0,0,1]=3 2847 B11R1.157 CC1CCCC(CC(=O)O)C1 Amb6749251 [0,1,0,1,0,0|0,0,2]=4 2848 B11R1.157 CC1CCCC(CC(=O)O)N1 Amb8387931 [0,1,0,1,0,0|0,0,2]=4 2849 B11R1.157 CC1CCCC(CC(=O)O)O1 Amb18126127 [0,1,0,1,0,0|0,0,2]=4 2850 B11R1.157 CC1CCCN(CC(=O)O)C1 Amb2721846 [0,1,0,1,0,0|1,0,1]=4 2851 B11R1.157 CC1CCC\C(=C\C(=O)O)C1 Amb33189155 [0,1,0,1,0,0|0,0,0]=2 2852 B11R1.157 CC1CCC\C(=C\C(N)=O)C1 Amb28285397 [0,1,0,1,0,0|1,0,0]=3 2853 B11R1.157 CN1CCC\C(=C/C(=O)O)C1 Amb31161564 [0,1,0,1,0,0|1,0,0]=3 2854 B11R1.157 C[C@@H](O)C[C@@H]1C=CCC(=O)O1 Amb27792014 [0,1,0,1,0,0|0,0,2]=4 2855 B11R1.157 C[C@@H](O)C[C@@H]1CC=CC(=O)O1 Amb27632728 [0,1,0,1,0,0|0,0,0]=2 2856 B11R1.157 C[C@@H](O)C[C@H]1CCCC(=O)O1 Amb27213971 [0,1,0,1,0,0|0,0,2]=4 2857 B11R1.157 C[C@@H]1CCC[C@H](CC(=O)O)O1 Amb27657703 [0,1,0,1,0,0|0,0,2]=4 2858 B11R1.157 C[C@H](O)C[C@@H]1CCCC(=O)O1 Amb27218939 [0,1,0,1,0,0|0,0,2]=4 2859 B11R1.157 NC(=O)\C=C1/CCCC(N)C1 Amb27202549 [0,1,0,1,0,0|1,0,0]=3 2860 B11R1.157 O=C(O)CC1CCCC(F)C1 Amb24651233 [0,1,0,1,0,0|0,0,2]=4 2861 B11R1.157 O=C(O)CC1CCCC(O)C1 Amb18645020 [0,1,0,1,0,0|0,0,2]=4 2862 B11R1.157 O=C(O)CN1CCCC(F)C1 Amb30028543 [0,1,0,1,0,0|1,0,1]=4 2863 B11R1.157 O=C(O)CN1CCCC(O)C1 Amb15701257 [0,1,0,1,0,0|1,0,1]=4 2864 B11R1.157 O=C(O)CN1CCC[C@@H](O)C1 Amb22224754 [0,1,0,1,0,0|1,0,1]=4 2865 B11R1.157 O=C(O)CN1CCC[C@H](O)C1 Amb22224789 [0,1,0,1,0,0|1,0,1]=4 2866 B11R1.157 O=C(O)C[C@@H]1CCC[C@@H](F)C1 Amb34912969 [0,1,0,1,0,0|0,0,2]=4 2867 B11R1.157 O=C(O)C[C@H]1CCC[C@@H](F)C1 Amb34912973 [0,1,0,1,0,0|0,0,2]=4 2868 B11R1.166 CC1CC=C(C(=O)Cl)C(C)O1 Amb25095328 [0,1,0,1,0,0|2,0,0]=4 2869 B11R1.166 CC1CNC(C(=O)O)C(C)C1 Amb26560226 [0,1,0,1,0,0|1,0,1]=4 2870 B11R1.166 CC1CNC(C(=O)O)C(C)C1 Amb33338906 [0,1,0,1,0,0|1,0,1]=4 2871 B11R1.166 C[C@@H]1CC=C(C(=O)O)[C@@H](O)C1 Amb27668943 [0,1,0,1,0,0|1,0,0]=3 2872 B11R1.166 C[C@@H]1O[C@H](C)CC=C1C(=O)Cl Amb24689432 [0,1,0,1,0,0|2,0,0]=4 2873 B11R1.166 C[C@@H]1O[C@H](C)CC=C1C(=O)O Amb27233465 [0,1,0,1,0,0|1,0,0]=3 2874 B11R1.166 C[C@@H]1O[C@H](C)CC=C1C(N)=O Amb28052003 [0,1,0,1,0,0|2,0,0]=4 2875 B11R1.166 C[C@H]1CC=C(C(=O)O)[C@H](C)O1 Amb27976681 [0,1,0,1,0,0|1,0,0]=3 2876 B11R1.172 CC(=O)N\N=C\C1CCCC1 Amb28065424 [0,1,0,1,0,0|2,0,0]=4 2877 B11R1.172 CC(=O)\C=C\CC1CCCC1 Amb33378003 [0,1,0,1,0,0|1,0,0]=3 2878 B11R1.172 O=C(Cl)\C=C\CN1CCCC1 Amb8388224 [0,1,0,1,0,0|1,0,0]=3 2879 B11R1.172 O=C(O)C#CCC1CCCC1 Amb28370188 [0,1,0,1,0,0|0,0,2]=4 2880 B11R1.172 O=C(O)CC#CC1CCCC1 Amb26346554 [0,1,0,1,0,0|0,0,2]=4 2881 B11R1.172 O=C(O)CCCC1CCCC1 Amb19149142 [0,1,0,1,0,0|0,0,2]=4 2882 B11R1.172 O=C(O)CCCC1CCCN1 Amb18199969 [0,1,0,1,0,0|0,0,2]=4 2883 B11R1.172 O=C(O)CCCC1CCCO1 Amb26990705 [0,1,0,1,0,0|0,0,2]=4 2884 B11R1.172 O=C(O)CCCC1CCCS1 Amb26659241 [0,1,0,1,0,0|0,0,2]=4 2885 B11R1.172 O=C(O)CCCC1CCOC1 Amb24755490 [0,1,0,1,0,0|0,0,2]=4 2886 B11R1.172 O=C(O)CCCC1CCSC1 Amb27989571 [0,1,0,1,0,0|0,0,2]=4 2887 B11R1.172 O=C(O)CCCN1CCCC1 Amb2607773 [0,1,0,1,0,0|0,0,2]=4 2888 B11R1.172 O=C(O)CCCN1CCCC1 Amb33551514 [0,1,0,1,0,0|0,0,2]=4 2889 B11R1.172 O=C(O)CCNC1CCCC1 Amb1109669 [0,1,0,1,0,0|0,0,2]=4 2890 B11R1.172 O=C(O)CCNC1CCCC1 Amb13951292 [0,1,0,1,0,0|0,0,2]=4 2891 B11R1.172 O=C(O)CCOC1CCCC1 Amb6275835 [0,1,0,1,0,0|0,0,2]=4 2892 B11R1.172 O=C(O)CCSC1CCCC1 Amb6274643 [0,1,0,1,0,0|0,0,2]=4 2893 B11R1.172 O=C(O)CNCC1CCCN1 Amb27673661 [0,1,0,1,0,0|1,0,1]=4 2894 B11R1.172 O=C(O)CNCC1CCCO1 Amb7766544 [0,1,0,1,0,0|1,0,1]=4 2895 B11R1.172 O=C(O)CNCC1CCOC1 Amb8827655 [0,1,0,1,0,0|1,0,1]=4 2896 B11R1.172 O=C(O)CNCC1CCSC1 Amb27989553 [0,1,0,1,0,0|1,0,1]=4 2897 B11R1.172 O=C(O)CNOC1CCCC1 Amb27271182 [0,1,0,1,0,0|1,0,1]=4 2898 B11R1.172 O=C(O)COCC1CCCC1 Amb21963936 [0,1,0,1,0,0|0,0,2]=4 2899 B11R1.172 O=C(O)COCC1CCCN1 Amb19516849 [0,1,0,1,0,0|1,0,1]=4 2900 B11R1.172 O=C(O)COCC1CCCN1 Amb22587360 [0,1,0,1,0,0|1,0,1]=4 2901 B11R1.172 O=C(O)COCC1CCCO1 Amb9720381 [0,1,0,1,0,0|1,0,1]=4 2902 B11R1.172 O=C(O)COCC1CCOC1 Amb18307774 [0,1,0,1,0,0|1,0,1]=4 2903 B11R1.172 O=C(O)CSCC1CCCO1 Amb9708921 [0,1,0,1,0,0|1,0,1]=4 2904 B11R1.172 O=C(O)C\C=C\C1CCCC1 Amb24473377 [0,1,0,1,0,0|0,0,0]=2 2905 B11R1.172 O=C(O)\C=C\C=C1CCCC1 Amb27870905 [0,1,0,1,0,0|0,0,1]=3 2906 B11R1.172 O=C(O)\C=C\CC1CCCC1 Amb33172382 [0,1,0,1,0,0|0,0,0]=2 2907 B11R1.172 O=C(O)\C=C\CN1CCCC1 Amb33969252 [0,1,0,1,0,0|0,0,0]=2 2908 B11R1.172 O=C(O)\C=C\CN1CCCC1 Amb34916713 [0,1,0,1,0,0|0,0,0]=2 2909 B11R1.172 O=C(O)\C=C\NC1C=CCC1 Amb29855827 [0,1,0,1,0,0|0,0,2]=4 2910 B11R1.172 O=[N+]([O-])\C=C\CC1CCCC1 Amb33378375 [0,1,0,1,0,0|1,0,1]=4 2911 B11R1.172 OB(O)\C=C\CC1CCCC1 Amb22491038 [0,1,0,1,0,0|1,0,1]=4 2912 B11R1.241 CCC1CC1N\C=C\C(=O)O Amb28284841 [0,1,0,1,0,0|0,0,0]=2 2913 B11R1.563 CC1CCCC(O)CC(=O)O1 Amb27651827 [0,1,0,1,0,0|0,0,2]=4 2914 B11R1.563 C[C@@H]1CCC[C@@H](O)CC(=O)O1 Amb27485838 [0,1,0,1,0,0|0,0,2]=4 2915 B11R1.563 C[C@@H]1CCC[C@H](O)CC(=O)O1 Amb28207207 [0,1,0,1,0,0|0,0,2]=4 2916 B11R1.565 CC(=O)C1=CCCC(=O)CC1 Amb24357309 [0,1,0,1,0,0|1,0,1]=4 2917 B11R1.565 CC1CCCC(C(=O)O)CC1 Amb24487583 [0,1,0,1,0,0|0,0,2]=4 2918 B11R1.565 CC1CCNC(C(=O)O)CC1 Amb27441897 [0,1,0,1,0,0|1,0,1]=4 2919 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743493 [0,1,0,1,0,0|0,0,2]=4 2920 B11R1.565 NC1CCCC(C(=O)O)CC1 Amb33743673 [0,1,0,1,0,0|0,0,2]=4 2921 B11R1.645 CC1CC(O)CN1CC(=O)O Amb27483321 [0,1,0,1,0,0|1,0,1]=4 2922 B11R1.645 CC1C\C(=C/C(=O)O)C(C)O1 Amb28058986 [0,1,0,1,0,0|1,0,0]=3 2923 B11R1.720 CC(=O)\C=C\CC(C)C1CC1 Amb32729551 [0,1,0,1,0,0|1,0,0]=3 2924 B11R1.720 CC(CCCC(=O)O)C1CC1 Amb33473957 [0,1,0,1,0,0|0,0,2]=4 2925 B11R1.720 CC(COCC(=O)O)C1CC1 Amb32729522 [0,1,0,1,0,0|1,0,1]=4 2926 B11R1.720 CC(C\C=C\C(=O)O)C1CC1 Amb32728744 [0,1,0,1,0,0|0,0,0]=2 2927 B11R1.720 CC(C\C=C\[N+](=O)[O-])C1CC1 Amb32728584 [0,1,0,1,0,0|1,0,1]=4 2928 B11R1.720 NC(CC#CC(=O)O)C1CC1 Amb33169054 [0,1,0,1,0,0|0,0,2]=4 2929 B11R1.816 CCCC(C)C1CC1C(=O)O Amb26082561 [0,1,0,1,0,0|0,0,2]=4 2930 B11R1.816 CCCC(C)[C@@H]1C[C@H]1C(=O)O Amb33322343 [0,1,0,1,0,0|0,0,2]=4 2931 B11R1.924 CC1(CNCC(=O)O)CCC1 Amb27271467 [0,1,0,1,0,0|1,0,1]=4 2932 B11R1.924 CC1(COCC(=O)O)CCC1 Amb27988226 [0,1,0,1,0,0|1,0,1]=4 2933 B11R1.924 CC1(N\C=C\C(=O)O)CCC1 Amb27952002 [0,1,0,1,0,0|1,0,0]=3 2934 B11R1.924 O=C(O)CCCC1(O)CCC1 Amb28079693 [0,1,0,1,0,0|0,0,2]=4 2935 B11R1.24 CCCCC1=CC(=O)C=CS1 Amb27855025 [0,1,0,1,0,0|1,0,1]=4 2936 B11R1.24 CCCCC1=CN=CC(=O)N1 Amb28203913 [0,1,0,1,0,0|1,0,1]=4 2937 B11R1.24 CCCCC1=NC(=O)NC=C1 Amb27849977 [0,1,0,1,0,0|1,0,1]=4 2938 B11R1.24 CCCCC1=NC=CC(=O)N1 Amb27154437 [0,1,0,1,0,0|1,0,1]=4 2939 B11R1.24 CCCCC1C=CNC(=S)C1 Amb27470812 [0,1,0,1,0,0|1,1,0]=4 2940 B11R1.24 CCCCC1C=CNC(=S)N1 Amb27470810 [0,1,0,1,0,0|1,1,0]=4 2941 B11R1.24 CCCCC1CC=CC(=O)N1 Amb27483840 [0,1,0,1,0,0|1,0,0]=3 2942 B11R1.24 CCCC[C@H]1C=CCC(=O)N1 Amb27176608 [0,1,0,1,0,0|1,0,0]=3 2943 B11R1.24 CCCCc1cccc(O)c1 Amb26463186 [0,1,0,1,0,0|1,0,1]=4 2944 B11R1.24 CCCCc1ccnc(O)c1 Amb22749775 [0,1,0,1,0,0|1,0,1]=4 2945 B11R1.24 CCCCc1cncc(O)c1 Amb28383031 [0,1,0,1,0,0|1,0,1]=4 2946 B11R1.24 CCOCC1CC=CC(O)C1 Amb27665133 [0,1,0,1,0,0|1,0,1]=4 2947 B11R1.24 CSCCC1CC(=O)C=CO1 Amb27593061 [0,1,0,1,0,0|2,0,0]=4 2948 B11R1.24 O=C1C=CC[C@H](CCCO)O1 Amb27775902 [0,1,0,1,0,0|0,0,0]=2 2949 B11R1.24 O=C1C=CNC(CCCO)C1 Amb27875208 [0,1,0,1,0,0|2,0,0]=4 2950 B11R1.27 CCCCCC1=CC(=O)CC1 Amb27987060 [0,1,0,1,0,0|1,0,0]=3 2951 B11R1.27 CCCCCC1=CC(=O)CO1 Amb27672377 [0,1,0,1,0,0|0,0,0]=2 2952 B11R1.27 CCCCCC1=CC(O)CC1 Amb27987048 [0,1,0,1,0,0|1,0,1]=4 2953 B11R1.27 CCCCCC1=CCC(=O)N1 Amb25384805 [0,1,0,1,0,0|1,0,0]=3 2954 B11R1.27 CCCCCC1=CCC(=O)O1 Amb26998895 [0,1,0,1,0,0|0,0,0]=2 2955 B11R1.27 CCCCCC1=NNC(=O)O1 Amb24755475 [0,1,0,1,0,0|1,0,0]=3 2956 B11R1.27 CCCCCC1C=CC(=O)O1 Amb24766300 [0,1,0,1,0,0|0,0,0]=2 2957 B11R1.27 CCCCCC1CCC(=O)O1 Amb569744 [0,1,0,1,0,0|0,0,2]=4 2958 B11R1.27 CCCCCC1CNC(=O)O1 Amb27987874 [0,1,0,1,0,0|0,0,2]=4 2959 B11R1.27 CCCCC[C@H]1CCC(=O)O1 Amb22348365 [0,1,0,1,0,0|0,0,2]=4 2960 B11R1.27 CCCCCc1cc(C)no1 Amb26999508 [0,1,0,1,0,0|1,0,0]=3 2961 B11R1.27 CCCCCc1cc(N)cs1 Amb27988356 [0,1,0,1,0,0|1,1,0]=4 2962 B11R1.27 CCCCCc1cc(N)on1 Amb7786705 [0,1,0,1,0,0|1,0,0]=3 2963 B11R1.27 CCCCCc1ccc(Br)s1 Amb26081675 [0,1,0,1,0,0|1,1,0]=4 2964 B11R1.27 CCCCCc1ccc(C)o1 Amb27672035 [0,1,0,1,0,0|1,0,0]=3 2965 B11R1.27 CCCCCc1nc(C)no1 Amb28387210 [0,1,0,1,0,0|2,0,0]=4 2966 B11R1.27 CCCCCc1nnc(C)o1 Amb27988782 [0,1,0,1,0,0|2,0,0]=4 2967 B11R1.27 CCCCCc1nnc(Cl)o1 Amb27268999 [0,1,0,1,0,0|2,0,0]=4 2968 B11R1.27 CCCCCc1nnc(I)o1 Amb27269088 [0,1,0,1,0,0|2,0,0]=4 2969 B11R1.27 CCCCCc1nnc(N)o1 Amb7786618 [0,1,0,1,0,0|2,0,0]=4 2970 B11R1.27 CCCCCc1nnc(S)o1 Amb7802054 [0,1,0,1,0,0|1,1,0]=4 2971 B11R1.27 CCCCCc1noc(C)n1 Amb27988783 [0,1,0,1,0,0|2,0,0]=4 2972 B11R1.27 CCCCCn1cc(O)cn1 Amb25381711 [0,1,0,1,0,0|2,0,0]=4 2973 B11R1.27 CCCCCn1ccc(Br)n1 Amb27988786 [0,1,0,1,0,0|2,0,0]=4 2974 B11R1.27 CCCCCn1ccc(Cl)n1 Amb27988787 [0,1,0,1,0,0|2,0,0]=4 2975 B11R1.27 CCCCCn1ccc(I)n1 Amb28386943 [0,1,0,1,0,0|2,0,0]=4 2976 B11R1.27 CCCCCn1ccc(N)n1 Amb18791553 [0,1,0,1,0,0|2,0,0]=4 2977 B11R1.27 CCCCNc1cc(C)no1 Amb9782140 [0,1,0,1,0,0|2,0,0]=4 2978 B11R1.27 CCCCNc1coc(C)c1 Amb27484053 [0,1,0,1,0,0|2,0,0]=4 2979 B11R1.27 CCCCOC1C=CC(=O)N1 Amb27673614 [0,1,0,1,0,0|1,0,0]=3 2980 B11R1.27 CCCCSC1=CC(=O)CC1 Amb27272290 [0,1,0,1,0,0|2,0,0]=4 2981 B11R1.27 CCCCSc1ncc(I)o1 Amb27674372 [0,1,0,1,0,0|2,0,0]=4 2982 B11R1.27 CCCNCC1=CNC(=O)N1 Amb27673091 [0,1,0,1,0,0|2,0,0]=4 2983 B11R1.27 CCCNCC1CNC(=O)O1 Amb28352094 [0,1,0,1,0,0|1,0,1]=4 2984 B11R1.27 CCCNCc1cc(Br)co1 Amb28352096 [0,1,0,1,0,0|2,0,0]=4 2985 B11R1.27 CCCNCc1cc(C)on1 Amb18182914 [0,1,0,1,0,0|2,0,0]=4 2986 B11R1.27 CCCNCc1ccc(Br)o1 Amb6270338 [0,1,0,1,0,0|1,0,1]=4 2987 B11R1.27 CCCNCc1ccc(C)o1 Amb20673507 [0,1,0,1,0,0|1,0,1]=4 2988 B11R1.27 CCCNCc1ccc(C)o1 Amb2592337 [0,1,0,1,0,0|1,0,1]=4 2989 B11R1.27 CCCNCc1ccc(Cl)o1 Amb18303796 [0,1,0,1,0,0|1,0,1]=4 2990 B11R1.27 CCCNCc1cnc(O)s1 Amb27492009 [0,1,0,1,0,0|1,1,0]=4 2991 B11R1.27 CCCNCc1coc(Br)c1 Amb28387930 [0,1,0,1,0,0|2,0,0]=4 2992 B11R1.27 CCCOCC1=CC(=O)CC1 Amb27987814 [0,1,0,1,0,0|2,0,0]=4 2993 B11R1.27 CCCOCc1cc(C)no1 Amb28080385 [0,1,0,1,0,0|2,0,0]=4 2994 B11R1.27 CCCOCc1nc(O)cs1 Amb27989538 [0,1,0,1,0,0|2,0,0]=4 2995 B11R1.27 CCCSCC1=NOC(=O)N1 Amb27987051 [0,1,0,1,0,0|2,0,0]=4 2996 B11R1.27 CCCSCc1cc(C)no1 Amb28352099 [0,1,0,1,0,0|2,0,0]=4 2997 B11R1.27 CCCSCc1cc(C)on1 Amb28352100 [0,1,0,1,0,0|2,0,0]=4 2998 B11R1.27 CCCSCc1nc(O)cs1 Amb27989537 [0,1,0,1,0,0|2,0,0]=4 2999 B11R1.27 CCNCCc1ccc(Br)o1 Amb27670959 [0,1,0,1,0,0|1,0,1]=4 3000 B11R1.27 CCNCCc1ccc(C)o1 Amb27670957 [0,1,0,1,0,0|1,0,1]=4 3001 B11R1.27 CCNCCc1csc(O)n1 Amb28387040 [0,1,0,1,0,0|2,0,0]=4 3002 B11R1.27 CCNCCc1ncc(C)o1 Amb27492618 [0,1,0,1,0,0|2,0,0]=4 3003 B11R1.27 CCOCCc1cc(N)on1 Amb33528634 [0,1,0,1,0,0|2,0,0]=4 3004 B11R1.27 CCOCCc1nc(O)cs1 Amb27989541 [0,1,0,1,0,0|2,0,0]=4 3005 B11R1.27 CCSCCC1=CC(=O)CC1 Amb27492308 [0,1,0,1,0,0|2,0,0]=4 3006 B11R1.27 CNCCCc1ccc(Br)o1 Amb28387938 [0,1,0,1,0,0|1,0,1]=4 3007 B11R1.27 CNCCCc1ccc(C)o1 Amb18125591 [0,1,0,1,0,0|1,0,1]=4 3008 B11R1.27 CNCCCc1coc(Br)c1 Amb28387918 [0,1,0,1,0,0|2,0,0]=4 3009 B11R1.27 CNCCCc1ncc(C)o1 Amb27492608 [0,1,0,1,0,0|2,0,0]=4 3010 B11R1.27 COCCCC1=CC(=O)CC1 Amb27987926 [0,1,0,1,0,0|2,0,0]=4 3011 B11R1.27 COCCCC1=NNC(=O)O1 Amb27988307 [0,1,0,1,0,0|2,0,0]=4 3012 B11R1.27 COCCCc1nc(O)cs1 Amb27989540 [0,1,0,1,0,0|2,0,0]=4 3013 B11R1.27 CSCCCC1=CC(=O)CC1 Amb27492307 [0,1,0,1,0,0|2,0,0]=4 3014 B11R1.27 Cc1cc(CCCCN)no1 Amb18200713 [0,1,0,1,0,0|2,0,0]=4 3015 B11R1.27 Cc1cc(CCCCN)on1 Amb33326421 [0,1,0,1,0,0|2,0,0]=4 3016 B11R1.27 Cc1cc(CCCCO)on1 Amb25383000 [0,1,0,1,0,0|2,0,0]=4 3017 B11R1.27 Cc1ccc(CCCCBr)o1 Amb27672185 [0,1,0,1,0,0|1,0,1]=4 3018 B11R1.27 Cc1ccc(CCCCN)o1 Amb18831090 [0,1,0,1,0,0|1,0,1]=4 3019 B11R1.27 Cc1cnc(CCCCN)o1 Amb18830994 [0,1,0,1,0,0|2,0,0]=4 3020 B11R1.27 Cc1coc(CCCCN)c1 Amb18200981 [0,1,0,1,0,0|2,0,0]=4 3021 B11R1.27 NCCCCC1CCC(=O)O1 Amb27671667 [0,1,0,1,0,0|0,0,2]=4 3022 B11R1.27 NCCCCc1cc(Br)co1 Amb33431937 [0,1,0,1,0,0|2,0,0]=4 3023 B11R1.27 NCCCCc1ccc(Br)o1 Amb28387923 [0,1,0,1,0,0|1,0,1]=4 3024 B11R1.27 NCCCCc1ccc(Cl)o1 Amb18197810 [0,1,0,1,0,0|1,0,1]=4 3025 B11R1.27 NCCCCc1coc(Br)c1 Amb28387922 [0,1,0,1,0,0|2,0,0]=4 3026 B11R1.27 O=C1C=C(CCCCBr)CC1 Amb27673335 [0,1,0,1,0,0|2,0,0]=4 3027 B11R1.27 O=C1C=C(CCCCCl)CN1 Amb27990105 [0,1,0,1,0,0|2,0,0]=4 3028 B11R1.27 O=C1C=C[C@@H](CCCCO)O1 Amb27989710 [0,1,0,1,0,0|0,0,0]=2 3029 B11R1.27 OCCCCc1ccc(Br)o1 Amb27674012 [0,1,0,1,0,0|1,0,1]=4 3030 B11R1.27 OCCCCc1coc(Br)c1 Amb27674011 [0,1,0,1,0,0|2,0,0]=4 3031 B11R1.27 [N-]=[N+]=NCCC1C=CC(=O)O1 Amb28123165 [0,1,0,1,0,0|2,0,0]=4 3032 B11R1.53 CCC1=C(C(=O)Cl)CCCC1 Amb28324256 [0,1,0,1,0,0|1,0,1]=4 3033 B11R1.53 CCC1=C(C(=O)O)CCCO1 Amb24528967 [0,1,0,1,0,0|0,0,2]=4 3034 B11R1.53 CCC1CCCCC1C(=O)O Amb27606678 [0,1,0,1,0,0|0,0,2]=4 3035 B11R1.53 CCC1CCCNC1C(=O)O Amb26014486 [0,1,0,1,0,0|0,0,2]=4 3036 B11R1.53 CCC1CCNCC1C(=O)O Amb18199964 [0,1,0,1,0,0|0,0,2]=4 3037 B11R1.53 CCC1CNCCC1C(=O)O Amb33275584 [0,1,0,1,0,0|0,0,2]=4 3038 B11R1.53 CCC1COCCC1C(=O)O Amb27791043 [0,1,0,1,0,0|0,0,2]=4 3039 B11R1.53 CCC1NCCCC1C(=O)O Amb27858957 [0,1,0,1,0,0|0,0,2]=4 3040 B11R1.53 CCC1OCCCC1C(=O)O Amb26441727 [0,1,0,1,0,0|0,0,2]=4 3041 B11R1.53 CCN1CCCCC1C(=O)O Amb10603421 [0,1,0,1,0,0|0,0,2]=4 3042 B11R1.53 CCN1CCCCC1C(=O)O Amb9299667 [0,1,0,1,0,0|0,0,2]=4 3043 B11R1.53 CCN1CCCC[C@@H]1C(=O)O Amb27400269 [0,1,0,1,0,0|0,0,2]=4 3044 B11R1.53 CCN1CCCC[C@H]1C(=O)O Amb28244690 [0,1,0,1,0,0|0,0,2]=4 3045 B11R1.53 CC[C@@H]1CCCN[C@@H]1C(=O)O Amb28200831 [0,1,0,1,0,0|0,0,2]=4 3046 B11R1.53 CC[C@@H]1NCCC[C@H]1C(=O)O Amb18199984 [0,1,0,1,0,0|0,0,2]=4 3047 B11R1.53 CC[C@@H]1OCCC[C@@H]1C(=O)O Amb27858544 [0,1,0,1,0,0|0,0,2]=4 3048 B11R1.53 CC[C@H]1CC=CC[C@@H]1C(=O)O Amb27252233 [0,1,0,1,0,0|0,0,2]=4 3049 B11R1.53 CC[C@H]1CCCN[C@@H]1C(=O)O Amb27620290 [0,1,0,1,0,0|0,0,2]=4 3050 B11R1.53 CNC1CCCC=C1C(=O)O Amb27411507 [0,1,0,1,0,0|0,0,0]=2 3051 B11R1.53 CNC1CCCCC1C(=O)O Amb26595951 [0,1,0,1,0,0|0,0,2]=4 3052 B11R1.53 COC1CCCCC1C(=O)O Amb18967398 [0,1,0,1,0,0|0,0,2]=4 3053 B11R1.53 CO[C@H]1CCCC[C@@H]1C(=O)O Amb27845470 [0,1,0,1,0,0|0,0,2]=4 3054 B11R1.53 NCC1CCCCC1C(=O)O Amb18126060 [0,1,0,1,0,0|0,0,2]=4 3055 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb22901093 [0,1,0,1,0,0|0,0,2]=4 3056 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O Amb24602383 [0,1,0,1,0,0|0,0,2]=4 3057 B11R1.53 O=C(O)C1=CCCCC1CO Amb27401800 [0,1,0,1,0,0|0,0,0]=2 3058 B11R1.53 O=C(O)C1CCCCC1CCl Amb28121870 [0,1,0,1,0,0|0,0,2]=4 3059 B11R1.53 O=C(O)C1CCCCC1CF Amb20668097 [0,1,0,1,0,0|0,0,2]=4 3060 B11R1.53 O=C(O)C1CCCCC1CO Amb24484407 [0,1,0,1,0,0|0,0,2]=4 3061 B11R1.53 O=C(O)[C@H]1CCCC[C@H]1CO Amb24615220 [0,1,0,1,0,0|0,0,2]=4 3062 B11R1.57 CCC1CNCC1CC(=O)O Amb28198977 [0,1,0,1,0,0|0,0,2]=4 3063 B11R1.57 CCC1COCC1CC(=O)O Amb35631919 [0,1,0,1,0,0|0,0,2]=4 3064 B11R1.57 CCC1COC\C1=C/C(=O)O Amb35631904 [0,1,0,1,0,0|0,0,0]=2 3065 B11R1.57 CCC1COC\C1=C/C(C)=O Amb35616359 [0,1,0,1,0,0|1,0,0]=3 3066 B11R1.57 CCC1COC\C1=C/C(C)O Amb35586674 [0,1,0,1,0,0|1,0,1]=4 3067 B11R1.57 CCN1CCCC1CC(=O)O Amb17504530 [0,1,0,1,0,0|0,0,2]=4 3068 B11R1.57 CCN1CCCC1CC(=O)O Amb33550833 [0,1,0,1,0,0|0,0,2]=4 3069 B11R1.57 CCN1CCC\C1=C/[N+](=O)[O-] Amb2610617 [0,1,0,1,0,0|1,0,1]=4 3070 B11R1.57 CC[C@@H]1NCC[C@H]1CC(=O)O Amb18199980 [0,1,0,1,0,0|0,0,2]=4 3071 B11R1.57 CC[C@H]1NCC[C@@H]1CC(=O)O Amb28429151 [0,1,0,1,0,0|0,0,2]=4 3072 B11R1.57 COC1CCCC1CC(=O)O Amb18199909 [0,1,0,1,0,0|0,0,2]=4 3073 B11R1.57 NCC1CCCN1CC(=O)O Amb26998361 [0,1,0,1,0,0|1,0,1]=4 3074 B11R1.57 NC[C@@H]1CCCN1CC(=O)O Amb24737565 [0,1,0,1,0,0|1,0,1]=4 3075 B11R1.57 NC[C@@H]1CCC[C@H]1CC(=O)O Amb27967366 [0,1,0,1,0,0|0,0,2]=4 3076 B11R1.57 NC[C@H]1CCCN1CC(=O)O Amb25314232 [0,1,0,1,0,0|1,0,1]=4 3077 B11R1.57 O=C(O)CN1CCCC1CO Amb18984550 [0,1,0,1,0,0|1,0,1]=4 3078 B11R1.57 O=C(O)CN1CCC[C@H]1CO Amb10067045 [0,1,0,1,0,0|1,0,1]=4 3079 B11R1.86 CC(=O)CC1=C(C)CCCC1 Amb17593809 [0,1,0,1,0,0|1,0,1]=4 3080 B11R1.86 CC(=O)NC1=C(C)CCCC1 Amb17845068 [0,1,0,1,0,0|2,0,0]=4 3081 B11R1.86 CC(=O)OC1=C(C)CCCC1 Amb28284233 [0,1,0,1,0,0|2,0,0]=4 3082 B11R1.86 CC1CCCCC1CC(=O)O Amb6749252 [0,1,0,1,0,0|0,0,2]=4 3083 B11R1.86 CC1CCCCN1CC(=O)O Amb6356107 [0,1,0,1,0,0|0,0,2]=4 3084 B11R1.86 CC1CCNCC1CC(=O)O Amb28652859 [0,1,0,1,0,0|0,0,2]=4 3085 B11R1.86 CC1CCNCC1CC(=O)O Amb8387926 [0,1,0,1,0,0|0,0,2]=4 3086 B11R1.86 CC1CNCCC1CC(=O)O Amb8387925 [0,1,0,1,0,0|0,0,2]=4 3087 B11R1.86 CC1CNCCN1CC(=O)O Amb18286635 [0,1,0,1,0,0|1,0,1]=4 3088 B11R1.86 CC1CSCCN1CC(=O)O Amb27454283 [0,1,0,1,0,0|1,0,1]=4 3089 B11R1.86 CC1NCCCC1CC(=O)O Amb32662853 [0,1,0,1,0,0|0,0,2]=4 3090 B11R1.86 CC1NCCCC1CC(=O)O Amb8387928 [0,1,0,1,0,0|0,0,2]=4 3091 B11R1.86 CC1SCCCC1CC(=O)O Amb27235116 [0,1,0,1,0,0|0,0,2]=4 3092 B11R1.86 CN1CCCCC1CC(=O)O Amb1076959 [0,1,0,1,0,0|0,0,2]=4 3093 B11R1.86 CN1CCCCC1CC(=O)O Amb13885783 [0,1,0,1,0,0|0,0,2]=4 3094 B11R1.86 CN1CCCC\C1=N/C(N)=O Amb27966531 [0,1,0,1,0,0|2,0,0]=4 3095 B11R1.86 C[C@@H]1CNCCN1CC(=O)O Amb28314163 [0,1,0,1,0,0|1,0,1]=4 3096 B11R1.86 C[C@H]1CNCCN1CC(=O)O Amb25843322 [0,1,0,1,0,0|1,0,1]=4 3097 B11R1.86 NC(=O)\C=C1/CCCCC1O Amb27813333 [0,1,0,1,0,0|1,0,0]=3 3098 B11R1.86 NC1=C(CC(=O)O)CCCC1 Amb27657786 [0,1,0,1,0,0|0,0,2]=4 3099 B11R1.86 NC1CCCCC1CC(=O)O Amb24509773 [0,1,0,1,0,0|0,0,2]=4 3100 B11R1.86 NC1CCCCC1CC(=O)O Amb28652992 [0,1,0,1,0,0|0,0,2]=4 3101 B11R1.86 NC1CCCCN1CC(=O)O Amb25152865 [0,1,0,1,0,0|1,0,1]=4 3102 B11R1.86 NC1CCCC\C1=C/C(=O)O Amb28285400 [0,1,0,1,0,0|0,0,0]=2 3103 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Amb26528136 [0,1,0,1,0,0|0,0,2]=4 3104 B11R1.86 N[C@@H]1CCCC[C@@H]1CC(=O)O Amb32661117 [0,1,0,1,0,0|0,0,2]=4 3105 B11R1.86 N[C@@H]1CCCC[C@H]1CC(=O)O Amb28199039 [0,1,0,1,0,0|0,0,2]=4 3106 B11R1.86 N[C@H]1CCCC[C@H]1CC(=O)O Amb24561031 [0,1,0,1,0,0|0,0,2]=4 3107 B11R1.86 O=C(O)CC1CCCCC1F Amb24697602 [0,1,0,1,0,0|0,0,2]=4 3108 B11R1.86 O=C(O)CC1CCCCC1O Amb8009303 [0,1,0,1,0,0|0,0,2]=4 3109 B11R1.86 O=C(O)CC1CCCC[C@H]1O Amb25792260 [0,1,0,1,0,0|0,0,2]=4 3110 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1F Amb25168843 [0,1,0,1,0,0|0,0,2]=4 3111 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O Amb28057566 [0,1,0,1,0,0|0,0,2]=4 3112 B11R1.86 O=C(O)C[C@H]1CCCC[C@@H]1O Amb25274080 [0,1,0,1,0,0|0,0,2]=4 3113 B11R1.86 O=C(O)C[C@H]1CCCC[C@H]1O Amb27419962 [0,1,0,1,0,0|0,0,2]=4 3114 B11R1.86 O=C(O)\C=C1\CCCCC1O Amb27241357 [0,1,0,1,0,0|0,0,0]=2 3115 B11R1.86 O=C(O)\C=C1\COCCC1=O Amb24509316 [0,1,0,1,0,0|1,0,1]=4 3116 B11R1.91 CC(=O)C=C=C1CCCCC1 Amb26587266 [0,1,0,1,0,0|1,0,0]=3 3117 B11R1.91 CC(=O)NC=C1CCCCC1 Amb27754020 [0,1,0,1,0,0|1,0,0]=3 3118 B11R1.91 CC(=O)ON=C1CCCCC1 Amb27825886 [0,1,0,1,0,0|2,0,0]=4 3119 B11R1.91 CC(=O)\C=C/C1CCCCC1 Amb28141273 [0,1,0,1,0,0|1,0,0]=3 3120 B11R1.91 CC(=O)\C=C\C1C=CCCC1 Amb25735805 [0,1,0,1,0,0|1,0,1]=4 3121 B11R1.91 CC(=O)\C=C\C1CC=CCC1 Amb26936607 [0,1,0,1,0,0|1,0,1]=4 3122 B11R1.91 CC(=O)\C=C\C1CCCCC1 Amb24625780 [0,1,0,1,0,0|1,0,0]=3 3123 B11R1.91 CC(=O)\C=C\C1CCCCO1 Amb32953626 [0,1,0,1,0,0|1,0,0]=3 3124 B11R1.91 CC(=O)\C=C\C1CCCOC1 Amb33474258 [0,1,0,1,0,0|1,0,0]=3 3125 B11R1.91 CC(=O)\C=C\C1CCCSC1 Amb32954832 [0,1,0,1,0,0|1,0,0]=3 3126 B11R1.91 CC(=O)\C=C\C1CCOCC1 Amb33171968 [0,1,0,1,0,0|1,0,0]=3 3127 B11R1.91 CC(=O)\C=C\N1CCOCC1 Amb10565266 [0,1,0,1,0,0|2,0,0]=4 3128 B11R1.91 CC(=O)\C=N\C1CCCCC1 Amb28052310 [0,1,0,1,0,0|1,0,1]=4 3129 B11R1.91 CC(O)\C=C\C1CCCCC1 Amb26897095 [0,1,0,1,0,0|1,0,1]=4 3130 B11R1.91 NC(=O)C=C=C1CCCCC1 Amb27153201 [0,1,0,1,0,0|1,0,0]=3 3131 B11R1.91 NC(=O)CC=C1CCNCC1 Amb27224004 [0,1,0,1,0,0|2,0,0]=4 3132 B11R1.91 NC(=O)C\C=C1\CCCNC1 Amb27851574 [0,1,0,1,0,0|2,0,0]=4 3133 B11R1.91 NC(=O)NN=C1CCCCC1 Amb2610542 [0,1,0,1,0,0|2,0,0]=4 3134 B11R1.91 NC(=O)\C=C/C1CCNCC1 Amb27471045 [0,1,0,1,0,0|1,0,0]=3 3135 B11R1.91 NC(=O)\C=C\C1=CCCCC1 Amb27843456 [0,1,0,1,0,0|1,0,1]=4 3136 B11R1.91 NC(=O)\C=C\C1CC=CCC1 Amb27627437 [0,1,0,1,0,0|1,0,1]=4 3137 B11R1.91 NC(=S)\C=C\N1CCCCC1 Amb17477775 [0,1,0,1,0,0|1,1,0]=4 3138 B11R1.91 O=C(O)C#CC1=CCCCC1 Amb28458581 [0,1,0,1,0,0|0,0,2]=4 3139 B11R1.91 O=C(O)C#CC1CCCCC1 Amb21963916 [0,1,0,1,0,0|0,0,2]=4 3140 B11R1.91 O=C(O)C#CC1CCCCN1 Amb33168942 [0,1,0,1,0,0|0,0,2]=4 3141 B11R1.91 O=C(O)C#CC1CCCCO1 Amb25266171 [0,1,0,1,0,0|0,0,2]=4 3142 B11R1.91 O=C(O)C#CC1CCCCS1 Amb33169039 [0,1,0,1,0,0|0,0,2]=4 3143 B11R1.91 O=C(O)C#CC1CCCNC1 Amb28722508 [0,1,0,1,0,0|0,0,2]=4 3144 B11R1.91 O=C(O)C#CC1CCCNC1 Amb32664897 [0,1,0,1,0,0|0,0,2]=4 3145 B11R1.91 O=C(O)C#CC1CCCOC1 Amb25151250 [0,1,0,1,0,0|0,0,2]=4 3146 B11R1.91 O=C(O)C#CC1CCCSC1 Amb33169033 [0,1,0,1,0,0|0,0,2]=4 3147 B11R1.91 O=C(O)C#CC1CCNCC1 Amb27855658 [0,1,0,1,0,0|0,0,2]=4 3148 B11R1.91 O=C(O)C#CC1CCNCC1 Amb28721181 [0,1,0,1,0,0|0,0,2]=4 3149 B11R1.91 O=C(O)C#CC1CCOCC1 Amb33546193 [0,1,0,1,0,0|0,0,2]=4 3150 B11R1.91 O=C(O)C#CC1CCSCC1 Amb33169017 [0,1,0,1,0,0|0,0,2]=4 3151 B11R1.91 O=C(O)CC=C1CCNCC1 Amb27626202 [0,1,0,1,0,0|1,0,0]=3 3152 B11R1.91 O=C(O)CC=C1CCSCC1 Amb23441815 [0,1,0,1,0,0|1,0,0]=3 3153 B11R1.91 O=C(O)CCC1=CCCCC1 Amb25775024 [0,1,0,1,0,0|0,0,2]=4 3154 B11R1.91 O=C(O)CCC1CCCCC1 Amb3939828 [0,1,0,1,0,0|0,0,2]=4 3155 B11R1.91 O=C(O)CCC1CCCCN1 Amb1102729 [0,1,0,1,0,0|0,0,2]=4 3156 B11R1.91 O=C(O)CCC1CCCCN1 Amb8630249 [0,1,0,1,0,0|0,0,2]=4 3157 B11R1.91 O=C(O)CCC1CCCCO1 Amb17506864 [0,1,0,1,0,0|0,0,2]=4 3158 B11R1.91 O=C(O)CCC1CCCCS1 Amb33470228 [0,1,0,1,0,0|0,0,2]=4 3159 B11R1.91 O=C(O)CCC1CCCNC1 Amb10576190 [0,1,0,1,0,0|0,0,2]=4 3160 B11R1.91 O=C(O)CCC1CCCNC1 Amb1101056 [0,1,0,1,0,0|0,0,2]=4 3161 B11R1.91 O=C(O)CCC1CCCOC1 Amb33529911 [0,1,0,1,0,0|0,0,2]=4 3162 B11R1.91 O=C(O)CCC1CCCSC1 Amb18825218 [0,1,0,1,0,0|0,0,2]=4 3163 B11R1.91 O=C(O)CCC1CCC[NH2+]C1 Amb2694709 [0,1,0,1,0,0|0,0,2]=4 3164 B11R1.91 O=C(O)CCC1CCNCC1 Amb10609864 [0,1,0,1,0,0|0,0,2]=4 3165 B11R1.91 O=C(O)CCC1CCNCC1 Amb10609915 [0,1,0,1,0,0|0,0,2]=4 3166 B11R1.91 O=C(O)CCC1CCNCC1 Amb2696646 [0,1,0,1,0,0|0,0,2]=4 3167 B11R1.91 O=C(O)CCC1CCOCC1 Amb18990337 [0,1,0,1,0,0|0,0,2]=4 3168 B11R1.91 O=C(O)CCC1CCSCC1 Amb18197511 [0,1,0,1,0,0|0,0,2]=4 3169 B11R1.91 O=C(O)CCN1CCCCC1 Amb10609748 [0,1,0,1,0,0|0,0,2]=4 3170 B11R1.91 O=C(O)CCN1CCCCC1 Amb594197 [0,1,0,1,0,0|0,0,2]=4 3171 B11R1.91 O=C(O)CNC1=NCCCC1 Amb10976583 [0,1,0,1,0,0|1,0,1]=4 3172 B11R1.91 O=C(O)CNC1CCCCC1 Amb19263851 [0,1,0,1,0,0|0,0,2]=4 3173 B11R1.91 O=C(O)CNC1CCCCC1 Amb840542 [0,1,0,1,0,0|0,0,2]=4 3174 B11R1.91 O=C(O)CNC1CCCSC1 Amb18301750 [0,1,0,1,0,0|1,0,1]=4 3175 B11R1.91 O=C(O)CNC1CCNCC1 Amb18289709 [0,1,0,1,0,0|1,0,1]=4 3176 B11R1.91 O=C(O)CNC1CCNCC1 Amb24271155 [0,1,0,1,0,0|1,0,1]=4 3177 B11R1.91 O=C(O)CNC1CCOCC1 Amb9472619 [0,1,0,1,0,0|1,0,1]=4 3178 B11R1.91 O=C(O)COC1CCCCC1 Amb2693120 [0,1,0,1,0,0|0,0,2]=4 3179 B11R1.91 O=C(O)COC1CCCCO1 Amb28325642 [0,1,0,1,0,0|1,0,1]=4 3180 B11R1.91 O=C(O)COC1CCCNC1 Amb13783632 [0,1,0,1,0,0|1,0,1]=4 3181 B11R1.91 O=C(O)COC1CCCNC1 Amb32661916 [0,1,0,1,0,0|1,0,1]=4 3182 B11R1.91 O=C(O)COC1CCCOC1 Amb27467259 [0,1,0,1,0,0|1,0,1]=4 3183 B11R1.91 O=C(O)COC1CCCSC1 Amb25117929 [0,1,0,1,0,0|1,0,1]=4 3184 B11R1.91 O=C(O)COC1CCNCC1 Amb10603194 [0,1,0,1,0,0|1,0,1]=4 3185 B11R1.91 O=C(O)COC1CCNCC1 Amb21960053 [0,1,0,1,0,0|1,0,1]=4 3186 B11R1.91 O=C(O)COC1CCOCC1 Amb18975304 [0,1,0,1,0,0|1,0,1]=4 3187 B11R1.91 O=C(O)CSC1CCCCC1 Amb6537757 [0,1,0,1,0,0|0,0,2]=4 3188 B11R1.91 O=C(O)CSC1CCCCO1 Amb26481367 [0,1,0,1,0,0|1,0,1]=4 3189 B11R1.91 O=C(O)CSC1CCNCC1 Amb17502143 [0,1,0,1,0,0|1,0,1]=4 3190 B11R1.91 O=C(O)\C=C/C1=NCCCN1 Amb27771523 [0,1,0,1,0,0|1,0,1]=4 3191 B11R1.91 O=C(O)\C=C\C1=CCCCC1 Amb24670201 [0,1,0,1,0,0|0,0,1]=3 3192 B11R1.91 O=C(O)\C=C\C1=CCCSC1 Amb26944890 [0,1,0,1,0,0|0,0,2]=4 3193 B11R1.91 O=C(O)\C=C\C1=COCCC1 Amb27185804 [0,1,0,1,0,0|0,0,2]=4 3194 B11R1.91 O=C(O)\C=C\C1=NCCCN1 Amb28384352 [0,1,0,1,0,0|1,0,1]=4 3195 B11R1.91 O=C(O)\C=C\C1C=CCCC1 Amb27481955 [0,1,0,1,0,0|0,0,1]=3 3196 B11R1.91 O=C(O)\C=C\C1CC=CCC1 Amb3992530 [0,1,0,1,0,0|0,0,1]=3 3197 B11R1.91 O=C(O)\C=C\C1CCC=CO1 Amb25145804 [0,1,0,1,0,0|0,0,2]=4 3198 B11R1.91 O=C(O)\C=C\C1CCCCC1 Amb31330735 [0,1,0,1,0,0|0,0,0]=2 3199 B11R1.91 O=C(O)\C=C\C1CCCCO1 Amb33475332 [0,1,0,1,0,0|0,0,0]=2 3200 B11R1.91 O=C(O)\C=C\C1CCCCS1 Amb33470059 [0,1,0,1,0,0|0,0,0]=2 3201 B11R1.91 O=C(O)\C=C\C1CCCNC1 Amb27783604 [0,1,0,1,0,0|0,0,0]=2 3202 B11R1.91 O=C(O)\C=C\C1CCCOC1 Amb33042780 [0,1,0,1,0,0|0,0,0]=2 3203 B11R1.91 O=C(O)\C=C\C1CCCSC1 Amb33474065 [0,1,0,1,0,0|0,0,0]=2 3204 B11R1.91 O=C(O)\C=C\C1CCOCC1 Amb18961299 [0,1,0,1,0,0|0,0,0]=2 3205 B11R1.91 O=C(O)\C=C\C1CCSCC1 Amb27619229 [0,1,0,1,0,0|0,0,0]=2 3206 B11R1.91 O=C(O)\C=C\N1CCCCC1 Amb27217215 [0,1,0,1,0,0|0,0,0]=2 3207 B11R1.91 O=C(O)\C=C\N1CCNCC1 Amb27167288 [0,1,0,1,0,0|1,0,0]=3 3208 B11R1.91 O=C(O)\C=C\N1CCSCC1 Amb27173886 [0,1,0,1,0,0|1,0,0]=3 3209 B11R1.91 O=C(O)\C=N\N1CCOCC1 Amb24650917 [0,1,0,1,0,0|2,0,0]=4 3210 B11R1.91 O=[N+]([O-])\C=C\C1CCCCC1 Amb18181954 [0,1,0,1,0,0|1,0,1]=4 3211 B11R1.91 O=[N+]([O-])\C=C\C1CCCCO1 Amb29883980 [0,1,0,1,0,0|1,0,1]=4 3212 B11R1.91 O=[N+]([O-])\C=C\C1CCCOC1 Amb25862231 [0,1,0,1,0,0|1,0,1]=4 3213 B11R1.91 O=[N+]([O-])\C=C\C1CCCSC1 Amb33359131 [0,1,0,1,0,0|1,0,1]=4 3214 B11R1.91 O=[N+]([O-])\C=C\C1CCOCC1 Amb18797109 [0,1,0,1,0,0|1,0,1]=4 3215 B11R1.91 O=[N+]([O-])\C=C\N1CCCCC1 Amb2610733 [0,1,0,1,0,0|1,0,1]=4 3216 B11R1.91 OB(O)\C=C\C1CCCCC1 Amb33869732 [0,1,0,1,0,0|1,0,1]=4 3217 B11R1.91 OB(O)\C=C\C1CCCCO1 Amb27878866 [0,1,0,1,0,0|1,0,1]=4 3218 B11R1.101 O=C1C=CCCCCCCC1 Amb28254479 [0,1,0,1,0,0|1,0,0]=3 3219 B11R1.101 O=C1CC=CCCCCCC1 Amb26880464 [0,1,0,1,0,0|1,0,0]=3 3220 B11R1.101 O[C@H]1C=C=CCCCCCC1 Amb27207812 [0,1,0,1,0,0|1,0,1]=4 3221 B11R1.101 O[C@H]1C=CCCCCCCC1 Amb28206118 [0,1,0,1,0,0|1,0,1]=4 3222 B11R1.102 CC1CC1NC\C=C\C(=O)O Amb28386718 [0,1,0,1,0,0|0,0,0]=2 3223 B11R1.107 O=C1C=CCCCCC(=O)C1 Amb28144181 [0,1,0,1,0,0|1,0,1]=4 3224 B11R1.107 O=C1CCCCCCC(=O)C1 Amb17593852 [0,1,0,1,0,0|1,0,1]=4 3225 B11R1.107 O=C1CCCCCCC(=O)O1 Amb27437831 [0,1,0,1,0,0|2,0,0]=4 3226 B11R1.110 CCC[C@@H]1CCC=CC(=O)N1 Amb27960353 [0,1,0,1,0,0|1,0,0]=3 3227 B11R1.110 O=C1CCCCC(CCCl)O1 Amb27407753 [0,1,0,1,0,0|0,0,2]=4 3228 B11R1.110 O=C1CCCC[C@@H](CCO)O1 Amb27197176 [0,1,0,1,0,0|0,0,2]=4 3229 B11R1.143 CC(=O)C1=CCCCC=C1C Amb28054835 [0,1,0,1,0,0|1,0,1]=4 3230 B11R1.143 CC(=O)C1=CCCCCC1=O Amb25244207 [0,1,0,1,0,0|1,0,1]=4 3231 B11R1.143 CC(=O)C1CCCCCC1=O Amb18796759 [0,1,0,1,0,0|1,0,1]=4 3232 B11R1.143 CC(O)C1=C(Cl)CCCCC1 Amb27662319 [0,1,0,1,0,0|1,0,1]=4 3233 B11R1.143 CC1CCNCCC1C(=O)O Amb27445777 [0,1,0,1,0,0|0,0,2]=4 3234 B11R1.143 CC1CCOCCC1C(=O)O Amb27861013 [0,1,0,1,0,0|0,0,2]=4 3235 B11R1.143 CC1NCCCCC1C(=O)O Amb27597000 [0,1,0,1,0,0|0,0,2]=4 3236 B11R1.143 CN1CCCCCC1C(=O)O Amb3941310 [0,1,0,1,0,0|0,0,2]=4 3237 B11R1.143 CN1CCCCCC1C(=O)O Amb8503498 [0,1,0,1,0,0|0,0,2]=4 3238 B11R1.143 C[C@@H]1NCCCC[C@H]1C(=O)O Amb18199981 [0,1,0,1,0,0|0,0,2]=4 3239 B11R1.143 C[C@H]1NCCCC[C@@H]1C(=O)O Amb27420245 [0,1,0,1,0,0|0,0,2]=4 3240 B11R1.143 NC1CCCCCC1C(=O)O Amb2694961 [0,1,0,1,0,0|0,0,2]=4 3241 B11R1.143 NC1CCCCCC1C(=O)O Amb8630073 [0,1,0,1,0,0|0,0,2]=4 3242 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1993851 [0,1,0,1,0,0|0,0,2]=4 3243 B11R1.143 N[C@@H]1CCCCC[C@@H]1C(=O)O Amb1994004 [0,1,0,1,0,0|0,0,2]=4 3244 B11R1.143 N[C@@H]1CCCCC[C@H]1C(=O)O Amb27635591 [0,1,0,1,0,0|0,0,2]=4 3245 B11R1.143 N[C@H]1CCCCC[C@@H]1C(=O)O Amb28411250 [0,1,0,1,0,0|0,0,2]=4 3246 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1993850 [0,1,0,1,0,0|0,0,2]=4 3247 B11R1.143 N[C@H]1CCCCC[C@H]1C(=O)O Amb1994003 [0,1,0,1,0,0|0,0,2]=4 3248 B11R1.143 O=C(O)C1=C(Cl)CCCCC1 Amb27858604 [0,1,0,1,0,0|0,0,0]=2 3249 B11R1.143 O=C(O)C1CCCCCC1O Amb18280963 [0,1,0,1,0,0|0,0,2]=4 3250 B11R1.143 O=C(O)C1CCCCCC1S Amb18949212 [0,1,0,1,0,0|0,0,2]=4 3251 B11R1.143 O=C(O)C1CCCCNC1=O Amb33803563 [0,1,0,1,0,0|1,0,1]=4 3252 B11R1.143 O=C(O)[C@@H]1CCCCC[C@@H]1O Amb27848050 [0,1,0,1,0,0|0,0,2]=4 3253 B11R1.143 O=C(O)[C@H]1CCCCC[C@@H]1O Amb27848051 [0,1,0,1,0,0|0,0,2]=4 3254 B11R1.143 O=C1CCCCCN1C(O)=S Amb27447243 [0,1,0,1,0,0|1,1,0]=4 3255 B11R1.161 CC1CCC1CCCC(=O)O Amb27266949 [0,1,0,1,0,0|0,0,2]=4 3256 B11R1.161 CC1CCC1NCCC(=O)O Amb27270129 [0,1,0,1,0,0|0,0,2]=4 3257 B11R1.174 O=C(O)C#CCOC1CCC1 Amb28132228 [0,1,0,1,0,0|0,0,2]=4 3258 B11R1.174 O=C(O)\C=C\CNC1CCC1 Amb28386721 [0,1,0,1,0,0|0,0,0]=2 3259 B11R1.174 O=C(O)\C=C\CNC1COC1 Amb28386732 [0,1,0,1,0,0|1,0,0]=3 3260 B11R1.174 O=C(O)\C=C\COC1CCC1 Amb19020651 [0,1,0,1,0,0|0,0,0]=2 3261 B11R1.174 O=C(O)\C=C\CSC1COC1 Amb27271347 [0,1,0,1,0,0|1,0,0]=3 3262 B11R1.174 O=C(O)\C=C\NCC1CCC1 Amb27495005 [0,1,0,1,0,0|0,0,0]=2 3263 B11R1.174 O=C(O)\C=C\NCC1CSC1 Amb35638850 [0,1,0,1,0,0|1,0,0]=3 3264 B11R1.176 O=C(O)CCCOCC1CC1 Amb6680910 [0,1,0,1,0,0|0,0,2]=4 3265 B11R1.176 O=C(O)\C=C\NCCC1CC1 Amb28386716 [0,1,0,1,0,0|0,0,0]=2 3266 B11R1.193 CCCC1CCCC1C(=O)O Amb18644850 [0,1,0,1,0,0|0,0,2]=4 3267 B11R1.193 CCCC1CCNC1C(=O)O Amb25241187 [0,1,0,1,0,0|0,0,2]=4 3268 B11R1.193 CCCC1CCNC1C(=O)O Amb28652947 [0,1,0,1,0,0|0,0,2]=4 3269 B11R1.193 CCCC1CCN[C@@H]1C(=O)O Amb28340938 [0,1,0,1,0,0|0,0,2]=4 3270 B11R1.193 CCCC1COCC1C(=O)O Amb27864218 [0,1,0,1,0,0|0,0,2]=4 3271 B11R1.193 CCCN1CCCC1C(=O)O Amb9704298 [0,1,0,1,0,0|0,0,2]=4 3272 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27591265 [0,1,0,1,0,0|0,0,2]=4 3273 B11R1.193 CCCN1CCC[C@@H]1C(=O)O Amb27839891 [0,1,0,1,0,0|0,0,2]=4 3274 B11R1.193 CCCN1CCC[C@H]1C(=O)O Amb25864864 [0,1,0,1,0,0|0,0,2]=4 3275 B11R1.193 CCC[C@@H]1CC=C[C@H]1C(C)=O Amb27629704 [0,1,0,1,0,0|1,0,0]=3 3276 B11R1.193 CCC[C@@H]1CCC[C@@H]1C(=O)O Amb27878683 [0,1,0,1,0,0|0,0,2]=4 3277 B11R1.193 CCC[C@@H]1CCN[C@H]1C(=O)O Amb26452406 [0,1,0,1,0,0|0,0,2]=4 3278 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992396 [0,1,0,1,0,0|0,0,2]=4 3279 B11R1.193 CCC[C@@H]1CNC[C@H]1C(=O)O Amb32992397 [0,1,0,1,0,0|0,0,2]=4 3280 B11R1.193 CCCc1ccsc1C(=O)O Amb29884498 [0,1,0,1,0,0|0,0,2]=4 3281 B11R1.193 CCCc1ncoc1C(=O)O Amb24423448 [0,1,0,1,0,0|1,0,1]=4 3282 B11R1.193 CCCc1ncsc1C(=O)O Amb17219818 [0,1,0,1,0,0|1,0,1]=4 3283 B11R1.193 CCCc1nocc1C(=O)O Amb27162996 [0,1,0,1,0,0|1,0,1]=4 3284 B11R1.193 CCCc1occc1C(=O)O Amb24549237 [0,1,0,1,0,0|0,0,2]=4 3285 B11R1.193 CCCc1ocnc1C(=O)O Amb8010410 [0,1,0,1,0,0|1,0,1]=4 3286 B11R1.193 CCCc1oncc1C(=O)O Amb8873733 [0,1,0,1,0,0|1,0,1]=4 3287 B11R1.193 CCCc1scnc1C(=O)O Amb3938738 [0,1,0,1,0,0|1,0,1]=4 3288 B11R1.193 CCCn1cccc1C(=O)O Amb33532892 [0,1,0,1,0,0|0,0,2]=4 3289 B11R1.193 CCCn1cncc1C(=O)O Amb18679873 [0,1,0,1,0,0|1,0,1]=4 3290 B11R1.193 CCCn1nccc1C(=O)O Amb2692980 [0,1,0,1,0,0|1,0,1]=4 3291 B11R1.193 CCCn1nncc1C(=O)O Amb17534541 [0,1,0,1,0,0|2,0,0]=4 3292 B11R1.193 CCOC1=C(C(=O)O)CCC1 Amb24487805 [0,1,0,1,0,0|0,0,2]=4 3293 B11R1.193 CNCC1CCCC1C(=O)O Amb27654981 [0,1,0,1,0,0|0,0,2]=4 3294 B11R1.193 COCC1CCCC1C(=O)O Amb25200900 [0,1,0,1,0,0|0,0,2]=4 3295 B11R1.193 COC[C@@H]1CCC[C@@H]1C(=O)O Amb27758197 [0,1,0,1,0,0|0,0,2]=4 3296 B11R1.193 COC[C@H]1CCC[C@H]1C(=O)O Amb25295380 [0,1,0,1,0,0|0,0,2]=4 3297 B11R1.193 COC[C@H]1CCO[C@H]1C(=O)O Amb27867716 [0,1,0,1,0,0|1,0,1]=4 3298 B11R1.193 O=C(O)C1CCCC1CCF Amb27635907 [0,1,0,1,0,0|0,0,2]=4 3299 B11R1.204 CCCCC1=C(C(C)=O)CC1 Amb28080144 [0,1,0,1,0,0|1,0,1]=4 3300 B11R1.204 CSCCC1CCC1C(=O)O Amb27986354 [0,1,0,1,0,0|0,0,2]=4 3301 B11R1.204 O=C(O)C1NCC1CCCO Amb27673478 [0,1,0,1,0,0|1,0,1]=4 3302 B11R1.245 CCC1CCCC=CC(=O)C1 Amb27954110 [0,1,0,1,0,0|1,0,0]=3 3303 B11R1.271 CCC1CCN1CCC(=O)O Amb27986912 [0,1,0,1,0,0|0,0,2]=4 3304 B11R1.271 CCN1CCC1C#CC(=O)O Amb33169073 [0,1,0,1,0,0|0,0,2]=4 3305 B11R1.706 CC(=O)C1=CCC=CCCC1 Amb25713503 [0,1,0,1,0,0|1,0,1]=4 3306 B11R1.706 CC(=O)C1=CCCCCC=C1 Amb26569390 [0,1,0,1,0,0|1,0,1]=4 3307 B11R1.706 CC(=O)C1=CCCCCCC1 Amb27473365 [0,1,0,1,0,0|1,0,0]=3 3308 B11R1.706 CC(=O)C1C=CCCCCC1 Amb22011813 [0,1,0,1,0,0|1,0,0]=3 3309 B11R1.706 C\C(O)=C1/C=CCCCCC1 Amb26494049 [0,1,0,1,0,0|1,0,0]=3 3310 B11R1.706 O=C(O)C1=CCCCCC=C1 Amb26452545 [0,1,0,1,0,0|0,0,1]=3 3311 B11R1.706 O=C(O)C1C=CCCCCC1 Amb27401809 [0,1,0,1,0,0|0,0,0]=2 3312 B11R1.706 O=C(O)C1CCCCCCC1 Amb18278612 [0,1,0,1,0,0|0,0,2]=4 3313 B11R1.706 O=C(O)C1CCCCCCN1 Amb27760420 [0,1,0,1,0,0|0,0,2]=4 3314 B11R1.706 O=C(O)C1CCCCCCN1 Amb28652940 [0,1,0,1,0,0|0,0,2]=4 3315 B11R1.706 O=C(O)C1CCCSCCC1 Amb28239756 [0,1,0,1,0,0|0,0,2]=4 3316 B11R1.706 OB(O)C1=CCCCCCC1 Amb27664628 [0,1,0,1,0,0|1,0,1]=4 3317 B11R1.742 CC(=O)C=C1CCCCCC1 Amb27948607 [0,1,0,1,0,0|1,0,0]=3 3318 B11R1.742 CC(=O)CC1=CCCCCC1 Amb28122365 [0,1,0,1,0,0|1,0,0]=3 3319 B11R1.742 CC(=O)\C=C1\CCCSCC1 Amb35712539 [0,1,0,1,0,0|1,0,0]=3 3320 B11R1.742 CC(O)CC1=CCCCCC1 Amb28455629 [0,1,0,1,0,0|1,0,1]=4 3321 B11R1.742 CC(O)\C=C1\CCCSCC1 Amb35684779 [0,1,0,1,0,0|1,0,1]=4 3322 B11R1.742 NC(=O)\N=C1/CCCCCN1 Amb24607781 [0,1,0,1,0,0|2,0,0]=4 3323 B11R1.742 O=C(O)C=C1CCCCCC1 Amb6749176 [0,1,0,1,0,0|0,0,0]=2 3324 B11R1.742 O=C(O)CC1C=CCCCC1 Amb26951387 [0,1,0,1,0,0|0,0,2]=4 3325 B11R1.742 O=C(O)CC1CCCCCC1 Amb6749261 [0,1,0,1,0,0|0,0,2]=4 3326 B11R1.742 O=C(O)CC1CCCCCN1 Amb18199972 [0,1,0,1,0,0|0,0,2]=4 3327 B11R1.742 O=C(O)CC1CCCCCO1 Amb27823132 [0,1,0,1,0,0|0,0,2]=4 3328 B11R1.742 O=C(O)CC1CCCCNC1 Amb18199974 [0,1,0,1,0,0|0,0,2]=4 3329 B11R1.742 O=C(O)CC1CCCNCC1 Amb18199994 [0,1,0,1,0,0|0,0,2]=4 3330 B11R1.742 O=C(O)CC1CCCNCC1 Amb30584770 [0,1,0,1,0,0|0,0,2]=4 3331 B11R1.742 O=C(O)CC1CCCOCC1 Amb18199912 [0,1,0,1,0,0|0,0,2]=4 3332 B11R1.742 O=C(O)CC1CCCSCC1 Amb18197457 [0,1,0,1,0,0|0,0,2]=4 3333 B11R1.742 O=C(O)CN1CCCCCC1 Amb2536986 [0,1,0,1,0,0|0,0,2]=4 3334 B11R1.742 O=C(O)CN1CCCCCC1 Amb9677404 [0,1,0,1,0,0|0,0,2]=4 3335 B11R1.742 O=C(O)CN1CCCNCC1 Amb13952776 [0,1,0,1,0,0|1,0,1]=4 3336 B11R1.742 O=C(O)CN1CCCNCC1 Amb9380317 [0,1,0,1,0,0|1,0,1]=4 3337 B11R1.742 O=C(O)\C=C1\CCCOCC1 Amb28313065 [0,1,0,1,0,0|0,0,0]=2 3338 B11R1.742 O=C(O)\C=C1\CCCSCC1 Amb35691471 [0,1,0,1,0,0|0,0,0]=2 3339 B11R1.742 O=[N+]([O-])\C=C1/CCCCCN1 Amb21922604 [0,1,0,1,0,0|1,0,1]=4 3340 B11R1.753 CCCCOC1CC1C(=O)O Amb9677555 [0,1,0,1,0,0|0,0,2]=4 3341 B11R1.34 CCCC1=CC(O)=CC(=O)O1 Amb22753964 [0,1,0,1,0,0|0,0,2]=4 3342 B11R1.34 CCCC1CC(=O)C=C(C)C1 Amb20621716 [0,1,0,1,0,0|1,0,0]=3 3343 B11R1.34 CCCC1CC(=O)C=C(C)O1 Amb27802671 [0,1,0,1,0,0|1,0,0]=3 3344 B11R1.34 CCCC1CC(=O)CC(=O)C1 Amb1153836 [0,1,0,1,0,0|1,0,1]=4 3345 B11R1.34 CCCC1CC(=O)CC(=O)N1 Amb33228658 [0,1,0,1,0,0|1,0,1]=4 3346 B11R1.34 CCCC1CC(=O)NC(=O)N1 Amb28123466 [0,1,0,1,0,0|2,0,0]=4 3347 B11R1.34 CCCC1CC(=O)OC(=O)C1 Amb33374804 [0,1,0,1,0,0|2,0,0]=4 3348 B11R1.34 CCCC1CC(O)CC(=O)O1 Amb27970476 [0,1,0,1,0,0|0,0,2]=4 3349 B11R1.34 CCC[C@@H]1C[C@@H](O)CC(=O)O1 Amb27259046 [0,1,0,1,0,0|0,0,2]=4 3350 B11R1.34 CCC[C@H]1CC(=O)C=C(C)C1 Amb533075 [0,1,0,1,0,0|1,0,0]=3 3351 B11R1.34 CNCC1CC(=O)C=C(O)C1 Amb27637386 [0,1,0,1,0,0|2,0,0]=4 3352 B11R1.34 COCC1CC(=O)C=C(N)C1 Amb27823116 [0,1,0,1,0,0|2,0,0]=4 3353 B11R1.34 NCCC1CC(=O)C=C(O)C1 Amb24567874 [0,1,0,1,0,0|2,0,0]=4 3354 B11R1.43 CC(=O)\C=C1\CCC(CBr)O1 Amb27486279 [0,1,0,1,0,0|2,0,0]=4 3355 B11R1.43 CC(=O)\C=C1\CCC(CO)O1 Amb26447247 [0,1,0,1,0,0|2,0,0]=4 3356 B11R1.43 CCC1CCC(CC(=O)O)O1 Amb33100554 [0,1,0,1,0,0|0,0,2]=4 3357 B11R1.43 CCC1CCN(CC(=O)O)C1 Amb27483743 [0,1,0,1,0,0|1,0,1]=4 3358 B11R1.43 CCC1CC\C(=C/C(C)=O)O1 Amb27807032 [0,1,0,1,0,0|1,0,0]=3 3359 B11R1.43 CCC1CC\C(=C/C(C)O)C1 Amb28284921 [0,1,0,1,0,0|1,0,1]=4 3360 B11R1.43 CCC1CN=C(CC(=O)O)O1 Amb27958614 [0,1,0,1,0,0|1,0,1]=4 3361 B11R1.43 CCC1COC(CC(=O)O)=N1 Amb27804296 [0,1,0,1,0,0|1,0,1]=4 3362 B11R1.43 CCC1C\C(=C\C(=O)O)CO1 Amb35633933 [0,1,0,1,0,0|1,0,0]=3 3363 B11R1.43 CCC1C\C(=C\C(C)=O)CO1 Amb35634239 [0,1,0,1,0,0|2,0,0]=4 3364 B11R1.43 CCN1CC\C(=C/C(=O)O)C1 Amb31161565 [0,1,0,1,0,0|1,0,0]=3 3365 B11R1.43 CCN1CC\C(=C/C(C)=O)C1 Amb27466944 [0,1,0,1,0,0|2,0,0]=4 3366 B11R1.77 CC(=O)CC(=O)C1CCCC1 Amb18791570 [0,1,0,1,0,0|1,0,1]=4 3367 B11R1.77 CC(=O)\C=C(/C)N1CCCC1 Amb10070618 [0,1,0,1,0,0|2,0,0]=4 3368 B11R1.77 CC(=O)\C=C(/N)N1CCCC1 Amb28122503 [0,1,0,1,0,0|2,0,0]=4 3369 B11R1.77 CC(=O)\C=C(\C)C1CCCC1 Amb27866800 [0,1,0,1,0,0|1,0,0]=3 3370 B11R1.77 CC(=O)\C=C(\C)N1CCCC1 Amb2726201 [0,1,0,1,0,0|2,0,0]=4 3371 B11R1.77 CC(C)=CC(=O)C1CCCC1 Amb27640830 [0,1,0,1,0,0|2,0,0]=4 3372 B11R1.77 CC(CC(=O)O)C1CCCC1 Amb17506860 [0,1,0,1,0,0|0,0,2]=4 3373 B11R1.77 CN(CC(=O)O)C1CCCC1 Amb8873524 [0,1,0,1,0,0|1,0,1]=4 3374 B11R1.77 C\C(=C/C(=O)O)C1CCCC1 Amb17506859 [0,1,0,1,0,0|0,0,0]=2 3375 B11R1.77 C\C(=C/C(=O)O)C1CCCO1 Amb28136299 [0,1,0,1,0,0|1,0,0]=3 3376 B11R1.77 C\C(=C/C(=O)O)N1CCCC1 Amb24109437 [0,1,0,1,0,0|1,0,0]=3 3377 B11R1.77 NC(=O)NC(=O)C1CCCC1 Amb27763512 [0,1,0,1,0,0|2,0,0]=4 3378 B11R1.77 NC(CC(=O)O)C1CCCC1 Amb33529949 [0,1,0,1,0,0|0,0,2]=4 3379 B11R1.77 N[C@@H](CC(=O)O)C1CCCC1 Amb22748847 [0,1,0,1,0,0|0,0,2]=4 3380 B11R1.77 N[C@@H](CC(=O)O)C1CCCC1 Amb24670269 [0,1,0,1,0,0|0,0,2]=4 3381 B11R1.77 N[C@H](CC(=O)O)C1CCCC1 Amb28457173 [0,1,0,1,0,0|0,0,2]=4 3382 B11R1.77 O=C(O)CC(=O)N1CCCC1 Amb17400018 [0,1,0,1,0,0|1,0,1]=4 3383 B11R1.77 O=C(O)CC(O)C1CCCC1 Amb18990583 [0,1,0,1,0,0|0,0,2]=4 3384 B11R1.77 O=C(O)C[C@@H](O)C1CCCC1 Amb33315761 [0,1,0,1,0,0|0,0,2]=4 3385 B11R1.77 O=C(O)C[C@H](O)C1CCCC1 Amb33315762 [0,1,0,1,0,0|0,0,2]=4 3386 B11R1.88 CC1CCCC1(N)CC(=O)O Amb26436834 [0,1,0,1,0,0|0,0,2]=4 3387 B11R1.88 CC1CCCC1(O)CC(=O)O Amb32680042 [0,1,0,1,0,0|0,0,2]=4 3388 B11R1.106 CC1CC1CN(C)CC(=O)O Amb27269828 [0,1,0,1,0,0|1,0,1]=4 3389 B11R1.141 CC1CCC1N(C)CC(=O)O Amb28423679 [0,1,0,1,0,0|1,0,1]=4 3390 B11R1.156 CC(=O)C1=C(C)CCCC1=O Amb24486039 [0,1,0,1,0,0|1,0,1]=4 3391 B11R1.156 CC1=CCCC(C)C1C(=O)O Amb24351203 [0,1,0,1,0,0|0,0,2]=4 3392 B11R1.156 CC1CCCC(O)C1C(=O)O Amb28422448 [0,1,0,1,0,0|0,0,2]=4 3393 B11R1.156 CC1CCCN(C)C1C(=O)O Amb27945655 [0,1,0,1,0,0|1,0,1]=4 3394 B11R1.156 C[C@H]1CCC[C@@H](N)[C@H]1C(=O)O Amb27818148 [0,1,0,1,0,0|0,0,2]=4 3395 B11R1.156 C\C(O)=C1/C(=O)CCCC1C Amb27250773 [0,1,0,1,0,0|1,0,0]=3 3396 B11R1.156 C\C(O)=C1/C(=O)OCCC1C Amb27779735 [0,1,0,1,0,0|2,0,0]=4 3397 B11R1.230 C=CCCC1OC(=O)C=C1O Amb24738417 [0,1,0,1,0,0|0,0,2]=4 3398 B11R1.230 CC1=CC(=O)OC1CCC=O Amb27799786 [0,1,0,1,0,0|1,0,1]=4 3399 B11R1.230 CCCCC1CC(=O)NC1=O Amb27392115 [0,1,0,1,0,0|2,0,0]=4 3400 B11R1.230 CCCCC1CC(=O)OC1=O Amb22230364 [0,1,0,1,0,0|2,0,0]=4 3401 B11R1.230 CCCCC1CC(C)=CC1=O Amb27256390 [0,1,0,1,0,0|2,0,0]=4 3402 B11R1.230 CCCCC1NC(=O)CC1=O Amb35711627 [0,1,0,1,0,0|1,0,1]=4 3403 B11R1.230 CCCCC1NC(=O)NC1=O Amb9330281 [0,1,0,1,0,0|2,0,0]=4 3404 B11R1.230 CCCCC1NC(=O)OC1=O Amb27754115 [0,1,0,1,0,0|2,0,0]=4 3405 B11R1.230 CCCCC1OC(=O)CC1C Amb15692528 [0,1,0,1,0,0|0,0,2]=4 3406 B11R1.230 CCCCC1OC(=O)CC1O Amb27405206 [0,1,0,1,0,0|0,0,2]=4 3407 B11R1.230 CCCCC1OC(=O)NC1=O Amb22495610 [0,1,0,1,0,0|1,0,0]=3 3408 B11R1.230 CCCCC1OC(N)=NC1=O Amb28458305 [0,1,0,1,0,0|2,0,0]=4 3409 B11R1.230 CCCC[C@@H]1NC(=O)OC1=O Amb33624536 [0,1,0,1,0,0|2,0,0]=4 3410 B11R1.230 CCCC[C@@H]1OC(=O)C[C@H]1O Amb27472606 [0,1,0,1,0,0|0,0,2]=4 3411 B11R1.230 CCCC[C@H]1CC(=O)OC1=O Amb27805036 [0,1,0,1,0,0|2,0,0]=4 3412 B11R1.230 CCCC[C@H]1OC(=O)C[C@@H]1C Amb27234681 [0,1,0,1,0,0|0,0,2]=4 3413 B11R1.230 CCCC[C@H]1OC(=O)C[C@H]1O Amb27969128 [0,1,0,1,0,0|0,0,2]=4 3414 B11R1.230 CSCCC1OC(=O)NC1=O Amb28368269 [0,1,0,1,0,0|2,0,0]=4 3415 B11R1.257 CC[C@@H]1C[C@H]1C(=O)C=C(C)C Amb28320539 [0,1,0,1,0,0|2,0,0]=4 3416 B11R1.471 CCC1=C(C(=O)O)C(=O)OC1 Amb26845511 [0,1,0,1,0,0|1,0,1]=4 3417 B11R1.471 CCC1CCC(N)=C1C(C)=O Amb24367283 [0,1,0,1,0,0|1,0,0]=3 3418 B11R1.471 CCC1CCC(O)=C1C(C)=O Amb26973234 [0,1,0,1,0,0|1,0,0]=3 3419 B11R1.471 CCC1COC(=O)C1C(=O)O Amb27658991 [0,1,0,1,0,0|1,0,1]=4 3420 B11R1.471 CC[C@@H]1CCC(=O)[C@H]1C(C)=O Amb27640617 [0,1,0,1,0,0|1,0,1]=4 3421 B11R1.484 C\C(=C/C(=O)O)CC1CCC1 Amb27766925 [0,1,0,1,0,0|0,0,0]=2 3422 B11R1.484 C\C(C=C1CCC1)=C\C(=O)O Amb35691756 [0,1,0,1,0,0|0,0,2]=4 3423 B11R1.484 NC(=O)NC(=O)CC1CCC1 Amb28435107 [0,1,0,1,0,0|2,0,0]=4 3424 B11R1.484 O=C(O)CC(=O)NC1CCC1 Amb18298121 [0,1,0,1,0,0|1,0,1]=4 3425 B11R1.484 O=C(O)CC(O)CC1CCC1 Amb33036223 [0,1,0,1,0,0|0,0,2]=4 3426 B11R1.484 O=C(O)CS(=O)CC1CCC1 Amb27986474 [0,1,0,1,0,0|1,0,1]=4 3427 B11R1.485 CC(=C\C(=O)O)\C=C\C1CC1 Amb35691757 [0,1,0,1,0,0|0,0,2]=4 3428 B11R1.485 CC(=O)\C=C(\C)NCC1CC1 Amb27453517 [0,1,0,1,0,0|2,0,0]=4 3429 B11R1.485 NC(CCC1CC1)CC(=O)O Amb33255553 [0,1,0,1,0,0|0,0,2]=4 3430 B11R1.485 O=C(O)CC(=O)NCC1CC1 Amb18183139 [0,1,0,1,0,0|1,0,1]=4 3431 B11R1.928 CC1(CC(=O)O)CCCCC1 Amb17194149 [0,1,0,1,0,0|0,0,2]=4 3432 B11R1.928 NC1(CC(=O)O)CCCCC1 Amb10602480 [0,1,0,1,0,0|0,0,2]=4 3433 B11R1.928 NC1(CC(=O)O)CCCCC1 Amb2697380 [0,1,0,1,0,0|0,0,2]=4 3434 B11R1.928 O=C(O)CC1(Cl)CCCCC1 Amb27477728 [0,1,0,1,0,0|0,0,2]=4 3435 B11R1.928 O=C(O)CC1(O)CCCCC1 Amb2785810 [0,1,0,1,0,0|0,0,2]=4 3436 B11R1.928 O=C(O)CC1(S)CCCCC1 Amb26951602 [0,1,0,1,0,0|0,0,2]=4 3437 B11R1.20 CC(=O)C=C1CCN(C)CC1 Amb28244688 [0,1,0,1,0,0|2,0,0]=4 3438 B11R1.20 CC(=O)\C=C1\CCC(C)OC1 Amb30010999 [0,1,0,1,0,0|2,0,0]=4 3439 B11R1.20 CC(=O)\C=C1\CCC(C)SC1 Amb35725412 [0,1,0,1,0,0|2,0,0]=4 3440 B11R1.20 CC1CC=C(CC(=O)O)CC1 Amb27983590 [0,1,0,1,0,0|0,0,2]=4 3441 B11R1.20 CC1CCC(=CC(=O)O)CC1 Amb4014442 [0,1,0,1,0,0|0,0,0]=2 3442 B11R1.20 CC1CCC(=CC(N)=O)CC1 Amb27813945 [0,1,0,1,0,0|1,0,0]=3 3443 B11R1.20 CC1CCC(=C[N+](=O)[O-])CC1 Amb32755995 [0,1,0,1,0,0|1,0,1]=4 3444 B11R1.20 CC1CCC(CC(=O)O)CC1 Amb3939873 [0,1,0,1,0,0|0,0,2]=4 3445 B11R1.20 CC1CCN(CC(=O)O)CC1 Amb2236300 [0,1,0,1,0,0|1,0,1]=4 3446 B11R1.20 CC1CCN(CC(=O)O)CC1 Amb2583054 [0,1,0,1,0,0|1,0,1]=4 3447 B11R1.20 CC1CC\C(=C/C(=O)O)CO1 Amb29866054 [0,1,0,1,0,0|1,0,0]=3 3448 B11R1.20 CC1CC\C(=C/C(=O)O)CS1 Amb35717570 [0,1,0,1,0,0|1,0,0]=3 3449 B11R1.20 CN1CCC(=CC(=O)O)CC1 Amb33068967 [0,1,0,1,0,0|1,0,0]=3 3450 B11R1.20 CN1CCC(=CC(=O)O)CC1 Amb5400512 [0,1,0,1,0,0|1,0,0]=3 3451 B11R1.20 C[C@@H]1CC=C(CC(=O)O)CC1 Amb27617304 [0,1,0,1,0,0|0,0,2]=4 3452 B11R1.20 C[C@H]1CC[C@H](CC(=O)O)CC1 Amb8631139 [0,1,0,1,0,0|0,0,2]=4 3453 B11R1.20 NC1CCN(CC(=O)O)CC1 Amb1099363 [0,1,0,1,0,0|1,0,1]=4 3454 B11R1.20 NC1CCN(CC(=O)O)CC1 Amb22284092 [0,1,0,1,0,0|1,0,1]=4 3455 B11R1.20 N[C@H]1CC[C@@H](CC(=O)O)CC1 Amb34150446 [0,1,0,1,0,0|0,0,2]=4 3456 B11R1.20 N[C@H]1CC[C@H](CC(=O)O)CC1 Amb22746078 [0,1,0,1,0,0|0,0,2]=4 3457 B11R1.20 O=C(O)C=C1CCC(F)CC1 Amb26929658 [0,1,0,1,0,0|0,0,0]=2 3458 B11R1.20 O=C(O)C=C1CCC(O)CC1 Amb28239820 [0,1,0,1,0,0|0,0,0]=2 3459 B11R1.20 O=C(O)CC1=CCC(O)CC1 Amb27409091 [0,1,0,1,0,0|0,0,2]=4 3460 B11R1.20 O=C(O)CC1CCC(Br)CC1 Amb27813326 [0,1,0,1,0,0|0,0,2]=4 3461 B11R1.20 O=C(O)CC1CCC(Cl)CC1 Amb27841820 [0,1,0,1,0,0|0,0,2]=4 3462 B11R1.20 O=C(O)CC1CCC(F)CC1 Amb27782078 [0,1,0,1,0,0|0,0,2]=4 3463 B11R1.20 O=C(O)CC1CCC(O)CC1 Amb18126157 [0,1,0,1,0,0|0,0,2]=4 3464 B11R1.20 O=C(O)CN1CCC(O)CC1 Amb10609681 [0,1,0,1,0,0|1,0,1]=4 3465 B11R1.20 O=C(O)CN1CCC(O)CC1 Amb6649512 [0,1,0,1,0,0|1,0,1]=4 3466 B11R1.20 O=C(O)C[C@H]1CC[C@@H](F)CC1 Amb34912967 [0,1,0,1,0,0|0,0,2]=4 3467 B11R1.20 O=C(O)C[C@H]1CC[C@H](F)CC1 Amb34912971 [0,1,0,1,0,0|0,0,2]=4 3468 B11R1.20 [NH3+]C1CCC(CC(=O)O)CC1 Amb9805882 [0,1,0,1,0,0|0,0,2]=4 3469 B11R1.23 CCC(C)C1CC(=O)C=CO1 Amb27619629 [0,1,0,1,0,0|2,0,0]=4 3470 B11R1.23 CC[C@@H](O)[C@@H]1CCC=C(C)O1 Amb28194140 [0,1,0,1,0,0|1,0,1]=4 3471 B11R1.23 O=C1C=CCC(C(O)CO)O1 Amb27425292 [0,1,0,1,0,0|1,0,0]=3 3472 B11R1.39 CC(CO)CC1C=CC(=O)O1 Amb28318485 [0,1,0,1,0,0|1,0,0]=3 3473 B11R1.39 CCC(=O)NC1C=CC(=O)O1 Amb27966694 [0,1,0,1,0,0|1,0,1]=4 3474 B11R1.39 CCC(C)\N=C1\C=CC(=O)O1 Amb27862118 [0,1,0,1,0,0|1,0,1]=4 3475 B11R1.39 CCC(Cl)Cc1ccc(Br)o1 Amb28201743 [0,1,0,1,0,0|1,0,1]=4 3476 B11R1.39 CCC(N)Cc1ccc(Br)o1 Amb9428890 [0,1,0,1,0,0|1,0,1]=4 3477 B11R1.39 CCC(N)Cc1ccc(C)o1 Amb9428895 [0,1,0,1,0,0|1,0,1]=4 3478 B11R1.39 CCC(N)Cc1ccc(Cl)o1 Amb18300827 [0,1,0,1,0,0|1,0,1]=4 3479 B11R1.39 CCC(N)Cc1ccc(I)o1 Amb25105439 [0,1,0,1,0,0|1,0,1]=4 3480 B11R1.39 CCC(O)Cc1ccc(Br)o1 Amb27953957 [0,1,0,1,0,0|1,0,1]=4 3481 B11R1.39 C[C@@H](C=O)C[C@H]1C=CC(=O)O1 Amb27253568 [0,1,0,1,0,0|1,0,1]=4 3482 B11R1.75 C=C1CCN(\C=C\C(=O)O)C1 Amb30028135 [0,1,0,1,0,0|1,0,1]=4 3483 B11R1.75 CC(=O)\C=C\C1CC[C@@H](C)O1 Amb32730442 [0,1,0,1,0,0|1,0,0]=3 3484 B11R1.75 CC(C)COC1C=CC(=O)N1 Amb27971358 [0,1,0,1,0,0|2,0,0]=4 3485 B11R1.75 CC(N)CCc1ccc(Br)o1 Amb24619887 [0,1,0,1,0,0|1,0,1]=4 3486 B11R1.75 CC(N)CCc1ccc(Cl)o1 Amb33258346 [0,1,0,1,0,0|1,0,1]=4 3487 B11R1.75 CC(O)CCC1CCC(=O)O1 Amb27484707 [0,1,0,1,0,0|0,0,2]=4 3488 B11R1.75 CC(O)CCc1ccc(Br)o1 Amb25094102 [0,1,0,1,0,0|1,0,1]=4 3489 B11R1.75 CC(O)CCc1ccc(Cl)o1 Amb33258353 [0,1,0,1,0,0|1,0,1]=4 3490 B11R1.75 CC(O)\C=C\C1CCC(C)O1 Amb27485205 [0,1,0,1,0,0|1,0,1]=4 3491 B11R1.75 CC1CCC(C#CC(=O)O)C1 Amb33169018 [0,1,0,1,0,0|0,0,2]=4 3492 B11R1.75 CC1CCC(CCC(=O)O)O1 Amb20623187 [0,1,0,1,0,0|0,0,2]=4 3493 B11R1.75 CC1CCN(\C=C\C(=O)O)C1 Amb27446491 [0,1,0,1,0,0|1,0,0]=3 3494 B11R1.75 CC1CC\C(=C/CC(=O)O)O1 Amb27226852 [0,1,0,1,0,0|0,0,2]=4 3495 B11R1.75 C[C@@H](N)CCc1ccc(Br)o1 Amb33452189 [0,1,0,1,0,0|1,0,1]=4 3496 B11R1.75 C[C@@H](N)CCc1ccc(Cl)o1 Amb33258610 [0,1,0,1,0,0|1,0,1]=4 3497 B11R1.75 C[C@@H](O)CCc1ccc(Br)o1 Amb33452192 [0,1,0,1,0,0|1,0,1]=4 3498 B11R1.75 C[C@@H](O)CCc1ccc(Cl)o1 Amb33258360 [0,1,0,1,0,0|1,0,1]=4 3499 B11R1.75 C[C@@H]1CCC(CCC(=O)O)O1 Amb33423436 [0,1,0,1,0,0|0,0,2]=4 3500 B11R1.75 C[C@@H]1CCC(OCC(=O)O)O1 Amb33484806 [0,1,0,1,0,0|1,0,1]=4 3501 B11R1.75 C[C@@H]1CCC(\C=C\C(=O)O)O1 Amb33423348 [0,1,0,1,0,0|0,0,0]=2 3502 B11R1.75 C[C@@H]1CCC(\C=C\[N+](=O)[O-])O1 Amb32729962 [0,1,0,1,0,0|1,0,1]=4 3503 B11R1.75 C[C@H](N)CCc1ccc(Br)o1 Amb33452190 [0,1,0,1,0,0|1,0,1]=4 3504 B11R1.75 C[C@H](N)CCc1ccc(Cl)o1 Amb33258615 [0,1,0,1,0,0|1,0,1]=4 3505 B11R1.75 C[C@H](O)CCc1ccc(Br)o1 Amb33452191 [0,1,0,1,0,0|1,0,1]=4 3506 B11R1.75 C[C@H](O)CCc1ccc(Cl)o1 Amb33258357 [0,1,0,1,0,0|1,0,1]=4 3507 B11R1.75 C[C@H]1CC[C@@H](CCC(=O)O)O1 Amb27637655 [0,1,0,1,0,0|0,0,2]=4 3508 B11R1.75 Cc1ccc(CCC(C)N)o1 Amb18644581 [0,1,0,1,0,0|1,0,1]=4 3509 B11R1.75 Cc1ccc(CCC(C)O)o1 Amb28322235 [0,1,0,1,0,0|1,0,1]=4 3510 B11R1.75 Cc1ccc(CC[C@@H](C)N)o1 Amb33374496 [0,1,0,1,0,0|1,0,1]=4 3511 B11R1.75 Cc1ccc(CC[C@@H](C)O)o1 Amb33317926 [0,1,0,1,0,0|1,0,1]=4 3512 B11R1.75 Cc1ccc(CC[C@H](C)N)o1 Amb33374495 [0,1,0,1,0,0|1,0,1]=4 3513 B11R1.75 Cc1ccc(CC[C@H](C)O)o1 Amb33317927 [0,1,0,1,0,0|1,0,1]=4 3514 B11R1.75 O=C(O)\C=C\N1CCC(F)C1 Amb35614254 [0,1,0,1,0,0|1,0,0]=3 3515 B11R1.159 C[C@H]1[C@@H](O)CCC[C@H]1C(=O)O Amb28051870 [0,1,0,1,0,0|0,0,2]=4 3516 B11R1.262 CCC1CN(\C=C\C(=O)O)C1 Amb35622914 [0,1,0,1,0,0|1,0,0]=3 3517 B11R1.266 CCC1C=C(C(C)=O)CCC1 Amb28131958 [0,1,0,1,0,0|1,0,1]=4 3518 B11R1.266 CCC1CCCC(C(=O)O)N1 Amb25110486 [0,1,0,1,0,0|0,0,2]=4 3519 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb18830613 [0,1,0,1,0,0|1,0,1]=4 3520 B11R1.266 CCC1CCNC(C(=O)O)C1 Amb33338905 [0,1,0,1,0,0|1,0,1]=4 3521 B11R1.266 CCC1CCNC(C(=O)O)O1 Amb33193374 [0,1,0,1,0,0|1,0,1]=4 3522 B11R1.266 CCC1CNC=C(C(C)=O)C1 Amb27470723 [0,1,0,1,0,0|2,0,0]=4 3523 B11R1.266 CC[C@@H]1CCC[C@H](C(=O)O)O1 Amb27233410 [0,1,0,1,0,0|0,0,2]=4 3524 B11R1.266 CC[C@@H]1CCN[C@H](C(=O)O)C1 Amb27421998 [0,1,0,1,0,0|1,0,1]=4 3525 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb25937982 [0,1,0,1,0,0|1,0,1]=4 3526 B11R1.266 CC[C@H]1CCN[C@@H](C(=O)O)C1 Amb33338984 [0,1,0,1,0,0|1,0,1]=4 3527 B11R1.313 CC(=O)\C=C1/COC(C)C1C Amb35580009 [0,1,0,1,0,0|2,0,0]=4 3528 B11R1.313 CC1CCC(CC(=O)O)C1C Amb27240379 [0,1,0,1,0,0|0,0,2]=4 3529 B11R1.313 CC1OC\C(=C/C(=O)O)C1C Amb29868234 [0,1,0,1,0,0|1,0,0]=3 3530 B11R1.870 CCC(C)C1CCC1C(=O)O Amb28185049 [0,1,0,1,0,0|0,0,2]=4 3531 B11R1.1044 CCC1(C)CC1NCC(=O)O Amb28079873 [0,1,0,1,0,0|1,0,1]=4 3532 B11R1.1 CCCCC1=NNC(=O)C=C1 Amb25791568 [0,1,0,1,0,0|1,0,1]=4 3533 B11R1.1 CCCCC1C=CC(O)CC1 Amb27857855 [0,1,0,1,0,0|1,0,1]=4 3534 B11R1.1 CCCCC1C=CC(O)CN1 Amb27980364 [0,1,0,1,0,0|1,0,1]=4 3535 B11R1.1 CCCC[C@H]1C=C[C@@H](O)CO1 Amb27448784 [0,1,0,1,0,0|0,0,2]=4 3536 B11R1.1 CCCC[C@H]1C=C[C@H](O)CC1 Amb27428347 [0,1,0,1,0,0|1,0,1]=4 3537 B11R1.1 CCCCc1ccc(O)cc1 Amb2778508 [0,1,0,1,0,0|1,0,1]=4 3538 B11R1.1 CCCCc1ccc(O)cn1 Amb25831110 [0,1,0,1,0,0|1,0,1]=4 3539 B11R1.1 O=C1C=CC(CCCO)OC1 Amb27410566 [0,1,0,1,0,0|1,0,0]=3 3540 B11R1.13 CCCC1=C(O)C(=O)C=CN1 Amb27239973 [0,1,0,1,0,0|1,0,1]=4 3541 B11R1.13 CCCN1C=CC=C(O)C1=O Amb27434869 [0,1,0,1,0,0|1,0,1]=4 3542 B11R1.25 CC(=C=CC1CCCC1)CO Amb27653017 [0,1,0,1,0,0|1,0,1]=4 3543 B11R1.25 CCC(=O)\C=C\N1CCCC1 Amb28253895 [0,1,0,1,0,0|2,0,0]=4 3544 B11R1.25 COC(=O)C#CC1CCCC1 Amb25756477 [0,1,0,1,0,0|0,0,2]=4 3545 B11R1.25 COC(=O)C=C=C1CCCC1 Amb32423554 [0,1,0,1,0,0|0,0,2]=4 3546 B11R1.25 COC(=O)CCC1CCCC1 Amb9241816 [0,1,0,1,0,0|0,0,2]=4 3547 B11R1.25 COC(=O)CNC1CCCC1 Amb19958344 [0,1,0,1,0,0|1,0,1]=4 3548 B11R1.25 COC(=O)CNC1CCCC1 Amb6686961 [0,1,0,1,0,0|1,0,1]=4 3549 B11R1.25 COC(=O)COC1CCCC1 Amb9206354 [0,1,0,1,0,0|1,0,1]=4 3550 B11R1.25 COC(=O)NOC1CCCC1 Amb27462937 [0,1,0,1,0,0|2,0,0]=4 3551 B11R1.25 COC(=O)\C=C/N1CCCC1 Amb32455904 [0,1,0,1,0,0|1,0,0]=3 3552 B11R1.25 COC(=O)\C=C\C1=CCCC1 Amb24392864 [0,1,0,1,0,0|0,0,2]=4 3553 B11R1.25 COC(=O)\C=C\C1CCCC1 Amb33986201 [0,1,0,1,0,0|0,0,0]=2 3554 B11R1.25 COC(=O)\C=C\C1CCOC1 Amb33529168 [0,1,0,1,0,0|1,0,0]=3 3555 B11R1.25 COC(=O)\C=C\N1CCCC1 Amb2384232 [0,1,0,1,0,0|1,0,0]=3 3556 B11R1.25 NNC(=O)\C=C\C1CCCC1 Amb28382244 [0,1,0,1,0,0|1,0,0]=3 3557 B11R1.25 O=C(CO)NCC1CCCC1 Amb28189061 [0,1,0,1,0,0|1,0,1]=4 3558 B11R1.25 OCC(O)\C=C\C1CCCC1 Amb28319837 [0,1,0,1,0,0|0,0,2]=4 3559 B11R1.40 CCC(=O)C=C1CCCCC1 Amb27256388 [0,1,0,1,0,0|1,0,0]=3 3560 B11R1.40 CCC(=O)\C=C1\CCCCN1 Amb26887433 [0,1,0,1,0,0|2,0,0]=4 3561 B11R1.40 CNC(=O)C=C1CCSCC1 Amb27458485 [0,1,0,1,0,0|2,0,0]=4 3562 B11R1.40 COC(=O)C=C1CCCCC1 Amb22365303 [0,1,0,1,0,0|0,0,0]=2 3563 B11R1.40 COC(=O)C=C1CCNCC1 Amb32645715 [0,1,0,1,0,0|1,0,0]=3 3564 B11R1.40 COC(=O)C=C1CCOCC1 Amb19337770 [0,1,0,1,0,0|1,0,0]=3 3565 B11R1.40 COC(=O)C=C1CCSCC1 Amb24727308 [0,1,0,1,0,0|1,0,0]=3 3566 B11R1.40 COC(=O)C=C1NCCCN1 Amb27613165 [0,1,0,1,0,0|2,0,0]=4 3567 B11R1.40 COC(=O)CC1CCCCC1 Amb9241853 [0,1,0,1,0,0|0,0,2]=4 3568 B11R1.40 COC(=O)CN1CCCCC1 Amb2583056 [0,1,0,1,0,0|1,0,1]=4 3569 B11R1.40 COC(=O)NC1CCCCC1 Amb9900327 [0,1,0,1,0,0|1,0,1]=4 3570 B11R1.40 COC(=O)\C=C1/CCCSC1 Amb33504059 [0,1,0,1,0,0|1,0,0]=3 3571 B11R1.40 COC(=O)\C=C1\CCCCN1 Amb23570717 [0,1,0,1,0,0|1,0,0]=3 3572 B11R1.40 COC(=O)\C=C1\CCCOC1 Amb33307118 [0,1,0,1,0,0|1,0,0]=3 3573 B11R1.40 COC(=O)\C=C1\CCCSC1 Amb27454204 [0,1,0,1,0,0|1,0,0]=3 3574 B11R1.40 C\C(=C/C1=CCCCC1)CO Amb27653047 [0,1,0,1,0,0|1,0,1]=4 3575 B11R1.40 C\C(C=O)=C/C1CCCCC1 Amb27813797 [0,1,0,1,0,0|1,0,1]=4 3576 B11R1.40 NNC(=O)C=C1CCCCC1 Amb28204691 [0,1,0,1,0,0|1,0,0]=3 3577 B11R1.40 O=C(CO)NC1CCCCC1 Amb1109698 [0,1,0,1,0,0|1,0,1]=4 3578 B11R1.40 O=C(CO)NN1CCCCC1 Amb8390164 [0,1,0,1,0,0|2,0,0]=4 3579 B11R1.40 O=C(NO)NC1CCCCC1 Amb27856471 [0,1,0,1,0,0|1,0,1]=4 3580 B11R1.40 O=C\C(F)=C\C1CCCCC1 Amb27592795 [0,1,0,1,0,0|1,0,1]=4 3581 B11R1.40 O=C\C(F)=C\N1CCCCC1 Amb27468707 [0,1,0,1,0,0|2,0,0]=4 3582 B11R1.59 C=CC1CCC=C1C(=O)OC Amb27433444 [0,1,0,1,0,0|0,0,2]=4 3583 B11R1.59 CCC1CC=CN1C(=O)OC Amb28251032 [0,1,0,1,0,0|1,0,1]=4 3584 B11R1.59 CCC1CCNC1C(=O)OC Amb18126064 [0,1,0,1,0,0|1,0,1]=4 3585 B11R1.59 CC[C@H]1CCN[C@@H]1C(=O)OC Amb24562884 [0,1,0,1,0,0|1,0,1]=4 3586 B11R1.59 CC[C@H]1CCN[C@H]1C(=O)OC Amb27649195 [0,1,0,1,0,0|1,0,1]=4 3587 B11R1.59 COC(=O)C1=CCCC1C#N Amb25172764 [0,1,0,1,0,0|1,0,1]=4 3588 B11R1.85 OC1CCCCCCC=C1Br Amb17595969 [0,1,0,1,0,0|1,0,1]=4 3589 B11R1.131 CCCC1CC1NC(=O)OC Amb27271433 [0,1,0,1,0,0|1,0,1]=4 3590 B11R1.144 CN1C=CC(=O)CCCCC1 Amb27164516 [0,1,0,1,0,0|2,0,0]=4 3591 B11R1.190 CCCCC\C=C1/CCC1=O Amb28080152 [0,1,0,1,0,0|1,0,0]=3 3592 B11R1.212 CCCCC1C=CC(=O)C1C Amb27427259 [0,1,0,1,0,0|1,0,0]=3 3593 B11R1.212 CCCCC1C=CC(=O)C1Cl Amb27477929 [0,1,0,1,0,0|1,0,0]=3 3594 B11R1.212 CCCCN1C=CC(=O)C1=O Amb27749778 [0,1,0,1,0,0|1,0,1]=4 3595 B11R1.214 CCCCc1ccc(C=O)s1 Amb3780691 [0,1,0,1,0,0|0,1,1]=4 3596 B11R1.214 CCCCc1ccc(CN)o1 Amb27671497 [0,1,0,1,0,0|1,0,1]=4 3597 B11R1.214 CCCCc1ccc(CO)s1 Amb26999503 [0,1,0,1,0,0|0,1,1]=4 3598 B11R1.214 CCCCn1ccc(C=O)n1 Amb23568552 [0,1,0,1,0,0|2,0,0]=4 3599 B11R1.214 CCCCn1ccc(CO)c1 Amb27271410 [0,1,0,1,0,0|2,0,0]=4 3600 B11R1.214 CCCCn1ccc(CO)n1 Amb23568560 [0,1,0,1,0,0|2,0,0]=4 3601 B11R1.214 CCOCc1ccc(C=O)o1 Amb18125681 [0,1,0,1,0,0|1,0,1]=4 3602 B11R1.222 COC(=O)C1=C(C)CCCC1 Amb24593167 [0,1,0,1,0,0|0,0,2]=4 3603 B11R1.222 COC(=O)C1=CCCCN1C Amb23585371 [0,1,0,1,0,0|1,0,0]=3 3604 B11R1.222 COC(=O)C1=CCCC[C@H]1O Amb27595339 [0,1,0,1,0,0|1,0,0]=3 3605 B11R1.222 COC(=O)C1NCCCC1C Amb23590118 [0,1,0,1,0,0|1,0,1]=4 3606 B11R1.222 COC(=O)[C@@H]1NCCC[C@@H]1C Amb24716098 [0,1,0,1,0,0|1,0,1]=4 3607 B11R1.222 COC(=O)[C@H]1NCCC[C@@H]1C Amb27623073 [0,1,0,1,0,0|1,0,1]=4 3608 B11R1.222 C\C(=N/O)C1=CCCC[C@H]1Br Amb27166035 [0,1,0,1,0,0|2,0,0]=4 3609 B11R1.222 C\C(C=O)=C1/CCCCC1C Amb27169477 [0,1,0,1,0,0|1,0,1]=4 3610 B11R1.223 COC(=O)CNC1CCC1C Amb27270147 [0,1,0,1,0,0|1,0,1]=4 3611 B11R1.228 C=CC(=O)\C=C1/CCCN1C Amb25150317 [0,1,0,1,0,0|2,0,0]=4 3612 B11R1.228 CC1CCCC1CC(=O)NO Amb28349806 [0,1,0,1,0,0|0,0,2]=4 3613 B11R1.228 COC(=O)CC1CCCC1C Amb27768232 [0,1,0,1,0,0|0,0,2]=4 3614 B11R1.228 COC(=O)\C=C1/CCCN1C Amb28985767 [0,1,0,1,0,0|1,0,0]=3 3615 B11R1.228 COC(=O)\C=C1/CCSC1C Amb33504056 [0,1,0,1,0,0|1,0,0]=3 3616 B11R1.228 COC(=O)\C=C1/NCCC1C Amb27215321 [0,1,0,1,0,0|1,0,0]=3 3617 B11R1.228 COC(=O)\C=C1\CCCC1C Amb24712218 [0,1,0,1,0,0|0,0,0]=2 3618 B11R1.228 COC(=O)\C=C1\CCCN1C Amb25310230 [0,1,0,1,0,0|1,0,0]=3 3619 B11R1.228 COC(=O)\C=C1\CCSC1C Amb28324788 [0,1,0,1,0,0|1,0,0]=3 3620 B11R1.228 COC(=O)\C=C1\COCC1C Amb33493016 [0,1,0,1,0,0|1,0,0]=3 3621 B11R1.236 COC(=O)NCCC1CCC1 Amb28387542 [0,1,0,1,0,0|1,0,1]=4 3622 B11R1.236 COC(=O)\C=C\CN1CCC1 Amb27671173 [0,1,0,1,0,0|1,0,0]=3 3623 B11R1.248 O=CC1=CCCCCCCC1 Amb25172766 [0,1,0,1,0,0|1,0,1]=4 3624 B11R1.255 CCC1CC1CNC(=O)OC Amb27671436 [0,1,0,1,0,0|1,0,1]=4 3625 B11R1.255 CC[C@@H]1C[C@H]1C#CC(=O)OC Amb27433670 [0,1,0,1,0,0|0,0,2]=4 3626 B11R1.255 CC[C@@H]1C[C@H]1CNC(=O)OC Amb27671437 [0,1,0,1,0,0|1,0,1]=4 3627 B11R1.272 CCC1CCN1CC(=O)OC Amb27986952 [0,1,0,1,0,0|1,0,1]=4 3628 B11R1.558 CC1CCCCC=C(F)C1=O Amb24485837 [0,1,0,1,0,0|1,0,1]=4 3629 B11R1.757 CCCCCC1=CC(=O)C1=O Amb27672574 [0,1,0,1,0,0|0,0,1]=3 3630 B11R1.757 CCCCC[C@@H]1NC(=O)[C@@H]1O Amb28080085 [0,1,0,1,0,0|1,0,1]=4 3631 B11R1.852 CC[C@@H](O)C1=CCCCCC1 Amb27823683 [0,1,0,1,0,0|1,0,1]=4 3632 B11R1.852 CNC(=O)C1=CCCCCC1 Amb27206336 [0,1,0,1,0,0|1,0,0]=3 3633 B11R1.852 COC(=O)C1=CCCCCC1 Amb26060569 [0,1,0,1,0,0|0,0,0]=2 3634 B11R1.852 COC(=O)C1=NNCCCC1 Amb26432638 [0,1,0,1,0,0|2,0,0]=4 3635 B11R1.852 COC(=O)C1CCCCCC1 Amb18182101 [0,1,0,1,0,0|0,0,2]=4 3636 B11R1.852 COC(=O)C1CCCCCN1 Amb21963566 [0,1,0,1,0,0|1,0,1]=4 3637 B11R1.852 COC(=O)C1CCCCCN1 Amb33548478 [0,1,0,1,0,0|1,0,1]=4 3638 B11R1.852 COC(=O)N1C=CCCCC1 Amb32674642 [0,1,0,1,0,0|1,0,1]=4 3639 B11R1.852 COC(=O)N1CCCCCC1 Amb17789384 [0,1,0,1,0,0|1,0,1]=4 3640 B11R1.852 COC(=O)N1CCCCCO1 Amb27207557 [0,1,0,1,0,0|2,0,0]=4 3641 B11R1.852 NCC(=O)C1=CCCCCC1 Amb28293576 [0,1,0,1,0,0|1,0,0]=3 3642 B11R1.852 O=C(CO)C1CCCCCN1 Amb28053242 [0,1,0,1,0,0|1,0,1]=4 3643 B11R1.852 O=C(CO)N1CCCCCC1 Amb1111379 [0,1,0,1,0,0|1,0,1]=4 3644 B11R1.852 O=C(NO)C1CCCCCC1 Amb18182216 [0,1,0,1,0,0|0,0,2]=4 3645 B11R1.852 O=C(NO)N1CCCCCC1 Amb27455505 [0,1,0,1,0,0|1,0,1]=4 3646 B11R1.852 O=CC(O)C1=CCCCCC1 Amb28345073 [0,1,0,1,0,0|0,0,1]=3 3647 B11R1.35 C=C(CC1CCCC1)C(C)=O Amb27589798 [0,1,0,1,0,0|1,0,1]=4 3648 B11R1.35 C=C(CN1CCCC1)C(=O)O Amb22265840 [0,1,0,1,0,0|1,0,1]=4 3649 B11R1.35 CC(=O)C(=O)CC1CCCC1 Amb24593200 [0,1,0,1,0,0|1,0,1]=4 3650 B11R1.35 CC(=O)C(=O)NC1CCCC1 Amb17399994 [0,1,0,1,0,0|2,0,0]=4 3651 B11R1.35 CC(=O)\C(C)=C\C1CCCO1 Amb27389889 [0,1,0,1,0,0|2,0,0]=4 3652 B11R1.35 CC(=O)\C(C)=C\N1CCCC1 Amb27973004 [0,1,0,1,0,0|2,0,0]=4 3653 B11R1.35 CC(CC1CCCC1)C(=O)O Amb10844013 [0,1,0,1,0,0|0,0,2]=4 3654 B11R1.35 CC(NC1CCCC1)C(=O)O Amb28872277 [0,1,0,1,0,0|1,0,1]=4 3655 B11R1.35 CC(NC1CCCC1)C(=O)O Amb9326976 [0,1,0,1,0,0|1,0,1]=4 3656 B11R1.35 CC(OC1CCCC1)C(=O)O Amb9281761 [0,1,0,1,0,0|1,0,1]=4 3657 B11R1.35 CC(SC1CCCC1)C(=O)O Amb6260626 [0,1,0,1,0,0|1,0,1]=4 3658 B11R1.35 C[C@@H](CC1CCCC1)C(=O)O Amb33745935 [0,1,0,1,0,0|0,0,2]=4 3659 B11R1.35 C[C@@H](NC1CCCC1)C(=O)O Amb25151812 [0,1,0,1,0,0|1,0,1]=4 3660 B11R1.35 C[C@H](CC1CCCC1)C(=O)O Amb33733080 [0,1,0,1,0,0|0,0,2]=4 3661 B11R1.35 C\C(=C/C1=CCCC1)C(=O)O Amb27233500 [0,1,0,1,0,0|0,0,2]=4 3662 B11R1.35 C\C(=C/C1CCCC1)C(=O)O Amb27874098 [0,1,0,1,0,0|0,0,0]=2 3663 B11R1.35 C\C(=C/C1CCCC1)[N+](=O)[O-] Amb18796842 [0,1,0,1,0,0|1,0,1]=4 3664 B11R1.35 C\C(=C/C1CCOC1)C(=O)O Amb27220863 [0,1,0,1,0,0|1,0,0]=3 3665 B11R1.35 NC(CC1CCCC1)C(=O)O Amb28872272 [0,1,0,1,0,0|0,0,2]=4 3666 B11R1.35 NC(CC1CCCC1)C(=O)O Amb6276342 [0,1,0,1,0,0|0,0,2]=4 3667 B11R1.35 N[C@@H](CC1CCCC1)C(=O)O Amb2699194 [0,1,0,1,0,0|0,0,2]=4 3668 B11R1.35 N[C@H](CC1CCCC1)C(=O)O Amb8385711 [0,1,0,1,0,0|0,0,2]=4 3669 B11R1.35 O=C(O)C(=O)CC1CCCC1 Amb18296288 [0,1,0,1,0,0|0,0,1]=3 3670 B11R1.35 O=C(O)C(=O)CC1CCCO1 Amb25891618 [0,1,0,1,0,0|1,0,1]=4 3671 B11R1.35 O=C(O)C(=O)CC1CCCS1 Amb33416222 [0,1,0,1,0,0|1,0,1]=4 3672 B11R1.35 O=C(O)C(=O)CC1CCOC1 Amb18987708 [0,1,0,1,0,0|1,0,1]=4 3673 B11R1.35 O=C(O)C(=O)CC1CCSC1 Amb33141372 [0,1,0,1,0,0|1,0,1]=4 3674 B11R1.35 O=C(O)C(=O)NC1CCCC1 Amb9238896 [0,1,0,1,0,0|1,0,0]=3 3675 B11R1.35 O=C(O)C(=O)NC1CCSC1 Amb27656411 [0,1,0,1,0,0|2,0,0]=4 3676 B11R1.35 O=C(O)C(F)CC1CCCC1 Amb25706351 [0,1,0,1,0,0|0,0,2]=4 3677 B11R1.35 O=C(O)C(O)CC1CCCC1 Amb28145934 [0,1,0,1,0,0|0,0,2]=4 3678 B11R1.35 O=C(O)C(S)CC1CCCC1 Amb18296291 [0,1,0,1,0,0|0,0,2]=4 3679 B11R1.35 O=C(O)[C@@H](O)CC1CCCC1 Amb25700901 [0,1,0,1,0,0|0,0,2]=4 3680 B11R1.35 O=C(O)[C@H](F)CC1CCCC1 Amb26517246 [0,1,0,1,0,0|0,0,2]=4 3681 B11R1.35 O=C(O)[C@H](O)CC1CCCC1 Amb25861169 [0,1,0,1,0,0|0,0,2]=4 3682 B11R1.35 O=C(O)\C(F)=C\C1CCCN1 Amb28142521 [0,1,0,1,0,0|1,0,0]=3 3683 B11R1.35 O=C(O)\C(F)=C\C1CCOC1 Amb27228084 [0,1,0,1,0,0|1,0,0]=3 3684 B11R1.36 C=C(C(=O)O)C1=COCCC1 Amb33414877 [0,1,0,1,0,0|1,0,1]=4 3685 B11R1.36 C=C(C(=O)O)C1CCCCC1 Amb26944910 [0,1,0,1,0,0|0,0,1]=3 3686 B11R1.36 C=C(C(=O)O)C1CCCCO1 Amb33375536 [0,1,0,1,0,0|1,0,1]=4 3687 B11R1.36 C=C(C(=O)O)C1CCCOC1 Amb33322119 [0,1,0,1,0,0|1,0,1]=4 3688 B11R1.36 C=C(C(=O)O)C1CCCSC1 Amb32726217 [0,1,0,1,0,0|1,0,1]=4 3689 B11R1.36 C=C(C(=O)O)C1CCNCC1 Amb27231813 [0,1,0,1,0,0|1,0,1]=4 3690 B11R1.36 CC(=C1CCCCC1)C(C)O Amb28189026 [0,1,0,1,0,0|1,0,1]=4 3691 B11R1.36 CC(=O)C(=O)N1CCCCC1 Amb17399995 [0,1,0,1,0,0|2,0,0]=4 3692 B11R1.36 CC(=O)\C(C)=C1/CCCCN1 Amb27185983 [0,1,0,1,0,0|2,0,0]=4 3693 B11R1.36 CC(=O)\C(C)=C1\CCCCN1 Amb27482816 [0,1,0,1,0,0|2,0,0]=4 3694 B11R1.36 CC(C(=O)O)=C1CCSCC1 Amb27642409 [0,1,0,1,0,0|1,0,0]=3 3695 B11R1.36 CC(C(=O)O)C1CCCCC1 Amb4036008 [0,1,0,1,0,0|0,0,2]=4 3696 B11R1.36 CC(C(=O)O)N1CCCCC1 Amb2693823 [0,1,0,1,0,0|1,0,1]=4 3697 B11R1.36 CC(C(=O)O)N1CCCCC1 Amb9677406 [0,1,0,1,0,0|1,0,1]=4 3698 B11R1.36 CC(O)C(F)=C1CCCCC1 Amb27775781 [0,1,0,1,0,0|1,0,1]=4 3699 B11R1.36 C[C@@H](C(=O)O)C1=CCCCC1 Amb27865484 [0,1,0,1,0,0|0,0,2]=4 3700 B11R1.36 C[C@@H](C(=O)O)C1CCCCC1 Amb10844024 [0,1,0,1,0,0|0,0,2]=4 3701 B11R1.36 C[C@H](C(=O)O)C1CCCCC1 Amb10844035 [0,1,0,1,0,0|0,0,2]=4 3702 B11R1.36 NC(=O)C(=O)N1CCCCC1 Amb27400430 [0,1,0,1,0,0|2,0,0]=4 3703 B11R1.36 NC(=O)C(=S)N1CCCCC1 Amb6875730 [0,1,0,1,0,0|2,0,0]=4 3704 B11R1.36 NC(C(=O)O)C1CCCCC1 Amb2747009 [0,1,0,1,0,0|0,0,2]=4 3705 B11R1.36 NC(C(=O)O)C1CCCCC1 Amb9718595 [0,1,0,1,0,0|0,0,2]=4 3706 B11R1.36 N[C@@H](C(=O)O)C1=CCCCC1 Amb27831409 [0,1,0,1,0,0|0,0,2]=4 3707 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 Amb20242426 [0,1,0,1,0,0|0,0,2]=4 3708 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 Amb8395975 [0,1,0,1,0,0|0,0,2]=4 3709 B11R1.36 N[C@H](C(=O)O)C1=CCCCC1 Amb25699117 [0,1,0,1,0,0|0,0,2]=4 3710 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 Amb20240588 [0,1,0,1,0,0|0,0,2]=4 3711 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 Amb2694839 [0,1,0,1,0,0|0,0,2]=4 3712 B11R1.36 O=C(O)C(=O)C1CCCCC1 Amb18125967 [0,1,0,1,0,0|0,0,1]=3 3713 B11R1.36 O=C(O)C(=O)C1CCCCO1 Amb33375692 [0,1,0,1,0,0|1,0,1]=4 3714 B11R1.36 O=C(O)C(=O)C1CCCOC1 Amb26540535 [0,1,0,1,0,0|1,0,1]=4 3715 B11R1.36 O=C(O)C(=O)C1CCCSC1 Amb32726311 [0,1,0,1,0,0|1,0,1]=4 3716 B11R1.36 O=C(O)C(=O)C1CCOCC1 Amb28365421 [0,1,0,1,0,0|1,0,1]=4 3717 B11R1.36 O=C(O)C(=O)C1CCSCC1 Amb28194700 [0,1,0,1,0,0|1,0,1]=4 3718 B11R1.36 O=C(O)C(=O)N1CCCCC1 Amb2692936 [0,1,0,1,0,0|1,0,0]=3 3719 B11R1.36 O=C(O)C(=O)N1CCNCC1 Amb2689986 [0,1,0,1,0,0|2,0,0]=4 3720 B11R1.36 O=C(O)C(=O)N1CCOCC1 Amb9303793 [0,1,0,1,0,0|2,0,0]=4 3721 B11R1.36 O=C(O)C(=O)N1CCSCC1 Amb9304017 [0,1,0,1,0,0|2,0,0]=4 3722 B11R1.36 O=C(O)C(Br)C1CCCCC1 Amb8439522 [0,1,0,1,0,0|0,0,2]=4 3723 B11R1.36 O=C(O)C(F)=C1CCNCC1 Amb28284847 [0,1,0,1,0,0|1,0,0]=3 3724 B11R1.36 O=C(O)C(F)C1=CCCCC1 Amb33744039 [0,1,0,1,0,0|0,0,2]=4 3725 B11R1.36 O=C(O)C(F)C1CCCCC1 Amb25921382 [0,1,0,1,0,0|0,0,2]=4 3726 B11R1.36 O=C(O)C(O)C1=CCCCC1 Amb17593900 [0,1,0,1,0,0|0,0,2]=4 3727 B11R1.36 O=C(O)C(O)C1CCCCC1 Amb2612433 [0,1,0,1,0,0|0,0,2]=4 3728 B11R1.36 O=C(O)[C@@H](O)C1CCCCC1 Amb9786753 [0,1,0,1,0,0|0,0,2]=4 3729 B11R1.36 O=C(O)[C@H](O)C1CCCCC1 Amb22361246 [0,1,0,1,0,0|0,0,2]=4 3730 B11R1.36 O=C(O)\C(F)=C1/CCCOC1 Amb28141569 [0,1,0,1,0,0|1,0,0]=3 3731 B11R1.89 C=C(C(=O)O)C1CCOC1C Amb33427192 [0,1,0,1,0,0|1,0,1]=4 3732 B11R1.89 CC1CCCC1C(C)C(=O)O Amb24645562 [0,1,0,1,0,0|0,0,2]=4 3733 B11R1.89 CC1CCCC1C(N)C(=O)O Amb35663083 [0,1,0,1,0,0|0,0,2]=4 3734 B11R1.89 CC1CCCC1[C@@H](C)C(=O)O Amb33726954 [0,1,0,1,0,0|0,0,2]=4 3735 B11R1.89 CC1CCCC1[C@H](C)C(=O)O Amb33743260 [0,1,0,1,0,0|0,0,2]=4 3736 B11R1.89 CC1CCCN1C(C)C(=O)O Amb18284138 [0,1,0,1,0,0|1,0,1]=4 3737 B11R1.89 CC1COC\C1=C(\F)C(=O)O Amb35647044 [0,1,0,1,0,0|1,0,0]=3 3738 B11R1.89 CC1OCCC1C(=O)C(=O)O Amb33427688 [0,1,0,1,0,0|1,0,1]=4 3739 B11R1.89 CC1OCC\C1=C(\F)C(=O)O Amb27972708 [0,1,0,1,0,0|1,0,0]=3 3740 B11R1.89 C\C(C(=O)O)=C1\COCC1C Amb35647043 [0,1,0,1,0,0|1,0,0]=3 3741 B11R1.89 C\C(C(=O)O)=C1\CSCC1C Amb27768552 [0,1,0,1,0,0|1,0,0]=3 3742 B11R1.104 C=C(CNC1CC1C)C(=O)O Amb28386719 [0,1,0,1,0,0|1,0,1]=4 3743 B11R1.104 CC(=O)C(=O)NCC1CC1C Amb28207059 [0,1,0,1,0,0|2,0,0]=4 3744 B11R1.104 CC(CCC1CC1C)C(=O)O Amb33143872 [0,1,0,1,0,0|0,0,2]=4 3745 B11R1.104 CC(NCC1CC1C)C(=O)O Amb28387391 [0,1,0,1,0,0|1,0,1]=4 3746 B11R1.142 CC1CCC1NC(=O)C(=O)O Amb27806705 [0,1,0,1,0,0|1,0,0]=3 3747 B11R1.142 CC1CCC1N[C@H](C)C(=O)O Amb28345484 [0,1,0,1,0,0|1,0,1]=4 3748 B11R1.211 CCCCC1CC(C(=O)O)C1 Amb23537588 [0,1,0,1,0,0|0,0,2]=4 3749 B11R1.211 CCCC[C@H]1C[C@H](C(=O)O)C1 Amb30988015 [0,1,0,1,0,0|0,0,2]=4 3750 B11R1.231 CC1=CC(CCC#N)OC1=O Amb27165239 [0,1,0,1,0,0|1,0,1]=4 3751 B11R1.231 CC1=CC(CCCO)OC1=O Amb27752320 [0,1,0,1,0,0|1,0,0]=3 3752 B11R1.231 CCCCC1CC(Cl)C(=O)O1 Amb26032369 [0,1,0,1,0,0|0,0,2]=4 3753 B11R1.231 CCCCC1CC(O)C(=O)O1 Amb28349942 [0,1,0,1,0,0|0,0,2]=4 3754 B11R1.231 CCCC[C@@H]1C[C@@H](N)C(=O)O1 Amb26971852 [0,1,0,1,0,0|0,0,2]=4 3755 B11R1.231 CCCC[C@@H]1C[C@H](N)C(=O)O1 Amb25263992 [0,1,0,1,0,0|0,0,2]=4 3756 B11R1.332 C=C(CNC1CCC1)C(=O)O Amb28386723 [0,1,0,1,0,0|1,0,1]=4 3757 B11R1.332 CC(CCC1CCC1)C(=O)O Amb24765911 [0,1,0,1,0,0|0,0,2]=4 3758 B11R1.332 CC(NCC1CCC1)C(=O)O Amb18182199 [0,1,0,1,0,0|1,0,1]=4 3759 B11R1.332 CC(SCC1CCC1)C(=O)O Amb27986475 [0,1,0,1,0,0|1,0,1]=4 3760 B11R1.332 C[C@@H](OCC1CCC1)C(=O)O Amb27986313 [0,1,0,1,0,0|1,0,1]=4 3761 B11R1.332 C[C@H](OCC1CCC1)C(=O)O Amb27986315 [0,1,0,1,0,0|1,0,1]=4 3762 B11R1.332 NC(CCC1CCC1)C(=O)O Amb24765840 [0,1,0,1,0,0|0,0,2]=4 3763 B11R1.332 N[C@@H](CCC1CCC1)C(=O)O Amb24765842 [0,1,0,1,0,0|0,0,2]=4 3764 B11R1.332 N[C@H](CCC1CCC1)C(=O)O Amb24765843 [0,1,0,1,0,0|0,0,2]=4 3765 B11R1.332 O=C(O)C(=O)NCC1CCC1 Amb9303766 [0,1,0,1,0,0|1,0,0]=3 3766 B11R1.332 O=C(O)C(=O)NCC1CSC1 Amb35638902 [0,1,0,1,0,0|2,0,0]=4 3767 B11R1.333 CC(CCCC1CC1)C(=O)O Amb33167109 [0,1,0,1,0,0|0,0,2]=4 3768 B11R1.333 C\C(=C/CCC1CC1)C(=O)O Amb27671721 [0,1,0,1,0,0|0,0,0]=2 3769 B11R1.333 NC(CCCC1CC1)C(=O)O Amb33065871 [0,1,0,1,0,0|0,0,2]=4 3770 B11R1.333 N[C@@H](CCCC1CC1)C(=O)O Amb33309079 [0,1,0,1,0,0|0,0,2]=4 3771 B11R1.333 N[C@H](CCCC1CC1)C(=O)O Amb33308609 [0,1,0,1,0,0|0,0,2]=4 3772 B11R1.333 O=C(O)\C(F)=C\CCC1CC1 Amb27671724 [0,1,0,1,0,0|0,0,0]=2 3773 B11R1.421 CCC1CCCC1(C)C(=O)O Amb32654895 [0,1,0,1,0,0|0,0,2]=4 3774 B11R1.421 CCC1CCCC1(N)C(=O)O Amb27823632 [0,1,0,1,0,0|0,0,2]=4 3775 B11R1.421 CC[C@@H]1CCC[C@]1(N)C(=O)O Amb25295379 [0,1,0,1,0,0|0,0,2]=4 3776 B11R1.468 CCC1CC1CC(N)C(=O)O Amb33066051 [0,1,0,1,0,0|0,0,2]=4 3777 B11R1.468 CCC1CC1C[C@@H](N)C(=O)O Amb33065440 [0,1,0,1,0,0|0,0,2]=4 3778 B11R1.468 CCC1CC1C[C@H](N)C(=O)O Amb33036903 [0,1,0,1,0,0|0,0,2]=4 3779 B11R1.468 CCC1CC1NC(C)C(=O)O Amb27271453 [0,1,0,1,0,0|1,0,1]=4 3780 B11R1.468 CC[C@@H]1C[C@H]1CC(N)C(=O)O Amb33066171 [0,1,0,1,0,0|0,0,2]=4 3781 B11R1.468 CC[C@@H]1C[C@H]1C[C@@H](N)C(=O)O Amb33065726 [0,1,0,1,0,0|0,0,2]=4 3782 B11R1.468 CC[C@@H]1C[C@H]1C[C@H](N)C(=O)O Amb33035586 [0,1,0,1,0,0|0,0,2]=4 3783 B11R1.497 CC(=O)C1=CC(=O)CCCC1 Amb27426734 [0,1,0,1,0,0|1,0,1]=4 3784 B11R1.497 CC(C)C1CCC=CC(=O)C1 Amb27759319 [0,1,0,1,0,0|1,0,0]=3 3785 B11R1.497 CC(C)[C@@H]1CCC=CC(=O)C1 Amb28250093 [0,1,0,1,0,0|1,0,0]=3 3786 B11R1.497 CC(C)[C@H]1CCCCC(=O)O1 Amb27267912 [0,1,0,1,0,0|0,0,2]=4 3787 B11R1.520 CC1CCCCC1(C)C(=O)O Amb24635732 [0,1,0,1,0,0|0,0,2]=4 3788 B11R1.520 CC1CCCCC1(N)C(=O)O Amb2695544 [0,1,0,1,0,0|0,0,2]=4 3789 B11R1.520 C[C@@H]1CCCC[C@@]1(N)C(=O)O Amb26431408 [0,1,0,1,0,0|0,0,2]=4 3790 B11R1.520 C[C@@H]1CCCC[C@]1(C)C(=O)O Amb28062305 [0,1,0,1,0,0|0,0,2]=4 3791 B11R1.520 C[C@@H]1CCCC[C@]1(N)C(=O)O Amb25263952 [0,1,0,1,0,0|0,0,2]=4 3792 B11R1.520 C[C@H]1CCCC[C@]1(N)C(=O)O Amb28319347 [0,1,0,1,0,0|0,0,2]=4 3793 B11R1.520 C[C@H]1CCCC[C@]1(O)C(=O)O Amb28051865 [0,1,0,1,0,0|0,0,2]=4 3794 B11R1.737 CC1(C(=O)O)CCCCCC1 Amb25152741 [0,1,0,1,0,0|0,0,2]=4 3795 B11R1.737 C[C@@]1(C(=O)O)CCCCCN1 Amb27848065 [0,1,0,1,0,0|1,0,1]=4 3796 B11R1.737 NC1(C(=O)O)CCCCCC1 Amb1841034 [0,1,0,1,0,0|0,0,2]=4 3797 B11R1.737 O=C(O)C1(Cl)CCCCCC1 Amb26847917 [0,1,0,1,0,0|0,0,2]=4 3798 B11R1.737 O=C(O)C1(F)CCCCCC1 Amb25151314 [0,1,0,1,0,0|0,0,2]=4 3799 B11R1.737 O=C(O)C1(O)CCCCCC1 Amb33537594 [0,1,0,1,0,0|0,0,2]=4 3800 B11R1.103 CC1CC1C(=O)\C=C\C(=O)O Amb35596104 [0,1,0,1,0,0|0,0,1]=3 3801 B11R1.103 CC1CC1C(C)NCC(=O)O Amb27989408 [0,1,0,1,0,0|1,0,1]=4 3802 B11R1.103 CC1CC1C(N)CCC(=O)O Amb33036326 [0,1,0,1,0,0|0,0,2]=4 3803 B11R1.103 CC1CC1C(O)CCC(=O)O Amb33036208 [0,1,0,1,0,0|0,0,2]=4 3804 B11R1.167 CC1=C(C(=O)O)C[C@@H](O)CC1 Amb27409054 [0,1,0,1,0,0|0,0,2]=4 3805 B11R1.167 CC1CCC(C)C(C(=O)O)C1 Amb27870887 [0,1,0,1,0,0|0,0,2]=4 3806 B11R1.167 CC1CCC(C)C(C(=O)O)N1 Amb33072383 [0,1,0,1,0,0|1,0,1]=4 3807 B11R1.167 CC1CCC(Cl)CC1C(=O)O Amb25260877 [0,1,0,1,0,0|0,0,2]=4 3808 B11R1.167 CC1CCC(F)CC1C(=O)O Amb28050842 [0,1,0,1,0,0|0,0,2]=4 3809 B11R1.167 CC1CCC(N)CC1C(=O)O Amb26073941 [0,1,0,1,0,0|0,0,2]=4 3810 B11R1.167 CC1CCC(O)CC1C(=O)O Amb24392245 [0,1,0,1,0,0|0,0,2]=4 3811 B11R1.167 CC1CC[C@H](O)C[C@H]1C(=O)O Amb28195098 [0,1,0,1,0,0|0,0,2]=4 3812 B11R1.167 C[C@H]1CC[C@@H](C)[C@@H](C(=O)O)C1 Amb26927968 [0,1,0,1,0,0|0,0,2]=4 3813 B11R1.182 C=CCC1OC(=O)C=CC1O Amb20246603 [0,1,0,1,0,0|0,0,2]=4 3814 B11R1.182 CCC[C@@H]1CC(=O)C=C[C@H]1O Amb28052470 [0,1,0,1,0,0|1,0,0]=3 3815 B11R1.182 C\C=C\C1OC(=O)C=CC1O Amb24504762 [0,1,0,1,0,0|0,0,2]=4 3816 B11R1.182 C\C=C\[C@@H]1OC(=O)C=C[C@@H]1O Amb16184147 [0,1,0,1,0,0|0,0,2]=4 3817 B11R1.346 CC(C#CC(=O)O)C1CCC1 Amb33169029 [0,1,0,1,0,0|0,0,2]=4 3818 B11R1.346 CC(CCC(=O)O)C1CCC1 Amb27989288 [0,1,0,1,0,0|0,0,2]=4 3819 B11R1.346 CN(\C=C\C(=O)O)C1CCC1 Amb28285051 [0,1,0,1,0,0|1,0,0]=3 3820 B11R1.346 NC(C#CC(=O)O)C1CCC1 Amb33169050 [0,1,0,1,0,0|0,0,2]=4 3821 B11R1.346 NC(CCC(=O)O)C1CCC1 Amb27271036 [0,1,0,1,0,0|0,0,2]=4 3822 B11R1.346 O=C(O)\C=C\C(=O)C1CCC1 Amb35596097 [0,1,0,1,0,0|0,0,1]=3 3823 B11R1.346 O=C(O)\C=C\C(=O)N1CCC1 Amb27666804 [0,1,0,1,0,0|1,0,1]=4 3824 B11R1.348 NC(CCC(=O)O)CC1CC1 Amb18787691 [0,1,0,1,0,0|0,0,2]=4 3825 B11R1.348 O=C(O)CCC(O)CC1CC1 Amb33036109 [0,1,0,1,0,0|0,0,2]=4 3826 B11R1.348 O=C(O)\C=C/C(=O)NC1CC1 Amb20622197 [0,1,0,1,0,0|1,0,1]=4 3827 B11R1.348 O=C(O)\C=C\C(=O)NC1CC1 Amb35824665 [0,1,0,1,0,0|1,0,1]=4 3828 B11R1.495 CC1CCC(C)N1CC(=O)O Amb10609615 [0,1,0,1,0,0|1,0,1]=4 3829 B11R1.495 CN1CCN(C)C1=CC(=O)O Amb18200192 [0,1,0,1,0,0|2,0,0]=4 3830 B11R1.713 CC1(OCC(=O)O)CCCC1 Amb24538298 [0,1,0,1,0,0|1,0,1]=4 3831 B11R1.713 CC1(\C=C\C(=O)O)CCCS1 Amb25187067 [0,1,0,1,0,0|1,0,0]=3 3832 B11R1.713 CC1(\C=C\[N+](=O)[O-])CCCC1 Amb27491336 [0,1,0,1,0,0|1,0,1]=4 3833 B11R1.713 NC1(CCC(=O)O)CCCC1 Amb18199966 [0,1,0,1,0,0|0,0,2]=4 3834 B11R1.713 NC1(CCC(=O)O)CCCC1 Amb31217522 [0,1,0,1,0,0|0,0,2]=4 3835 B11R1.713 O=C(O)C#CC1(O)CCCC1 Amb27617434 [0,1,0,1,0,0|0,0,2]=4 3836 B11R1.713 O=C(O)CCC1(O)CCCC1 Amb33136536 [0,1,0,1,0,0|0,0,2]=4 3837 B11R1.914 CC1(CCC=O)C=CC(=O)O1 Amb27184129 [0,1,0,1,0,0|1,0,1]=4 3838 B11R1.914 CCCC[C@@]1(O)C=C[C@H](O)C1 Amb28319932 [0,1,0,1,0,0|1,0,1]=4 3839 B11R1.177 CC1(C)CCCCC1C(=O)O Amb28458483 [0,1,0,1,0,0|0,0,2]=4 3840 B11R1.177 CC1(C)CCCNC1C(=O)O Amb23589293 [0,1,0,1,0,0|1,0,1]=4 3841 B11R1.177 CC1(C)CCCNC1C(=O)O Amb28872325 [0,1,0,1,0,0|1,0,1]=4 3842 B11R1.177 CC1(N)CCCCC1C(=O)O Amb25803877 [0,1,0,1,0,0|0,0,2]=4 3843 B11R1.177 CC1(N)CCCCC1C(=O)O Amb28652995 [0,1,0,1,0,0|0,0,2]=4 3844 B11R1.177 C[C@@]1(N)CCCC[C@@H]1C(=O)O Amb1993789 [0,1,0,1,0,0|0,0,2]=4 3845 B11R1.177 C[C@@]1(N)CCCC[C@@H]1C(=O)O Amb1993896 [0,1,0,1,0,0|0,0,2]=4 3846 B11R1.177 C[C@@]1(O)CCCC[C@H]1C(=O)O Amb35664180 [0,1,0,1,0,0|0,0,2]=4 3847 B11R1.177 C[C@]1(N)CCCC[C@H]1C(=O)O Amb26414538 [0,1,0,1,0,0|0,0,2]=4 3848 B11R1.178 CC(=O)N1CCC=C1C(=O)O Amb27249478 [0,1,0,1,0,0|1,0,1]=4 3849 B11R1.178 CC(C)C1=C(C(=O)O)CCC1 Amb27471127 [0,1,0,1,0,0|0,0,2]=4 3850 B11R1.178 CC(C)C1CCCC1C(=O)O Amb27878368 [0,1,0,1,0,0|0,0,2]=4 3851 B11R1.178 CC(C)C1CCN[C@@H]1C(=O)O Amb25976372 [0,1,0,1,0,0|1,0,1]=4 3852 B11R1.178 CC(C)C1CCOC1C(=O)O Amb24370040 [0,1,0,1,0,0|1,0,1]=4 3853 B11R1.178 CC(C)[C@@H]1CCC[C@H]1C(=O)O Amb25911911 [0,1,0,1,0,0|0,0,2]=4 3854 B11R1.178 CC(C)[C@@H]1CCN[C@H]1C(=O)O Amb27208705 [0,1,0,1,0,0|1,0,1]=4 3855 B11R1.178 CC(C)[C@@H]1CCO[C@@H]1C(=O)O Amb25249400 [0,1,0,1,0,0|1,0,1]=4 3856 B11R1.178 CC(C)[C@@H]1NCC=C1C(=O)O Amb27184110 [0,1,0,1,0,0|1,0,0]=3 3857 B11R1.178 CC(C)[C@H]1CCC[C@@H]1C(=O)O Amb27845503 [0,1,0,1,0,0|0,0,2]=4 3858 B11R1.178 CC(C)[C@H]1CCN[C@@H]1C(=O)O Amb28346326 [0,1,0,1,0,0|1,0,1]=4 3859 B11R1.178 CC(C)[C@H]1CCO[C@H]1C(=O)O Amb24636009 [0,1,0,1,0,0|1,0,1]=4 3860 B11R1.234 CC1(C)CCCC1CC(=O)O Amb26352892 [0,1,0,1,0,0|0,0,2]=4 3861 B11R1.234 CC1(C)CCCN1CC(=O)O Amb27621340 [0,1,0,1,0,0|1,0,1]=4 3862 B11R1.234 CC1(C)COC\C1=C/C(=O)O Amb27955346 [0,1,0,1,0,0|1,0,0]=3 3863 B11R1.234 CC1(C)OCC\C1=C\C(=O)O Amb33468667 [0,1,0,1,0,0|1,0,0]=3 3864 B11R1.708 CC(C)CC1CCC1C(=O)O Amb27451597 [0,1,0,1,0,0|0,0,2]=4 3865 B11R1.711 CC(C)CCC1CC1C(=O)O Amb27989325 [0,1,0,1,0,0|0,0,2]=4 3866 B11R1.923 CC1(C)CC1CNCC(=O)O Amb27271457 [0,1,0,1,0,0|1,0,1]=4 3867 B11R1.923 CC1(C)CC1N\C=C\C(=O)O Amb28367021 [0,1,0,1,0,0|1,0,0]=3 3868 B11R2.35 O=C1C=COC(C2CC2)C1 Amb25055019 [0,0,0,2,0,0|2,0,0]=4 3869 B11R2.36 O=C1C=C2CCC[C@H]2CC1 Amb28049904 [0,0,0,2,0,0|1,0,0]=3 3870 B11R2.36 O=C1C=CC2CCCC2C1 Amb27433303 [0,0,0,2,0,0|1,0,0]=3 3871 B11R2.36 O=C1C=CN2CCCC2C1 Amb25698683 [0,0,0,2,0,0|2,0,0]=4 3872 B11R2.36 O=C1C=CN2CCC[C@H]2C1 Amb27828981 [0,0,0,2,0,0|2,0,0]=4 3873 B11R2.36 O=C1C=C[C@@H]2CCC[C@H]2C1 Amb27881830 [0,0,0,2,0,0|1,0,0]=3 3874 B11R2.36 O=C1NC[C@H]2CCC[C@@H]2O1 Amb27625649 [0,0,0,2,0,0|1,0,1]=4 3875 B11R2.106 O=C1C=CCC2CCCN12 Amb27838010 [0,0,0,2,0,0|1,0,0]=3 3876 B11R2.106 O=C1C=CNC2CCCC12 Amb27221064 [0,0,0,2,0,0|2,0,0]=4 3877 B11R2.106 O=C1CCCC2SCC=C12 Amb27164586 [0,0,0,2,0,0|2,0,0]=4 3878 B11R2.106 O=C1NCCN2CCC=C12 Amb27786321 [0,0,0,2,0,0|2,0,0]=4 3879 B11R2.106 O=C1OCCC2CCNC12 Amb26611135 [0,0,0,2,0,0|1,0,1]=4 3880 B11R2.106 O=C1OCCC2CCNC12 Amb28555523 [0,0,0,2,0,0|1,0,1]=4 3881 B11R2.106 OC1C=CCC2CCCC12 Amb27756012 [0,0,0,2,0,0|1,0,1]=4 3882 B11R2.106 O[C@@H]1C=CC[C@H]2CCC[C@H]12 Amb27653410 [0,0,0,2,0,0|1,0,1]=4 3883 B11R2.678 O=C1NC2CCCC(C2)O1 Amb27830368 [0,0,0,2,0,0|1,0,1]=4 3884 B11R2.1478 O=C1NCCC2(CCC2)O1 Amb33135715 [0,0,0,2,0,0|1,0,1]=4 3885 B11R2.1 O=C1C=C[C@@H]2CCCC[C@H]12 Amb28052345 [0,0,0,2,0,0|1,0,0]=3 3886 B11R2.1 O=C1C=C[C@H]2CCCC[C@H]12 Amb27253540 [0,0,0,2,0,0|1,0,0]=3 3887 B11R2.1 O=C1OCC2=C1CCCC2 Amb28050216 [0,0,0,2,0,0|0,0,2]=4 3888 B11R2.1 O=C1OCC2CCCCC12 Amb22551108 [0,0,0,2,0,0|0,0,2]=4 3889 B11R2.1 O=C1OCC2CCCCN12 Amb26946593 [0,0,0,2,0,0|1,0,1]=4 3890 B11R2.1 O=C1OC[C@@H]2CCCC[C@H]12 Amb26594527 [0,0,0,2,0,0|0,0,2]=4 3891 B11R2.10 O=C1C=C2CCCCC2C1 Amb3994718 [0,0,0,2,0,0|1,0,0]=3 3892 B11R2.10 O=C1C=C2CCCCC2O1 Amb28146298 [0,0,0,2,0,0|0,0,0]=2 3893 B11R2.10 O=C1C=C2CCCCN2N1 Amb27228287 [0,0,0,2,0,0|2,0,0]=4 3894 B11R2.10 O=C1C=C2CNCCC2S1 Amb15692582 [0,0,0,2,0,0|1,1,0]=4 3895 B11R2.10 O=C1C=C2CNCCC2S1 Amb22497522 [0,0,0,2,0,0|1,1,0]=4 3896 B11R2.10 O=C1C=C2NCCCC2O1 Amb27203400 [0,0,0,2,0,0|1,0,0]=3 3897 B11R2.10 O=C1N=C2NCCCC2O1 Amb27240567 [0,0,0,2,0,0|2,0,0]=4 3898 B11R2.10 O=C1NC2=C(CCCC2)O1 Amb27947306 [0,0,0,2,0,0|1,0,1]=4 3899 B11R2.10 O=C1N[C@H]2CCCC[C@@H]2O1 Amb25988675 [0,0,0,2,0,0|1,0,1]=4 3900 B11R2.10 O=C1OC2CCCCC2O1 Amb1031385 [0,0,0,2,0,0|1,0,1]=4 3901 B11R2.10 OC1C=C2CCCCC2C1 Amb27753046 [0,0,0,2,0,0|1,0,1]=4 3902 B11R2.10 Oc1cc2c(s1)CCCC2 Amb33340145 [0,0,0,2,0,0|0,1,1]=4 3903 B11R2.33 CC1CC1C2CCC(=O)O2 Amb33036197 [0,0,0,2,0,0|0,0,2]=4 3904 B11R2.33 CC1CC1C2CNC(=O)O2 Amb33449184 [0,0,0,2,0,0|1,0,1]=4 3905 B11R2.33 CC1CC1c2ccc(Br)o2 Amb33009153 [0,0,0,2,0,0|1,0,1]=4 3906 B11R2.33 CC1CC1c2ccc(O)o2 Amb32729257 [0,0,0,2,0,0|0,0,2]=4 3907 B11R2.66 CC1CCC2CC(=O)C=C12 Amb27212491 [0,0,0,2,0,0|1,0,0]=3 3908 B11R2.66 C[C@@H]1CC[C@H]2CC(=O)C=C21 Amb27263021 [0,0,0,2,0,0|1,0,0]=3 3909 B11R2.66 C[C@@H]1CC[C@H]2OC(=O)N[C@@H]12 Amb27656582 [0,0,0,2,0,0|1,0,1]=4 3910 B11R2.66 C[C@@H]1OC[C@H]2CC(=O)C=C21 Amb27627345 [0,0,0,2,0,0|2,0,0]=4 3911 B11R2.67 O=C1C=CC2CCC(O)C12 Amb28324373 [0,0,0,2,0,0|2,0,0]=4 3912 B11R2.351 O=C1CCC(CC2CC2)O1 Amb33036203 [0,0,0,2,0,0|0,0,2]=4 3913 B11R2.351 O=C1NCC(CC2CC2)O1 Amb33361883 [0,0,0,2,0,0|1,0,1]=4 3914 B11R2.352 Brc1ccc(C2CCC2)o1 Amb10600912 [0,0,0,2,0,0|1,0,1]=4 3915 B11R2.352 O=C1NCC(C2CCC2)O1 Amb26979194 [0,0,0,2,0,0|1,0,1]=4 3916 B11R2.359 O[C@@H]1C=C[C@H]2CC[C@@H](C1)C2 Amb28194266 [0,0,0,2,0,0|1,0,1]=4 3917 B11R2.748 O=C1C=CC2(CCCC2)C1 Amb25767081 [0,0,0,2,0,0|1,0,0]=3 3918 B11R2.748 O=C1CCC2(CCCC2)O1 Amb33109782 [0,0,0,2,0,0|0,0,2]=4 3919 B11R2.748 O=C1NCC2(CCCC2)O1 Amb17506328 [0,0,0,2,0,0|1,0,1]=4 3920 B11R2.748 OC1C=CC2(CCCC2)C1 Amb27651856 [0,0,0,2,0,0|1,0,1]=4 3921 B11R2.59 O=S1(=O)C=C2CCCCC21 Amb22364563 [0,0,0,2,0,0|1,0,1]=4 3922 B11R2.824 O=C(O)C1C2CCC1CC2 Amb27196504 [0,0,0,2,0,0|0,0,2]=4 3923 B11R2.824 O=C(O)C1C2CCN1CC2 Amb24074708 [0,0,0,2,0,0|1,0,1]=4 3924 B11R2.824 O=C(O)C1C2CCN1CC2 Amb24078266 [0,0,0,2,0,0|1,0,1]=4 3925 B11R2.860 O=C(O)CC1C2CCCC21 Amb27593732 [0,0,0,2,0,0|0,0,2]=4 3926 B11R2.932 CC(=O)\C=C1\CCC2CC12 Amb27406463 [0,0,0,2,0,0|1,0,0]=3 3927 B11R2.932 O=C(O)CC1CCC2CC12 Amb25766461 [0,0,0,2,0,0|0,0,2]=4 3928 B11R2.932 O=C(O)\C=C1\CCC2CC12 Amb27752621 [0,0,0,2,0,0|0,0,0]=2 3929 B11R2.934 O=C(O)CC1CC2CC2C1 Amb26067688 [0,0,0,2,0,0|0,0,2]=4 3930 B11R2.934 O=C(O)CN1CC2CC2C1 Amb25257563 [0,0,0,2,0,0|1,0,1]=4 3931 B11R2.934 O=C(O)CN1CC2CC2C1 Amb33620693 [0,0,0,2,0,0|1,0,1]=4 3932 B11R2.1852 O=C(O)C1C2CCCCC21 Amb9774962 [0,0,0,2,0,0|0,0,2]=4 3933 B11R2.1852 O=C(O)C1C2CCCCN21 Amb32681201 [0,0,0,2,0,0|1,0,1]=4 3934 B11R2.1852 O=C(O)[C@@H]1[C@H]2CCCC[C@H]21 Amb27615049 [0,0,0,2,0,0|0,0,2]=4 3935 B11R2.391 CC1(O)C=CC2CCC1C2 Amb22356370 [0,0,0,2,0,0|1,0,1]=4 3936 B11R2.142 O=C(O)C1CCCC12CC2 Amb18202870 [0,0,0,2,0,0|0,0,2]=4 3937 B11R2.819 O=C(O)[C@@]12CC[C@@H]1CCN2 Amb31156565 [0,0,0,2,0,0|1,0,1]=4 3938 B11R2.819 O=C(O)[C@@]12CC[C@@H]1CCN2 Amb33044344 [0,0,0,2,0,0|1,0,1]=4 3939 B11R2.819 O=C(O)[C@]12CC[C@H]1CCN2 Amb35745854 [0,0,0,2,0,0|1,0,1]=4 3940 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2CC[C@@H]21 Amb33743872 [0,0,0,2,0,0|1,0,1]=4 3941 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2CC[C@@H]21 Amb33803658 [0,0,0,2,0,0|1,0,1]=4 3942 B11R2.822 O=C(O)[C@@H]1NC[C@H]2CC[C@H]21 Amb33714601 [0,0,0,2,0,0|1,0,1]=4 3943 B11R2.822 O=C(O)[C@@H]1NC[C@H]2CC[C@H]21 Amb33803580 [0,0,0,2,0,0|1,0,1]=4 3944 B11R2.822 O=C(O)[C@H]1OC[C@@H]2CC[C@H]12 Amb28203936 [0,0,0,2,0,0|1,0,1]=4 3945 B11R2.845 NC(=O)C1=CC2CCC1C2 Amb24505178 [0,0,0,2,0,0|1,0,0]=3 3946 B11R2.845 O=C(Cl)C1=CC2CCC1C2 Amb26621584 [0,0,0,2,0,0|1,0,0]=3 3947 B11R2.845 O=C(O)C1=C[C@H]2CC[C@@H]1C2 Amb27467878 [0,0,0,2,0,0|0,0,0]=2 3948 B11R2.845 O=C(O)C1CC2CCC1C2 Amb32643951 [0,0,0,2,0,0|0,0,2]=4 3949 B11R2.845 O=C(O)C1CC2CCC1C2 Amb6335820 [0,0,0,2,0,0|0,0,2]=4 3950 B11R2.845 O=C(O)C1C[C@@H]2CC[C@H]1C2 Amb28068735 [0,0,0,2,0,0|0,0,2]=4 3951 B11R2.845 O=C(O)C1NC2CCC1C2 Amb2796335 [0,0,0,2,0,0|1,0,1]=4 3952 B11R2.845 O=C(O)C1NC2CCC1C2 Amb32665985 [0,0,0,2,0,0|1,0,1]=4 3953 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1C2 Amb27421974 [0,0,0,2,0,0|0,0,2]=4 3954 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1C2 Amb24630346 [0,0,0,2,0,0|0,0,2]=4 3955 B11R2.845 O=C(O)[C@@H]1NC2CCC1C2 Amb27776982 [0,0,0,2,0,0|1,0,1]=4 3956 B11R2.845 O=C(O)[C@@H]1N[C@@H]2CC[C@H]1C2 Amb24560741 [0,0,0,2,0,0|1,0,1]=4 3957 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 Amb18180724 [0,0,0,2,0,0|1,0,1]=4 3958 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 Amb22748360 [0,0,0,2,0,0|1,0,1]=4 3959 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@H]1C2 Amb22745380 [0,0,0,2,0,0|1,0,1]=4 3960 B11R2.845 O=C(O)[C@H]1CC2CCC1C2 Amb27252127 [0,0,0,2,0,0|0,0,2]=4 3961 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1C2 Amb27420163 [0,0,0,2,0,0|0,0,2]=4 3962 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2 Amb24548859 [0,0,0,2,0,0|0,0,2]=4 3963 B11R2.845 O=C(O)[C@H]1NC2CCC1C2 Amb26570917 [0,0,0,2,0,0|1,0,1]=4 3964 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@@H]1C2 Amb26546902 [0,0,0,2,0,0|1,0,1]=4 3965 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@@H]1C2 Amb34916347 [0,0,0,2,0,0|1,0,1]=4 3966 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 Amb2371885 [0,0,0,2,0,0|1,0,1]=4 3967 B11R2.845 OB(O)C1=CC2CCC1C2 Amb10072045 [0,0,0,2,0,0|1,0,1]=4 3968 B11R2.845 OB(O)C1=C[C@H]2CC[C@@H]1C2 Amb33524027 [0,0,0,2,0,0|1,0,1]=4 3969 B11R2.1726 CC1C2CCCC12C(=O)O Amb28251035 [0,0,0,2,0,0|0,0,2]=4 3970 B11R2.135 O=C1C=CCC[C@H]2C[C@H]2C1 Amb27261992 [0,0,0,2,0,0|1,0,0]=3 3971 B11R2.813 O=C(O)C12CC1CCCN2 Amb24112951 [0,0,0,2,0,0|1,0,1]=4 3972 B11R2.813 O=C(O)C12CC1CCCN2 Amb33714480 [0,0,0,2,0,0|1,0,1]=4 3973 B11R2.813 O=C(O)C12CCCCC1C2 Amb25709012 [0,0,0,2,0,0|0,0,2]=4 3974 B11R2.813 O=C(O)C12CCCCC1O2 Amb26396244 [0,0,0,2,0,0|1,0,1]=4 3975 B11R2.813 O=C(O)[C@@]12C[C@@H]1CCCN2 Amb33098529 [0,0,0,2,0,0|1,0,1]=4 3976 B11R2.813 O=C(O)[C@]12C[C@H]1CCCN2 Amb24609781 [0,0,0,2,0,0|1,0,1]=4 3977 B11R2.813 O=C(O)[C@]12C[C@H]1CCCN2 Amb35746859 [0,0,0,2,0,0|1,0,1]=4 3978 B11R2.821 O=C(O)C1CCC2CC1C2 Amb27776869 [0,0,0,2,0,0|0,0,2]=4 3979 B11R2.821 O=C(O)C1NCC2CC1C2 Amb28196614 [0,0,0,2,0,0|1,0,1]=4 3980 B11R2.1837 O=C(O)C1CCCC2CC21 Amb26335134 [0,0,0,2,0,0|0,0,2]=4 3981 B11R2.1837 O=C(O)C1NCCC2CC21 Amb24758905 [0,0,0,2,0,0|1,0,1]=4 3982 B11R2.1837 O=C(O)C1NCCC2CC21 Amb33295309 [0,0,0,2,0,0|1,0,1]=4 3983 B11R2.1837 O=C(O)C1NCC[C@@H]2C[C@H]12 Amb34913022 [0,0,0,2,0,0|1,0,1]=4 3984 B11R2.1837 O=C(O)C1NCC[C@H]2C[C@@H]12 Amb34158527 [0,0,0,2,0,0|1,0,1]=4 3985 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2C[C@H]21 Amb33496159 [0,0,0,2,0,0|1,0,1]=4 3986 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2C[C@H]21 Amb33496160 [0,0,0,2,0,0|1,0,1]=4 3987 B11R2.1837 O=C(O)[C@H]1CCC[C@@H]2C[C@H]12 Amb27630509 [0,0,0,2,0,0|0,0,2]=4 3988 B11R2.1854 C[C@]12CCC[C@@H]1[C@@H]2C(=O)O Amb28423498 [0,0,0,2,0,0|0,0,2]=4 3989 B11R2.9 C[C@]12CCCC1=CC(=O)C2 Amb22356941 [0,0,0,2,0,0|1,0,0]=3 3990 B11R2.814 O=C(O)C1=CC2CCCC12 Amb33620437 [0,0,0,2,0,0|0,0,0]=2 3991 B11R2.814 O=C(O)C1CC2CCCC21 Amb24524606 [0,0,0,2,0,0|0,0,2]=4 3992 B11R2.814 O=C(O)C1C[C@H]2CCC[C@@H]12 Amb28196683 [0,0,0,2,0,0|0,0,2]=4 3993 B11R2.141 O=C(O)C1CC12CCCC2 Amb33530349 [0,0,0,2,0,0|0,0,2]=4 3994 B11R2.141 O=C(O)C1OC12CCCC2 Amb27249665 [0,0,0,2,0,0|1,0,1]=4 3995 B11R2.111 O=C1C=CCC2CC2CC1 Amb22356805 [0,0,0,2,0,0|1,0,0]=3 3996 B11R2.111 O[C@@H]1C=CC2CC2CCC1 Amb22356855 [0,0,0,2,0,0|1,0,1]=4 3997 B11R2.457 CC1CC1C2CC2C(=O)O Amb32671154 [0,0,0,2,0,0|0,0,2]=4 3998 B11R2.457 CC1CC1[C@@H]2C[C@H]2C(=O)O Amb33144660 [0,0,0,2,0,0|0,0,2]=4 3999 B11R2.839 CC(=O)C1=CCC2OC2C1 Amb27945521 [0,0,0,2,0,0|2,0,0]=4 4000 B11R2.839 O=C(O)C1CCC2CC2C1 Amb27876727 [0,0,0,2,0,0|0,0,2]=4 4001 B11R2.61 C=C1C=C[C@@H]2CC[C@@H]2CC1 Amb24514940 [0,0,0,2,0,0|2,0,0]=4 4002 B11R2.61 O=C1C=CC2CCC2CC1 Amb27837963 [0,0,0,2,0,0|1,0,0]=3 4003 B11R2.61 O=C1C=C[C@@H]2CCC2CC1 Amb27788954 [0,0,0,2,0,0|1,0,0]=3 4004 B11R2.1869 O=C(O)C1CCC12CCC2 Amb27882602 [0,0,0,2,0,0|0,0,2]=4 4005 B11R2.1869 O=C(O)C1NCC12CCC2 Amb26553687 [0,0,0,2,0,0|1,0,1]=4 4006 B11R2.1869 O=C(O)C1NCC12CCC2 Amb32665285 [0,0,0,2,0,0|1,0,1]=4 4007 B11R2.826 O=C(O)CC1CC1C2CC2 Amb25738014 [0,0,0,2,0,0|0,0,2]=4 4008 B11R2.826 O=C(O)C[C@@H]1C[C@H]1C2CC2 Amb25919287 [0,0,0,2,0,0|0,0,2]=4 4009 B11R2.826 O=C(O)C[C@H]1C[C@H]1C2CC2 Amb28428451 [0,0,0,2,0,0|0,0,2]=4 4010 B11R2.842 O=C(O)C1CC2CCC2C1 Amb25256091 [0,0,0,2,0,0|0,0,2]=4 4011 B11R2.842 O=C(O)[C@@H]1C[C@@H]2CC[C@@H]2N1 Amb33714602 [0,0,0,2,0,0|1,0,1]=4 4012 B11R2.817 O=C(O)C1CC1CC2CC2 Amb33361503 [0,0,0,2,0,0|0,0,2]=4 4013 B11R2.817 O=C(O)[C@@H]1C[C@H]1CC2CC2 Amb33361501 [0,0,0,2,0,0|0,0,2]=4 4014 B11R2.831 O=C(O)C#CC1CC12CC2 Amb33168970 [0,0,0,2,0,0|0,0,2]=4 4015 B11R2.1836 O=C(O)C1CC1C2CCC2 Amb20622343 [0,0,0,2,0,0|0,0,2]=4 4016 B11R2.1836 O=C(O)[C@@H]1C[C@H]1C2CCC2 Amb27878873 [0,0,0,2,0,0|0,0,2]=4