0 B7R0.4 BrCCCCC(=O)C Amb16234126 [0,0,0,0,0,0|1,0,0]=1 1 B7R0.4 C#CCCOC(=O)Cl Amb22360631 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.4 C#CCOCC(=O)Cl Amb24686000 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.4 C#CCSCC(=O)O Amb2372297 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.4 C#CCSCC(N)=O Amb24706564 [0,0,0,0,0,0|2,0,2]=4 5 B7R0.4 C=C(Br)CCCC=O Amb24390485 [0,0,0,0,0,0|2,0,2]=4 6 B7R0.4 C=C(Br)CCCCCl Amb24703183 [0,0,0,0,0,0|2,0,1]=3 7 B7R0.4 C=C(Br)CCCCO Amb25381428 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.4 C=C(Br)CNCCN Amb18180845 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.4 C=C(Br)CNCCO Amb18523816 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.4 C=C(Br)COCCN Amb19020783 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.4 C=C(Br)CSCCN Amb18303981 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.4 C=C(Br)CSCCO Amb19053954 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.4 C=C(Cl)CCCCO Amb25064782 [0,0,0,0,0,0|2,0,1]=3 14 B7R0.4 C=C(Cl)CNCCF Amb24709983 [0,0,0,0,0,0|3,0,1]=4 15 B7R0.4 C=C(Cl)CNCCO Amb19004198 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.4 C=C(Cl)COCCN Amb19020765 [0,0,0,0,0,0|3,0,1]=4 17 B7R0.4 C=C(F)CCCCBr Amb24635488 [0,0,0,0,0,0|2,0,1]=3 18 B7R0.4 C=C(F)CCCCO Amb22641473 [0,0,0,0,0,0|2,0,1]=3 19 B7R0.4 C=CCCCC(=O)C Amb17593171 [0,0,0,0,0,0|0,0,2]=2 20 B7R0.4 C=CCCCC(N)=N Amb24595568 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.4 C=CCCCC(N)=O Amb24579642 [0,0,0,0,0,0|1,0,2]=3 22 B7R0.4 C=CCCC[N+]([O-])=O Amb22338382 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.4 C=CCCNC(N)=O Amb25789999 [0,0,0,0,0,0|2,0,2]=4 24 B7R0.4 C=CCNCC(=C)C Amb17308750 [0,0,0,0,0,0|2,0,2]=4 25 B7R0.4 C=CCSCC(=O)O Amb1110888 [0,0,0,0,0,0|2,0,2]=4 26 B7R0.4 C=CCSCC(N)=O Amb19129905 [0,0,0,0,0,0|2,0,2]=4 27 B7R0.4 CB(C)NCCCN Amb25315199 [0,0,0,0,0,0|4,0,0]=4 28 B7R0.4 CC#CCCC(C)=O Amb24471185 [0,0,0,0,0,0|0,0,2]=2 29 B7R0.4 CC#CCCC(C)Br Amb25045853 [0,0,0,0,0,0|1,0,3]=4 30 B7R0.4 CC#CCCC(C)C Amb22052677 [0,0,0,0,0,0|1,0,3]=4 31 B7R0.4 CC#CCCC(C)N Amb25101063 [0,0,0,0,0,0|1,0,3]=4 32 B7R0.4 CC#CCCN(C)C Amb25054131 [0,0,0,0,0,0|2,0,2]=4 33 B7R0.4 CC#CCC[C@@H](C)O Amb22896361 [0,0,0,0,0,0|0,0,4]=4 34 B7R0.4 CC#CCC[C@H](C)O Amb24734021 [0,0,0,0,0,0|0,0,4]=4 35 B7R0.4 CC#CCNC(N)=O Amb24332663 [0,0,0,0,0,0|2,0,2]=4 36 B7R0.4 CC#CCOC(=O)Cl Amb22001616 [0,0,0,0,0,0|2,0,2]=4 37 B7R0.4 CC#CCOC(C)=O Amb22043383 [0,0,0,0,0,0|1,0,2]=3 38 B7R0.4 CC#C\C=C\C(C)=O Amb24359262 [0,0,0,0,0,0|0,0,4]=4 39 B7R0.4 CC(=C)CCCC=C Amb25787099 [0,0,0,0,0,0|1,0,2]=3 40 B7R0.4 CC(=C)CCCC=O Amb18641705 [0,0,0,0,0,0|2,0,1]=3 41 B7R0.4 CC(=C)CCCCBr Amb25129478 [0,0,0,0,0,0|2,0,0]=2 42 B7R0.4 CC(=C)CCCCCl Amb24481468 [0,0,0,0,0,0|2,0,0]=2 43 B7R0.4 CC(=C)CCCCN Amb25142976 [0,0,0,0,0,0|2,0,0]=2 44 B7R0.4 CC(=C)CNCC#C Amb18296128 [0,0,0,0,0,0|2,0,2]=4 45 B7R0.4 CC(=C)CNCC#N Amb24657244 [0,0,0,0,0,0|3,0,1]=4 46 B7R0.4 CC(=C)CNCCN Amb25336867 [0,0,0,0,0,0|3,0,0]=3 47 B7R0.4 CC(=C)CNCCO Amb24591963 [0,0,0,0,0,0|3,0,0]=3 48 B7R0.4 CC(=C)COCCN Amb19020764 [0,0,0,0,0,0|3,0,0]=3 49 B7R0.4 CC(=C)COCCN Amb20631068 [0,0,0,0,0,0|3,0,0]=3 50 B7R0.4 CC(=C)CSCCCl Amb24462749 [0,0,0,0,0,0|3,0,0]=3 51 B7R0.4 CC(=C)OCCCBr Amb25337400 [0,0,0,0,0,0|3,0,0]=3 52 B7R0.4 CC(=C)OCCCO Amb24581723 [0,0,0,0,0,0|3,0,0]=3 53 B7R0.4 CC(=C)\C=C\CCBr Amb25775579 [0,0,0,0,0,0|2,0,2]=4 54 B7R0.4 CC(=C)\C=C\CCCl Amb24483160 [0,0,0,0,0,0|2,0,2]=4 55 B7R0.4 CC(=C)\C=C\CCN Amb25214158 [0,0,0,0,0,0|2,0,2]=4 56 B7R0.4 CC(=C)\C=C\CCO Amb24474428 [0,0,0,0,0,0|2,0,2]=4 57 B7R0.4 CC(=N)CCCCN Amb25076530 [0,0,0,0,0,0|2,0,0]=2 58 B7R0.4 CC(=N)NCCC#N Amb24712410 [0,0,0,0,0,0|3,0,1]=4 59 B7R0.4 CC(=N)NCCCF Amb25144823 [0,0,0,0,0,0|3,0,0]=3 60 B7R0.4 CC(=O)CCCC#C Amb18115312 [0,0,0,0,0,0|0,0,2]=2 61 B7R0.4 CC(=O)CCCC=O Amb18641775 [0,0,0,0,0,0|1,0,1]=2 62 B7R0.4 CC(=O)CCN=C=O Amb24481500 [0,0,0,0,0,0|2,0,1]=3 63 B7R0.4 CC(=O)CCN=[N+]=[N-] Amb18522048 [0,0,0,0,0,0|3,0,0]=3 64 B7R0.4 CC(=O)CCNC=O Amb25075578 [0,0,0,0,0,0|2,0,1]=3 65 B7R0.4 CC(=O)CCOC=O Amb24408302 [0,0,0,0,0,0|2,0,1]=3 66 B7R0.4 CC(=O)CC\C=C/Br Amb25758398 [0,0,0,0,0,0|1,0,2]=3 67 B7R0.4 CC(=O)CC\C=C\Br Amb25336747 [0,0,0,0,0,0|1,0,2]=3 68 B7R0.4 CC(=O)CN=NC#N Amb25294341 [0,0,0,0,0,0|3,0,1]=4 69 B7R0.4 CC(=O)CNCC#C Amb24528702 [0,0,0,0,0,0|1,0,2]=3 70 B7R0.4 CC(=O)CNCCO Amb18108527 [0,0,0,0,0,0|2,0,0]=2 71 B7R0.4 CC(=O)CNCCS Amb25328157 [0,0,0,0,0,0|2,0,0]=2 72 B7R0.4 CC(=O)COCC=O Amb18641868 [0,0,0,0,0,0|2,0,1]=3 73 B7R0.4 CC(=O)COCCCl Amb25346574 [0,0,0,0,0,0|2,0,0]=2 74 B7R0.4 CC(=O)COCCN Amb18630459 [0,0,0,0,0,0|2,0,0]=2 75 B7R0.4 CC(=O)CSCC#C Amb25333140 [0,0,0,0,0,0|1,0,2]=3 76 B7R0.4 CC(=O)CSCC=C Amb25767863 [0,0,0,0,0,0|1,0,2]=3 77 B7R0.4 CC(=O)CSCCCl Amb25110707 [0,0,0,0,0,0|2,0,0]=2 78 B7R0.4 CC(=O)CSCCF Amb24621173 [0,0,0,0,0,0|2,0,0]=2 79 B7R0.4 CC(=O)C\C=C\C=C Amb24711717 [0,0,0,0,0,0|0,0,4]=4 80 B7R0.4 CC(=O)C\C=C\CO Amb24583096 [0,0,0,0,0,0|1,0,2]=3 81 B7R0.4 CC(=O)NCCC#C Amb21942373 [0,0,0,0,0,0|1,0,2]=3 82 B7R0.4 CC(=O)NCCCF Amb25048794 [0,0,0,0,0,0|2,0,0]=2 83 B7R0.4 CC(=O)NCCCI Amb24733809 [0,0,0,0,0,0|2,0,0]=2 84 B7R0.4 CC(=O)NCCCN Amb10610286 [0,0,0,0,0,0|2,0,0]=2 85 B7R0.4 CC(=O)NCCNN Amb24117179 [0,0,0,0,0,0|3,0,0]=3 86 B7R0.4 CC(=O)NCCNN Amb25076762 [0,0,0,0,0,0|3,0,0]=3 87 B7R0.4 CC(=O)NCCON Amb17138368 [0,0,0,0,0,0|3,0,0]=3 88 B7R0.4 CC(=O)NCCSCl Amb24482235 [0,0,0,0,0,0|3,0,0]=3 89 B7R0.4 CC(=O)NCNC=O Amb24568316 [0,0,0,0,0,0|3,0,1]=4 90 B7R0.4 CC(=O)NOCC=C Amb25189056 [0,0,0,0,0,0|2,0,2]=4 91 B7R0.4 CC(=O)OCCC#N Amb18641722 [0,0,0,0,0,0|2,0,1]=3 92 B7R0.4 CC(=O)OCCC=O Amb18641862 [0,0,0,0,0,0|2,0,1]=3 93 B7R0.4 CC(=O)OCCCF Amb22008199 [0,0,0,0,0,0|2,0,0]=2 94 B7R0.4 CC(=O)OCCCI Amb24532815 [0,0,0,0,0,0|2,0,0]=2 95 B7R0.4 CC(=O)OCCCN Amb18641920 [0,0,0,0,0,0|2,0,0]=2 96 B7R0.4 CC(=O)OCCCO Amb25854267 [0,0,0,0,0,0|2,0,0]=2 97 B7R0.4 CC(=O)OCSCCl Amb25315538 [0,0,0,0,0,0|3,0,0]=3 98 B7R0.4 CC(=O)OC\C=C\Cl Amb25144667 [0,0,0,0,0,0|2,0,2]=4 99 B7R0.4 CC(=O)ON=CCCl Amb24651878 [0,0,0,0,0,0|3,0,1]=4 100 B7R0.4 CC(=O)OOCCBr Amb22233446 [0,0,0,0,0,0|3,0,0]=3 101 B7R0.4 CC(=O)O\C=C\CBr Amb25053906 [0,0,0,0,0,0|2,0,2]=4 102 B7R0.4 CC(=O)O\C=C\CCl Amb24671285 [0,0,0,0,0,0|2,0,2]=4 103 B7R0.4 CC(=O)O\N=C\CCl Amb24622642 [0,0,0,0,0,0|3,0,1]=4 104 B7R0.4 CC(=O)SCCC#N Amb22351951 [0,0,0,0,0,0|2,0,1]=3 105 B7R0.4 CC(=O)SCCC=C Amb24117956 [0,0,0,0,0,0|1,0,2]=3 106 B7R0.4 CC(=O)SCCC=O Amb25101351 [0,0,0,0,0,0|2,0,1]=3 107 B7R0.4 CC(=O)SCCCBr Amb17610077 [0,0,0,0,0,0|2,0,0]=2 108 B7R0.4 CC(=O)SCCCF Amb25240055 [0,0,0,0,0,0|2,0,0]=2 109 B7R0.4 CC(=O)SCCCN Amb25368304 [0,0,0,0,0,0|2,0,0]=2 110 B7R0.4 CC(=O)SCNC=O Amb25378456 [0,0,0,0,0,0|3,0,1]=4 111 B7R0.4 CC(=O)SC\C=C\Cl Amb24483090 [0,0,0,0,0,0|2,0,2]=4 112 B7R0.4 CC(=O)SC\C=C\O Amb24371969 [0,0,0,0,0,0|2,0,2]=4 113 B7R0.4 CC(=O)SSCCCl Amb25060782 [0,0,0,0,0,0|3,0,0]=3 114 B7R0.4 CC(=O)SSCCN Amb24625990 [0,0,0,0,0,0|3,0,0]=3 115 B7R0.4 CC(=O)S\C=C\CO Amb25098660 [0,0,0,0,0,0|2,0,2]=4 116 B7R0.4 CC(=O)\C=C\CCCl Amb25806173 [0,0,0,0,0,0|1,0,2]=3 117 B7R0.4 CC(=S)NCCC#N Amb25189875 [0,0,0,0,0,0|2,1,1]=4 118 B7R0.4 CC(=S)OCCCCl Amb22232259 [0,0,0,0,0,0|2,1,0]=3 119 B7R0.4 CC(=S)SCCCCl Amb24524361 [0,0,0,0,0,0|2,1,0]=3 120 B7R0.4 CC(Br)=CCCCBr Amb22347606 [0,0,0,0,0,0|2,0,1]=3 121 B7R0.4 CC(Br)=CCCCCl Amb25274964 [0,0,0,0,0,0|2,0,1]=3 122 B7R0.4 CC(Br)CCCC#C Amb25067289 [0,0,0,0,0,0|1,0,3]=4 123 B7R0.4 CC(Br)CCCCO Amb25859232 [0,0,0,0,0,0|2,0,1]=3 124 B7R0.4 CC(Br)COCCCl Amb24654744 [0,0,0,0,0,0|3,0,1]=4 125 B7R0.4 CC(C)=C=CCCN Amb25304273 [0,0,0,0,0,0|2,0,2]=4 126 B7R0.4 CC(C)=CCCC=C Amb25789441 [0,0,0,0,0,0|1,0,3]=4 127 B7R0.4 CC(C)=CCCCBr Amb24483213 [0,0,0,0,0,0|2,0,1]=3 128 B7R0.4 CC(C)=CCCCN Amb18641749 [0,0,0,0,0,0|2,0,1]=3 129 B7R0.4 CC(C)=CCC[Mg]Br Amb22897338 [0,0,0,0,0,0|3,0,1]=4 130 B7R0.4 CC(C)=CCC[Zn]Br Amb22897257 [0,0,0,0,0,0|3,0,1]=4 131 B7R0.4 CC(C)=CSCCO Amb24363694 [0,0,0,0,0,0|3,0,1]=4 132 B7R0.4 CC(C)=NNCCN Amb18641854 [0,0,0,0,0,0|4,0,0]=4 133 B7R0.4 CC(C)CCCC#C Amb18635315 [0,0,0,0,0,0|1,0,3]=4 134 B7R0.4 CC(C)CCCC#N Amb21811944 [0,0,0,0,0,0|2,0,2]=4 135 B7R0.4 CC(C)CCCC=C Amb25127926 [0,0,0,0,0,0|1,0,3]=4 136 B7R0.4 CC(C)CCCC=O Amb17940235 [0,0,0,0,0,0|2,0,2]=4 137 B7R0.4 CC(C)CCCCCl Amb20670590 [0,0,0,0,0,0|2,0,1]=3 138 B7R0.4 CC(C)CCCCN Amb19374781 [0,0,0,0,0,0|2,0,1]=3 139 B7R0.4 CC(C)CCCNO Amb25232356 [0,0,0,0,0,0|3,0,1]=4 140 B7R0.4 CC(C)CCC[Mg]Br Amb22897339 [0,0,0,0,0,0|3,0,1]=4 141 B7R0.4 CC(C)CCC[Zn]Br Amb22897392 [0,0,0,0,0,0|3,0,1]=4 142 B7R0.4 CC(C)CCSCCl Amb24481232 [0,0,0,0,0,0|3,0,1]=4 143 B7R0.4 CC(C)CCSCO Amb24450091 [0,0,0,0,0,0|3,0,1]=4 144 B7R0.4 CC(C)CNCCBr Amb25801102 [0,0,0,0,0,0|3,0,1]=4 145 B7R0.4 CC(C)CNCCF Amb24366225 [0,0,0,0,0,0|3,0,1]=4 146 B7R0.4 CC(C)CNCCO Amb22587152 [0,0,0,0,0,0|3,0,1]=4 147 B7R0.4 CC(C)CNCCS Amb24616771 [0,0,0,0,0,0|3,0,1]=4 148 B7R0.4 CC(C)COCCS Amb24589392 [0,0,0,0,0,0|3,0,1]=4 149 B7R0.4 CC(C)NCCCBr Amb24483135 [0,0,0,0,0,0|3,0,1]=4 150 B7R0.4 CC(C)NCCCCl Amb18124442 [0,0,0,0,0,0|3,0,1]=4 151 B7R0.4 CC(C)NCCCI Amb24733808 [0,0,0,0,0,0|3,0,1]=4 152 B7R0.4 CC(C)NCCCO Amb22492397 [0,0,0,0,0,0|3,0,1]=4 153 B7R0.4 CC(C)OCCCS Amb24551906 [0,0,0,0,0,0|3,0,1]=4 154 B7R0.4 CC(C)SCCCBr Amb19053955 [0,0,0,0,0,0|3,0,1]=4 155 B7R0.4 CC(C)SCCCCl Amb18179463 [0,0,0,0,0,0|3,0,1]=4 156 B7R0.4 CC(C)SCCCS Amb24483199 [0,0,0,0,0,0|3,0,1]=4 157 B7R0.4 CC(Cl)CCCC#C Amb25209433 [0,0,0,0,0,0|1,0,3]=4 158 B7R0.4 CC(Cl)CCCC#N Amb24524251 [0,0,0,0,0,0|2,0,2]=4 159 B7R0.4 CC(Cl)CCCCO Amb24532074 [0,0,0,0,0,0|2,0,1]=3 160 B7R0.4 CC(Cl)CNCCCl Amb24442200 [0,0,0,0,0,0|3,0,1]=4 161 B7R0.4 CC(Cl)CNCCF Amb25300193 [0,0,0,0,0,0|3,0,1]=4 162 B7R0.4 CC(Cl)CSCCCl Amb25101009 [0,0,0,0,0,0|3,0,1]=4 163 B7R0.4 CC(F)CCCCBr Amb24440754 [0,0,0,0,0,0|2,0,1]=3 164 B7R0.4 CC(F)CCCCO Amb24414878 [0,0,0,0,0,0|2,0,1]=3 165 B7R0.4 CC(F)CNCCO Amb24518852 [0,0,0,0,0,0|3,0,1]=4 166 B7R0.4 CC(N)=NCCC#C Amb25727551 [0,0,0,0,0,0|2,0,2]=4 167 B7R0.4 CC(N)=NCCC#N Amb25187743 [0,0,0,0,0,0|3,0,1]=4 168 B7R0.4 CC(N)CCCC#C Amb24418743 [0,0,0,0,0,0|1,0,3]=4 169 B7R0.4 CC(N)CCCCN Amb25214697 [0,0,0,0,0,0|2,0,1]=3 170 B7R0.4 CC(N)CNCCO Amb24668970 [0,0,0,0,0,0|3,0,1]=4 171 B7R0.4 CC(N)CSCCO Amb25101466 [0,0,0,0,0,0|3,0,1]=4 172 B7R0.4 CC(O)CCCC#C Amb24360348 [0,0,0,0,0,0|0,0,4]=4 173 B7R0.4 CC(O)CCCC#N Amb24354435 [0,0,0,0,0,0|1,0,3]=4 174 B7R0.4 CC(O)CCCC=C Amb22059432 [0,0,0,0,0,0|0,0,4]=4 175 B7R0.4 CC(O)CCCC=O Amb18641887 [0,0,0,0,0,0|1,0,3]=4 176 B7R0.4 CC(O)CCCCBr Amb24552945 [0,0,0,0,0,0|1,0,2]=3 177 B7R0.4 CC(O)CCCCCl Amb24462574 [0,0,0,0,0,0|1,0,2]=3 178 B7R0.4 CC(O)CCCCO Amb22227757 [0,0,0,0,0,0|1,0,2]=3 179 B7R0.4 CC(O)CCCON Amb24412992 [0,0,0,0,0,0|2,0,2]=4 180 B7R0.4 CC(O)COCCO Amb24590103 [0,0,0,0,0,0|2,0,2]=4 181 B7R0.4 CC(O)CSCCN Amb18304010 [0,0,0,0,0,0|2,0,2]=4 182 B7R0.4 CC(O)CSCCO Amb22055428 [0,0,0,0,0,0|2,0,2]=4 183 B7R0.4 CC(S)CSCCO Amb24476156 [0,0,0,0,0,0|2,1,1]=4 184 B7R0.4 CC=C=CCC(C)=O Amb24100849 [0,0,0,0,0,0|0,0,3]=3 185 B7R0.4 CC=C=CCC(O)=O Amb25118481 [0,0,0,0,0,0|1,0,3]=4 186 B7R0.4 CC=CCCC(C)=C Amb22228882 [0,0,0,0,0,0|1,0,2]=3 187 B7R0.4 CCC#CCC(C)O Amb22045231 [0,0,0,0,0,0|0,0,4]=4 188 B7R0.4 CCC#CC[C@H](C)O Amb25851544 [0,0,0,0,0,0|0,0,4]=4 189 B7R0.4 CCC=C=CC(C)=O Amb25830543 [0,0,0,0,0,0|0,0,3]=3 190 B7R0.4 CCCC#CC(=O)Cl Amb25250583 [0,0,0,0,0,0|1,0,2]=3 191 B7R0.4 CCCC#CC(C)=C Amb22228884 [0,0,0,0,0,0|1,0,2]=3 192 B7R0.4 CCCC#CC(C)N Amb25261362 [0,0,0,0,0,0|1,0,3]=4 193 B7R0.4 CCCC#CC(C)O Amb24273363 [0,0,0,0,0,0|0,0,4]=4 194 B7R0.4 CCCC#C[C@H](C)O Amb25283222 [0,0,0,0,0,0|0,0,4]=4 195 B7R0.4 CCCC=NC(N)=O Amb24411468 [0,0,0,0,0,0|2,0,1]=3 196 B7R0.4 CCCCC=C(C)C Amb22228888 [0,0,0,0,0,0|1,0,1]=2 197 B7R0.4 CCCCC=C(F)F Amb10840485 [0,0,0,0,0,0|2,0,1]=3 198 B7R0.4 CCCCCB(O)O Amb2447470 [0,0,0,0,0,0|2,0,1]=3 199 B7R0.4 CCCCCC(C)Cl Amb22228752 [0,0,0,0,0,0|1,0,1]=2 200 B7R0.4 CCCCCC(C)N Amb21962698 [0,0,0,0,0,0|1,0,1]=2 201 B7R0.4 CCCCCC(C)S Amb17939452 [0,0,0,0,0,0|0,1,1]=2 202 B7R0.4 CCCCCC(Cl)Br Amb25061271 [0,0,0,0,0,0|2,0,1]=3 203 B7R0.4 CCCCCC(F)Br Amb24641242 [0,0,0,0,0,0|2,0,1]=3 204 B7R0.4 CCCCCC(N)=N Amb19890171 [0,0,0,0,0,0|2,0,0]=2 205 B7R0.4 CCCCCC(N)C Amb10843721 [0,0,0,0,0,0|1,0,1]=2 206 B7R0.4 CCCCCC(N)O Amb24673933 [0,0,0,0,0,0|1,0,2]=3 207 B7R0.4 CCCCCC([O-])=O Amb22337624 [0,0,0,0,0,0|1,0,0]=1 208 B7R0.4 CCCCCC([O-])=O Amb22525161 [0,0,0,0,0,0|1,0,0]=1 209 B7R0.4 CCCCCC([O-])=O Amb22730527 [0,0,0,0,0,0|1,0,0]=1 210 B7R0.4 CCCCCC([O-])=O Amb22731343 [0,0,0,0,0,0|1,0,0]=1 211 B7R0.4 CCCCCN(C)C Amb10560438 [0,0,0,0,0,0|2,0,0]=2 212 B7R0.4 CCCCCN(C)N Amb24354275 [0,0,0,0,0,0|2,0,0]=2 213 B7R0.4 CCCCC[13C](O)=O Amb22353417 [0,0,0,0,0,0|1,0,0]=1 214 B7R0.4 CCCCC[C@@H](C)Br Amb24692738 [0,0,0,0,0,0|1,0,1]=2 215 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [0,0,0,0,0,0|0,0,2]=2 216 B7R0.4 CCCCC[N+]([O-])=O Amb22227991 [0,0,0,0,0,0|2,0,0]=2 217 B7R0.4 CCCCC[SiH](C)C Amb25173961 [0,0,0,0,0,0|1,1,0]=2 218 B7R0.4 CCCCNC(=N)N Amb16206158 [0,0,0,0,0,0|3,0,0]=3 219 B7R0.4 CCCCNC(=O)Cl Amb24574309 [0,0,0,0,0,0|2,0,0]=2 220 B7R0.4 CCCCNC(=S)N Amb1152044 [0,0,0,0,0,0|2,1,0]=3 221 B7R0.4 CCCCNC(C)=C Amb25291695 [0,0,0,0,0,0|2,0,0]=2 222 B7R0.4 CCCCNC(C)C Amb2111112 [0,0,0,0,0,0|2,0,1]=3 223 B7R0.4 CCCCNC(C)O Amb24715795 [0,0,0,0,0,0|1,0,2]=3 224 B7R0.4 CCCCNC(N)=N Amb19748357 [0,0,0,0,0,0|3,0,0]=3 225 B7R0.4 CCCCOB(O)O Amb25687500 [0,0,0,0,0,0|3,0,1]=4 226 B7R0.4 CCCCOC(=O)F Amb24710483 [0,0,0,0,0,0|2,0,0]=2 227 B7R0.4 CCCCOC(C)=S Amb22230357 [0,0,0,0,0,0|1,1,0]=2 228 B7R0.4 CCCCOC(C)Br Amb17689407 [0,0,0,0,0,0|2,0,1]=3 229 B7R0.4 CCCCOC(C)Cl Amb17689402 [0,0,0,0,0,0|2,0,1]=3 230 B7R0.4 CCCCOC(N)=N Amb24579254 [0,0,0,0,0,0|3,0,0]=3 231 B7R0.4 CCCCOC(N)=S Amb24761515 [0,0,0,0,0,0|2,1,0]=3 232 B7R0.4 CCCCSC(=N)N Amb10552525 [0,0,0,0,0,0|3,0,0]=3 233 B7R0.4 CCCCSC(=O)C Amb10552685 [0,0,0,0,0,0|1,0,0]=1 234 B7R0.4 CCCCSC(=O)Cl Amb22352826 [0,0,0,0,0,0|2,0,0]=2 235 B7R0.4 CCCCSC(Cl)Cl Amb24635698 [0,0,0,0,0,0|3,0,1]=4 236 B7R0.4 CCCCSC(F)F Amb24354543 [0,0,0,0,0,0|3,0,1]=4 237 B7R0.4 CCCCSC(N)=O Amb24533653 [0,0,0,0,0,0|2,0,0]=2 238 B7R0.4 CCCCSC([O-])=S Amb25359489 [0,0,0,0,0,0|2,0,1]=3 239 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [0,0,0,0,0,0|1,0,0]=1 240 B7R0.4 CCCNCC(=C)Br Amb18303968 [0,0,0,0,0,0|2,0,1]=3 241 B7R0.4 CCCNCC(=C)C Amb17308631 [0,0,0,0,0,0|2,0,0]=2 242 B7R0.4 CCCNCC(=C)Cl Amb19004838 [0,0,0,0,0,0|2,0,1]=3 243 B7R0.4 CCCNCC(=O)N Amb1124632 [0,0,0,0,0,0|2,0,0]=2 244 B7R0.4 CCCNCC(=O)O Amb10609640 [0,0,0,0,0,0|2,0,0]=2 245 B7R0.4 CCCNCC(=O)O Amb1110628 [0,0,0,0,0,0|2,0,0]=2 246 B7R0.4 CCCNCC(=S)N Amb17231883 [0,0,0,0,0,0|2,1,0]=3 247 B7R0.4 CCCNCC(C)Cl Amb25074390 [0,0,0,0,0,0|2,0,1]=3 248 B7R0.4 CCCNCC(C)N Amb19024658 [0,0,0,0,0,0|2,0,1]=3 249 B7R0.4 CCCNCC(C)O Amb22292467 [0,0,0,0,0,0|1,0,2]=3 250 B7R0.4 CCCNCC(C)S Amb18124358 [0,0,0,0,0,0|1,1,1]=3 251 B7R0.4 CCCNCC(F)F Amb13951924 [0,0,0,0,0,0|3,0,1]=4 252 B7R0.4 CCCNC[C@@H](C)O Amb25042630 [0,0,0,0,0,0|1,0,2]=3 253 B7R0.4 CCCNC[C@H](C)N Amb25730636 [0,0,0,0,0,0|2,0,1]=3 254 B7R0.4 CCCNC[C@H](C)O Amb24473274 [0,0,0,0,0,0|1,0,2]=3 255 B7R0.4 CCCNN=C(C)C Amb24747220 [0,0,0,0,0,0|3,0,0]=3 256 B7R0.4 CCCNNC(N)=S Amb19514593 [0,0,0,0,0,0|3,1,0]=4 257 B7R0.4 CCCOCC(C)Br Amb24563738 [0,0,0,0,0,0|2,0,1]=3 258 B7R0.4 CCCOC[C@H](C)O Amb24575974 [0,0,0,0,0,0|1,0,2]=3 259 B7R0.4 CCCONC(C)C Amb25799117 [0,0,0,0,0,0|3,0,1]=4 260 B7R0.4 CCCONC(N)=N Amb25843240 [0,0,0,0,0,0|4,0,0]=4 261 B7R0.4 CCCSCC(=C)Br Amb25206483 [0,0,0,0,0,0|2,0,1]=3 262 B7R0.4 CCCSCC(=C)Cl Amb24476596 [0,0,0,0,0,0|2,0,1]=3 263 B7R0.4 CCCSCC(=O)O Amb1137113 [0,0,0,0,0,0|2,0,0]=2 264 B7R0.4 CCCSCC(C)N Amb25101048 [0,0,0,0,0,0|2,0,1]=3 265 B7R0.4 CCCSC[C@@H](C)N Amb25839433 [0,0,0,0,0,0|2,0,1]=3 266 B7R0.4 CCCSC[C@H](C)N Amb24409083 [0,0,0,0,0,0|2,0,1]=3 267 B7R0.4 CCCSC[C@H](C)O Amb24526704 [0,0,0,0,0,0|1,0,2]=3 268 B7R0.4 CCCSSC(N)=N Amb25174907 [0,0,0,0,0,0|4,0,0]=4 269 B7R0.4 CCC\C=C/C(=O)C Amb17593161 [0,0,0,0,0,0|0,0,2]=2 270 B7R0.4 CCC\C=C/C(C)C Amb25747213 [0,0,0,0,0,0|1,0,3]=4 271 B7R0.4 CCC\C=C\C(=C)O Amb24332587 [0,0,0,0,0,0|0,0,4]=4 272 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [0,0,0,0,0,0|0,0,2]=2 273 B7R0.4 CCC\C=C\C(C)O Amb25083446 [0,0,0,0,0,0|0,0,4]=4 274 B7R0.4 CCC\C=C\C(N)=N Amb24549908 [0,0,0,0,0,0|2,0,2]=4 275 B7R0.4 CCC\C=C\[N+]([O-])=O Amb24558342 [0,0,0,0,0,0|2,0,2]=4 276 B7R0.4 CCN=C=CC(C)=O Amb24481402 [0,0,0,0,0,0|1,0,2]=3 277 B7R0.4 CCNCC=C(C)C Amb25084591 [0,0,0,0,0,0|2,0,1]=3 278 B7R0.4 CCNCCC(=S)N Amb17231882 [0,0,0,0,0,0|2,1,0]=3 279 B7R0.4 CCNCCC(C)=C Amb18312576 [0,0,0,0,0,0|2,0,0]=2 280 B7R0.4 CCNCCC(C)=O Amb18641851 [0,0,0,0,0,0|1,0,0]=1 281 B7R0.4 CCNCCC(C)Br Amb25697002 [0,0,0,0,0,0|2,0,1]=3 282 B7R0.4 CCNCCC(C)F Amb25250453 [0,0,0,0,0,0|2,0,1]=3 283 B7R0.4 CCNCCC(C)N Amb18305008 [0,0,0,0,0,0|2,0,1]=3 284 B7R0.4 CCNCCC(F)F Amb25307874 [0,0,0,0,0,0|3,0,1]=4 285 B7R0.4 CCNCCC(N)=N Amb25112934 [0,0,0,0,0,0|3,0,0]=3 286 B7R0.4 CCNCCN(C)C Amb1128271 [0,0,0,0,0,0|3,0,0]=3 287 B7R0.4 CCNCCN(C)N Amb18641934 [0,0,0,0,0,0|3,0,0]=3 288 B7R0.4 CCNCCS(N)=N Amb25255199 [0,0,0,0,0,0|4,0,0]=4 289 B7R0.4 CCNCC[C@H](C)O Amb25757479 [0,0,0,0,0,0|1,0,2]=3 290 B7R0.4 CCNCNC(C)=O Amb25809446 [0,0,0,0,0,0|2,0,0]=2 291 B7R0.4 CCNN=CC(C)=O Amb24595042 [0,0,0,0,0,0|2,0,1]=3 292 B7R0.4 CCNOCC(C)=C Amb24539134 [0,0,0,0,0,0|3,0,0]=3 293 B7R0.4 CCNOCC(N)=O Amb24505259 [0,0,0,0,0,0|3,0,0]=3 294 B7R0.4 CCN\C=C\C(C)=O Amb24761435 [0,0,0,0,0,0|1,0,2]=3 295 B7R0.4 CCN\N=C\C(C)=O Amb25024484 [0,0,0,0,0,0|2,0,1]=3 296 B7R0.4 CCOC#CC(C)=O Amb25335173 [0,0,0,0,0,0|1,0,2]=3 297 B7R0.4 CCOC=NC(N)=O Amb24665192 [0,0,0,0,0,0|3,0,1]=4 298 B7R0.4 CCOCC=C(C)C Amb25320552 [0,0,0,0,0,0|2,0,1]=3 299 B7R0.4 CCOCCC(=O)Cl Amb20672027 [0,0,0,0,0,0|2,0,0]=2 300 B7R0.4 CCOCCN(C)C Amb24676540 [0,0,0,0,0,0|3,0,0]=3 301 B7R0.4 CCOCCN(C)N Amb24690005 [0,0,0,0,0,0|3,0,0]=3 302 B7R0.4 CCOCCS(=O)Cl Amb24625733 [0,0,0,0,0,0|3,0,0]=3 303 B7R0.4 CCOCCS(C)=O Amb25206909 [0,0,0,0,0,0|2,0,0]=2 304 B7R0.4 CCOCC[C@@H](C)N Amb25744371 [0,0,0,0,0,0|2,0,1]=3 305 B7R0.4 CCOCC[C@@H](C)O Amb24524285 [0,0,0,0,0,0|1,0,2]=3 306 B7R0.4 CCOCC[C@H](C)N Amb24439507 [0,0,0,0,0,0|2,0,1]=3 307 B7R0.4 CCOCNC(C)=O Amb24334070 [0,0,0,0,0,0|2,0,0]=2 308 B7R0.4 CCOCNC(N)=O Amb25765493 [0,0,0,0,0,0|3,0,0]=3 309 B7R0.4 CCOCNC(N)=S Amb25810109 [0,0,0,0,0,0|3,1,0]=4 310 B7R0.4 CCOCOC(C)=O Amb25191864 [0,0,0,0,0,0|2,0,0]=2 311 B7R0.4 CCONCC(C)C Amb25265636 [0,0,0,0,0,0|3,0,1]=4 312 B7R0.4 CCONCC(N)=O Amb25745510 [0,0,0,0,0,0|3,0,0]=3 313 B7R0.4 CCONC[C@@H](C)O Amb24526714 [0,0,0,0,0,0|2,0,2]=4 314 B7R0.4 CCO[SiH2]CN(C)C Amb22733279 [0,0,0,0,0,0|3,1,0]=4 315 B7R0.4 CCO\C=C/C(C)=O Amb24379536 [0,0,0,0,0,0|1,0,2]=3 316 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [0,0,0,0,0,0|1,0,2]=3 317 B7R0.4 CCSC#CC(C)=O Amb25322915 [0,0,0,0,0,0|1,0,2]=3 318 B7R0.4 CCSC#CC(O)=O Amb25793529 [0,0,0,0,0,0|2,0,2]=4 319 B7R0.4 CCSCC=C(C)C Amb24408057 [0,0,0,0,0,0|2,0,1]=3 320 B7R0.4 CCSCCC(=S)N Amb17307560 [0,0,0,0,0,0|2,1,0]=3 321 B7R0.4 CCSCCC(C)=C Amb25236682 [0,0,0,0,0,0|2,0,0]=2 322 B7R0.4 CCSCCC(C)C Amb22230685 [0,0,0,0,0,0|2,0,1]=3 323 B7R0.4 CCSCCC(C)N Amb19149259 [0,0,0,0,0,0|2,0,1]=3 324 B7R0.4 CCSCNC(N)=S Amb24681142 [0,0,0,0,0,0|3,1,0]=4 325 B7R0.4 CCSSCC(C)C Amb25376742 [0,0,0,0,0,0|3,0,1]=4 326 B7R0.4 CCSSCC(C)O Amb24412221 [0,0,0,0,0,0|2,0,2]=4 327 B7R0.4 CCSSCC(O)=O Amb25233433 [0,0,0,0,0,0|3,0,0]=3 328 B7R0.4 CCS\C=C/C(O)=O Amb25200140 [0,0,0,0,0,0|2,0,2]=4 329 B7R0.4 CCS\C=C\C(C)=O Amb25328935 [0,0,0,0,0,0|1,0,2]=3 330 B7R0.4 CCS\C=C\C(O)=O Amb18642902 [0,0,0,0,0,0|2,0,2]=4 331 B7R0.4 CC\C=C\CC(C)N Amb25357984 [0,0,0,0,0,0|1,0,3]=4 332 B7R0.4 CC\C=C\CC(N)=N Amb24642056 [0,0,0,0,0,0|2,0,2]=4 333 B7R0.4 CC\C=C\CC(N)=O Amb24595892 [0,0,0,0,0,0|1,0,2]=3 334 B7R0.4 CC\C=C\C[C@@H](C)O Amb24352295 [0,0,0,0,0,0|0,0,4]=4 335 B7R0.4 CC\C=C\OC(C)=O Amb25219263 [0,0,0,0,0,0|1,0,2]=3 336 B7R0.4 CN(C)CCCC#C Amb18116175 [0,0,0,0,0,0|2,0,2]=4 337 B7R0.4 CN(C)CCCC=O Amb22753951 [0,0,0,0,0,0|3,0,1]=4 338 B7R0.4 CN(C)CCCC=O Amb24117840 [0,0,0,0,0,0|3,0,1]=4 339 B7R0.4 CN(C)CCCCBr Amb18178257 [0,0,0,0,0,0|3,0,0]=3 340 B7R0.4 CN(C)CCCCBr Amb19148184 [0,0,0,0,0,0|3,0,0]=3 341 B7R0.4 CN(C)CCCCCl Amb20668164 [0,0,0,0,0,0|3,0,0]=3 342 B7R0.4 CN(C)CCCCF Amb24527895 [0,0,0,0,0,0|3,0,0]=3 343 B7R0.4 CN(C)CCSCCl Amb24705524 [0,0,0,0,0,0|4,0,0]=4 344 B7R0.4 CNCCC=C(C)C Amb18993046 [0,0,0,0,0,0|2,0,1]=3 345 B7R0.4 CNCCCC(=O)O Amb1153115 [0,0,0,0,0,0|2,0,0]=2 346 B7R0.4 CNCCCC(C)=C Amb25742210 [0,0,0,0,0,0|2,0,0]=2 347 B7R0.4 CNCCCC(C)Cl Amb24706205 [0,0,0,0,0,0|2,0,1]=3 348 B7R0.4 CNCCCC(N)=O Amb18303611 [0,0,0,0,0,0|2,0,0]=2 349 B7R0.4 CNCCCC(O)C Amb17569899 [0,0,0,0,0,0|1,0,2]=3 350 B7R0.4 CNCCCS(O)=O Amb24656214 [0,0,0,0,0,0|3,0,0]=3 351 B7R0.4 CNCCNC(N)=N Amb24617858 [0,0,0,0,0,0|4,0,0]=4 352 B7R0.4 CNCCNC(N)=O Amb18299975 [0,0,0,0,0,0|3,0,0]=3 353 B7R0.4 CNCCOC(C)=O Amb18124262 [0,0,0,0,0,0|2,0,0]=2 354 B7R0.4 CNCCOC(C)C Amb19024604 [0,0,0,0,0,0|3,0,1]=4 355 B7R0.4 CNCCOC(N)=O Amb25136928 [0,0,0,0,0,0|3,0,0]=3 356 B7R0.4 CNCCSC(C)C Amb19024679 [0,0,0,0,0,0|3,0,1]=4 357 B7R0.4 CNCCSC(N)=N Amb23590673 [0,0,0,0,0,0|4,0,0]=4 358 B7R0.4 CNC\C=C\C(O)=O Amb25368293 [0,0,0,0,0,0|2,0,2]=4 359 B7R0.4 CNOCCN(C)C Amb24625525 [0,0,0,0,0,0|4,0,0]=4 360 B7R0.4 COCCCC(=O)Cl Amb24481572 [0,0,0,0,0,0|2,0,0]=2 361 B7R0.4 COCCCC(C)Br Amb18185551 [0,0,0,0,0,0|2,0,1]=3 362 B7R0.4 COCCCC(C)S Amb25810805 [0,0,0,0,0,0|1,1,1]=3 363 B7R0.4 COCCCC(N)=N Amb19269156 [0,0,0,0,0,0|3,0,0]=3 364 B7R0.4 COCCCC(N)=O Amb24670109 [0,0,0,0,0,0|2,0,0]=2 365 B7R0.4 COCCC[C@@H](C)N Amb24749054 [0,0,0,0,0,0|2,0,1]=3 366 B7R0.4 COCCNC(=O)N Amb1104938 [0,0,0,0,0,0|3,0,0]=3 367 B7R0.4 COCCNC(C)=N Amb24586273 [0,0,0,0,0,0|3,0,0]=3 368 B7R0.4 COCCNC(N)=N Amb19374354 [0,0,0,0,0,0|4,0,0]=4 369 B7R0.4 COCCNC(N)=N Amb22587024 [0,0,0,0,0,0|4,0,0]=4 370 B7R0.4 COCCNC(S)=S Amb24366657 [0,0,0,0,0,0|3,1,0]=4 371 B7R0.4 COCCNS(C)=O Amb24601463 [0,0,0,0,0,0|3,0,0]=3 372 B7R0.4 COCCOC(C)Br Amb25810790 [0,0,0,0,0,0|3,0,1]=4 373 B7R0.4 COCCOC(N)=N Amb25313305 [0,0,0,0,0,0|4,0,0]=4 374 B7R0.4 COCCOC(N)=O Amb25054225 [0,0,0,0,0,0|3,0,0]=3 375 B7R0.4 COCCOC([S-])=S Amb20671928 [0,0,0,0,0,0|3,1,0]=4 376 B7R0.4 COCCSC(C)C Amb24333320 [0,0,0,0,0,0|3,0,1]=4 377 B7R0.4 COCCSC(N)=N Amb20675994 [0,0,0,0,0,0|4,0,0]=4 378 B7R0.4 COCCSC(N)=N Amb24532155 [0,0,0,0,0,0|4,0,0]=4 379 B7R0.4 COCNCC(C)O Amb25216574 [0,0,0,0,0,0|2,0,2]=4 380 B7R0.4 COCSCC(C)=O Amb24717297 [0,0,0,0,0,0|2,0,0]=2 381 B7R0.4 COC\C=C\C(C)=O Amb25066961 [0,0,0,0,0,0|1,0,2]=3 382 B7R0.4 COC\C=C\C(O)=O Amb18296423 [0,0,0,0,0,0|2,0,2]=4 383 B7R0.4 CONCCC(C)=C Amb24543965 [0,0,0,0,0,0|3,0,0]=3 384 B7R0.4 CONCCC(C)=O Amb25342369 [0,0,0,0,0,0|2,0,0]=2 385 B7R0.4 CONCCC(C)C Amb20669574 [0,0,0,0,0,0|3,0,1]=4 386 B7R0.4 CONCCC(C)C Amb22058740 [0,0,0,0,0,0|3,0,1]=4 387 B7R0.4 CONCCC(N)=O Amb24481431 [0,0,0,0,0,0|3,0,0]=3 388 B7R0.4 CONCCC(O)=O Amb24441275 [0,0,0,0,0,0|3,0,0]=3 389 B7R0.4 CONCCN(C)C Amb24481430 [0,0,0,0,0,0|4,0,0]=4 390 B7R0.4 CO\C=C\CC(O)=O Amb25174889 [0,0,0,0,0,0|2,0,2]=4 391 B7R0.4 CS(=O)CCN=C=S Amb24381843 [0,0,0,0,0,0|3,0,1]=4 392 B7R0.4 CS(=O)CCNC=O Amb24350245 [0,0,0,0,0,0|3,0,1]=4 393 B7R0.4 CS(=O)NCCC#C Amb25279234 [0,0,0,0,0,0|2,0,2]=4 394 B7R0.4 CS(=O)NCCC#N Amb25347327 [0,0,0,0,0,0|3,0,1]=4 395 B7R0.4 CS(=O)NCCCI Amb24536638 [0,0,0,0,0,0|3,0,0]=3 396 B7R0.4 CS(=O)NCCCN Amb25177124 [0,0,0,0,0,0|3,0,0]=3 397 B7R0.4 CS(=O)NCCCO Amb25233860 [0,0,0,0,0,0|3,0,0]=3 398 B7R0.4 CSCCCC(=O)O Amb17503622 [0,0,0,0,0,0|2,0,0]=2 399 B7R0.4 CSCCCC(C)=O Amb25122381 [0,0,0,0,0,0|1,0,0]=1 400 B7R0.4 CSCCCC(C)N Amb18124381 [0,0,0,0,0,0|2,0,1]=3 401 B7R0.4 CSCCCC(N)=O Amb19129736 [0,0,0,0,0,0|2,0,0]=2 402 B7R0.4 CSCCNC(C)C Amb18523836 [0,0,0,0,0,0|3,0,1]=4 403 B7R0.4 CSCCNC(N)=S Amb24414359 [0,0,0,0,0,0|3,1,0]=4 404 B7R0.4 CSCCNC(S)=S Amb25856953 [0,0,0,0,0,0|3,1,0]=4 405 B7R0.4 CSCCNN(C)C Amb25747184 [0,0,0,0,0,0|4,0,0]=4 406 B7R0.4 CSCCOC(=O)Cl Amb25857013 [0,0,0,0,0,0|3,0,0]=3 407 B7R0.4 CSCCSC(C)C Amb25041305 [0,0,0,0,0,0|3,0,1]=4 408 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [0,0,0,0,0,0|1,0,2]=3 409 B7R0.4 CSC\C=C\C(C)=O Amb24515276 [0,0,0,0,0,0|1,0,2]=3 410 B7R0.4 CSC\C=C\C(O)=O Amb18291627 [0,0,0,0,0,0|2,0,2]=4 411 B7R0.4 CS\C=C/CC(C)=O Amb25064716 [0,0,0,0,0,0|1,0,2]=3 412 B7R0.4 CS\C=C\CC(C)=O Amb24690833 [0,0,0,0,0,0|1,0,2]=3 413 B7R0.4 C[C@@H](N)CNCCF Amb24534041 [0,0,0,0,0,0|3,0,1]=4 414 B7R0.4 C[C@@H](O)CCCC#N Amb24556435 [0,0,0,0,0,0|1,0,3]=4 415 B7R0.4 C[C@@H](O)CCCC=O Amb22896885 [0,0,0,0,0,0|1,0,3]=4 416 B7R0.4 C[C@@H](O)CCCCN Amb22896886 [0,0,0,0,0,0|1,0,2]=3 417 B7R0.4 C[C@@H](O)CNCCN Amb25689140 [0,0,0,0,0,0|2,0,2]=4 418 B7R0.4 C[C@@H](O)CSCCO Amb24643786 [0,0,0,0,0,0|2,0,2]=4 419 B7R0.4 C[C@H](N)CSCCO Amb24434353 [0,0,0,0,0,0|3,0,1]=4 420 B7R0.4 C[C@H](O)CCCC=C Amb24704360 [0,0,0,0,0,0|0,0,4]=4 421 B7R0.4 C[C@H](O)CCCCCl Amb25715881 [0,0,0,0,0,0|1,0,2]=3 422 B7R0.4 C[C@H](O)CNCCN Amb25777107 [0,0,0,0,0,0|2,0,2]=4 423 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [0,0,0,0,0,0|2,0,0]=2 424 B7R0.4 C\C(\Br)=C\CCCBr Amb25169514 [0,0,0,0,0,0|2,0,1]=3 425 B7R0.4 C\C(\F)=C\CCC=O Amb25290222 [0,0,0,0,0,0|2,0,2]=4 426 B7R0.4 C\C=C/C#CC(C)=O Amb24706752 [0,0,0,0,0,0|0,0,4]=4 427 B7R0.4 C\C=C/C=C\C(C)=O Amb24538831 [0,0,0,0,0,0|0,0,4]=4 428 B7R0.4 C\C=C/CCC(C)=O Amb24333832 [0,0,0,0,0,0|0,0,2]=2 429 B7R0.4 C\C=C/CC[C@H](C)N Amb24617340 [0,0,0,0,0,0|1,0,3]=4 430 B7R0.4 C\C=C\C=C\C(=O)C Amb17593137 [0,0,0,0,0,0|0,0,4]=4 431 B7R0.4 C\C=C\CC=C(C)C Amb24654746 [0,0,0,0,0,0|1,0,3]=4 432 B7R0.4 C\C=C\CCC(=O)Cl Amb25246754 [0,0,0,0,0,0|1,0,2]=3 433 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [0,0,0,0,0,0|1,0,2]=3 434 B7R0.4 C\C=C\CCC(C)=C Amb25746764 [0,0,0,0,0,0|1,0,2]=3 435 B7R0.4 C\C=C\CCC(C)C Amb24401080 [0,0,0,0,0,0|1,0,3]=4 436 B7R0.4 C\C=C\CCC(N)=O Amb25343167 [0,0,0,0,0,0|1,0,2]=3 437 B7R0.4 C\C=C\CNC(C)=O Amb24370252 [0,0,0,0,0,0|1,0,2]=3 438 B7R0.4 C\C=C\OCC(C)=O Amb24481479 [0,0,0,0,0,0|1,0,2]=3 439 B7R0.4 ClB(Cl)CCCCBr Amb25189034 [0,0,0,0,0,0|4,0,0]=4 440 B7R0.4 ClC(=O)OCCC=C Amb10844792 [0,0,0,0,0,0|2,0,2]=4 441 B7R0.4 ClC(Cl)=CCCCBr Amb24670156 [0,0,0,0,0,0|3,0,1]=4 442 B7R0.4 ClC(Cl)CCCCBr Amb24567653 [0,0,0,0,0,0|3,0,1]=4 443 B7R0.4 ClCCCCC(Cl)Cl Amb25238318 [0,0,0,0,0,0|3,0,1]=4 444 B7R0.4 ClCCCCN(C)C Amb17334150 [0,0,0,0,0,0|3,0,0]=3 445 B7R0.4 ClCCCCP(Cl)Cl Amb25774935 [0,0,0,0,0,0|4,0,0]=4 446 B7R0.4 ClCCCOC(=O)Cl Amb10844795 [0,0,0,0,0,0|3,0,0]=3 447 B7R0.4 ClCCNCC(C)C Amb17334145 [0,0,0,0,0,0|3,0,1]=4 448 B7R0.4 ClCCOCC(=O)Cl Amb17610887 [0,0,0,0,0,0|3,0,0]=3 449 B7R0.4 FC(Cl)=CCCCCl Amb24761249 [0,0,0,0,0,0|3,0,1]=4 450 B7R0.4 FC(F)CCCCBr Amb24693913 [0,0,0,0,0,0|3,0,1]=4 451 B7R0.4 N#CCCCC(=O)C Amb17106756 [0,0,0,0,0,0|1,0,1]=2 452 B7R0.4 N#CCCCC(O)=O Amb18560874 [0,0,0,0,0,0|2,0,1]=3 453 B7R0.4 N#CCSCC(=C)C Amb17501754 [0,0,0,0,0,0|3,0,1]=4 454 B7R0.4 N#CCSCC(=O)C Amb17501747 [0,0,0,0,0,0|2,0,1]=3 455 B7R0.4 N#CSCCC(O)=O Amb24481186 [0,0,0,0,0,0|3,0,1]=4 456 B7R0.4 NC(=N)NCCCO Amb25327526 [0,0,0,0,0,0|4,0,0]=4 457 B7R0.4 NC(=N)SCCCO Amb24381931 [0,0,0,0,0,0|4,0,0]=4 458 B7R0.4 NC(=O)CCCC#N Amb25337207 [0,0,0,0,0,0|2,0,1]=3 459 B7R0.4 NC(=O)CCCCI Amb25788033 [0,0,0,0,0,0|2,0,0]=2 460 B7R0.4 NC(=O)CCNC=O Amb24630476 [0,0,0,0,0,0|3,0,1]=4 461 B7R0.4 NC(=O)CCSC#N Amb24333945 [0,0,0,0,0,0|3,0,1]=4 462 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [0,0,0,0,0,0|2,0,2]=4 463 B7R0.4 NC(=O)CNCCF Amb24443361 [0,0,0,0,0,0|3,0,0]=3 464 B7R0.4 NC(=O)COCCBr Amb25133475 [0,0,0,0,0,0|3,0,0]=3 465 B7R0.4 NC(=O)CSCC=O Amb25806671 [0,0,0,0,0,0|3,0,1]=4 466 B7R0.4 NC(=O)CSCCCl Amb25846245 [0,0,0,0,0,0|3,0,0]=3 467 B7R0.4 NC(=O)C\C=C\CCl Amb25169594 [0,0,0,0,0,0|2,0,2]=4 468 B7R0.4 NC(=O)NCOCO Amb24469438 [0,0,0,0,0,0|4,0,0]=4 469 B7R0.4 NC(=O)OCCCCl Amb24635478 [0,0,0,0,0,0|3,0,0]=3 470 B7R0.4 NC(=O)SCCCCl Amb24481372 [0,0,0,0,0,0|3,0,0]=3 471 B7R0.4 NC(=S)CCCCCl Amb25177620 [0,0,0,0,0,0|2,1,0]=3 472 B7R0.4 NC(=S)CCCCF Amb24613464 [0,0,0,0,0,0|2,1,0]=3 473 B7R0.4 NC(=S)NCCCF Amb25219344 [0,0,0,0,0,0|3,1,0]=4 474 B7R0.4 NCCCCC(N)=N Amb25714813 [0,0,0,0,0,0|3,0,0]=3 475 B7R0.4 NCCCCC(N)=O Amb18641897 [0,0,0,0,0,0|2,0,0]=2 476 B7R0.4 NCCCCC(N)=S Amb24481404 [0,0,0,0,0,0|2,1,0]=3 477 B7R0.4 NCCCCC(N)O Amb24333310 [0,0,0,0,0,0|2,0,2]=4 478 B7R0.4 NCCCCC(O)C Amb17569903 [0,0,0,0,0,0|1,0,2]=3 479 B7R0.4 NCCCCC([O-])=O Amb22753853 [0,0,0,0,0,0|2,0,0]=2 480 B7R0.4 NCCCCP(O)=O Amb24520720 [0,0,0,0,0,0|3,0,0]=3 481 B7R0.4 NCCCCS(=O)C Amb17617794 [0,0,0,0,0,0|2,0,0]=2 482 B7R0.4 NCCCNC(N)=N Amb25859352 [0,0,0,0,0,0|4,0,0]=4 483 B7R0.4 NCCCNC(N)=O Amb18296186 [0,0,0,0,0,0|3,0,0]=3 484 B7R0.4 NCCCNC(N)=O Amb20622408 [0,0,0,0,0,0|3,0,0]=3 485 B7R0.4 NCCCNC(O)=O Amb24093884 [0,0,0,0,0,0|3,0,0]=3 486 B7R0.4 NCCCSC(C)C Amb10075505 [0,0,0,0,0,0|3,0,1]=4 487 B7R0.4 NCCCSC(N)=N Amb25805750 [0,0,0,0,0,0|4,0,0]=4 488 B7R0.4 NCCNCC(=O)O Amb17608063 [0,0,0,0,0,0|3,0,0]=3 489 B7R0.4 NCCNCC(C)C Amb17091016 [0,0,0,0,0,0|3,0,1]=4 490 B7R0.4 NCCNCC(O)=O Amb19958818 [0,0,0,0,0,0|3,0,0]=3 491 B7R0.4 NCCOCC(C)C Amb10609251 [0,0,0,0,0,0|3,0,1]=4 492 B7R0.4 NCCOCC(N)=O Amb18523830 [0,0,0,0,0,0|3,0,0]=3 493 B7R0.4 NCCOCC(N)=O Amb20631066 [0,0,0,0,0,0|3,0,0]=3 494 B7R0.4 NCCOCC(O)=O Amb18630146 [0,0,0,0,0,0|3,0,0]=3 495 B7R0.4 NCCOCC(O)=O Amb22751540 [0,0,0,0,0,0|3,0,0]=3 496 B7R0.4 NCCSCC(=O)C Amb17500454 [0,0,0,0,0,0|2,0,0]=2 497 B7R0.4 NCCSCC(=O)O Amb17500446 [0,0,0,0,0,0|3,0,0]=3 498 B7R0.4 NCCSCC(O)=O Amb20622325 [0,0,0,0,0,0|3,0,0]=3 499 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [0,0,0,0,0,0|2,0,2]=4 500 B7R0.4 NC\C=C\CC(O)=O Amb18641825 [0,0,0,0,0,0|2,0,2]=4 501 B7R0.4 NNCCCC(O)=O Amb24455803 [0,0,0,0,0,0|3,0,0]=3 502 B7R0.4 NOCCCC(=O)O Amb10975956 [0,0,0,0,0,0|3,0,0]=3 503 B7R0.4 NOCCCC(O)=O Amb22011795 [0,0,0,0,0,0|3,0,0]=3 504 B7R0.4 NOCCCN(C)C Amb17104868 [0,0,0,0,0,0|4,0,0]=4 505 B7R0.4 O=C(Cl)C\C=C\CCl Amb25127032 [0,0,0,0,0,0|2,0,2]=4 506 B7R0.4 O=C(Cl)OCCCBr Amb25137067 [0,0,0,0,0,0|3,0,0]=3 507 B7R0.4 O=C(F)CCCCCl Amb24472276 [0,0,0,0,0,0|2,0,0]=2 508 B7R0.4 O=C(F)OCCCCl Amb25122991 [0,0,0,0,0,0|3,0,0]=3 509 B7R0.4 O=C=NCCC(=O)Cl Amb17593404 [0,0,0,0,0,0|3,0,1]=4 510 B7R0.4 O=CCCC=C(C)C Amb17593168 [0,0,0,0,0,0|2,0,2]=4 511 B7R0.4 O=CCCCC(=O)O Amb17593198 [0,0,0,0,0,0|2,0,1]=3 512 B7R0.4 O=CCCNC(=O)C Amb17102165 [0,0,0,0,0,0|2,0,1]=3 513 B7R0.4 OB(O)CCCCBr Amb20171450 [0,0,0,0,0,0|3,0,1]=4 514 B7R0.4 OB(O)CCCCCl Amb25184744 [0,0,0,0,0,0|3,0,1]=4 515 B7R0.4 OC(=O)CCC=C=C Amb10605299 [0,0,0,0,0,0|1,0,3]=4 516 B7R0.4 OC(=O)CCN=C=S Amb24562253 [0,0,0,0,0,0|3,0,1]=4 517 B7R0.4 OC(=O)CCNC=O Amb18290434 [0,0,0,0,0,0|3,0,1]=4 518 B7R0.4 OC(=O)CC\C=C\Br Amb25238247 [0,0,0,0,0,0|2,0,2]=4 519 B7R0.4 OC(=O)CC\C=C\Cl Amb25803087 [0,0,0,0,0,0|2,0,2]=4 520 B7R0.4 OC(=O)CNCCS Amb18124468 [0,0,0,0,0,0|3,0,0]=3 521 B7R0.4 OC(=O)COCCBr Amb24057760 [0,0,0,0,0,0|3,0,0]=3 522 B7R0.4 OC(=O)COCCCl Amb21857870 [0,0,0,0,0,0|3,0,0]=3 523 B7R0.4 OC(=O)CSCC=O Amb24628311 [0,0,0,0,0,0|3,0,1]=4 524 B7R0.4 OC(=O)CSCCCl Amb18644703 [0,0,0,0,0,0|3,0,0]=3 525 B7R0.4 OC(=O)CSCCS Amb24711400 [0,0,0,0,0,0|3,0,0]=3 526 B7R0.4 OC(=O)C\C=C/CS Amb18124361 [0,0,0,0,0,0|2,0,2]=4 527 B7R0.4 OC(=O)C\C=C\CBr Amb18125611 [0,0,0,0,0,0|2,0,2]=4 528 B7R0.4 OC(=O)C\C=C\CCl Amb18124409 [0,0,0,0,0,0|2,0,2]=4 529 B7R0.4 OC(=O)C\C=C\CS Amb24693621 [0,0,0,0,0,0|2,0,2]=4 530 B7R0.4 OC(=O)\C=C\CCBr Amb25702661 [0,0,0,0,0,0|2,0,2]=4 531 B7R0.4 OCC#CCC(O)=O Amb24395623 [0,0,0,0,0,0|2,0,2]=4 532 B7R0.4 OCCC#CC(O)=O Amb25844914 [0,0,0,0,0,0|2,0,2]=4 533 B7R0.4 OCCCCB(O)O Amb25351122 [0,0,0,0,0,0|3,0,1]=4 534 B7R0.4 OCCCCC(=O)C Amb10603864 [0,0,0,0,0,0|1,0,0]=1 535 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [0,0,0,0,0,0|2,0,0]=2 536 B7R0.4 OCCCCC(N)C Amb17569907 [0,0,0,0,0,0|2,0,1]=3 537 B7R0.4 OCCCCC(O)=O Amb22351244 [0,0,0,0,0,0|2,0,0]=2 538 B7R0.4 OCCCCC(O)O Amb25204642 [0,0,0,0,0,0|2,0,2]=4 539 B7R0.4 OCCCCN(Cl)Cl Amb25071515 [0,0,0,0,0,0|4,0,0]=4 540 B7R0.4 OCCCC[C@H](O)C Amb10605245 [0,0,0,0,0,0|1,0,2]=3 541 B7R0.4 OCCCOC(C)C Amb10608350 [0,0,0,0,0,0|3,0,1]=4 542 B7R0.4 OCCCOP(=O)S Amb24641084 [0,0,0,0,0,0|4,0,0]=4 543 B7R0.4 OCCCSC(C)C Amb17502841 [0,0,0,0,0,0|3,0,1]=4 544 B7R0.4 OCCSCC(=O)O Amb1110090 [0,0,0,0,0,0|3,0,0]=3 545 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [0,0,0,0,0,0|2,0,2]=4 546 B7R0.4 OP(=O)OCCCCl Amb24562481 [0,0,0,0,0,0|4,0,0]=4 547 B7R0.4 SCCCCC(=O)O Amb17503767 [0,0,0,0,0,0|2,0,0]=2 548 B7R0.4 [C-]#[N+]CCCN(C)C Amb1981034 [0,0,0,0,0,0|3,0,1]=4 549 B7R0.4 [N-]=[N+]=NCCC(O)=O Amb20622326 [0,0,0,0,0,0|4,0,0]=4 550 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [0,0,0,0,0,0|2,0,0]=2 551 B7R0.4 [O-][N+](=O)CCCCO Amb25739830 [0,0,0,0,0,0|3,0,0]=3 552 B7R0.4 [O-][N+](=O)NCCCC Amb10552431 [0,0,0,0,0,0|3,0,0]=3 553 B7R0.4 [O-][N+](=O)OCCCBr Amb21953589 [0,0,0,0,0,0|4,0,0]=4 554 B7R0.4 [O-][N+](=O)OCCCC Amb17610378 [0,0,0,0,0,0|3,0,0]=3 555 B7R0.4 [S-]C(=S)OCCCC Amb16186572 [0,0,0,0,0,0|2,1,0]=3 556 B6R0.4 BC(=O)OCCCl Amb25199831 [1,0,0,0,0,0|3,0,0]=4 557 B6R0.4 BrCCCN(C)C Amb10603677 [1,0,0,0,0,0|3,0,0]=4 558 B6R0.4 C#CCCC(N)=O Amb18636026 [1,0,0,0,0,0|1,0,2]=4 559 B6R0.4 C#CCCC([O-])=O Amb22232009 [1,0,0,0,0,0|1,0,2]=4 560 B6R0.4 C=C(Cl)CCCBr Amb25811643 [1,0,0,0,0,0|2,0,1]=4 561 B6R0.4 C=C(Cl)CCCCl Amb24635037 [1,0,0,0,0,0|2,0,1]=4 562 B6R0.4 C=C(F)CCCO Amb25811029 [1,0,0,0,0,0|2,0,1]=4 563 B6R0.4 C=C(I)CCCN Amb24581029 [1,0,0,0,0,0|2,0,1]=4 564 B6R0.4 C=NCCC(O)=O Amb24480865 [1,0,0,0,0,0|2,0,1]=4 565 B6R0.4 CC#CCC(N)=O Amb24761404 [1,0,0,0,0,0|1,0,2]=4 566 B6R0.4 CC#CCC(O)=O Amb17939740 [1,0,0,0,0,0|1,0,2]=4 567 B6R0.4 CC(=C)CCC#C Amb18634222 [1,0,0,0,0,0|1,0,2]=4 568 B6R0.4 CC(=C)CCC=C Amb22228883 [1,0,0,0,0,0|1,0,2]=4 569 B6R0.4 CC(=C)CCC=O Amb18120891 [1,0,0,0,0,0|2,0,1]=4 570 B6R0.4 CC(=C)CCCBr Amb22886717 [1,0,0,0,0,0|2,0,0]=3 571 B6R0.4 CC(=C)CCCCl Amb24089299 [1,0,0,0,0,0|2,0,0]=3 572 B6R0.4 CC(=C)CCCN Amb24761452 [1,0,0,0,0,0|2,0,0]=3 573 B6R0.4 CC(=C)CCCO Amb22886814 [1,0,0,0,0,0|2,0,0]=3 574 B6R0.4 CC(=C)CCNN Amb25745941 [1,0,0,0,0,0|3,0,0]=4 575 B6R0.4 CC(=C)NCCO Amb25127040 [1,0,0,0,0,0|3,0,0]=4 576 B6R0.4 CC(=N)OCCCl Amb25063085 [1,0,0,0,0,0|3,0,0]=4 577 B6R0.4 CC(=O)C#CCCl Amb24427329 [1,0,0,0,0,0|1,0,2]=4 578 B6R0.4 CC(=O)CC=C=C Amb25746318 [1,0,0,0,0,0|0,0,3]=4 579 B6R0.4 CC(=O)CC=NO Amb25024487 [1,0,0,0,0,0|2,0,1]=4 580 B6R0.4 CC(=O)CCC=O Amb18639597 [1,0,0,0,0,0|1,0,1]=3 581 B6R0.4 CC(=O)CCC=S Amb25662155 [1,0,0,0,0,0|1,0,1]=3 582 B6R0.4 CC(=O)CCCF Amb25068187 [1,0,0,0,0,0|1,0,0]=2 583 B6R0.4 CC(=O)CCCI Amb25346994 [1,0,0,0,0,0|1,0,0]=2 584 B6R0.4 CC(=O)CCCN Amb18121547 [1,0,0,0,0,0|1,0,0]=2 585 B6R0.4 CC(=O)CCON Amb25186994 [1,0,0,0,0,0|2,0,0]=3 586 B6R0.4 CC(=O)CN=[N+]=[N-] Amb18114476 [1,0,0,0,0,0|3,0,0]=4 587 B6R0.4 CC(=O)CNC=O Amb23442787 [1,0,0,0,0,0|2,0,1]=4 588 B6R0.4 CC(=O)COC=O Amb24736861 [1,0,0,0,0,0|2,0,1]=4 589 B6R0.4 CC(=O)CSC=C Amb24479150 [1,0,0,0,0,0|1,0,2]=4 590 B6R0.4 CC(=O)C\C=C/Cl Amb25276014 [1,0,0,0,0,0|1,0,2]=4 591 B6R0.4 CC(=O)C\C=C\Cl Amb25094325 [1,0,0,0,0,0|1,0,2]=4 592 B6R0.4 CC(=O)C\C=N/O Amb25066399 [1,0,0,0,0,0|2,0,1]=4 593 B6R0.4 CC(=O)N=CCO Amb24420730 [1,0,0,0,0,0|2,0,1]=4 594 B6R0.4 CC(=O)NCC#C Amb20623038 [1,0,0,0,0,0|1,0,2]=4 595 B6R0.4 CC(=O)NCC=O Amb25757509 [1,0,0,0,0,0|2,0,1]=4 596 B6R0.4 CC(=O)NCCF Amb25832238 [1,0,0,0,0,0|2,0,0]=3 597 B6R0.4 CC(=O)NCCI Amb25761166 [1,0,0,0,0,0|2,0,0]=3 598 B6R0.4 CC(=O)NCCN Amb1218225 [1,0,0,0,0,0|2,0,0]=3 599 B6R0.4 CC(=O)NCCS Amb22230992 [1,0,0,0,0,0|2,0,0]=3 600 B6R0.4 CC(=O)NNCCl Amb24532146 [1,0,0,0,0,0|3,0,0]=4 601 B6R0.4 CC(=O)OCCF Amb25123333 [1,0,0,0,0,0|2,0,0]=3 602 B6R0.4 CC(=O)OCCI Amb17673987 [1,0,0,0,0,0|2,0,0]=3 603 B6R0.4 CC(=O)OCCN Amb18121947 [1,0,0,0,0,0|2,0,0]=3 604 B6R0.4 CC(=O)OCCP Amb25810695 [1,0,0,0,0,0|2,0,0]=3 605 B6R0.4 CC(=O)SCC=C Amb24531624 [1,0,0,0,0,0|1,0,2]=4 606 B6R0.4 CC(=O)SCCBr Amb24608039 [1,0,0,0,0,0|2,0,0]=3 607 B6R0.4 CC(=O)SCCCl Amb24746776 [1,0,0,0,0,0|2,0,0]=3 608 B6R0.4 CC(=O)SCCN Amb21953963 [1,0,0,0,0,0|2,0,0]=3 609 B6R0.4 CC(=O)SCCN Amb22011516 [1,0,0,0,0,0|2,0,0]=3 610 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [1,0,0,0,0,0|1,0,2]=4 611 B6R0.4 CC(=O)\C=C\CO Amb24414835 [1,0,0,0,0,0|1,0,2]=4 612 B6R0.4 CC(=S)NCCO Amb25747406 [1,0,0,0,0,0|2,1,0]=4 613 B6R0.4 CC(Br)=CCCO Amb24734140 [1,0,0,0,0,0|2,0,1]=4 614 B6R0.4 CC(Br)CCCN Amb25680649 [1,0,0,0,0,0|2,0,1]=4 615 B6R0.4 CC(Br)CCCS Amb25238249 [1,0,0,0,0,0|2,0,1]=4 616 B6R0.4 CC(C)=CCCI Amb22395000 [1,0,0,0,0,0|2,0,1]=4 617 B6R0.4 CC(C)=CCCN Amb18962494 [1,0,0,0,0,0|2,0,1]=4 618 B6R0.4 CC(C)=CCCO Amb22002283 [1,0,0,0,0,0|2,0,1]=4 619 B6R0.4 CC(C)=NCCN Amb24479886 [1,0,0,0,0,0|3,0,0]=4 620 B6R0.4 CC(Cl)=CCCBr Amb24479000 [1,0,0,0,0,0|2,0,1]=4 621 B6R0.4 CC(Cl)CCCBr Amb24479119 [1,0,0,0,0,0|2,0,1]=4 622 B6R0.4 CC(Cl)CCCCl Amb19516004 [1,0,0,0,0,0|2,0,1]=4 623 B6R0.4 CC(Cl)CCCN Amb24479883 [1,0,0,0,0,0|2,0,1]=4 624 B6R0.4 CC(F)CCCN Amb25127855 [1,0,0,0,0,0|2,0,1]=4 625 B6R0.4 CC(I)=CCCN Amb25663209 [1,0,0,0,0,0|2,0,1]=4 626 B6R0.4 CC(I)CCCO Amb25302406 [1,0,0,0,0,0|2,0,1]=4 627 B6R0.4 CC(N)=NCCO Amb25083393 [1,0,0,0,0,0|3,0,0]=4 628 B6R0.4 CC(N)CCCBr Amb24635757 [1,0,0,0,0,0|2,0,1]=4 629 B6R0.4 CC(N)CCCCl Amb24454593 [1,0,0,0,0,0|2,0,1]=4 630 B6R0.4 CC(N)CCCN Amb22168271 [1,0,0,0,0,0|2,0,1]=4 631 B6R0.4 CC(O)CCCCl Amb22270232 [1,0,0,0,0,0|1,0,2]=4 632 B6R0.4 CC(O)CCCF Amb24385806 [1,0,0,0,0,0|1,0,2]=4 633 B6R0.4 CC(O)CCCO Amb22227752 [1,0,0,0,0,0|1,0,2]=4 634 B6R0.4 CC(O)CCCS Amb25219256 [1,0,0,0,0,0|1,0,2]=4 635 B6R0.4 CC(S)CCCO Amb24412207 [1,0,0,0,0,0|1,1,1]=4 636 B6R0.4 CCC#CC(=O)Cl Amb25857496 [1,0,0,0,0,0|1,0,2]=4 637 B6R0.4 CCC#CC(N)=O Amb25255265 [1,0,0,0,0,0|1,0,2]=4 638 B6R0.4 CCC=CC(C)=O Amb22731698 [1,0,0,0,0,0|0,0,2]=3 639 B6R0.4 CCCC=C(F)F Amb10840483 [1,0,0,0,0,0|2,0,1]=4 640 B6R0.4 CCCCB(Cl)Cl Amb22230362 [1,0,0,0,0,0|3,0,0]=4 641 B6R0.4 CCCCB(O)O Amb2447142 [1,0,0,0,0,0|2,0,1]=4 642 B6R0.4 CCCCC(=C)Br Amb22583744 [1,0,0,0,0,0|1,0,1]=3 643 B6R0.4 CCCCC(=N)N Amb10066937 [1,0,0,0,0,0|2,0,0]=3 644 B6R0.4 CCCCC(=O)Br Amb22730323 [1,0,0,0,0,0|1,0,0]=2 645 B6R0.4 CCCCC(Br)Br Amb25784787 [1,0,0,0,0,0|2,0,1]=4 646 B6R0.4 CCCCC(C)Cl Amb22228753 [1,0,0,0,0,0|1,0,1]=3 647 B6R0.4 CCCCC(C)F Amb24350567 [1,0,0,0,0,0|1,0,1]=3 648 B6R0.4 CCCCC(C)I Amb17673919 [1,0,0,0,0,0|1,0,1]=3 649 B6R0.4 CCCCC(I)I Amb25186537 [1,0,0,0,0,0|2,0,1]=4 650 B6R0.4 CCCCC(N)O Amb24479887 [1,0,0,0,0,0|1,0,2]=4 651 B6R0.4 CCCCC(O)=S Amb24682342 [1,0,0,0,0,0|1,0,1]=3 652 B6R0.4 CCCCC(O)O Amb24687253 [1,0,0,0,0,0|1,0,2]=4 653 B6R0.4 CCCCC(O)S Amb24480485 [1,0,0,0,0,0|1,0,2]=4 654 B6R0.4 CCCCC([O-])=O Amb19879370 [1,0,0,0,0,0|1,0,0]=2 655 B6R0.4 CCCCC([O-])=O Amb22056343 [1,0,0,0,0,0|1,0,0]=2 656 B6R0.4 CCCCC([O-])=O Amb22729192 [1,0,0,0,0,0|1,0,0]=2 657 B6R0.4 CCCCC([O-])=O Amb22731639 [1,0,0,0,0,0|1,0,0]=2 658 B6R0.4 CCCCN(C)N Amb22730468 [1,0,0,0,0,0|2,0,0]=3 659 B6R0.4 CCCCP(Cl)Cl Amb25051489 [1,0,0,0,0,0|3,0,0]=4 660 B6R0.4 CCCCS(=O)Cl Amb24551332 [1,0,0,0,0,0|2,0,0]=3 661 B6R0.4 CCCCS([O-])=O Amb19889352 [1,0,0,0,0,0|2,0,0]=3 662 B6R0.4 CCCC[13C](O)=O Amb22367454 [1,0,0,0,0,0|1,0,0]=2 663 B6R0.4 CCCC[C@@H](C)Br Amb25146346 [1,0,0,0,0,0|1,0,1]=3 664 B6R0.4 CCCC[C@@H](C)I Amb25785621 [1,0,0,0,0,0|1,0,1]=3 665 B6R0.4 CCCC[C@@H](C)N Amb20242479 [1,0,0,0,0,0|1,0,1]=3 666 B6R0.4 CCCC[C@@H](C)O Amb19929139 [1,0,0,0,0,0|0,0,2]=3 667 B6R0.4 CCCC[C@H](C)Br Amb25374601 [1,0,0,0,0,0|1,0,1]=3 668 B6R0.4 CCCC[C@H](C)N Amb20242478 [1,0,0,0,0,0|1,0,1]=3 669 B6R0.4 CCCC[Sn](=O)S Amb22730994 [1,0,0,0,0,0|2,0,0]=3 670 B6R0.4 CCCC[Sn](O)=O Amb22336393 [1,0,0,0,0,0|2,0,0]=3 671 B6R0.4 CCCNC(=N)N Amb10844865 [1,0,0,0,0,0|3,0,0]=4 672 B6R0.4 CCCNC(=N)N Amb16206147 [1,0,0,0,0,0|3,0,0]=4 673 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,0,0,0,0,0|2,0,0]=3 674 B6R0.4 CCCNC(=O)N Amb1152241 [1,0,0,0,0,0|2,0,0]=3 675 B6R0.4 CCCNC(=S)N Amb1152085 [1,0,0,0,0,0|2,1,0]=4 676 B6R0.4 CCCNC(C)=S Amb25742111 [1,0,0,0,0,0|1,1,0]=3 677 B6R0.4 CCCNC(C)O Amb25821613 [1,0,0,0,0,0|1,0,2]=4 678 B6R0.4 CCCNC(N)=N Amb20667746 [1,0,0,0,0,0|3,0,0]=4 679 B6R0.4 CCCNC(O)=S Amb25302945 [1,0,0,0,0,0|2,0,1]=4 680 B6R0.4 CCCNN(C)C Amb25791383 [1,0,0,0,0,0|3,0,0]=4 681 B6R0.4 CCCNS(C)=O Amb25024775 [1,0,0,0,0,0|2,0,0]=3 682 B6R0.4 CCCN[N+]([O-])=O Amb21953652 [1,0,0,0,0,0|3,0,0]=4 683 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,0,0,0,0,0|2,0,0]=3 684 B6R0.4 CCCOC(N)=S Amb24382119 [1,0,0,0,0,0|2,1,0]=4 685 B6R0.4 CCCOC([S-])=S Amb22334111 [1,0,0,0,0,0|2,1,0]=4 686 B6R0.4 CCCOP(O)=O Amb25366595 [1,0,0,0,0,0|3,0,0]=4 687 B6R0.4 CCCO[N+]([O-])=O Amb22732564 [1,0,0,0,0,0|3,0,0]=4 688 B6R0.4 CCCSC(C)=O Amb22043301 [1,0,0,0,0,0|1,0,0]=2 689 B6R0.4 CCCSC(C)Cl Amb24478992 [1,0,0,0,0,0|2,0,1]=4 690 B6R0.4 CCCSC(N)=N Amb20676008 [1,0,0,0,0,0|3,0,0]=4 691 B6R0.4 CCCSC(N)=N Amb23482968 [1,0,0,0,0,0|3,0,0]=4 692 B6R0.4 CCCSC(N)=S Amb24349580 [1,0,0,0,0,0|2,1,0]=4 693 B6R0.4 CCNC=C(C)C Amb25224644 [1,0,0,0,0,0|2,0,1]=4 694 B6R0.4 CCNCC(=C)Br Amb18969562 [1,0,0,0,0,0|2,0,1]=4 695 B6R0.4 CCNCC(=C)Cl Amb18289297 [1,0,0,0,0,0|2,0,1]=4 696 B6R0.4 CCNCC(=O)N Amb1128676 [1,0,0,0,0,0|2,0,0]=3 697 B6R0.4 CCNCC(=O)O Amb10609667 [1,0,0,0,0,0|2,0,0]=3 698 B6R0.4 CCNCC(=S)N Amb17231834 [1,0,0,0,0,0|2,1,0]=4 699 B6R0.4 CCNCC(C)=O Amb24545893 [1,0,0,0,0,0|1,0,0]=2 700 B6R0.4 CCNCC(C)Cl Amb25759481 [1,0,0,0,0,0|2,0,1]=4 701 B6R0.4 CCNCC(C)F Amb24743616 [1,0,0,0,0,0|2,0,1]=4 702 B6R0.4 CCNCC(C)N Amb18299415 [1,0,0,0,0,0|2,0,1]=4 703 B6R0.4 CCNCC(C)S Amb18640729 [1,0,0,0,0,0|1,1,1]=4 704 B6R0.4 CCNC[C@H](C)N Amb24720969 [1,0,0,0,0,0|2,0,1]=4 705 B6R0.4 CCNC[C@H](C)O Amb25785620 [1,0,0,0,0,0|1,0,2]=4 706 B6R0.4 CCN\N=C(\C)/N Amb24479322 [1,0,0,0,0,0|3,0,0]=4 707 B6R0.4 CCOCC(=C)Br Amb24673237 [1,0,0,0,0,0|2,0,1]=4 708 B6R0.4 CCOCC(C)=C Amb25761593 [1,0,0,0,0,0|2,0,0]=3 709 B6R0.4 CCOCC(C)C Amb17673917 [1,0,0,0,0,0|2,0,1]=4 710 B6R0.4 CCOCC(C)Cl Amb24429086 [1,0,0,0,0,0|2,0,1]=4 711 B6R0.4 CCOCC(N)=N Amb19890012 [1,0,0,0,0,0|3,0,0]=4 712 B6R0.4 CCOCC(N)C Amb10610346 [1,0,0,0,0,0|2,0,1]=4 713 B6R0.4 CCOCC(N)C Amb1133021 [1,0,0,0,0,0|2,0,1]=4 714 B6R0.4 CCOC[C@@H](C)N Amb18016634 [1,0,0,0,0,0|2,0,1]=4 715 B6R0.4 CCOC[C@@H](N)C Amb17061642 [1,0,0,0,0,0|2,0,1]=4 716 B6R0.4 CCOC[C@H](C)O Amb25067464 [1,0,0,0,0,0|1,0,2]=4 717 B6R0.4 CCON=C(C)N Amb25046559 [1,0,0,0,0,0|3,0,0]=4 718 B6R0.4 CCONC(C)=O Amb22230675 [1,0,0,0,0,0|2,0,0]=3 719 B6R0.4 CCSCC(=O)O Amb1125185 [1,0,0,0,0,0|2,0,0]=3 720 B6R0.4 CCSCC(C)Br Amb25108973 [1,0,0,0,0,0|2,0,1]=4 721 B6R0.4 CCSCC(C)C Amb22230686 [1,0,0,0,0,0|2,0,1]=4 722 B6R0.4 CCSCC(C)N Amb19149261 [1,0,0,0,0,0|2,0,1]=4 723 B6R0.4 CCSCC(C)O Amb24458211 [1,0,0,0,0,0|1,0,2]=4 724 B6R0.4 CCSCC(N)=O Amb24420234 [1,0,0,0,0,0|2,0,0]=3 725 B6R0.4 CCSC[C@H](C)O Amb25220206 [1,0,0,0,0,0|1,0,2]=4 726 B6R0.4 CCSNC(N)=O Amb24479375 [1,0,0,0,0,0|3,0,0]=4 727 B6R0.4 CC\C=C/C(O)=O Amb22230421 [1,0,0,0,0,0|1,0,2]=4 728 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,0,0,0,0,0|1,0,2]=4 729 B6R0.4 CC\C=N\C(N)=O Amb24479183 [1,0,0,0,0,0|2,0,1]=4 730 B6R0.4 CN(C)CCCF Amb25719076 [1,0,0,0,0,0|3,0,0]=4 731 B6R0.4 CN(C)CCCS Amb24078629 [1,0,0,0,0,0|3,0,0]=4 732 B6R0.4 CN(N)CCCN Amb18640289 [1,0,0,0,0,0|3,0,0]=4 733 B6R0.4 CN(N)CCCO Amb25236057 [1,0,0,0,0,0|3,0,0]=4 734 B6R0.4 CN=C=CC(C)=O Amb25233778 [1,0,0,0,0,0|1,0,2]=4 735 B6R0.4 CN=CCC(C)=O Amb25261368 [1,0,0,0,0,0|1,0,1]=3 736 B6R0.4 CNCC=C(C)C Amb18121215 [1,0,0,0,0,0|2,0,1]=4 737 B6R0.4 CNCCC(=O)O Amb10609760 [1,0,0,0,0,0|2,0,0]=3 738 B6R0.4 CNCCC(=S)N Amb17231833 [1,0,0,0,0,0|2,1,0]=4 739 B6R0.4 CNCCC(C)=C Amb18993045 [1,0,0,0,0,0|2,0,0]=3 740 B6R0.4 CNCCC(C)=O Amb24560306 [1,0,0,0,0,0|1,0,0]=2 741 B6R0.4 CNCCC(C)Br Amb25718866 [1,0,0,0,0,0|2,0,1]=4 742 B6R0.4 CNCCC(C)C Amb10609494 [1,0,0,0,0,0|2,0,1]=4 743 B6R0.4 CNCCC(C)C Amb1114399 [1,0,0,0,0,0|2,0,1]=4 744 B6R0.4 CNCCC(C)Cl Amb24479264 [1,0,0,0,0,0|2,0,1]=4 745 B6R0.4 CNCCC(C)N Amb18288833 [1,0,0,0,0,0|2,0,1]=4 746 B6R0.4 CNCCC(N)=O Amb19959913 [1,0,0,0,0,0|2,0,0]=3 747 B6R0.4 CNCCC(O)C Amb17569889 [1,0,0,0,0,0|1,0,2]=4 748 B6R0.4 CNCCN(C)C Amb19958398 [1,0,0,0,0,0|3,0,0]=4 749 B6R0.4 CNCCN(C)C Amb20621873 [1,0,0,0,0,0|3,0,0]=4 750 B6R0.4 CNCCN(C)N Amb18122212 [1,0,0,0,0,0|3,0,0]=4 751 B6R0.4 CNCCS(C)=O Amb21984676 [1,0,0,0,0,0|2,0,0]=3 752 B6R0.4 CNCC[C@H](C)N Amb25825236 [1,0,0,0,0,0|2,0,1]=4 753 B6R0.4 CNC\C=C(\C)/Cl Amb25041057 [1,0,0,0,0,0|2,0,1]=4 754 B6R0.4 CNN=CC(C)=O Amb24481082 [1,0,0,0,0,0|2,0,1]=4 755 B6R0.4 CNNCC(N)=O Amb25773971 [1,0,0,0,0,0|3,0,0]=4 756 B6R0.4 CNNCC(O)=O Amb21929288 [1,0,0,0,0,0|3,0,0]=4 757 B6R0.4 CNOCC(C)=C Amb25235106 [1,0,0,0,0,0|3,0,0]=4 758 B6R0.4 CNOCC(O)=O Amb25104714 [1,0,0,0,0,0|3,0,0]=4 759 B6R0.4 CN\C=C/C(C)=O Amb24646447 [1,0,0,0,0,0|1,0,2]=4 760 B6R0.4 CN\C=C\C(=O)C Amb17593076 [1,0,0,0,0,0|1,0,2]=4 761 B6R0.4 COCCC(C)Br Amb18805533 [1,0,0,0,0,0|2,0,1]=4 762 B6R0.4 COCCC(C)O Amb20621489 [1,0,0,0,0,0|1,0,2]=4 763 B6R0.4 COCCN(=O)=O Amb24126452 [1,0,0,0,0,0|3,0,0]=4 764 B6R0.4 COCCN(C)C Amb16231530 [1,0,0,0,0,0|3,0,0]=4 765 B6R0.4 COCCN(C)N Amb25326276 [1,0,0,0,0,0|3,0,0]=4 766 B6R0.4 COCNC(C)=O Amb24659843 [1,0,0,0,0,0|2,0,0]=3 767 B6R0.4 COCNC(N)=O Amb25744350 [1,0,0,0,0,0|3,0,0]=4 768 B6R0.4 CON=CC(C)=O Amb25236948 [1,0,0,0,0,0|2,0,1]=4 769 B6R0.4 CONCC(C)=C Amb24479610 [1,0,0,0,0,0|3,0,0]=4 770 B6R0.4 CP(=O)OCCO Amb25221445 [1,0,0,0,0,0|3,0,0]=4 771 B6R0.4 CS(=O)CCC#N Amb18641926 [1,0,0,0,0,0|2,0,1]=4 772 B6R0.4 CS(=O)CCCBr Amb24365916 [1,0,0,0,0,0|2,0,0]=3 773 B6R0.4 CS(=O)CCCN Amb18974527 [1,0,0,0,0,0|2,0,0]=3 774 B6R0.4 CS(=O)CCNN Amb25810588 [1,0,0,0,0,0|3,0,0]=4 775 B6R0.4 CS(=O)CCON Amb25368924 [1,0,0,0,0,0|3,0,0]=4 776 B6R0.4 CS(=O)NCCI Amb24662928 [1,0,0,0,0,0|3,0,0]=4 777 B6R0.4 CSCCC(=S)N Amb17307559 [1,0,0,0,0,0|2,1,0]=4 778 B6R0.4 CSCCC(C)F Amb25853953 [1,0,0,0,0,0|2,0,1]=4 779 B6R0.4 CSCCC(C)N Amb19515505 [1,0,0,0,0,0|2,0,1]=4 780 B6R0.4 CSCCC(N)=N Amb19373501 [1,0,0,0,0,0|3,0,0]=4 781 B6R0.4 CSCCC(N)=N Amb19516878 [1,0,0,0,0,0|3,0,0]=4 782 B6R0.4 CSCCC(N)=O Amb24479809 [1,0,0,0,0,0|2,0,0]=3 783 B6R0.4 CSCCN(=O)=O Amb24179458 [1,0,0,0,0,0|3,0,0]=4 784 B6R0.4 CSCCN(C)C Amb24611721 [1,0,0,0,0,0|3,0,0]=4 785 B6R0.4 CSCNC(C)=O Amb24561383 [1,0,0,0,0,0|2,0,0]=3 786 B6R0.4 CSCNC(N)=O Amb24612362 [1,0,0,0,0,0|3,0,0]=4 787 B6R0.4 CSCOC(C)=O Amb19884027 [1,0,0,0,0,0|2,0,0]=3 788 B6R0.4 CSSCC(N)=O Amb24480454 [1,0,0,0,0,0|3,0,0]=4 789 B6R0.4 CSSCC(O)=O Amb25378801 [1,0,0,0,0,0|3,0,0]=4 790 B6R0.4 CS\C=C\C(C)=O Amb25768455 [1,0,0,0,0,0|1,0,2]=4 791 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [1,0,0,0,0,0|1,0,2]=4 792 B6R0.4 C[C@@H](O)CCCN Amb24479875 [1,0,0,0,0,0|1,0,2]=4 793 B6R0.4 C[C@@H](O)CCCS Amb25794939 [1,0,0,0,0,0|1,0,2]=4 794 B6R0.4 C[C@H](Cl)CCCO Amb24525158 [1,0,0,0,0,0|2,0,1]=4 795 B6R0.4 C[C@H](O)CCCCl Amb22348392 [1,0,0,0,0,0|1,0,2]=4 796 B6R0.4 C[Si](=O)CCCN Amb22351702 [1,0,0,0,0,0|1,1,0]=3 797 B6R0.4 C\C(\Br)=C\CCCl Amb25374563 [1,0,0,0,0,0|2,0,1]=4 798 B6R0.4 C\C=C/CC(C)=O Amb25723218 [1,0,0,0,0,0|0,0,2]=3 799 B6R0.4 C\C=C/CC(O)=O Amb25692581 [1,0,0,0,0,0|1,0,2]=4 800 B6R0.4 C\C=C\CC(C)=O Amb24359011 [1,0,0,0,0,0|0,0,2]=3 801 B6R0.4 C\C=N\CC(O)=O Amb24618330 [1,0,0,0,0,0|2,0,1]=4 802 B6R0.4 ClCCCC(=O)N Amb1138237 [1,0,0,0,0,0|2,0,0]=3 803 B6R0.4 FCCCC(=O)O Amb17593104 [1,0,0,0,0,0|2,0,0]=3 804 B6R0.4 N#CCCC(=O)C Amb17334046 [1,0,0,0,0,0|1,0,1]=3 805 B6R0.4 N#CCCC(=O)Cl Amb25106570 [1,0,0,0,0,0|2,0,1]=4 806 B6R0.4 NC(=O)CCCBr Amb25779163 [1,0,0,0,0,0|2,0,0]=3 807 B6R0.4 NC(=O)CCCO Amb20623438 [1,0,0,0,0,0|2,0,0]=3 808 B6R0.4 NC(=O)CSCCl Amb25135617 [1,0,0,0,0,0|3,0,0]=4 809 B6R0.4 NC(=O)NCCO Amb1146041 [1,0,0,0,0,0|3,0,0]=4 810 B6R0.4 NC(=O)OCCBr Amb25145573 [1,0,0,0,0,0|3,0,0]=4 811 B6R0.4 NC(=O)OCCO Amb20623788 [1,0,0,0,0,0|3,0,0]=4 812 B6R0.4 NC(=S)CCCF Amb24667655 [1,0,0,0,0,0|2,1,0]=4 813 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,0,0,0,0,0|2,0,0]=3 814 B6R0.4 NCCCC(=O)N Amb2099583 [1,0,0,0,0,0|2,0,0]=3 815 B6R0.4 NCCCC(=O)O Amb1935210 [1,0,0,0,0,0|2,0,0]=3 816 B6R0.4 NCCCC(C)C Amb1136518 [1,0,0,0,0,0|2,0,1]=4 817 B6R0.4 NCCCC(C)C Amb13952127 [1,0,0,0,0,0|2,0,1]=4 818 B6R0.4 NCCCC(Cl)=O Amb17801145 [1,0,0,0,0,0|2,0,0]=3 819 B6R0.4 NCCCC(N)=S Amb24479598 [1,0,0,0,0,0|2,1,0]=4 820 B6R0.4 NCCCP(O)=O Amb22370049 [1,0,0,0,0,0|3,0,0]=4 821 B6R0.4 NCCCS(=O)=O Amb24427014 [1,0,0,0,0,0|3,0,0]=4 822 B6R0.4 NCCCS(O)=O Amb25185942 [1,0,0,0,0,0|3,0,0]=4 823 B6R0.4 NCCC[N+]([O-])=O Amb18833132 [1,0,0,0,0,0|3,0,0]=4 824 B6R0.4 NCCNC(N)=O Amb19374121 [1,0,0,0,0,0|3,0,0]=4 825 B6R0.4 NCCOC(N)=O Amb22059480 [1,0,0,0,0,0|3,0,0]=4 826 B6R0.4 NCCOC(N)=O Amb24271076 [1,0,0,0,0,0|3,0,0]=4 827 B6R0.4 NNCCC(N)=O Amb24406769 [1,0,0,0,0,0|3,0,0]=4 828 B6R0.4 NOCCC(=O)O Amb17569891 [1,0,0,0,0,0|3,0,0]=4 829 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,0,0,0,0,0|2,0,0]=3 830 B6R0.4 O=C(Br)CCCCl Amb25146320 [1,0,0,0,0,0|2,0,0]=3 831 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,0,0,0,0,0|3,0,0]=4 832 B6R0.4 O=C(Cl)OCCF Amb21618836 [1,0,0,0,0,0|3,0,0]=4 833 B6R0.4 O=C(Cl)SCCCl Amb25272444 [1,0,0,0,0,0|3,0,0]=4 834 B6R0.4 O=C(S)CCCCl Amb24683280 [1,0,0,0,0,0|2,0,0]=3 835 B6R0.4 O=CCOC(=O)C Amb10070247 [1,0,0,0,0,0|2,0,1]=4 836 B6R0.4 O=S(Cl)CCCCl Amb25791632 [1,0,0,0,0,0|3,0,0]=4 837 B6R0.4 OC(=O)CCC=O Amb17673897 [1,0,0,0,0,0|2,0,1]=4 838 B6R0.4 OC(=O)CCCI Amb22295911 [1,0,0,0,0,0|2,0,0]=3 839 B6R0.4 OC(=O)CCCP Amb24717184 [1,0,0,0,0,0|2,0,0]=3 840 B6R0.4 OC(=O)CCNCl Amb24437846 [1,0,0,0,0,0|3,0,0]=4 841 B6R0.4 OCCCC(=O)O Amb17615189 [1,0,0,0,0,0|2,0,0]=3 842 B6R0.4 OCCCC(N)C Amb17569888 [1,0,0,0,0,0|2,0,1]=4 843 B6R0.4 OCCCC(O)=O Amb18640332 [1,0,0,0,0,0|2,0,0]=3 844 B6R0.4 OCCOC(=O)S Amb25106059 [1,0,0,0,0,0|3,0,0]=4 845 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [1,0,0,0,0,0|2,0,0]=3 846 B6R0.4 SCCCC(=O)O Amb16185429 [1,0,0,0,0,0|2,0,0]=3 847 B6R0.4 [C-]#[N+]CCC(N)=O Amb24411954 [1,0,0,0,0,0|2,0,1]=4 848 B6R0.4 [O-]C(=O)OCCBr Amb24394548 [1,0,0,0,0,0|3,0,0]=4 849 B6R0.4 [O-][N+](=O)CCCCl Amb25267487 [1,0,0,0,0,0|3,0,0]=4 850 B6R0.4 [O-][N+](=O)CCCF Amb25234942 [1,0,0,0,0,0|3,0,0]=4 851 B6R0.4 [O-][N+](=O)CCCO Amb20247690 [1,0,0,0,0,0|3,0,0]=4 852 B6R0.6 BrCCCCC#C Amb17673315 [1,0,0,0,0,0|1,0,2]=4 853 B6R0.6 C#CCCCCI Amb22752649 [1,0,0,0,0,0|1,0,2]=4 854 B6R0.6 C#CCCCCN Amb20668925 [1,0,0,0,0,0|1,0,2]=4 855 B6R0.6 C#CCCCCN Amb22059283 [1,0,0,0,0,0|1,0,2]=4 856 B6R0.6 C#CCCCCS Amb24120444 [1,0,0,0,0,0|1,0,2]=4 857 B6R0.6 C#CCOCC=O Amb25123719 [1,0,0,0,0,0|1,0,2]=4 858 B6R0.6 C=CCCCC#C Amb22227961 [1,0,0,0,0,0|0,0,3]=4 859 B6R0.6 C=CCCCC=C Amb22227760 [1,0,0,0,0,0|0,0,3]=4 860 B6R0.6 C=CCCCC=O Amb13883672 [1,0,0,0,0,0|0,0,2]=3 861 B6R0.6 C=CCCCCF Amb24409527 [1,0,0,0,0,0|1,0,1]=3 862 B6R0.6 C=CCCCCN Amb18639514 [1,0,0,0,0,0|1,0,1]=3 863 B6R0.6 C=CCCCCN Amb22899138 [1,0,0,0,0,0|1,0,1]=3 864 B6R0.6 C=CCCCON Amb25284631 [1,0,0,0,0,0|2,0,1]=4 865 B6R0.6 C=CCCC[Zn]Br Amb22000384 [1,0,0,0,0,0|2,0,1]=4 866 B6R0.6 C=CCCOCO Amb22338634 [1,0,0,0,0,0|2,0,1]=4 867 B6R0.6 C=CCNCCF Amb25062629 [1,0,0,0,0,0|2,0,1]=4 868 B6R0.6 C=CCNCCI Amb25026445 [1,0,0,0,0,0|2,0,1]=4 869 B6R0.6 C=CCNCCS Amb18641942 [1,0,0,0,0,0|2,0,1]=4 870 B6R0.6 C=CCOCCI Amb24739964 [1,0,0,0,0,0|2,0,1]=4 871 B6R0.6 C=CCOCCN Amb19033754 [1,0,0,0,0,0|2,0,1]=4 872 B6R0.6 C=CCOCCS Amb24333486 [1,0,0,0,0,0|2,0,1]=4 873 B6R0.6 C=CCSCC=O Amb18641509 [1,0,0,0,0,0|1,0,2]=4 874 B6R0.6 C=CCSCCBr Amb24390288 [1,0,0,0,0,0|2,0,1]=4 875 B6R0.6 C=CCSCCS Amb25284972 [1,0,0,0,0,0|2,0,1]=4 876 B6R0.6 C=COCCCBr Amb25811206 [1,0,0,0,0,0|2,0,1]=4 877 B6R0.6 C=COCCCF Amb22008255 [1,0,0,0,0,0|2,0,1]=4 878 B6R0.6 C=CSCCCO Amb25026486 [1,0,0,0,0,0|2,0,1]=4 879 B6R0.6 CC#CCCC=O Amb24600953 [1,0,0,0,0,0|0,0,2]=3 880 B6R0.6 CC#CCCCBr Amb18791571 [1,0,0,0,0,0|1,0,2]=4 881 B6R0.6 CC#CCCCI Amb24648366 [1,0,0,0,0,0|1,0,2]=4 882 B6R0.6 CC#CCCCN Amb18993494 [1,0,0,0,0,0|1,0,2]=4 883 B6R0.6 CC#CCCCO Amb20242139 [1,0,0,0,0,0|1,0,2]=4 884 B6R0.6 CC#CCCNC Amb18299523 [1,0,0,0,0,0|1,0,2]=4 885 B6R0.6 CC#CCCOC Amb25286924 [1,0,0,0,0,0|1,0,2]=4 886 B6R0.6 CC#CCNC=O Amb25146465 [1,0,0,0,0,0|1,0,2]=4 887 B6R0.6 CC#CCNCC Amb18296250 [1,0,0,0,0,0|1,0,2]=4 888 B6R0.6 CC#CCOCC Amb24332856 [1,0,0,0,0,0|1,0,2]=4 889 B6R0.6 CC#CCSCC Amb25343689 [1,0,0,0,0,0|1,0,2]=4 890 B6R0.6 CC=C=CCC=O Amb24579458 [1,0,0,0,0,0|0,0,3]=4 891 B6R0.6 CC=C=CCCBr Amb25147378 [1,0,0,0,0,0|1,0,2]=4 892 B6R0.6 CC=C=CCCCl Amb25728377 [1,0,0,0,0,0|1,0,2]=4 893 B6R0.6 CC=NNCCN Amb25083083 [1,0,0,0,0,0|3,0,0]=4 894 B6R0.6 CCC#CCC=C Amb22227956 [1,0,0,0,0,0|0,0,3]=4 895 B6R0.6 CCCC#CC=C Amb17673843 [1,0,0,0,0,0|0,0,3]=4 896 B6R0.6 CCCC/C=C/Br Amb17940862 [1,0,0,0,0,0|1,0,1]=3 897 B6R0.6 CCCC=NOC Amb24507605 [1,0,0,0,0,0|2,0,1]=4 898 B6R0.6 CCCCBOC Amb22728871 [1,0,0,0,0,0|2,0,0]=3 899 B6R0.6 CCCCC=C=C Amb17670592 [1,0,0,0,0,0|0,0,3]=4 900 B6R0.6 CCCCC=NN Amb25344632 [1,0,0,0,0,0|2,0,1]=4 901 B6R0.6 CCCCCC[13CH3] Amb22337896 [1,0,0,0,0,0|0,0,1]=2 902 B6R0.6 CCCCCC[15NH2] Amb22336214 [1,0,0,0,0,0|1,0,1]=3 903 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,0,0,0,0,0|0,1,1]=3 904 B6R0.6 CCCCCNN Amb22231340 [1,0,0,0,0,0|2,0,0]=3 905 B6R0.6 CCCCCNO Amb25067859 [1,0,0,0,0,0|1,0,1]=3 906 B6R0.6 CCCCCON Amb18122095 [1,0,0,0,0,0|2,0,0]=3 907 B6R0.6 CCCCCSC Amb21618865 [1,0,0,0,0,0|1,0,0]=2 908 B6R0.6 CCCCC[Mg]Br Amb17938645 [1,0,0,0,0,0|2,0,0]=3 909 B6R0.6 CCCCC[Mg]Cl Amb22369733 [1,0,0,0,0,0|2,0,0]=3 910 B6R0.6 CCCCN=[N+]=[N-] Amb17939434 [1,0,0,0,0,0|3,0,0]=4 911 B6R0.6 CCCCNC#N Amb24479826 [1,0,0,0,0,0|2,0,1]=4 912 B6R0.6 CCCCNC=C Amb25822786 [1,0,0,0,0,0|1,0,1]=3 913 B6R0.6 CCCCNOC Amb24479420 [1,0,0,0,0,0|2,0,0]=3 914 B6R0.6 CCCCOC#C Amb24453550 [1,0,0,0,0,0|1,0,2]=4 915 B6R0.6 CCCCOCCl Amb22168152 [1,0,0,0,0,0|2,0,1]=4 916 B6R0.6 CCCCOCO Amb24480826 [1,0,0,0,0,0|1,0,2]=4 917 B6R0.6 CCCCOP=O Amb24354901 [1,0,0,0,0,0|2,0,0]=3 918 B6R0.6 CCCCSCCl Amb25146885 [1,0,0,0,0,0|2,0,1]=4 919 B6R0.6 CCCC[SiH2]CBr Amb25101548 [1,0,0,0,0,0|1,1,1]=4 920 B6R0.6 CCCC\C=C\Cl Amb25306532 [1,0,0,0,0,0|1,0,1]=3 921 B6R0.6 CCCC\C=C\I Amb25173925 [1,0,0,0,0,0|1,0,1]=3 922 B6R0.6 CCCNCC#C Amb10610181 [1,0,0,0,0,0|1,0,2]=4 923 B6R0.6 CCCNCC=C Amb22587187 [1,0,0,0,0,0|1,0,1]=3 924 B6R0.6 CCCNCCBr Amb24360522 [1,0,0,0,0,0|2,0,1]=4 925 B6R0.6 CCCNCCC Amb22350702 [1,0,0,0,0,0|1,0,1]=3 926 B6R0.6 CCCNCCCl Amb17334074 [1,0,0,0,0,0|2,0,1]=4 927 B6R0.6 CCCNCCF Amb24567579 [1,0,0,0,0,0|2,0,1]=4 928 B6R0.6 CCCNCCI Amb25315312 [1,0,0,0,0,0|2,0,1]=4 929 B6R0.6 CCCNCCN Amb22353438 [1,0,0,0,0,0|2,0,1]=4 930 B6R0.6 CCCNCCS Amb18640722 [1,0,0,0,0,0|1,1,1]=4 931 B6R0.6 CCCNCSC Amb25305097 [1,0,0,0,0,0|2,0,0]=3 932 B6R0.6 CCCNNCC Amb24057118 [1,0,0,0,0,0|2,0,1]=4 933 B6R0.6 CCCOCC=O Amb24421025 [1,0,0,0,0,0|1,0,0]=2 934 B6R0.6 CCCOCNN Amb25856438 [1,0,0,0,0,0|3,0,0]=4 935 B6R0.6 CCCONC=O Amb24374223 [1,0,0,0,0,0|2,0,0]=3 936 B6R0.6 CCCSCC#C Amb25196546 [1,0,0,0,0,0|1,0,2]=4 937 B6R0.6 CCCSCC=O Amb24479810 [1,0,0,0,0,0|1,0,0]=2 938 B6R0.6 CCCSCCN Amb19888435 [1,0,0,0,0,0|2,0,1]=4 939 B6R0.6 CCCSSCC Amb24063527 [1,0,0,0,0,0|2,0,1]=4 940 B6R0.6 CCC[Hg]CCC Amb22732575 [1,0,0,0,0,0|1,0,1]=3 941 B6R0.6 CCC[Sn+2]CCC Amb22728829 [1,0,0,0,0,0|1,0,1]=3 942 B6R0.6 CCC\C=C/CC Amb22734071 [1,0,0,0,0,0|0,0,3]=4 943 B6R0.6 CCC\C=C\CC Amb19930065 [1,0,0,0,0,0|0,0,3]=4 944 B6R0.6 CCNCCC#C Amb18299437 [1,0,0,0,0,0|1,0,2]=4 945 B6R0.6 CCNCCC=C Amb19025187 [1,0,0,0,0,0|1,0,1]=3 946 B6R0.6 CCNCCC=O Amb25712349 [1,0,0,0,0,0|1,0,0]=2 947 B6R0.6 CCNCCCI Amb25342283 [1,0,0,0,0,0|2,0,1]=4 948 B6R0.6 CCNCCCS Amb18122695 [1,0,0,0,0,0|1,1,1]=4 949 B6R0.6 CCNCCNN Amb24479853 [1,0,0,0,0,0|3,0,0]=4 950 B6R0.6 CCNCCOC Amb22284536 [1,0,0,0,0,0|2,0,0]=3 951 B6R0.6 CCNCCSC Amb19024605 [1,0,0,0,0,0|2,0,0]=3 952 B6R0.6 CCNC\C=C/I Amb23539308 [1,0,0,0,0,0|2,0,1]=4 953 B6R0.6 CCNC\C=C\I Amb24518608 [1,0,0,0,0,0|2,0,1]=4 954 B6R0.6 CCNOCC=C Amb24543090 [1,0,0,0,0,0|2,0,1]=4 955 B6R0.6 CCNOCCC Amb24423538 [1,0,0,0,0,0|2,0,1]=4 956 B6R0.6 CCOCCC=C Amb25210333 [1,0,0,0,0,0|1,0,1]=3 957 B6R0.6 CCOCCC=O Amb25688261 [1,0,0,0,0,0|1,0,0]=2 958 B6R0.6 CCOCCCS Amb24479268 [1,0,0,0,0,0|1,1,1]=4 959 B6R0.6 CCOCCNC Amb19959934 [1,0,0,0,0,0|2,0,0]=3 960 B6R0.6 CCOCCNN Amb22587352 [1,0,0,0,0,0|3,0,0]=4 961 B6R0.6 CCOCCON Amb18061689 [1,0,0,0,0,0|3,0,0]=4 962 B6R0.6 CCOCCSC Amb24396764 [1,0,0,0,0,0|2,0,0]=3 963 B6R0.6 CCOCC[Hg]Cl Amb22359817 [1,0,0,0,0,0|3,0,0]=4 964 B6R0.6 CCOC\C=C\Cl Amb24676600 [1,0,0,0,0,0|2,0,1]=4 965 B6R0.6 CCONCCC Amb24416002 [1,0,0,0,0,0|2,0,1]=4 966 B6R0.6 CCO\C=C\C=O Amb18639560 [1,0,0,0,0,0|1,0,2]=4 967 B6R0.6 CCSCCC#C Amb24670860 [1,0,0,0,0,0|1,0,2]=4 968 B6R0.6 CCSCCCF Amb25846157 [1,0,0,0,0,0|2,0,1]=4 969 B6R0.6 CCSCCOC Amb24333360 [1,0,0,0,0,0|2,0,0]=3 970 B6R0.6 CCSCCON Amb24414250 [1,0,0,0,0,0|3,0,0]=4 971 B6R0.6 CCSCSCC Amb17609604 [1,0,0,0,0,0|2,0,1]=4 972 B6R0.6 CCSC\C=C\Cl Amb24415413 [1,0,0,0,0,0|2,0,1]=4 973 B6R0.6 CCSSCC=C Amb24063524 [1,0,0,0,0,0|2,0,1]=4 974 B6R0.6 CCS\C=C\C=O Amb18641909 [1,0,0,0,0,0|1,0,2]=4 975 B6R0.6 CC[SiH2]CCCCl Amb24620188 [1,0,0,0,0,0|1,1,1]=4 976 B6R0.6 CC\C=C/CC=O Amb18639157 [1,0,0,0,0,0|0,0,2]=3 977 B6R0.6 CC\C=C\CC=C Amb25275369 [1,0,0,0,0,0|0,0,3]=4 978 B6R0.6 CC\C=C\CC=O Amb25136370 [1,0,0,0,0,0|0,0,2]=3 979 B6R0.6 CNCCCC#C Amb18993049 [1,0,0,0,0,0|1,0,2]=4 980 B6R0.6 CNCCCC=C Amb18523846 [1,0,0,0,0,0|1,0,1]=3 981 B6R0.6 CNCCCC=O Amb25026193 [1,0,0,0,0,0|1,0,0]=2 982 B6R0.6 CNCCCCBr Amb22490953 [1,0,0,0,0,0|2,0,0]=3 983 B6R0.6 CNCCCCBr Amb22491228 [1,0,0,0,0,0|2,0,0]=3 984 B6R0.6 CNCCCCCl Amb25106571 [1,0,0,0,0,0|2,0,0]=3 985 B6R0.6 CNCCCCI Amb25275194 [1,0,0,0,0,0|2,0,0]=3 986 B6R0.6 CNCCCCN Amb17334048 [1,0,0,0,0,0|2,0,0]=3 987 B6R0.6 CNCCCCO Amb17334049 [1,0,0,0,0,0|2,0,0]=3 988 B6R0.6 CNCCCCS Amb24479785 [1,0,0,0,0,0|2,0,0]=3 989 B6R0.6 CNCCNNC Amb24386099 [1,0,0,0,0,0|3,0,0]=4 990 B6R0.6 CNCCOC=C Amb18639709 [1,0,0,0,0,0|2,0,1]=4 991 B6R0.6 CNCCONC Amb24744491 [1,0,0,0,0,0|3,0,0]=4 992 B6R0.6 CNCCSC=C Amb25743976 [1,0,0,0,0,0|2,0,1]=4 993 B6R0.6 CNCCSCC Amb16186669 [1,0,0,0,0,0|2,0,0]=3 994 B6R0.6 CNCCSCC Amb19889162 [1,0,0,0,0,0|2,0,0]=3 995 B6R0.6 COCC#CC=O Amb25054795 [1,0,0,0,0,0|1,0,2]=4 996 B6R0.6 COCCCC#C Amb25694831 [1,0,0,0,0,0|1,0,2]=4 997 B6R0.6 COCCCC=C Amb24432882 [1,0,0,0,0,0|1,0,1]=3 998 B6R0.6 COCCCCCl Amb17942999 [1,0,0,0,0,0|2,0,0]=3 999 B6R0.6 COCCCCN Amb10610278 [1,0,0,0,0,0|2,0,0]=3 1000 B6R0.6 COCCCCO Amb17666901 [1,0,0,0,0,0|2,0,0]=3 1001 B6R0.6 COCCCCS Amb24654696 [1,0,0,0,0,0|2,0,0]=3 1002 B6R0.6 COCCCOC Amb22168275 [1,0,0,0,0,0|2,0,0]=3 1003 B6R0.6 COCCCON Amb18559290 [1,0,0,0,0,0|3,0,0]=4 1004 B6R0.6 COCCC[Mg]Cl Amb22897395 [1,0,0,0,0,0|3,0,0]=4 1005 B6R0.6 COCCC[Zn]Cl Amb22897901 [1,0,0,0,0,0|3,0,0]=4 1006 B6R0.6 COCCNC=O Amb24334241 [1,0,0,0,0,0|2,0,0]=3 1007 B6R0.6 COCCOC=C Amb21520356 [1,0,0,0,0,0|2,0,1]=4 1008 B6R0.6 COCCOCBr Amb24414243 [1,0,0,0,0,0|3,0,0]=4 1009 B6R0.6 COCCOCC Amb22052684 [1,0,0,0,0,0|2,0,0]=3 1010 B6R0.6 COCCOCI Amb24480989 [1,0,0,0,0,0|3,0,0]=4 1011 B6R0.6 COCNCCO Amb18522071 [1,0,0,0,0,0|3,0,0]=4 1012 B6R0.6 COCOCC=C Amb24385255 [1,0,0,0,0,0|2,0,1]=4 1013 B6R0.6 COCOCCBr Amb22336766 [1,0,0,0,0,0|3,0,0]=4 1014 B6R0.6 COCOCCCl Amb22546806 [1,0,0,0,0,0|3,0,0]=4 1015 B6R0.6 COCOCCN Amb25314793 [1,0,0,0,0,0|3,0,0]=4 1016 B6R0.6 COCOCCO Amb23590973 [1,0,0,0,0,0|3,0,0]=4 1017 B6R0.6 COCOCOC Amb22728050 [1,0,0,0,0,0|3,0,0]=4 1018 B6R0.6 COCSCCN Amb24672416 [1,0,0,0,0,0|3,0,0]=4 1019 B6R0.6 COCSCCO Amb24701888 [1,0,0,0,0,0|3,0,0]=4 1020 B6R0.6 COC\C=C\C=O Amb18639577 [1,0,0,0,0,0|1,0,2]=4 1021 B6R0.6 CONCCC=C Amb22897002 [1,0,0,0,0,0|2,0,1]=4 1022 B6R0.6 CONCCCI Amb25846019 [1,0,0,0,0,0|3,0,0]=4 1023 B6R0.6 CONCCCO Amb24479622 [1,0,0,0,0,0|3,0,0]=4 1024 B6R0.6 CO\C=C/CC=O Amb24741941 [1,0,0,0,0,0|1,0,2]=4 1025 B6R0.6 CO\C=C\CC=O Amb24741886 [1,0,0,0,0,0|1,0,2]=4 1026 B6R0.6 CSCCCC#N Amb17504231 [1,0,0,0,0,0|2,0,1]=4 1027 B6R0.6 CSCCCCBr Amb19054837 [1,0,0,0,0,0|2,0,0]=3 1028 B6R0.6 CSCCCCCl Amb25240444 [1,0,0,0,0,0|2,0,0]=3 1029 B6R0.6 CSCCCCN Amb17500948 [1,0,0,0,0,0|2,0,0]=3 1030 B6R0.6 CSCCCNN Amb24093854 [1,0,0,0,0,0|3,0,0]=4 1031 B6R0.6 CSCCCSC Amb22043311 [1,0,0,0,0,0|2,0,0]=3 1032 B6R0.6 CSCCN=C=O Amb19889355 [1,0,0,0,0,0|2,0,1]=4 1033 B6R0.6 CSCCOC=C Amb25801320 [1,0,0,0,0,0|2,0,1]=4 1034 B6R0.6 CSCCOCCl Amb25132478 [1,0,0,0,0,0|3,0,0]=4 1035 B6R0.6 CSCCSCCl Amb24504428 [1,0,0,0,0,0|3,0,0]=4 1036 B6R0.6 CSCSCSC Amb25025600 [1,0,0,0,0,0|3,0,0]=4 1037 B6R0.6 C\C=C/CCCC Amb24467666 [1,0,0,0,0,0|0,0,1]=2 1038 B6R0.6 C\C=C/CCCCl Amb22732552 [1,0,0,0,0,0|1,0,1]=3 1039 B6R0.6 C\C=C/CCCO Amb17614951 [1,0,0,0,0,0|1,0,1]=3 1040 B6R0.6 C\C=C\C=C\CC Amb25145643 [1,0,0,0,0,0|0,0,3]=4 1041 B6R0.6 C\C=C\CCC#N Amb18638697 [1,0,0,0,0,0|1,0,2]=4 1042 B6R0.6 C\C=C\CCC=C Amb22734684 [1,0,0,0,0,0|0,0,3]=4 1043 B6R0.6 C\C=C\CCCBr Amb24525194 [1,0,0,0,0,0|1,0,1]=3 1044 B6R0.6 C\C=C\CCCI Amb25837122 [1,0,0,0,0,0|1,0,1]=3 1045 B6R0.6 C\C=C\CCCN Amb25288441 [1,0,0,0,0,0|1,0,1]=3 1046 B6R0.6 C\C=C\CCCO Amb22347882 [1,0,0,0,0,0|1,0,1]=3 1047 B6R0.6 C\C=C\CCNC Amb18993047 [1,0,0,0,0,0|1,0,1]=3 1048 B6R0.6 C\C=C\CCNO Amb25245372 [1,0,0,0,0,0|2,0,1]=4 1049 B6R0.6 C\C=C\CNCC Amb24370243 [1,0,0,0,0,0|1,0,1]=3 1050 B6R0.6 C\C=C\CNOC Amb24506606 [1,0,0,0,0,0|2,0,1]=4 1051 B6R0.6 C\C=C\COCCl Amb24353241 [1,0,0,0,0,0|2,0,1]=4 1052 B6R0.6 C\C=C\NCCC Amb25113340 [1,0,0,0,0,0|1,0,1]=3 1053 B6R0.6 C\C=C\OCCCl Amb25076175 [1,0,0,0,0,0|2,0,1]=4 1054 B6R0.6 C\C=C\SCCC Amb22168314 [1,0,0,0,0,0|1,0,1]=3 1055 B6R0.6 ClCCCCCI Amb10069913 [1,0,0,0,0,0|2,0,1]=4 1056 B6R0.6 ClCCC\C=C\Br Amb25146715 [1,0,0,0,0,0|2,0,1]=4 1057 B6R0.6 ClCCNCC=C Amb17334072 [1,0,0,0,0,0|2,0,1]=4 1058 B6R0.6 Cl\C=C\CCCCl Amb24379157 [1,0,0,0,0,0|2,0,1]=4 1059 B6R0.6 FCCCCCBr Amb15701635 [1,0,0,0,0,0|2,0,1]=4 1060 B6R0.6 FCCCCCCl Amb24479767 [1,0,0,0,0,0|2,0,1]=4 1061 B6R0.6 FCCCCCI Amb25690320 [1,0,0,0,0,0|2,0,1]=4 1062 B6R0.6 FCCCCCS Amb24409033 [1,0,0,0,0,0|1,1,1]=4 1063 B6R0.6 FCCCC[Mg]Br Amb22897418 [1,0,0,0,0,0|3,0,0]=4 1064 B6R0.6 FCCCC[Zn]Br Amb22897529 [1,0,0,0,0,0|3,0,0]=4 1065 B6R0.6 N#CCCCC=O Amb18120556 [1,0,0,0,0,0|1,0,1]=3 1066 B6R0.6 N#CCCNC=O Amb18639097 [1,0,0,0,0,0|2,0,1]=4 1067 B6R0.6 N#CSCCC=O Amb24666788 [1,0,0,0,0,0|2,0,1]=4 1068 B6R0.6 N=CCCCC=O Amb24690651 [1,0,0,0,0,0|1,0,1]=3 1069 B6R0.6 N=CCOCCO Amb24407453 [1,0,0,0,0,0|3,0,0]=4 1070 B6R0.6 NCCCCC#N Amb18301883 [1,0,0,0,0,0|2,0,1]=4 1071 B6R0.6 NCCCCCBr Amb17610058 [1,0,0,0,0,0|2,0,1]=4 1072 B6R0.6 NCCCCCCl Amb17593241 [1,0,0,0,0,0|2,0,1]=4 1073 B6R0.6 NCCCCCN Amb22002397 [1,0,0,0,0,0|2,0,1]=4 1074 B6R0.6 NCCCCCN Amb22337298 [1,0,0,0,0,0|2,0,1]=4 1075 B6R0.6 NCCCCNCl Amb25228620 [1,0,0,0,0,0|3,0,0]=4 1076 B6R0.6 NCCCCNO Amb24117989 [1,0,0,0,0,0|2,0,1]=4 1077 B6R0.6 NCCCNCC Amb17315269 [1,0,0,0,0,0|2,0,1]=4 1078 B6R0.6 NCCC\C=C\Cl Amb24479838 [1,0,0,0,0,0|2,0,1]=4 1079 B6R0.6 NCCNCC=C Amb17091015 [1,0,0,0,0,0|2,0,1]=4 1080 B6R0.6 NCCSCC=C Amb13951462 [1,0,0,0,0,0|2,0,1]=4 1081 B6R0.6 NNCCCCCl Amb24674957 [1,0,0,0,0,0|3,0,0]=4 1082 B6R0.6 NNCCCCO Amb24692523 [1,0,0,0,0,0|3,0,0]=4 1083 B6R0.6 NOCCCCF Amb22896553 [1,0,0,0,0,0|3,0,0]=4 1084 B6R0.6 NOCCCCO Amb25756966 [1,0,0,0,0,0|3,0,0]=4 1085 B6R0.6 N[14CH2]CCC[14CH2]N Amb22350129 [1,0,0,0,0,0|2,0,1]=4 1086 B6R0.6 O=C=CCCCCl Amb25084548 [1,0,0,0,0,0|1,0,2]=4 1087 B6R0.6 O=CCCCC#C Amb17593060 [1,0,0,0,0,0|0,0,2]=3 1088 B6R0.6 O=CCCCCBr Amb18126353 [1,0,0,0,0,0|1,0,0]=2 1089 B6R0.6 O=CCCCCCl Amb18123550 [1,0,0,0,0,0|1,0,0]=2 1090 B6R0.6 O=CCCCCF Amb25725976 [1,0,0,0,0,0|1,0,0]=2 1091 B6R0.6 O=CCCCCI Amb24707459 [1,0,0,0,0,0|1,0,0]=2 1092 B6R0.6 O=CCCN=C=S Amb25081456 [1,0,0,0,0,0|2,0,1]=4 1093 B6R0.6 O=CCCNC=O Amb25087053 [1,0,0,0,0,0|2,0,1]=4 1094 B6R0.6 O=CCC\C=C\Br Amb24479765 [1,0,0,0,0,0|1,0,2]=4 1095 B6R0.6 O=CCC\C=C\C Amb17593074 [1,0,0,0,0,0|0,0,2]=3 1096 B6R0.6 O=CCNCC=O Amb24384445 [1,0,0,0,0,0|2,0,1]=4 1097 B6R0.6 O=CCOCC=O Amb18121758 [1,0,0,0,0,0|2,0,1]=4 1098 B6R0.6 O=CCOCCCl Amb24665263 [1,0,0,0,0,0|2,0,0]=3 1099 B6R0.6 O=CCSCC=O Amb18641963 [1,0,0,0,0,0|2,0,1]=4 1100 B6R0.6 O=CNCCCBr Amb25745639 [1,0,0,0,0,0|2,0,0]=3 1101 B6R0.6 O=CNCCCF Amb25092168 [1,0,0,0,0,0|2,0,0]=3 1102 B6R0.6 O=CNCCCS Amb24659838 [1,0,0,0,0,0|2,0,0]=3 1103 B6R0.6 O=COCCCBr Amb25725047 [1,0,0,0,0,0|2,0,0]=3 1104 B6R0.6 O=COCCCCl Amb24427057 [1,0,0,0,0,0|2,0,0]=3 1105 B6R0.6 O=COCCCF Amb22008204 [1,0,0,0,0,0|2,0,0]=3 1106 B6R0.6 O=COCCCI Amb25839622 [1,0,0,0,0,0|2,0,0]=3 1107 B6R0.6 O=C\C=C\CCF Amb25723268 [1,0,0,0,0,0|1,0,2]=4 1108 B6R0.6 O=S=NCCCCl Amb24523810 [1,0,0,0,0,0|3,0,0]=4 1109 B6R0.6 OCCCCC=O Amb10603837 [1,0,0,0,0,0|1,0,0]=2 1110 B6R0.6 OCCCCCBr Amb10603824 [1,0,0,0,0,0|1,0,2]=4 1111 B6R0.6 OCCCCCF Amb24479828 [1,0,0,0,0,0|1,0,2]=4 1112 B6R0.6 OCCCCCI Amb25025520 [1,0,0,0,0,0|1,0,2]=4 1113 B6R0.6 OCCCCSCl Amb24619715 [1,0,0,0,0,0|3,0,0]=4 1114 B6R0.6 OCCCOC=O Amb24733886 [1,0,0,0,0,0|2,0,0]=3 1115 B6R0.6 OCCOCC=O Amb24060822 [1,0,0,0,0,0|2,0,0]=3 1116 B6R0.6 OCCSCC=O Amb24525990 [1,0,0,0,0,0|2,0,0]=3 1117 B6R0.6 OCC\C=C\C=O Amb18119862 [1,0,0,0,0,0|1,0,2]=4 1118 B6R0.6 O\C=C\CCCO Amb24480597 [1,0,0,0,0,0|1,0,2]=4 1119 B6R0.6 SCCCCCBr Amb25775029 [1,0,0,0,0,0|1,1,1]=4 1120 B6R0.6 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2]Br Amb22367407 [1,0,0,0,0,0|1,0,1]=3 1121 B6R0.6 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2]O Amb22367427 [1,0,0,0,0,0|0,0,2]=3 1122 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [1,0,0,0,0,0|2,0,1]=4 1123 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [1,0,0,0,0,0|2,0,1]=4 1124 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb22746284 [0,1,0,0,0,0|1,0,2]=4 1125 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb24539924 [0,1,0,0,0,0|1,0,2]=4 1126 B8R0.5 C#CC[C@H](N)CC(O)=O Amb22226648 [0,1,0,0,0,0|1,0,2]=4 1127 B8R0.5 C#CC[C@H](N)CC(O)=O Amb24642007 [0,1,0,0,0,0|1,0,2]=4 1128 B8R0.5 C/C=C/C(Cl)OC(C)=O Amb17673772 [0,1,0,0,0,0|1,0,2]=4 1129 B8R0.5 C=C(Br)CC(O)CCO Amb25343863 [0,1,0,0,0,0|2,0,1]=4 1130 B8R0.5 C=CCC(CC(=O)C)C Amb17593320 [0,1,0,0,0,0|0,0,2]=3 1131 B8R0.5 C=CCC(N)CC(O)=O Amb22641964 [0,1,0,0,0,0|1,0,2]=4 1132 B8R0.5 C=CCC(O)CC(O)=O Amb18642785 [0,1,0,0,0,0|1,0,2]=4 1133 B8R0.5 C=CC[C@@H](CC(=O)O)C Amb10844371 [0,1,0,0,0,0|1,0,2]=4 1134 B8R0.5 C=CC[C@@H](N)CC(O)=O Amb22746166 [0,1,0,0,0,0|1,0,2]=4 1135 B8R0.5 C=CC[C@@H](O)CC(N)=O Amb24680790 [0,1,0,0,0,0|1,0,2]=4 1136 B8R0.5 C=CC[C@H](CC(=O)O)C Amb10844336 [0,1,0,0,0,0|1,0,2]=4 1137 B8R0.5 CC#CC(O)CC(C)=C Amb24475103 [0,1,0,0,0,0|1,0,2]=4 1138 B8R0.5 CC#CC(O)CC(C)=O Amb24736733 [0,1,0,0,0,0|0,0,2]=3 1139 B8R0.5 CC(=C)CC(=O)CCC Amb24377405 [0,1,0,0,0,0|1,0,1]=3 1140 B8R0.5 CC(=C)CC(=O)CCN Amb24496397 [0,1,0,0,0,0|2,0,1]=4 1141 B8R0.5 CC(=C)CC(=O)COC Amb25142356 [0,1,0,0,0,0|2,0,1]=4 1142 B8R0.5 CC(=C)CC(N)CC=C Amb25843456 [0,1,0,0,0,0|1,0,2]=4 1143 B8R0.5 CC(=C)CC(O)CC#C Amb25215858 [0,1,0,0,0,0|1,0,2]=4 1144 B8R0.5 CC(=C)CN(C)CCI Amb25740918 [0,1,0,0,0,0|3,0,0]=4 1145 B8R0.5 CC(=C)CN(C)CCN Amb19028420 [0,1,0,0,0,0|3,0,0]=4 1146 B8R0.5 CC(=C)C[C@@H](O)CCO Amb24412924 [0,1,0,0,0,0|2,0,0]=3 1147 B8R0.5 CC(=C)C[C@H](O)CCO Amb24414030 [0,1,0,0,0,0|2,0,0]=3 1148 B8R0.5 CC(=O)C=C(N)CCC Amb25145980 [0,1,0,0,0,0|0,0,2]=3 1149 B8R0.5 CC(=O)C=C(N)COC Amb24540259 [0,1,0,0,0,0|1,0,2]=4 1150 B8R0.5 CC(=O)C=C(N)OCC Amb24561013 [0,1,0,0,0,0|1,0,2]=4 1151 B8R0.5 CC(=O)CC(=N)OCC Amb24103656 [0,1,0,0,0,0|1,0,1]=3 1152 B8R0.5 CC(=O)CC(=O)CC#N Amb24456593 [0,1,0,0,0,0|1,0,2]=4 1153 B8R0.5 CC(=O)CC(=O)CCC Amb22347230 [0,1,0,0,0,0|0,0,1]=2 1154 B8R0.5 CC(=O)CC(=O)CCO Amb25685471 [0,1,0,0,0,0|1,0,1]=3 1155 B8R0.5 CC(=O)CC(=O)NOC Amb24096697 [0,1,0,0,0,0|2,0,1]=4 1156 B8R0.5 CC(=O)CC(=O)OCC Amb22360190 [0,1,0,0,0,0|1,0,1]=3 1157 B8R0.5 CC(=O)CC(=O)OOC Amb24096083 [0,1,0,0,0,0|2,0,1]=4 1158 B8R0.5 CC(=O)CC(=O)\C=C\C Amb25807638 [0,1,0,0,0,0|0,0,3]=4 1159 B8R0.5 CC(=O)CC(=S)OCC Amb25282821 [0,1,0,0,0,0|1,0,1]=3 1160 B8R0.5 CC(=O)CC(Cl)=CCCl Amb25056100 [0,1,0,0,0,0|1,0,2]=4 1161 B8R0.5 CC(=O)CN(C)CC=C Amb24752867 [0,1,0,0,0,0|1,0,2]=4 1162 B8R0.5 CC(=O)C[C@H](O)CCBr Amb24634001 [0,1,0,0,0,0|1,0,0]=2 1163 B8R0.5 CC(=O)C[C@H](O)CCO Amb24551545 [0,1,0,0,0,0|1,0,0]=2 1164 B8R0.5 CC(=O)C\C(\Br)=C\CCl Amb24370172 [0,1,0,0,0,0|1,0,2]=4 1165 B8R0.5 CC(=O)C\C(\Cl)=C/CC Amb24334261 [0,1,0,0,0,0|0,0,2]=3 1166 B8R0.5 CC(=O)C\C(\Cl)=C\CC Amb25370634 [0,1,0,0,0,0|0,0,2]=3 1167 B8R0.5 CC(=O)N=C(N)NCC Amb25093054 [0,1,0,0,0,0|2,0,1]=4 1168 B8R0.5 CC(=O)NC(=O)CCBr Amb25188997 [0,1,0,0,0,0|2,0,1]=4 1169 B8R0.5 CC(=O)NC(=O)CCC Amb25324995 [0,1,0,0,0,0|1,0,1]=3 1170 B8R0.5 CC(=O)NC(=O)CNC Amb24593410 [0,1,0,0,0,0|2,0,1]=4 1171 B8R0.5 CC(=O)NC(=S)NCC Amb24477714 [0,1,0,0,0,0|2,0,1]=4 1172 B8R0.5 CC(=O)NC(=S)OCC Amb24356625 [0,1,0,0,0,0|2,0,1]=4 1173 B8R0.5 CC(=O)OC(Br)CCCl Amb25771672 [0,1,0,0,0,0|2,0,0]=3 1174 B8R0.5 CC(=O)OC(Cl)CCCl Amb25109244 [0,1,0,0,0,0|2,0,0]=3 1175 B8R0.5 CC(=O)S\C(\N)=C/CC Amb25341526 [0,1,0,0,0,0|1,0,2]=4 1176 B8R0.5 CC(=O)\C=C(/N)\COC Amb24340140 [0,1,0,0,0,0|1,0,2]=4 1177 B8R0.5 CC(=O)\C=C(/N)\OCC Amb24451604 [0,1,0,0,0,0|1,0,2]=4 1178 B8R0.5 CC(=O)\C=C(/N)\SCC Amb25113924 [0,1,0,0,0,0|1,0,2]=4 1179 B8R0.5 CC(=O)\C=C(\C)/CCN Amb20621191 [0,1,0,0,0,0|1,0,2]=4 1180 B8R0.5 CC(=O)\C=C(\Cl)/CCC Amb24339441 [0,1,0,0,0,0|0,0,2]=3 1181 B8R0.5 CC(=S)NC(=O)CCC Amb25783781 [0,1,0,0,0,0|1,1,1]=4 1182 B8R0.5 CC(C)=CC(F)CCN Amb25718229 [0,1,0,0,0,0|2,0,1]=4 1183 B8R0.5 CC(C)=CC(O)CCO Amb24734335 [0,1,0,0,0,0|2,0,1]=4 1184 B8R0.5 CC(C)CC(Br)CCBr Amb23456162 [0,1,0,0,0,0|2,0,1]=4 1185 B8R0.5 CC(C)CC(C)CCC Amb22228271 [0,1,0,0,0,0|1,0,1]=3 1186 B8R0.5 CC(C)CC(C)CCN Amb25848784 [0,1,0,0,0,0|2,0,1]=4 1187 B8R0.5 CC(C)CC(C)CNC Amb19023731 [0,1,0,0,0,0|2,0,1]=4 1188 B8R0.5 CC(C)CC(Cl)CCC Amb24480096 [0,1,0,0,0,0|1,0,1]=3 1189 B8R0.5 CC(C)CC(Cl)CCCl Amb24606456 [0,1,0,0,0,0|2,0,1]=4 1190 B8R0.5 CC(C)CC(Cl)CNC Amb25200031 [0,1,0,0,0,0|2,0,1]=4 1191 B8R0.5 CC(C)CC(Cl)COC Amb25085213 [0,1,0,0,0,0|2,0,1]=4 1192 B8R0.5 CC(C)CC(F)CCN Amb24690000 [0,1,0,0,0,0|2,0,1]=4 1193 B8R0.5 CC(C)CC(N)CCC Amb18307059 [0,1,0,0,0,0|1,0,1]=3 1194 B8R0.5 CC(C)CC(N)CCO Amb18203172 [0,1,0,0,0,0|2,0,1]=4 1195 B8R0.5 CC(C)CC(N)CNC Amb19009731 [0,1,0,0,0,0|2,0,1]=4 1196 B8R0.5 CC(C)CC(N)CSC Amb18314440 [0,1,0,0,0,0|2,0,1]=4 1197 B8R0.5 CC(C)CC(O)CCC Amb22730597 [0,1,0,0,0,0|1,0,1]=3 1198 B8R0.5 CC(C)CC(O)CCCl Amb25188911 [0,1,0,0,0,0|2,0,1]=4 1199 B8R0.5 CC(C)CC(O)CCO Amb23512717 [0,1,0,0,0,0|2,0,1]=4 1200 B8R0.5 CC(C)CC(O)CNC Amb19031253 [0,1,0,0,0,0|2,0,1]=4 1201 B8R0.5 CC(C)CC(O)COC Amb19301971 [0,1,0,0,0,0|2,0,1]=4 1202 B8R0.5 CC(C)C[C@@H](N)COC Amb18016632 [0,1,0,0,0,0|2,0,1]=4 1203 B8R0.5 CC(C)C[C@@H](O)CCO Amb25343763 [0,1,0,0,0,0|2,0,1]=4 1204 B8R0.5 CC(C)C[C@H](C)CCBr Amb24479945 [0,1,0,0,0,0|2,0,1]=4 1205 B8R0.5 CC(C)C[C@H](C)CCO Amb24456802 [0,1,0,0,0,0|2,0,1]=4 1206 B8R0.5 CC(C)C[C@H](N)CCO Amb24446600 [0,1,0,0,0,0|2,0,1]=4 1207 B8R0.5 CC(C)C[C@H](N)CNC Amb25319273 [0,1,0,0,0,0|2,0,1]=4 1208 B8R0.5 CC(C)C[C@H](O)CCO Amb25129820 [0,1,0,0,0,0|2,0,1]=4 1209 B8R0.5 CC(C)SC(C)CCC Amb24376116 [0,1,0,0,0,0|2,0,1]=4 1210 B8R0.5 CC(CC#C)CC(C)=O Amb24707587 [0,1,0,0,0,0|0,0,2]=3 1211 B8R0.5 CC(CC#C)NC(C)=O Amb24373503 [0,1,0,0,0,0|1,0,2]=4 1212 B8R0.5 CC(CC#C)OC(C)=O Amb25091916 [0,1,0,0,0,0|1,0,2]=4 1213 B8R0.5 CC(CC#N)CC(C)=O Amb24339577 [0,1,0,0,0,0|1,0,1]=3 1214 B8R0.5 CC(CC#N)CC(O)=O Amb18642506 [0,1,0,0,0,0|2,0,1]=4 1215 B8R0.5 CC(CC#N)NC(C)=O Amb25061726 [0,1,0,0,0,0|2,0,1]=4 1216 B8R0.5 CC(CC(C)=O)=CCCl Amb24581453 [0,1,0,0,0,0|1,0,2]=4 1217 B8R0.5 CC(CC(C)=O)=NOC Amb25179533 [0,1,0,0,0,0|2,0,1]=4 1218 B8R0.5 CC(CC(C)=O)N=[N+]=[N-] Amb24447192 [0,1,0,0,0,0|3,0,0]=4 1219 B8R0.5 CC(CC(C)=O)NC=O Amb24477804 [0,1,0,0,0,0|2,0,1]=4 1220 B8R0.5 CC(CC=C)CC(O)=O Amb18642628 [0,1,0,0,0,0|1,0,2]=4 1221 B8R0.5 CC(CC=O)CC(C)=C Amb18642471 [0,1,0,0,0,0|2,0,1]=4 1222 B8R0.5 CC(CC=O)NC(C)=O Amb25705280 [0,1,0,0,0,0|2,0,1]=4 1223 B8R0.5 CC(CC=O)OC(C)=O Amb18642743 [0,1,0,0,0,0|2,0,1]=4 1224 B8R0.5 CC(CCBr)CC(C)=O Amb24740003 [0,1,0,0,0,0|1,0,0]=2 1225 B8R0.5 CC(CCBr)NC(C)=O Amb25213338 [0,1,0,0,0,0|2,0,0]=3 1226 B8R0.5 CC(CCBr)OC(C)=O Amb25111237 [0,1,0,0,0,0|2,0,0]=3 1227 B8R0.5 CC(CCCl)CC(C)=O Amb25231057 [0,1,0,0,0,0|1,0,0]=2 1228 B8R0.5 CC(CCF)CC(O)=O Amb24477914 [0,1,0,0,0,0|2,0,0]=3 1229 B8R0.5 CC(CCN)CC(C)O Amb25064091 [0,1,0,0,0,0|1,0,2]=4 1230 B8R0.5 CC(CCN)CC(O)=O Amb20667689 [0,1,0,0,0,0|2,0,0]=3 1231 B8R0.5 CC(CCN)CC(O)=O Amb24376646 [0,1,0,0,0,0|2,0,0]=3 1232 B8R0.5 CC(CCN)NC(C)=O Amb18986174 [0,1,0,0,0,0|2,0,0]=3 1233 B8R0.5 CC(CCN)NC(N)=O Amb18985721 [0,1,0,0,0,0|3,0,0]=4 1234 B8R0.5 CC(CCO)C=C(C)C Amb24581739 [0,1,0,0,0,0|2,0,1]=4 1235 B8R0.5 CC(CCO)CC(C)=C Amb24525539 [0,1,0,0,0,0|2,0,0]=3 1236 B8R0.5 CC(CCO)CC(C)=O Amb24563263 [0,1,0,0,0,0|1,0,0]=2 1237 B8R0.5 CC(CCO)CC(O)=O Amb18642882 [0,1,0,0,0,0|2,0,0]=3 1238 B8R0.5 CC(CCO)NC(N)=O Amb25043087 [0,1,0,0,0,0|3,0,0]=4 1239 B8R0.5 CC(CCO)NS(C)=O Amb24736064 [0,1,0,0,0,0|3,0,0]=4 1240 B8R0.5 CC(CCO)OC(N)=O Amb25090414 [0,1,0,0,0,0|3,0,0]=4 1241 B8R0.5 CC(Cl)CC(C)CCCl Amb25790039 [0,1,0,0,0,0|2,0,1]=4 1242 B8R0.5 CC(N)CC(Br)CCN Amb25069225 [0,1,0,0,0,0|2,0,1]=4 1243 B8R0.5 CC(N)CC(Cl)CCN Amb24605143 [0,1,0,0,0,0|2,0,1]=4 1244 B8R0.5 CC(NC(=O)C)CON Amb17138376 [0,1,0,0,0,0|3,0,0]=4 1245 B8R0.5 CC(NCC)CC(=O)N Amb17231866 [0,1,0,0,0,0|2,0,0]=3 1246 B8R0.5 CC(NCC)CC(=O)O Amb13952759 [0,1,0,0,0,0|2,0,0]=3 1247 B8R0.5 CC(O)CC(N)CCC Amb24477692 [0,1,0,0,0,0|0,0,2]=3 1248 B8R0.5 CC(O)CC(O)CCO Amb24733599 [0,1,0,0,0,0|1,0,2]=4 1249 B8R0.5 CC(O)CC(O)COC Amb24543387 [0,1,0,0,0,0|1,0,2]=4 1250 B8R0.5 CC(O)CC(O)OCC Amb25734373 [0,1,0,0,0,0|1,0,2]=4 1251 B8R0.5 CC(O)CC(S)CCC Amb24379900 [0,1,0,0,0,0|0,0,2]=3 1252 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [0,1,0,0,0,0|1,0,1]=3 1253 B8R0.5 CCCC(=O)CC(C)Br Amb25232584 [0,1,0,0,0,0|1,0,2]=4 1254 B8R0.5 CCCC(=O)CC(C)O Amb24676902 [0,1,0,0,0,0|0,0,3]=4 1255 B8R0.5 CCCC(=O)C[C@@H](C)O Amb24645371 [0,1,0,0,0,0|0,0,3]=4 1256 B8R0.5 CCCC(=O)C[C@H](C)O Amb25767694 [0,1,0,0,0,0|0,0,3]=4 1257 B8R0.5 CCCC(Br)CC(O)=O Amb18127175 [0,1,0,0,0,0|1,0,0]=2 1258 B8R0.5 CCCC(C)CC(C)=C Amb22730409 [0,1,0,0,0,0|1,0,0]=2 1259 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [0,1,0,0,0,0|0,0,0]=1 1260 B8R0.5 CCCC(C)CC(C)Cl Amb25823700 [0,1,0,0,0,0|1,0,1]=3 1261 B8R0.5 CCCC(C)CC(C)N Amb19026129 [0,1,0,0,0,0|1,0,1]=3 1262 B8R0.5 CCCC(C)CC(C)O Amb22229840 [0,1,0,0,0,0|0,0,2]=3 1263 B8R0.5 CCCC(C)CC(N)=N Amb25771598 [0,1,0,0,0,0|2,0,0]=3 1264 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [0,1,0,0,0,0|1,0,0]=2 1265 B8R0.5 CCCC(C)NC(C)=N Amb25289823 [0,1,0,0,0,0|2,0,0]=3 1266 B8R0.5 CCCC(C)NC(N)=N Amb25189065 [0,1,0,0,0,0|3,0,0]=4 1267 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,1,0,0,0,0|1,0,0]=2 1268 B8R0.5 CCCC(C)SC(N)=N Amb25750723 [0,1,0,0,0,0|3,0,0]=4 1269 B8R0.5 CCCC(CC(=O)C)O Amb17593376 [0,1,0,0,0,0|0,0,0]=1 1270 B8R0.5 CCCC(CC(=O)O)N Amb1993864 [0,1,0,0,0,0|1,0,0]=2 1271 B8R0.5 CCCC(CN(C)C)C Amb10560435 [0,1,0,0,0,0|2,0,0]=3 1272 B8R0.5 CCCC(Cl)CN(Cl)Cl Amb25724405 [0,1,0,0,0,0|3,0,0]=4 1273 B8R0.5 CCCC(Cl)CP(Cl)Cl Amb25277199 [0,1,0,0,0,0|3,0,0]=4 1274 B8R0.5 CCCC(Cl)OC(=O)Cl Amb24480168 [0,1,0,0,0,0|2,0,0]=3 1275 B8R0.5 CCCC(N)CC(C)=C Amb25145992 [0,1,0,0,0,0|1,0,0]=2 1276 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,1,0,0,0,0|1,0,0]=2 1277 B8R0.5 CCCC(N)CC(O)=O Amb21961469 [0,1,0,0,0,0|1,0,0]=2 1278 B8R0.5 CCCC(N)NC(C)=O Amb24670118 [0,1,0,0,0,0|1,0,0]=2 1279 B8R0.5 CCCC(O)C=C(F)F Amb24414043 [0,1,0,0,0,0|2,0,1]=4 1280 B8R0.5 CCCC(O)CC(N)=O Amb25072270 [0,1,0,0,0,0|1,0,0]=2 1281 B8R0.5 CCCC(O)C[N+]([O-])=O Amb25265997 [0,1,0,0,0,0|2,0,0]=3 1282 B8R0.5 CCCC(O)OC(C)=O Amb25245948 [0,1,0,0,0,0|1,0,0]=2 1283 B8R0.5 CCCC(O)OC(N)=O Amb24476660 [0,1,0,0,0,0|2,0,0]=3 1284 B8R0.5 CCCC(O)OS(=O)=O Amb25098605 [0,1,0,0,0,0|3,0,0]=4 1285 B8R0.5 CCCN(C)CC(=C)Cl Amb24763817 [0,1,0,0,0,0|2,0,1]=4 1286 B8R0.5 CCCN(C)CC(N)=O Amb24700757 [0,1,0,0,0,0|2,0,0]=3 1287 B8R0.5 CCCN(C)CC(O)=O Amb19373314 [0,1,0,0,0,0|2,0,0]=3 1288 B8R0.5 CCCN(C)C[C@@H](C)N Amb24502335 [0,1,0,0,0,0|2,0,1]=4 1289 B8R0.5 CCCN(C)C[C@@H](C)O Amb24394137 [0,1,0,0,0,0|1,0,2]=4 1290 B8R0.5 CCCN(C)C[C@H](C)O Amb24502341 [0,1,0,0,0,0|1,0,2]=4 1291 B8R0.5 CCCN(CC(O)C)C Amb17334132 [0,1,0,0,0,0|1,0,2]=4 1292 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,1,0,0,0,0|2,0,0]=3 1293 B8R0.5 CCC[C@@H](C)CC(N)=O Amb24761385 [0,1,0,0,0,0|1,0,0]=2 1294 B8R0.5 CCC[C@@H](C)CC(O)=O Amb24622486 [0,1,0,0,0,0|1,0,0]=2 1295 B8R0.5 CCC[C@@H](C)NC(C)=O Amb25844046 [0,1,0,0,0,0|1,0,0]=2 1296 B8R0.5 CCC[C@@H](CC(=O)O)C Amb10844381 [0,1,0,0,0,0|1,0,0]=2 1297 B8R0.5 CCC[C@@H](N)CC(O)=O Amb22225223 [0,1,0,0,0,0|1,0,0]=2 1298 B8R0.5 CCC[C@@H](N)CC(O)=O Amb24739278 [0,1,0,0,0,0|1,0,0]=2 1299 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,1,0,0,0,0|0,0,0]=1 1300 B8R0.5 CCC[C@@H](O)CC(O)=O Amb25188904 [0,1,0,0,0,0|1,0,0]=2 1301 B8R0.5 CCC[C@H](C)CC(N)=O Amb25340178 [0,1,0,0,0,0|1,0,0]=2 1302 B8R0.5 CCC[C@H](N)CC(O)=O Amb22226359 [0,1,0,0,0,0|1,0,0]=2 1303 B8R0.5 CCC[C@H](O)CC(O)=O Amb25367955 [0,1,0,0,0,0|1,0,0]=2 1304 B8R0.5 CCC\C(\C)=C/C(C)=O Amb24676836 [0,1,0,0,0,0|0,0,2]=3 1305 B8R0.5 CCC\C(\C)=C\C(C)=O Amb25735089 [0,1,0,0,0,0|0,0,2]=3 1306 B8R0.5 CCC\C(\F)=C/C(O)=O Amb25359319 [0,1,0,0,0,0|1,0,2]=4 1307 B8R0.5 CCC\C(\N)=C\C(N)=O Amb24411410 [0,1,0,0,0,0|1,0,2]=4 1308 B8R0.5 CCNC(=N)CC(N)=O Amb25769007 [0,1,0,0,0,0|2,0,1]=4 1309 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,1,0,0,0,0|2,0,1]=4 1310 B8R0.5 CCNC(=S)CC([O-])=O Amb25771930 [0,1,0,0,0,0|2,0,1]=4 1311 B8R0.5 CCNC(C)CC(C)=O Amb25131542 [0,1,0,0,0,0|1,0,0]=2 1312 B8R0.5 CCNC(C)CC(C)Br Amb24589023 [0,1,0,0,0,0|2,0,1]=4 1313 B8R0.5 CCNC(C)CC(C)Cl Amb24481697 [0,1,0,0,0,0|2,0,1]=4 1314 B8R0.5 CCNC(C)CC(C)O Amb25836121 [0,1,0,0,0,0|1,0,2]=4 1315 B8R0.5 CCN\C(=C\C(=O)C)\C Amb10602727 [0,1,0,0,0,0|1,0,2]=4 1316 B8R0.5 CCOC(=O)CC(C)=C Amb17940814 [0,1,0,0,0,0|2,0,1]=4 1317 B8R0.5 CCOC(=O)CC(O)=O Amb22360654 [0,1,0,0,0,0|2,0,1]=4 1318 B8R0.5 CCOC(=O)CC([13CH3])=O Amb22366911 [0,1,0,0,0,0|1,0,1]=3 1319 B8R0.5 CCOC(=O)CS(C)=O Amb18177141 [0,1,0,0,0,0|2,0,1]=4 1320 B8R0.5 CCOC(=O)C[13C](C)=O Amb22336363 [0,1,0,0,0,0|1,0,1]=3 1321 B8R0.5 CCOC(=O)C[13C]([13CH3])=O Amb22351420 [0,1,0,0,0,0|1,0,1]=3 1322 B8R0.5 CCOC(=O)[13CH2]C([13CH3])=O Amb22362626 [0,1,0,0,0,0|1,0,1]=3 1323 B8R0.5 CCOC(Br)OC(C)=O Amb24425527 [0,1,0,0,0,0|2,0,0]=3 1324 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,1,0,0,0,0|1,0,0]=2 1325 B8R0.5 CCOC(C)CN(C)C Amb24620141 [0,1,0,0,0,0|3,0,0]=4 1326 B8R0.5 CCOC(C)NC(N)=O Amb24655701 [0,1,0,0,0,0|3,0,0]=4 1327 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,1,0,0,0,0|2,0,0]=3 1328 B8R0.5 CCOC(O)\C=C(/C)\N Amb24477754 [0,1,0,0,0,0|2,0,1]=4 1329 B8R0.5 CCO[13C](=O)[13CH2]C(C)=O Amb22353575 [0,1,0,0,0,0|1,0,1]=3 1330 B8R0.5 CCO[13C](=O)[13CH2][13C](=O)O Amb17618079 [0,1,0,0,0,0|2,0,1]=4 1331 B8R0.5 CCO[13C](=O)[13CH2][13C]([13CH3])=O Amb22351473 [0,1,0,0,0,0|1,0,1]=3 1332 B8R0.5 CCO[C@@H](O)CC(C)=O Amb25051240 [0,1,0,0,0,0|1,0,0]=2 1333 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [0,1,0,0,0,0|2,0,0]=3 1334 B8R0.5 CCO[C@H](C)C[C@@H](C)O Amb24466310 [0,1,0,0,0,0|1,0,2]=4 1335 B8R0.5 CCO[N+]([O-])=CC(C)=O Amb25744989 [0,1,0,0,0,0|2,0,1]=4 1336 B8R0.5 CCSC(C)CC(N)=N Amb24333275 [0,1,0,0,0,0|3,0,0]=4 1337 B8R0.5 CC\C=C(/C)\CC(C)=O Amb24751417 [0,1,0,0,0,0|0,0,2]=3 1338 B8R0.5 CC\C=C(\C)/CC(C)=O Amb25314826 [0,1,0,0,0,0|0,0,2]=3 1339 B8R0.5 CC\N=C(\C)/CC(C)=O Amb25838829 [0,1,0,0,0,0|1,0,1]=3 1340 B8R0.5 CN(C)CC(O)CCN Amb18063241 [0,1,0,0,0,0|3,0,0]=4 1341 B8R0.5 CN(CCCl)CC(N)=O Amb24626078 [0,1,0,0,0,0|3,0,0]=4 1342 B8R0.5 CN(CCCl)CC(O)=O Amb25829318 [0,1,0,0,0,0|3,0,0]=4 1343 B8R0.5 CN(CCF)CC(O)=O Amb25760005 [0,1,0,0,0,0|3,0,0]=4 1344 B8R0.5 CN(CCI)CC(N)=O Amb25042038 [0,1,0,0,0,0|3,0,0]=4 1345 B8R0.5 CN(CCN)CC(O)=O Amb18313585 [0,1,0,0,0,0|3,0,0]=4 1346 B8R0.5 CNCC(C)CC(O)=O Amb25284797 [0,1,0,0,0,0|2,0,0]=3 1347 B8R0.5 CNCC(C)CN(C)C Amb19021215 [0,1,0,0,0,0|3,0,0]=4 1348 B8R0.5 CNCC(C)NC(C)=O Amb25834936 [0,1,0,0,0,0|2,0,0]=3 1349 B8R0.5 COCC(=O)CC(=O)C Amb15701314 [0,1,0,0,0,0|1,0,1]=3 1350 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [0,1,0,0,0,0|2,0,1]=4 1351 B8R0.5 COCC(=O)CS(C)=O Amb25736407 [0,1,0,0,0,0|2,0,1]=4 1352 B8R0.5 COCC(C)CC(O)=O Amb19024342 [0,1,0,0,0,0|2,0,0]=3 1353 B8R0.5 COCC(C)CN(C)N Amb24495578 [0,1,0,0,0,0|3,0,0]=4 1354 B8R0.5 COCC(C)OC(N)=O Amb24645730 [0,1,0,0,0,0|3,0,0]=4 1355 B8R0.5 COCC(Cl)CC(=O)Cl Amb25059197 [0,1,0,0,0,0|2,0,0]=3 1356 B8R0.5 COCC(Cl)CC(O)=O Amb24627002 [0,1,0,0,0,0|2,0,0]=3 1357 B8R0.5 COCC(O)C=C(C)C Amb24687612 [0,1,0,0,0,0|2,0,1]=4 1358 B8R0.5 COCC(O)CC(C)=C Amb25716730 [0,1,0,0,0,0|2,0,0]=3 1359 B8R0.5 COCC(O)CC(N)=N Amb24665644 [0,1,0,0,0,0|3,0,0]=4 1360 B8R0.5 COCC(O)CC(O)=O Amb18832518 [0,1,0,0,0,0|2,0,0]=3 1361 B8R0.5 COCC(O)CN(C)C Amb24697165 [0,1,0,0,0,0|3,0,0]=4 1362 B8R0.5 COCC(O)CN(C)N Amb25285196 [0,1,0,0,0,0|3,0,0]=4 1363 B8R0.5 COC[C@@H](C)CC(O)=O Amb25064328 [0,1,0,0,0,0|2,0,0]=3 1364 B8R0.5 COC[C@@H](C)NC(C)=O Amb24477698 [0,1,0,0,0,0|2,0,0]=3 1365 B8R0.5 COC[C@@H](C)NC(N)=O Amb24718117 [0,1,0,0,0,0|3,0,0]=4 1366 B8R0.5 COC[C@H](C)NC(C)=O Amb24477723 [0,1,0,0,0,0|2,0,0]=3 1367 B8R0.5 COC[C@H](CC(C)C)N Amb17061639 [0,1,0,0,0,0|2,0,1]=4 1368 B8R0.5 CS(=O)CC(N)CCO Amb25711601 [0,1,0,0,0,0|2,0,0]=3 1369 B8R0.5 CS(=O)CC(O)CCN Amb25272158 [0,1,0,0,0,0|2,0,0]=3 1370 B8R0.5 CSCC(C)NC(C)=N Amb25032327 [0,1,0,0,0,0|3,0,0]=4 1371 B8R0.5 CSCC(C)NC(C)=O Amb24481592 [0,1,0,0,0,0|2,0,0]=3 1372 B8R0.5 CSCC(C)OC(C)=O Amb24450062 [0,1,0,0,0,0|2,0,0]=3 1373 B8R0.5 CSCC(Cl)C=C(C)C Amb24480262 [0,1,0,0,0,0|2,0,1]=4 1374 B8R0.5 CSCC(Cl)CC(O)=O Amb18126320 [0,1,0,0,0,0|2,0,0]=3 1375 B8R0.5 CSCC(N)C=C(C)C Amb25162822 [0,1,0,0,0,0|2,0,1]=4 1376 B8R0.5 CSCC(N)CC(N)=O Amb25784570 [0,1,0,0,0,0|2,0,0]=3 1377 B8R0.5 CSCC(O)C=C(C)C Amb25329192 [0,1,0,0,0,0|2,0,1]=4 1378 B8R0.5 CSCC(O)CC(O)=O Amb24621046 [0,1,0,0,0,0|2,0,0]=3 1379 B8R0.5 CSCC(O)CN(C)C Amb24524885 [0,1,0,0,0,0|3,0,0]=4 1380 B8R0.5 CSSC(C)CC(O)=O Amb25241180 [0,1,0,0,0,0|3,0,0]=4 1381 B8R0.5 C[13C](=O)C[13C](=O)OCC Amb22336726 [0,1,0,0,0,0|1,0,1]=3 1382 B8R0.5 C[C@@H](CCN)CC(O)=O Amb25318051 [0,1,0,0,0,0|2,0,0]=3 1383 B8R0.5 C[C@@H](CCO)CC(C)=C Amb25187356 [0,1,0,0,0,0|2,0,0]=3 1384 B8R0.5 C[C@@H](CCO)CC(O)=O Amb24699186 [0,1,0,0,0,0|2,0,0]=3 1385 B8R0.5 C[C@@H](CCO)NC(C)=O Amb25140356 [0,1,0,0,0,0|2,0,0]=3 1386 B8R0.5 C[C@@H](CCO)NC(N)=O Amb24676501 [0,1,0,0,0,0|3,0,0]=4 1387 B8R0.5 C[C@@H](O)C[C@@H](O)CCBr Amb24692601 [0,1,0,0,0,0|1,0,2]=4 1388 B8R0.5 C[C@@H](O)C[C@@H](S)CCC Amb25107605 [0,1,0,0,0,0|0,0,2]=3 1389 B8R0.5 C[C@H](CC#N)NC(C)=O Amb24381940 [0,1,0,0,0,0|2,0,1]=4 1390 B8R0.5 C[C@H](CC=O)CC(C)=C Amb25680323 [0,1,0,0,0,0|2,0,1]=4 1391 B8R0.5 C[C@H](CCO)CC(C)=C Amb24362138 [0,1,0,0,0,0|2,0,0]=3 1392 B8R0.5 C[C@H](CCO)NC(N)=O Amb24690086 [0,1,0,0,0,0|3,0,0]=4 1393 B8R0.5 C[C@H](O)C[C@H](O)CCC Amb25272245 [0,1,0,0,0,0|0,0,2]=3 1394 B8R0.5 C[C@H](O)C[C@H](O)COC Amb25688669 [0,1,0,0,0,0|1,0,2]=4 1395 B8R0.5 C\C(=C/C(=O)O)\CCC Amb10610367 [0,1,0,0,0,0|1,0,2]=4 1396 B8R0.5 C\C(=C/C(C)=O)\OCC Amb25373030 [0,1,0,0,0,0|1,0,2]=4 1397 B8R0.5 C\C(=C/C(C)=O)\SCC Amb25031784 [0,1,0,0,0,0|1,0,2]=4 1398 B8R0.5 C\C(=C\C(C)=O)\NCC Amb20241597 [0,1,0,0,0,0|1,0,2]=4 1399 B8R0.5 C\C(=C\C(C)=O)\OCC Amb25147210 [0,1,0,0,0,0|1,0,2]=4 1400 B8R0.5 C\C(\CC(C)=O)=C/OC Amb24334053 [0,1,0,0,0,0|1,0,2]=4 1401 B8R0.5 C\C(\CC(C)=O)=C\OC Amb24580390 [0,1,0,0,0,0|1,0,2]=4 1402 B8R0.5 C\C(\CC(O)=O)=C/CC Amb25087318 [0,1,0,0,0,0|1,0,2]=4 1403 B8R0.5 C\C(\CC(O)=O)=C\CC Amb24562251 [0,1,0,0,0,0|1,0,2]=4 1404 B8R0.5 C\C(\CCC)=C\C(O)=O Amb24055711 [0,1,0,0,0,0|1,0,2]=4 1405 B8R0.5 C\C(\Cl)=C\C(=O)CCC Amb25179508 [0,1,0,0,0,0|1,0,2]=4 1406 B8R0.5 C\C(\N)=C\C(=O)CCC Amb25059647 [0,1,0,0,0,0|1,0,2]=4 1407 B8R0.5 C\C=C\C(C)CC(C)=O Amb25211017 [0,1,0,0,0,0|0,0,2]=3 1408 B8R0.5 C\C=C\C(C)CC(O)=O Amb24731262 [0,1,0,0,0,0|1,0,2]=4 1409 B8R0.5 C\C=C\C(C)OC(C)=O Amb24678106 [0,1,0,0,0,0|1,0,2]=4 1410 B8R0.5 C\C=C\C(N)CC(N)=O Amb24599388 [0,1,0,0,0,0|1,0,2]=4 1411 B8R0.5 C\C=C\C(O)CC(C)=O Amb24676886 [0,1,0,0,0,0|0,0,2]=3 1412 B8R0.5 C\C=C\C(O)CC(N)=O Amb24567413 [0,1,0,0,0,0|1,0,2]=4 1413 B8R0.5 C\C=C\[C@@H](C)CC(O)=O Amb25343237 [0,1,0,0,0,0|1,0,2]=4 1414 B8R0.5 C\C=C\[C@@H](O)CC(C)=O Amb25143519 [0,1,0,0,0,0|0,0,2]=3 1415 B8R0.5 C\C=C\[C@H](O)CC(O)=O Amb25312045 [0,1,0,0,0,0|1,0,2]=4 1416 B8R0.5 N#CCC(Br)CC(O)=O Amb25211652 [0,1,0,0,0,0|2,0,1]=4 1417 B8R0.5 N#CC[C@H](O)CC(O)=O Amb25294743 [0,1,0,0,0,0|2,0,1]=4 1418 B8R0.5 NC(=O)CS(=O)CCCl Amb24751567 [0,1,0,0,0,0|3,0,0]=4 1419 B8R0.5 NC(=O)CS(=O)CCO Amb24502237 [0,1,0,0,0,0|3,0,0]=4 1420 B8R0.5 NC(=O)C[C@@H](O)CC#N Amb22226710 [0,1,0,0,0,0|2,0,1]=4 1421 B8R0.5 NC(=O)C[C@H](O)CC#N Amb22225367 [0,1,0,0,0,0|2,0,1]=4 1422 B8R0.5 NCCC(CC(C)C)O Amb17231876 [0,1,0,0,0,0|2,0,1]=4 1423 B8R0.5 NCCC(CN(C)C)C Amb17334120 [0,1,0,0,0,0|3,0,0]=4 1424 B8R0.5 NCCC(O)CP(O)=O Amb25708296 [0,1,0,0,0,0|3,0,0]=4 1425 B8R0.5 NCCS(=O)CC(O)=O Amb25124054 [0,1,0,0,0,0|3,0,0]=4 1426 B8R0.5 NCC[C@@H](CC(=O)O)N Amb10067021 [0,1,0,0,0,0|2,0,0]=3 1427 B8R0.5 NCC[C@H](CC(=O)O)N Amb10067019 [0,1,0,0,0,0|2,0,0]=3 1428 B8R0.5 N[C@@H](CCO)CC(O)=O Amb25851007 [0,1,0,0,0,0|2,0,0]=3 1429 B8R0.5 OC(=O)CS(=O)CCF Amb25094766 [0,1,0,0,0,0|3,0,0]=4 1430 B8R0.5 OCCN(CC(=O)C)C Amb10608107 [0,1,0,0,0,0|2,0,0]=3 1431 B8R0.5 OCCN(CC(=O)Cl)C Amb17142874 [0,1,0,0,0,0|3,0,0]=4 1432 B8R0.5 OCCN(CC(=O)N)C Amb17142858 [0,1,0,0,0,0|3,0,0]=4 1433 B8R0.5 [O-]C(=O)CC(=O)OCC Amb2221978 [0,1,0,0,0,0|2,0,1]=4 1434 B8R0.6 BrCCCCC(=O)NC Amb17235862 [0,1,0,0,0,0|1,0,0]=2 1435 B8R0.6 C#CC(=O)CCCCO Amb25838830 [0,1,0,0,0,0|1,0,1]=3 1436 B8R0.6 C#CC(=O)NCCCN Amb18296191 [0,1,0,0,0,0|2,0,1]=4 1437 B8R0.6 C#CCCNC(=O)CBr Amb22896651 [0,1,0,0,0,0|1,0,2]=4 1438 B8R0.6 C#CCCNC(=O)CN Amb24477856 [0,1,0,0,0,0|1,0,2]=4 1439 B8R0.6 C=C(CCCC=O)C=O Amb25338086 [0,1,0,0,0,0|1,0,2]=4 1440 B8R0.6 C=C(CCCCBr)C=O Amb24480109 [0,1,0,0,0,0|1,0,1]=3 1441 B8R0.6 C=C(CCl)CCCCBr Amb24394731 [0,1,0,0,0,0|2,0,0]=3 1442 B8R0.6 C=C(CO)CCCCBr Amb24339522 [0,1,0,0,0,0|2,0,0]=3 1443 B8R0.6 C=C=CCCC(=O)OC Amb10605302 [0,1,0,0,0,0|0,0,3]=4 1444 B8R0.6 C=CC(=C)CCCCO Amb25281427 [0,1,0,0,0,0|2,0,1]=4 1445 B8R0.6 C=CC(=O)CCCCBr Amb24480228 [0,1,0,0,0,0|1,0,1]=3 1446 B8R0.6 C=CC(=O)CCCCCl Amb25711018 [0,1,0,0,0,0|1,0,1]=3 1447 B8R0.6 C=CC(=O)CCCCF Amb25743214 [0,1,0,0,0,0|1,0,1]=3 1448 B8R0.6 C=CC(=O)NCCCCl Amb25836279 [0,1,0,0,0,0|2,0,1]=4 1449 B8R0.6 C=CC(=O)NCCCN Amb18305779 [0,1,0,0,0,0|2,0,1]=4 1450 B8R0.6 C=CC(=O)OCCCF Amb22008270 [0,1,0,0,0,0|2,0,1]=4 1451 B8R0.6 C=CC(=O)OCCCN Amb24120374 [0,1,0,0,0,0|2,0,1]=4 1452 B8R0.6 C=CC(=O)OCCCO Amb22167329 [0,1,0,0,0,0|2,0,1]=4 1453 B8R0.6 C=CCCCC(=C)CCl Amb25230689 [0,1,0,0,0,0|1,0,2]=4 1454 B8R0.6 C=CCCCC(=C)CO Amb25188985 [0,1,0,0,0,0|1,0,2]=4 1455 B8R0.6 C=CCCCC(=O)C#C Amb25251962 [0,1,0,0,0,0|0,0,3]=4 1456 B8R0.6 C=CCCCC(=O)C#N Amb25807418 [0,1,0,0,0,0|0,0,3]=4 1457 B8R0.6 C=CCCCC(=O)CO Amb25114937 [0,1,0,0,0,0|0,0,2]=3 1458 B8R0.6 C=CCCCC(=O)NN Amb24745072 [0,1,0,0,0,0|1,0,2]=4 1459 B8R0.6 C=CCCCC(=O)NN Amb25332027 [0,1,0,0,0,0|1,0,2]=4 1460 B8R0.6 C=CCCCC(=O)NO Amb25742329 [0,1,0,0,0,0|1,0,2]=4 1461 B8R0.6 C=CCCNC(=O)CBr Amb25708152 [0,1,0,0,0,0|1,0,2]=4 1462 B8R0.6 C=CCCNC(=O)CCl Amb25113798 [0,1,0,0,0,0|1,0,2]=4 1463 B8R0.6 C=CCCNC(=O)CI Amb24440549 [0,1,0,0,0,0|1,0,2]=4 1464 B8R0.6 C=CCCNC(=O)CN Amb25077542 [0,1,0,0,0,0|1,0,2]=4 1465 B8R0.6 CC#CCCC(=O)CC Amb25113725 [0,1,0,0,0,0|0,0,2]=3 1466 B8R0.6 CC#CCCC(=O)CN Amb25694472 [0,1,0,0,0,0|0,0,2]=3 1467 B8R0.6 CC#CCCC(C)C=O Amb24600856 [0,1,0,0,0,0|0,0,3]=4 1468 B8R0.6 CC#CCNC(=O)CS Amb25797319 [0,1,0,0,0,0|1,0,2]=4 1469 B8R0.6 CC#CCOC(=O)CBr Amb24627083 [0,1,0,0,0,0|1,0,2]=4 1470 B8R0.6 CC#CCOC(=O)CC Amb25741101 [0,1,0,0,0,0|1,0,2]=4 1471 B8R0.6 CC#CCOC(=O)CCl Amb25758358 [0,1,0,0,0,0|1,0,2]=4 1472 B8R0.6 CC#CCOC(=O)CO Amb25296198 [0,1,0,0,0,0|1,0,2]=4 1473 B8R0.6 CC(=CCCCO)C#C Amb24464925 [0,1,0,0,0,0|2,0,1]=4 1474 B8R0.6 CC(C#N)NCCCC Amb17044849 [0,1,0,0,0,0|2,0,1]=4 1475 B8R0.6 CC(C=O)=CCCC#C Amb24642052 [0,1,0,0,0,0|0,0,3]=4 1476 B8R0.6 CC(CBr)=CCCCCl Amb25176464 [0,1,0,0,0,0|2,0,1]=4 1477 B8R0.6 CC(CCCC#C)C=O Amb24478639 [0,1,0,0,0,0|0,0,3]=4 1478 B8R0.6 CC(CCCC=O)=C=C Amb25309689 [0,1,0,0,0,0|2,0,1]=4 1479 B8R0.6 CC(CCCC=O)C=O Amb18642651 [0,1,0,0,0,0|1,0,2]=4 1480 B8R0.6 CC(CCCCBr)C#C Amb24480213 [0,1,0,0,0,0|2,0,1]=4 1481 B8R0.6 CC(CCCCBr)C=C Amb25690382 [0,1,0,0,0,0|2,0,1]=4 1482 B8R0.6 CC(CCCCCl)C=O Amb24428839 [0,1,0,0,0,0|1,0,1]=3 1483 B8R0.6 CC(CCCCO)=NN Amb24475650 [0,1,0,0,0,0|2,0,0]=3 1484 B8R0.6 CC(CCCCO)C=O Amb25072654 [0,1,0,0,0,0|1,0,1]=3 1485 B8R0.6 CC(CCNCC)CC Amb25327121 [0,1,0,0,0,0|2,0,1]=4 1486 B8R0.6 CC(CNCCI)=CCl Amb25237378 [0,1,0,0,0,0|3,0,0]=4 1487 B8R0.6 CC(CNCCN)=CCl Amb25091049 [0,1,0,0,0,0|3,0,0]=4 1488 B8R0.6 CC(CNCCO)=CCl Amb25052449 [0,1,0,0,0,0|3,0,0]=4 1489 B8R0.6 CC(CO)CCCCBr Amb24649978 [0,1,0,0,0,0|1,0,2]=4 1490 B8R0.6 CC(COCCO)=C=C Amb25794822 [0,1,0,0,0,0|3,0,0]=4 1491 B8R0.6 CC(CSCCN)=CCl Amb24701955 [0,1,0,0,0,0|3,0,0]=4 1492 B8R0.6 CC(CSCCO)=NO Amb25739741 [0,1,0,0,0,0|2,0,1]=4 1493 B8R0.6 CC=NSCC(=O)CCl Amb24567878 [0,1,0,0,0,0|2,0,1]=4 1494 B8R0.6 CCC#CCC(=C)CO Amb25686334 [0,1,0,0,0,0|1,0,2]=4 1495 B8R0.6 CCC(=C)CCCC=O Amb18642469 [0,1,0,0,0,0|2,0,1]=4 1496 B8R0.6 CCC(=C)CCCCO Amb25057130 [0,1,0,0,0,0|2,0,0]=3 1497 B8R0.6 CCC(=C)CCCNC Amb25265577 [0,1,0,0,0,0|2,0,0]=3 1498 B8R0.6 CCC(=C)CCNCC Amb24472904 [0,1,0,0,0,0|2,0,0]=3 1499 B8R0.6 CCC(=C)CNCCN Amb25762491 [0,1,0,0,0,0|3,0,0]=4 1500 B8R0.6 CCC(=C)CNCCO Amb24615526 [0,1,0,0,0,0|3,0,0]=4 1501 B8R0.6 CCC(=C)CNOCC Amb24688394 [0,1,0,0,0,0|3,0,0]=4 1502 B8R0.6 CCC(=C)COCCN Amb24478736 [0,1,0,0,0,0|3,0,0]=4 1503 B8R0.6 CCC(=N)NCCSC Amb25825663 [0,1,0,0,0,0|3,0,0]=4 1504 B8R0.6 CCC(=O)CCCC#N Amb25139954 [0,1,0,0,0,0|1,0,1]=3 1505 B8R0.6 CCC(=O)CCCC=O Amb18642643 [0,1,0,0,0,0|1,0,1]=3 1506 B8R0.6 CCC(=O)CCCCF Amb25842980 [0,1,0,0,0,0|1,0,0]=2 1507 B8R0.6 CCC(=O)CCCCN Amb25757344 [0,1,0,0,0,0|1,0,0]=2 1508 B8R0.6 CCC(=O)CCCNC Amb24411172 [0,1,0,0,0,0|1,0,0]=2 1509 B8R0.6 CCC(=O)CCCSC Amb24433713 [0,1,0,0,0,0|1,0,0]=2 1510 B8R0.6 CCC(=O)CNCC#C Amb24407406 [0,1,0,0,0,0|1,0,2]=4 1511 B8R0.6 CCC(=O)CNCC=C Amb24603096 [0,1,0,0,0,0|1,0,2]=4 1512 B8R0.6 CCC(=O)COCCCl Amb25091814 [0,1,0,0,0,0|2,0,0]=3 1513 B8R0.6 CCC(=O)C\C=C\CC Amb25282725 [0,1,0,0,0,0|0,0,2]=3 1514 B8R0.6 CCC(=O)NCCC#N Amb17399812 [0,1,0,0,0,0|2,0,1]=4 1515 B8R0.6 CCC(=O)NCCC=C Amb10562815 [0,1,0,0,0,0|1,0,2]=4 1516 B8R0.6 CCC(=O)NCCC=O Amb17102166 [0,1,0,0,0,0|2,0,1]=4 1517 B8R0.6 CCC(=O)NCCCS Amb25081972 [0,1,0,0,0,0|2,0,0]=3 1518 B8R0.6 CCC(=O)NCCOC Amb17738048 [0,1,0,0,0,0|2,0,0]=3 1519 B8R0.6 CCC(=O)NCCON Amb17138375 [0,1,0,0,0,0|3,0,0]=4 1520 B8R0.6 CCC(=O)NCNCC Amb25146128 [0,1,0,0,0,0|2,0,0]=3 1521 B8R0.6 CCC(=O)NOCCC Amb25031184 [0,1,0,0,0,0|2,0,0]=3 1522 B8R0.6 CCC(=O)OCCC#C Amb25306062 [0,1,0,0,0,0|1,0,2]=4 1523 B8R0.6 CCC(=O)OCCC#N Amb18642507 [0,1,0,0,0,0|2,0,1]=4 1524 B8R0.6 CCC(=O)OCCC=C Amb25315116 [0,1,0,0,0,0|1,0,2]=4 1525 B8R0.6 CCC(=O)OCCC=O Amb18642741 [0,1,0,0,0,0|2,0,1]=4 1526 B8R0.6 CCC(=O)OCCCCl Amb25707031 [0,1,0,0,0,0|2,0,0]=3 1527 B8R0.6 CCC(=O)OCCCF Amb25345816 [0,1,0,0,0,0|2,0,0]=3 1528 B8R0.6 CCC(=O)OCCCI Amb25856256 [0,1,0,0,0,0|2,0,0]=3 1529 B8R0.6 CCC(=O)OCCCN Amb24652701 [0,1,0,0,0,0|2,0,0]=3 1530 B8R0.6 CCC(=O)OCSCCl Amb24714956 [0,1,0,0,0,0|3,0,0]=4 1531 B8R0.6 CCC(=O)\C=C/NCC Amb25838666 [0,1,0,0,0,0|1,0,2]=4 1532 B8R0.6 CCC(=O)\C=C\OCC Amb22055193 [0,1,0,0,0,0|1,0,2]=4 1533 B8R0.6 CCC(=O)\C=C\SCC Amb24424828 [0,1,0,0,0,0|1,0,2]=4 1534 B8R0.6 CCC(=S)SCCCCl Amb24532861 [0,1,0,0,0,0|2,1,0]=4 1535 B8R0.6 CCC(Br)=CCCCCl Amb24655978 [0,1,0,0,0,0|2,0,1]=4 1536 B8R0.6 CCC(Br)CCCCBr Amb25375320 [0,1,0,0,0,0|2,0,1]=4 1537 B8R0.6 CCC(Br)CCCOC Amb18329558 [0,1,0,0,0,0|2,0,1]=4 1538 B8R0.6 CCC(Br)CCNCC Amb25796689 [0,1,0,0,0,0|2,0,1]=4 1539 B8R0.6 CCC(Br)CCOCC Amb24590489 [0,1,0,0,0,0|2,0,1]=4 1540 B8R0.6 CCC(C)=CCCCO Amb24371214 [0,1,0,0,0,0|2,0,1]=4 1541 B8R0.6 CCC(C)=CCCNC Amb25766830 [0,1,0,0,0,0|2,0,1]=4 1542 B8R0.6 CCC(C)CCCCBr Amb24410922 [0,1,0,0,0,0|2,0,1]=4 1543 B8R0.6 CCC(C)CCCCCl Amb25809492 [0,1,0,0,0,0|2,0,1]=4 1544 B8R0.6 CCC(C)CCCCN Amb25146190 [0,1,0,0,0,0|2,0,1]=4 1545 B8R0.6 CCC(C)CCCCO Amb25367714 [0,1,0,0,0,0|2,0,1]=4 1546 B8R0.6 CCC(Cl)CCCCCl Amb24545870 [0,1,0,0,0,0|2,0,1]=4 1547 B8R0.6 CCC(Cl)CCCCO Amb24479989 [0,1,0,0,0,0|2,0,1]=4 1548 B8R0.6 CCC(Cl)CCCNC Amb24587627 [0,1,0,0,0,0|2,0,1]=4 1549 B8R0.6 CCC(Cl)CCCOC Amb18180141 [0,1,0,0,0,0|2,0,1]=4 1550 B8R0.6 CCC(Cl)CCCSC Amb25687319 [0,1,0,0,0,0|2,0,1]=4 1551 B8R0.6 CCC(Cl)CCNCC Amb24481777 [0,1,0,0,0,0|2,0,1]=4 1552 B8R0.6 CCC(N)=NOCCC Amb25331450 [0,1,0,0,0,0|3,0,0]=4 1553 B8R0.6 CCC(N)CCCCF Amb24482006 [0,1,0,0,0,0|2,0,1]=4 1554 B8R0.6 CCC(N)CCCSC Amb24709842 [0,1,0,0,0,0|2,0,1]=4 1555 B8R0.6 CCC(N)CCOCC Amb25756792 [0,1,0,0,0,0|2,0,1]=4 1556 B8R0.6 CCC(N)CCSCC Amb24518047 [0,1,0,0,0,0|2,0,1]=4 1557 B8R0.6 CCC(O)CCCCBr Amb25146987 [0,1,0,0,0,0|1,0,2]=4 1558 B8R0.6 CCC(O)CCCCF Amb25710820 [0,1,0,0,0,0|1,0,2]=4 1559 B8R0.6 CCC(O)CCCCN Amb24411425 [0,1,0,0,0,0|1,0,2]=4 1560 B8R0.6 CCC(O)CCSCC Amb24711817 [0,1,0,0,0,0|1,0,2]=4 1561 B8R0.6 CCCC#CC(=O)CC Amb25142621 [0,1,0,0,0,0|0,0,2]=3 1562 B8R0.6 CCCC=C=C(C)CO Amb25381424 [0,1,0,0,0,0|0,0,3]=4 1563 B8R0.6 CCCC=CC(=O)OC Amb24093828 [0,1,0,0,0,0|0,0,2]=3 1564 B8R0.6 CCCCCC(=C)C=O Amb18642442 [0,1,0,0,0,0|0,0,1]=2 1565 B8R0.6 CCCCCC(=C)CCl Amb24703635 [0,1,0,0,0,0|1,0,0]=2 1566 B8R0.6 CCCCCC(=C)CO Amb24556289 [0,1,0,0,0,0|1,0,0]=2 1567 B8R0.6 CCCCCC(=O)C#N Amb25767785 [0,1,0,0,0,0|0,0,1]=2 1568 B8R0.6 CCCCCC(=O)C=C Amb20671146 [0,1,0,0,0,0|0,0,1]=2 1569 B8R0.6 CCCCCC(=O)C=O Amb18642604 [0,1,0,0,0,0|0,0,1]=2 1570 B8R0.6 CCCCCC(=O)CBr Amb22276985 [0,1,0,0,0,0|0,0,0]=1 1571 B8R0.6 CCCCCC(=O)CCl Amb17593704 [0,1,0,0,0,0|0,0,0]=1 1572 B8R0.6 CCCCCC(=O)CI Amb22276984 [0,1,0,0,0,0|0,0,0]=1 1573 B8R0.6 CCCCCC(=O)CN Amb18642725 [0,1,0,0,0,0|0,0,0]=1 1574 B8R0.6 CCCCCC(=O)NC Amb24106949 [0,1,0,0,0,0|0,0,0]=1 1575 B8R0.6 CCCCCC(=O)SC Amb22168308 [0,1,0,0,0,0|0,0,0]=1 1576 B8R0.6 CCCCCC(Br)C#N Amb18129814 [0,1,0,0,0,0|1,0,2]=4 1577 B8R0.6 CCCCCC(Br)C=C Amb17666912 [0,1,0,0,0,0|1,0,2]=4 1578 B8R0.6 CCCCCC(Br)CC Amb18324626 [0,1,0,0,0,0|1,0,1]=3 1579 B8R0.6 CCCCCC(Br)CF Amb24480174 [0,1,0,0,0,0|1,0,1]=3 1580 B8R0.6 CCCCCC(C)=NO Amb22232375 [0,1,0,0,0,0|0,0,1]=2 1581 B8R0.6 CCCCCC(C)C#N Amb18642348 [0,1,0,0,0,0|1,0,1]=3 1582 B8R0.6 CCCCCC(C)CC Amb22229361 [0,1,0,0,0,0|1,0,1]=3 1583 B8R0.6 CCCCCC(C)CCl Amb24401516 [0,1,0,0,0,0|1,0,1]=3 1584 B8R0.6 CCCCCC(C)CO Amb21618749 [0,1,0,0,0,0|0,0,2]=3 1585 B8R0.6 CCCCCC(C)NN Amb25327848 [0,1,0,0,0,0|1,0,1]=3 1586 B8R0.6 CCCCCC(C)ON Amb25717019 [0,1,0,0,0,0|0,0,2]=3 1587 B8R0.6 CCCCCC(C)[Mg]Br Amb22897307 [0,1,0,0,0,0|1,0,1]=3 1588 B8R0.6 CCCCCC(C)[Zn]Br Amb22000405 [0,1,0,0,0,0|1,0,1]=3 1589 B8R0.6 CCCCCC(C=O)Br Amb17595055 [0,1,0,0,0,0|1,0,1]=3 1590 B8R0.6 CCCCCC(C=O)C Amb17593349 [0,1,0,0,0,0|0,0,1]=2 1591 B8R0.6 CCCCCC(Cl)=CCl Amb25124050 [0,1,0,0,0,0|1,0,1]=3 1592 B8R0.6 CCCCCC(Cl)=NO Amb25287496 [0,1,0,0,0,0|1,0,1]=3 1593 B8R0.6 CCCCCC(Cl)C#C Amb24480102 [0,1,0,0,0,0|1,0,2]=4 1594 B8R0.6 CCCCCC(Cl)C#N Amb25696257 [0,1,0,0,0,0|1,0,2]=4 1595 B8R0.6 CCCCCC(Cl)C=C Amb24340311 [0,1,0,0,0,0|1,0,2]=4 1596 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [0,1,0,0,0,0|1,0,1]=3 1597 B8R0.6 CCCCCC(Cl)CC Amb22229245 [0,1,0,0,0,0|1,0,1]=3 1598 B8R0.6 CCCCCC(Cl)OC Amb24340104 [0,1,0,0,0,0|1,0,1]=3 1599 B8R0.6 CCCCCC(F)=CBr Amb24552014 [0,1,0,0,0,0|1,0,1]=3 1600 B8R0.6 CCCCCC(F)=CCl Amb24557827 [0,1,0,0,0,0|1,0,1]=3 1601 B8R0.6 CCCCCC(F)CBr Amb24480152 [0,1,0,0,0,0|1,0,1]=3 1602 B8R0.6 CCCCCC(F)CN Amb24117054 [0,1,0,0,0,0|1,0,1]=3 1603 B8R0.6 CCCCCC(F)CO Amb24724495 [0,1,0,0,0,0|1,0,1]=3 1604 B8R0.6 CCCCCC(N)C=C Amb18642554 [0,1,0,0,0,0|1,0,2]=4 1605 B8R0.6 CCCCCC(N)CO Amb24524295 [0,1,0,0,0,0|1,0,1]=3 1606 B8R0.6 CCCCCC(O)C=O Amb18642802 [0,1,0,0,0,0|1,0,1]=3 1607 B8R0.6 CCCCCC(O)CCl Amb21962884 [0,1,0,0,0,0|0,0,2]=3 1608 B8R0.6 CCCCCC(O)CF Amb22546481 [0,1,0,0,0,0|0,0,2]=3 1609 B8R0.6 CCCCCC(O)CO Amb22227711 [0,1,0,0,0,0|0,0,2]=3 1610 B8R0.6 CCCCCC(O)OC Amb25796374 [0,1,0,0,0,0|0,0,2]=3 1611 B8R0.6 CCCCCN(C)C#N Amb24481704 [0,1,0,0,0,0|2,0,0]=3 1612 B8R0.6 CCCCCN(C)C=O Amb24524171 [0,1,0,0,0,0|1,0,0]=2 1613 B8R0.6 CCCCCN(C)OC Amb25295871 [0,1,0,0,0,0|1,0,1]=3 1614 B8R0.6 CCCCCN(N=O)C Amb10070585 [0,1,0,0,0,0|1,0,0]=2 1615 B8R0.6 CCCCC[C@@H](C)CN Amb25213957 [0,1,0,0,0,0|1,0,1]=3 1616 B8R0.6 CCCCC[C@@H](Cl)C#C Amb24390924 [0,1,0,0,0,0|1,0,2]=4 1617 B8R0.6 CCCCC[C@@H](N)CO Amb24473164 [0,1,0,0,0,0|1,0,1]=3 1618 B8R0.6 CCCCC[C@@H](O)C=O Amb24653719 [0,1,0,0,0,0|1,0,1]=3 1619 B8R0.6 CCCCC[C@@H](O)CBr Amb24524540 [0,1,0,0,0,0|0,0,2]=3 1620 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,1,0,0,0,0|0,0,2]=3 1621 B8R0.6 CCCCC[C@@H](O)CCl Amb22736717 [0,1,0,0,0,0|0,0,2]=3 1622 B8R0.6 CCCCC[C@@H](O)CN Amb24476655 [0,1,0,0,0,0|0,0,2]=3 1623 B8R0.6 CCCCC[C@@H](O)CS Amb24735025 [0,1,0,0,0,0|0,0,2]=3 1624 B8R0.6 CCCCC[C@H](Br)CC Amb25272761 [0,1,0,0,0,0|1,0,1]=3 1625 B8R0.6 CCCCC[C@H](C)C=O Amb25717736 [0,1,0,0,0,0|0,0,1]=2 1626 B8R0.6 CCCCC[C@H](Cl)C#C Amb24373197 [0,1,0,0,0,0|1,0,2]=4 1627 B8R0.6 CCCCC[C@H](F)CO Amb25222193 [0,1,0,0,0,0|1,0,1]=3 1628 B8R0.6 CCCCC[C@H](N)C#C Amb25742849 [0,1,0,0,0,0|1,0,2]=4 1629 B8R0.6 CCCCC[C@H](O)C#N Amb24532826 [0,1,0,0,0,0|0,0,3]=4 1630 B8R0.6 CCCCC[C@H](O)CBr Amb24652638 [0,1,0,0,0,0|0,0,2]=3 1631 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,1,0,0,0,0|0,0,2]=3 1632 B8R0.6 CCCCC[C@H](O)CCl Amb22736718 [0,1,0,0,0,0|0,0,2]=3 1633 B8R0.6 CCCCC[C@H](O)CS Amb24748459 [0,1,0,0,0,0|0,0,2]=3 1634 B8R0.6 CCCCC\C(\C)=N\O Amb22338237 [0,1,0,0,0,0|0,0,1]=2 1635 B8R0.6 CCCCN=C(N)NCl Amb25836351 [0,1,0,0,0,0|3,0,0]=4 1636 B8R0.6 CCCCNC(=N)CCl Amb24477805 [0,1,0,0,0,0|2,0,0]=3 1637 B8R0.6 CCCCNC(=N)NBr Amb25363083 [0,1,0,0,0,0|3,0,0]=4 1638 B8R0.6 CCCCNC(=N)OC Amb25691671 [0,1,0,0,0,0|2,0,0]=3 1639 B8R0.6 CCCCNC(=O)C#C Amb25339961 [0,1,0,0,0,0|1,0,1]=3 1640 B8R0.6 CCCCNC(=O)CBr Amb17327510 [0,1,0,0,0,0|1,0,0]=2 1641 B8R0.6 CCCCNC(=O)CCl Amb1204239 [0,1,0,0,0,0|1,0,0]=2 1642 B8R0.6 CCCCNC(=O)CF Amb24585704 [0,1,0,0,0,0|1,0,0]=2 1643 B8R0.6 CCCCNC(=O)CI Amb23447330 [0,1,0,0,0,0|1,0,0]=2 1644 B8R0.6 CCCCNC(=O)CN Amb21958688 [0,1,0,0,0,0|1,0,0]=2 1645 B8R0.6 CCCCNC(=O)N=O Amb25825914 [0,1,0,0,0,0|2,0,0]=3 1646 B8R0.6 CCCCNC(=O)NC Amb1060752 [0,1,0,0,0,0|1,0,0]=2 1647 B8R0.6 CCCCNC(=S)NN Amb1104554 [0,1,0,0,0,0|2,1,0]=4 1648 B8R0.6 CCCCNC(=S)NO Amb10574487 [0,1,0,0,0,0|2,0,1]=4 1649 B8R0.6 CCCCNC(=S)OC Amb25757454 [0,1,0,0,0,0|1,1,0]=3 1650 B8R0.6 CCCCNC(=S)SC Amb24468347 [0,1,0,0,0,0|1,1,0]=3 1651 B8R0.6 CCCCNC(C)C=C Amb25127953 [0,1,0,0,0,0|2,0,1]=4 1652 B8R0.6 CCCCNC(C)CCl Amb25323246 [0,1,0,0,0,0|2,0,1]=4 1653 B8R0.6 CCCCNC(C)CN Amb24481793 [0,1,0,0,0,0|2,0,1]=4 1654 B8R0.6 CCCCNC(C)CS Amb24340092 [0,1,0,0,0,0|1,1,1]=4 1655 B8R0.6 CCCCNC(N)=NN Amb25090390 [0,1,0,0,0,0|3,0,0]=4 1656 B8R0.6 CCCCNC(N)=NO Amb24735707 [0,1,0,0,0,0|2,0,1]=4 1657 B8R0.6 CCCCNC(O)CC Amb25749396 [0,1,0,0,0,0|1,0,2]=4 1658 B8R0.6 CCCCN[C@@H](C)CC Amb24118022 [0,1,0,0,0,0|2,0,1]=4 1659 B8R0.6 CCCCOC(=C)C=O Amb18642623 [0,1,0,0,0,0|1,0,1]=3 1660 B8R0.6 CCCCOC(=C)CCl Amb25032095 [0,1,0,0,0,0|2,0,0]=3 1661 B8R0.6 CCCCOC(=N)C#N Amb24748600 [0,1,0,0,0,0|2,0,1]=4 1662 B8R0.6 CCCCOC(=O)C#C Amb25839203 [0,1,0,0,0,0|1,0,1]=3 1663 B8R0.6 CCCCOC(=O)C#N Amb25676361 [0,1,0,0,0,0|1,0,1]=3 1664 B8R0.6 CCCCOC(=O)C=C Amb22351622 [0,1,0,0,0,0|1,0,1]=3 1665 B8R0.6 CCCCOC(=O)CBr Amb10601879 [0,1,0,0,0,0|1,0,0]=2 1666 B8R0.6 CCCCOC(=O)CF Amb10838878 [0,1,0,0,0,0|1,0,0]=2 1667 B8R0.6 CCCCOC(=O)CN Amb19373374 [0,1,0,0,0,0|1,0,0]=2 1668 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [0,1,0,0,0,0|1,0,0]=2 1669 B8R0.6 CCCCOC(=O)NC Amb24680085 [0,1,0,0,0,0|1,0,0]=2 1670 B8R0.6 CCCCOC(=O)NN Amb25321437 [0,1,0,0,0,0|2,0,0]=3 1671 B8R0.6 CCCCOC(=S)NN Amb24710633 [0,1,0,0,0,0|2,1,0]=4 1672 B8R0.6 CCCCOC(C)C=O Amb18642805 [0,1,0,0,0,0|1,0,1]=3 1673 B8R0.6 CCCCOC(C)CO Amb24712962 [0,1,0,0,0,0|1,0,2]=4 1674 B8R0.6 CCCCOC(C)ON Amb25375946 [0,1,0,0,0,0|1,0,2]=4 1675 B8R0.6 CCCCOC(CN)C Amb17485998 [0,1,0,0,0,0|2,0,1]=4 1676 B8R0.6 CCCCOC(Cl)=CCl Amb25178995 [0,1,0,0,0,0|2,0,1]=4 1677 B8R0.6 CCCCOC(Cl)CCl Amb17940716 [0,1,0,0,0,0|2,0,1]=4 1678 B8R0.6 CCCCOC(N)=NO Amb24555551 [0,1,0,0,0,0|2,0,1]=4 1679 B8R0.6 CCCCOC(O)CO Amb25144479 [0,1,0,0,0,0|1,0,2]=4 1680 B8R0.6 CCCCO[C@H](C)CO Amb24439158 [0,1,0,0,0,0|1,0,2]=4 1681 B8R0.6 CCCCSC(=C)CO Amb25716344 [0,1,0,0,0,0|2,0,0]=3 1682 B8R0.6 CCCCSC(C)C=O Amb18644295 [0,1,0,0,0,0|1,0,1]=3 1683 B8R0.6 CCCCSC(C)CN Amb24382073 [0,1,0,0,0,0|2,0,1]=4 1684 B8R0.6 CCCCSC(C)CO Amb24481648 [0,1,0,0,0,0|1,0,2]=4 1685 B8R0.6 CCCCSC(Cl)=CCl Amb24693917 [0,1,0,0,0,0|2,0,1]=4 1686 B8R0.6 CCCC\C=C(/C)\C=O Amb18642452 [0,1,0,0,0,0|0,0,1]=2 1687 B8R0.6 CCCC\C=C(/Cl)\CCl Amb25292215 [0,1,0,0,0,0|1,0,1]=3 1688 B8R0.6 CCCC\C=C(/F)\C=O Amb24378145 [0,1,0,0,0,0|1,0,1]=3 1689 B8R0.6 CCCC\C=C(\Br)/CO Amb24371336 [0,1,0,0,0,0|1,0,1]=3 1690 B8R0.6 CCCC\C=C(\C)/C=O Amb25785624 [0,1,0,0,0,0|0,0,1]=2 1691 B8R0.6 CCCC\C=C(\C)/CCl Amb25317209 [0,1,0,0,0,0|1,0,1]=3 1692 B8R0.6 CCCC\C=C(\C)/CO Amb24556106 [0,1,0,0,0,0|0,0,2]=3 1693 B8R0.6 CCCC\C=C(\F)/CCl Amb24528616 [0,1,0,0,0,0|1,0,1]=3 1694 B8R0.6 CCCNCC(=O)C#C Amb24680523 [0,1,0,0,0,0|1,0,1]=3 1695 B8R0.6 CCCNCC(=O)C=C Amb25215155 [0,1,0,0,0,0|1,0,1]=3 1696 B8R0.6 CCCNCC(=O)CC Amb24715612 [0,1,0,0,0,0|1,0,0]=2 1697 B8R0.6 CCCNCC(C)CO Amb24388936 [0,1,0,0,0,0|1,0,2]=4 1698 B8R0.6 CCCNCC(N)=NO Amb25147147 [0,1,0,0,0,0|2,0,1]=4 1699 B8R0.6 CCCNC[C@@H](N)CC Amb25319142 [0,1,0,0,0,0|2,0,1]=4 1700 B8R0.6 CCCNC[C@H](O)CC Amb25146113 [0,1,0,0,0,0|1,0,2]=4 1701 B8R0.6 CCCOCC(=C)C=O Amb25198952 [0,1,0,0,0,0|1,0,1]=3 1702 B8R0.6 CCCOCC(=C)NN Amb24528399 [0,1,0,0,0,0|2,0,1]=4 1703 B8R0.6 CCCOCC(=N)NC Amb24340084 [0,1,0,0,0,0|2,0,0]=3 1704 B8R0.6 CCCOCC(=O)C#C Amb25698675 [0,1,0,0,0,0|1,0,1]=3 1705 B8R0.6 CCCOCC(=O)C=C Amb24360271 [0,1,0,0,0,0|1,0,1]=3 1706 B8R0.6 CCCOCC(=O)CO Amb24416729 [0,1,0,0,0,0|1,0,0]=2 1707 B8R0.6 CCCOCC(=O)NN Amb19960407 [0,1,0,0,0,0|2,0,0]=3 1708 B8R0.6 CCCOCC(=O)NO Amb25261947 [0,1,0,0,0,0|2,0,0]=3 1709 B8R0.6 CCCOCC(C)CBr Amb24370433 [0,1,0,0,0,0|2,0,1]=4 1710 B8R0.6 CCCOCC(C)NC Amb24618931 [0,1,0,0,0,0|2,0,1]=4 1711 B8R0.6 CCCOCC(CC)N Amb17485992 [0,1,0,0,0,0|2,0,1]=4 1712 B8R0.6 CCCOCC(CO)O Amb10071476 [0,1,0,0,0,0|1,0,2]=4 1713 B8R0.6 CCCOCC(Cl)CC Amb25192529 [0,1,0,0,0,0|2,0,1]=4 1714 B8R0.6 CCCOCC(F)CN Amb24611651 [0,1,0,0,0,0|2,0,1]=4 1715 B8R0.6 CCCOCC(N)=NN Amb25710700 [0,1,0,0,0,0|3,0,0]=4 1716 B8R0.6 CCCOCC(N)CO Amb24681930 [0,1,0,0,0,0|2,0,1]=4 1717 B8R0.6 CCCOCC(O)C=O Amb25217476 [0,1,0,0,0,0|2,0,1]=4 1718 B8R0.6 CCCOCN(C)C=O Amb24096760 [0,1,0,0,0,0|2,0,0]=3 1719 B8R0.6 CCCOC[C@@H](N)CO Amb25363717 [0,1,0,0,0,0|2,0,1]=4 1720 B8R0.6 CCCOC[C@@H](O)CN Amb24596176 [0,1,0,0,0,0|1,0,2]=4 1721 B8R0.6 CCCOC[C@@H](O)CO Amb25144456 [0,1,0,0,0,0|1,0,2]=4 1722 B8R0.6 CCCOC[C@H](O)CN Amb25032338 [0,1,0,0,0,0|1,0,2]=4 1723 B8R0.6 CCCONC(=O)C=C Amb25101856 [0,1,0,0,0,0|2,0,1]=4 1724 B8R0.6 CCCONC(=O)CN Amb24340270 [0,1,0,0,0,0|2,0,0]=3 1725 B8R0.6 CCCO\C=C(/C)\C=O Amb24679011 [0,1,0,0,0,0|1,0,1]=3 1726 B8R0.6 CCCSCC(=C)CC Amb25331591 [0,1,0,0,0,0|2,0,0]=3 1727 B8R0.6 CCCSCC(=C)CS Amb25222547 [0,1,0,0,0,0|2,0,0]=3 1728 B8R0.6 CCCSCC(=O)NN Amb25190080 [0,1,0,0,0,0|2,0,0]=3 1729 B8R0.6 CCCSCC(=O)NO Amb24457617 [0,1,0,0,0,0|2,0,0]=3 1730 B8R0.6 CCCSCC(C)CC Amb24430672 [0,1,0,0,0,0|2,0,1]=4 1731 B8R0.6 CCCSCC(C)OC Amb25344458 [0,1,0,0,0,0|1,0,2]=4 1732 B8R0.6 CCCSCC(CC)N Amb17485961 [0,1,0,0,0,0|2,0,1]=4 1733 B8R0.6 CCCSCC(Cl)=CCl Amb25317171 [0,1,0,0,0,0|2,0,1]=4 1734 B8R0.6 CCCSCC(O)CBr Amb24610498 [0,1,0,0,0,0|1,0,2]=4 1735 B8R0.6 CCCSCC(O)CCl Amb24709373 [0,1,0,0,0,0|1,0,2]=4 1736 B8R0.6 CCCSCC(O)CF Amb24573949 [0,1,0,0,0,0|1,0,2]=4 1737 B8R0.6 CCCSC[C@H](N)CC Amb24481830 [0,1,0,0,0,0|2,0,1]=4 1738 B8R0.6 CCCSC[C@H](O)CC Amb25344752 [0,1,0,0,0,0|1,0,2]=4 1739 B8R0.6 CCCSC[C@H](O)CN Amb24431306 [0,1,0,0,0,0|1,0,2]=4 1740 B8R0.6 CCC\C=C\C(=O)C#C Amb25746662 [0,1,0,0,0,0|0,0,3]=4 1741 B8R0.6 CCC\C=C\C(=O)CCl Amb24633372 [0,1,0,0,0,0|0,0,2]=3 1742 B8R0.6 CCC\C=C\C(=O)CF Amb25288551 [0,1,0,0,0,0|0,0,2]=3 1743 B8R0.6 CCC\C=C\C(=O)NC Amb24744883 [0,1,0,0,0,0|0,0,2]=3 1744 B8R0.6 CCC\C=C\C(=O)NN Amb25852581 [0,1,0,0,0,0|1,0,2]=4 1745 B8R0.6 CCN(C)CCCCBr Amb19037649 [0,1,0,0,0,0|3,0,0]=4 1746 B8R0.6 CCN(C)CCCCCl Amb24532820 [0,1,0,0,0,0|3,0,0]=4 1747 B8R0.6 CCN(C)CCCCF Amb24457662 [0,1,0,0,0,0|3,0,0]=4 1748 B8R0.6 CCN(C)CCCCS Amb24340203 [0,1,0,0,0,0|3,0,0]=4 1749 B8R0.6 CCN(N)CCNCC Amb25679054 [0,1,0,0,0,0|3,0,0]=4 1750 B8R0.6 CCN(N)CCOCC Amb24646828 [0,1,0,0,0,0|3,0,0]=4 1751 B8R0.6 CCNCCC(=O)C=C Amb24550936 [0,1,0,0,0,0|1,0,1]=3 1752 B8R0.6 CCNCCC(=O)NO Amb25251897 [0,1,0,0,0,0|2,0,0]=3 1753 B8R0.6 CCNCCC(C)CO Amb24697609 [0,1,0,0,0,0|1,0,2]=4 1754 B8R0.6 CCNCCC(C)SC Amb24481775 [0,1,0,0,0,0|1,1,1]=4 1755 B8R0.6 CCNCCC(CN)C Amb17334117 [0,1,0,0,0,0|2,0,1]=4 1756 B8R0.6 CCNCCC(O)CO Amb24424060 [0,1,0,0,0,0|1,0,2]=4 1757 B8R0.6 CCNCC[C@H](O)CO Amb24478395 [0,1,0,0,0,0|1,0,2]=4 1758 B8R0.6 CCNCC\C(\N)=N/O Amb19981295 [0,1,0,0,0,0|2,0,1]=4 1759 B8R0.6 CCNC\C=C(\C)/C#C Amb24617877 [0,1,0,0,0,0|2,0,1]=4 1760 B8R0.6 CCN\C=C\C(=O)OC Amb2386650 [0,1,0,0,0,0|1,0,2]=4 1761 B8R0.6 CCOCCC(=N)NC Amb25784909 [0,1,0,0,0,0|2,0,0]=3 1762 B8R0.6 CCOCCC(=O)CO Amb24478622 [0,1,0,0,0,0|1,0,0]=2 1763 B8R0.6 CCOCCC(=O)NC Amb25302984 [0,1,0,0,0,0|1,0,0]=2 1764 B8R0.6 CCOCCC(C)CBr Amb24552402 [0,1,0,0,0,0|2,0,1]=4 1765 B8R0.6 CCOCCC(C)CCl Amb24478711 [0,1,0,0,0,0|2,0,1]=4 1766 B8R0.6 CCOCCC(C)CN Amb25765458 [0,1,0,0,0,0|2,0,1]=4 1767 B8R0.6 CCOCCC(C)CO Amb25303340 [0,1,0,0,0,0|1,0,2]=4 1768 B8R0.6 CCOCCC(C)NC Amb25662108 [0,1,0,0,0,0|2,0,1]=4 1769 B8R0.6 CCOCCC(N)C=O Amb25743805 [0,1,0,0,0,0|2,0,1]=4 1770 B8R0.6 CCOCCC(N)CO Amb24388796 [0,1,0,0,0,0|2,0,1]=4 1771 B8R0.6 CCOCCC(O)CN Amb25147160 [0,1,0,0,0,0|1,0,2]=4 1772 B8R0.6 CCOC\C=C(/C)\CCl Amb24518085 [0,1,0,0,0,0|2,0,1]=4 1773 B8R0.6 CCOC\C=C(\C)/C=O Amb25218240 [0,1,0,0,0,0|1,0,1]=3 1774 B8R0.6 CCOC\C=C(\Cl)/CBr Amb24557175 [0,1,0,0,0,0|2,0,1]=4 1775 B8R0.6 CCONCC(C)=CCl Amb24475776 [0,1,0,0,0,0|3,0,0]=4 1776 B8R0.6 CCO\C=C\C(=O)CCl Amb24389562 [0,1,0,0,0,0|1,0,2]=4 1777 B8R0.6 CCS(=O)CCCC#N Amb24619313 [0,1,0,0,0,0|2,0,1]=4 1778 B8R0.6 CCS(=O)CCCCO Amb24354490 [0,1,0,0,0,0|2,0,0]=3 1779 B8R0.6 CCS(=O)CCCNC Amb25188926 [0,1,0,0,0,0|2,0,0]=3 1780 B8R0.6 CCS(=O)CCNCC Amb24650548 [0,1,0,0,0,0|2,0,0]=3 1781 B8R0.6 CCS(=O)NCCCBr Amb24512255 [0,1,0,0,0,0|3,0,0]=4 1782 B8R0.6 CCS(=O)NCCOC Amb24589164 [0,1,0,0,0,0|3,0,0]=4 1783 B8R0.6 CCSCCC(C)=NO Amb24672386 [0,1,0,0,0,0|1,0,1]=3 1784 B8R0.6 CCSCCC(C)CBr Amb25112497 [0,1,0,0,0,0|2,0,1]=4 1785 B8R0.6 CCSCCC(C)CCl Amb25829491 [0,1,0,0,0,0|2,0,1]=4 1786 B8R0.6 CCSCCC(C)CN Amb24476172 [0,1,0,0,0,0|2,0,1]=4 1787 B8R0.6 CCSCCC(C)NC Amb19149279 [0,1,0,0,0,0|2,0,1]=4 1788 B8R0.6 CCSCCC(N)CF Amb25233183 [0,1,0,0,0,0|2,0,1]=4 1789 B8R0.6 CCSCCC(N)CO Amb25820753 [0,1,0,0,0,0|2,0,1]=4 1790 B8R0.6 CCSCCC(O)CN Amb24581930 [0,1,0,0,0,0|1,0,2]=4 1791 B8R0.6 CCSCCC(O)CO Amb24470380 [0,1,0,0,0,0|1,0,2]=4 1792 B8R0.6 CCSC\C=C(\C)/CO Amb24529088 [0,1,0,0,0,0|1,0,2]=4 1793 B8R0.6 CCS\C=C\C(=O)OC Amb24387094 [0,1,0,0,0,0|1,0,2]=4 1794 B8R0.6 CC[C@@H](C)CCCCO Amb22801082 [0,1,0,0,0,0|2,0,1]=4 1795 B8R0.6 CC[C@@H](F)CCCCO Amb24454648 [0,1,0,0,0,0|2,0,1]=4 1796 B8R0.6 CC[C@H](C)CCCCBr Amb24623524 [0,1,0,0,0,0|2,0,1]=4 1797 B8R0.6 CC[C@H](C)CCCCN Amb24466420 [0,1,0,0,0,0|2,0,1]=4 1798 B8R0.6 CC[C@H](C)CCCCO Amb22226718 [0,1,0,0,0,0|2,0,1]=4 1799 B8R0.6 CC[C@H](N)CCCOC Amb24520752 [0,1,0,0,0,0|2,0,1]=4 1800 B8R0.6 CC[C@H](N)CCOCC Amb25074395 [0,1,0,0,0,0|2,0,1]=4 1801 B8R0.6 CC\C=C/OC(=O)NC Amb25244757 [0,1,0,0,0,0|1,0,2]=4 1802 B8R0.6 CC\C=C\C=C(/C)\C=O Amb24480315 [0,1,0,0,0,0|0,0,3]=4 1803 B8R0.6 CC\C=C\CC(=O)C=C Amb24574125 [0,1,0,0,0,0|0,0,3]=4 1804 B8R0.6 CC\C=C\CC(=O)CCl Amb24611212 [0,1,0,0,0,0|0,0,2]=3 1805 B8R0.6 CC\C=C\CC(=O)NC Amb25328971 [0,1,0,0,0,0|0,0,2]=3 1806 B8R0.6 CC\C=C\OC(=O)NC Amb24658253 [0,1,0,0,0,0|1,0,2]=4 1807 B8R0.6 CN(CCCC=C)C=O Amb25209472 [0,1,0,0,0,0|1,0,2]=4 1808 B8R0.6 CN(CCCCBr)C#N Amb25111143 [0,1,0,0,0,0|3,0,0]=4 1809 B8R0.6 CN(CCCCO)N=O Amb25709435 [0,1,0,0,0,0|2,0,0]=3 1810 B8R0.6 CN(COCCCl)C=O Amb25831019 [0,1,0,0,0,0|3,0,0]=4 1811 B8R0.6 CN=C(N)SCCOC Amb25051165 [0,1,0,0,0,0|3,0,0]=4 1812 B8R0.6 CN=C(N)SCCOC Amb25662475 [0,1,0,0,0,0|3,0,0]=4 1813 B8R0.6 CNC(=N)NCCCO Amb25102954 [0,1,0,0,0,0|3,0,0]=4 1814 B8R0.6 CNC(=N)NCCSC Amb25797365 [0,1,0,0,0,0|3,0,0]=4 1815 B8R0.6 CNC(=N)NOCCC Amb25784269 [0,1,0,0,0,0|3,0,0]=4 1816 B8R0.6 CNC(=O)CCCSC Amb18411875 [0,1,0,0,0,0|1,0,0]=2 1817 B8R0.6 CNC(=O)CCN=[N+]=[N-] Amb24418387 [0,1,0,0,0,0|3,0,0]=4 1818 B8R0.6 CNC(=O)CCNOC Amb24608579 [0,1,0,0,0,0|2,0,0]=3 1819 B8R0.6 CNC(=O)CNCCF Amb24636629 [0,1,0,0,0,0|2,0,0]=3 1820 B8R0.6 CNC(=O)CNCCN Amb24456298 [0,1,0,0,0,0|2,0,0]=3 1821 B8R0.6 CNC(=O)CNOCC Amb25723721 [0,1,0,0,0,0|2,0,0]=3 1822 B8R0.6 CNC(=O)COCCCl Amb25844524 [0,1,0,0,0,0|2,0,0]=3 1823 B8R0.6 CNC(=O)COCCN Amb19016737 [0,1,0,0,0,0|2,0,0]=3 1824 B8R0.6 CNC(=O)COCCN Amb24271094 [0,1,0,0,0,0|2,0,0]=3 1825 B8R0.6 CNC(=O)CSCC#N Amb17501760 [0,1,0,0,0,0|2,0,1]=4 1826 B8R0.6 CNC(=O)CSCC=C Amb18411972 [0,1,0,0,0,0|1,0,2]=4 1827 B8R0.6 CNC(=O)CSCC=O Amb25683635 [0,1,0,0,0,0|2,0,1]=4 1828 B8R0.6 CNC(=O)CSCCCl Amb24742987 [0,1,0,0,0,0|2,0,0]=3 1829 B8R0.6 CNC(=O)CSCCS Amb24663591 [0,1,0,0,0,0|2,0,0]=3 1830 B8R0.6 CNC(=O)NCCCCl Amb13951257 [0,1,0,0,0,0|2,0,0]=3 1831 B8R0.6 CNC(=O)NCCCN Amb18908303 [0,1,0,0,0,0|2,0,0]=3 1832 B8R0.6 CNC(=O)NOCCC Amb25330024 [0,1,0,0,0,0|2,0,0]=3 1833 B8R0.6 CNC(=O)OCCCBr Amb24635809 [0,1,0,0,0,0|2,0,0]=3 1834 B8R0.6 CNC(=O)OCCCCl Amb25357949 [0,1,0,0,0,0|2,0,0]=3 1835 B8R0.6 CNC(=O)\C=C\COC Amb24476723 [0,1,0,0,0,0|1,0,2]=4 1836 B8R0.6 CNC(=S)NCCCF Amb25341022 [0,1,0,0,0,0|2,1,0]=4 1837 B8R0.6 CNC(=S)NCCCO Amb25777180 [0,1,0,0,0,0|2,1,0]=4 1838 B8R0.6 CNC(=S)NCCSC Amb25188932 [0,1,0,0,0,0|2,1,0]=4 1839 B8R0.6 CNC(=S)NNCCC Amb25214594 [0,1,0,0,0,0|2,1,0]=4 1840 B8R0.6 CNC(=S)SCCCS Amb24739786 [0,1,0,0,0,0|2,1,0]=4 1841 B8R0.6 CNC(C)CCCCF Amb24500284 [0,1,0,0,0,0|2,0,1]=4 1842 B8R0.6 CNC(C)CCCCN Amb25709671 [0,1,0,0,0,0|2,0,1]=4 1843 B8R0.6 CNCCCC(=O)NC Amb18303609 [0,1,0,0,0,0|1,0,0]=2 1844 B8R0.6 CNCCCC(=O)NC Amb22098814 [0,1,0,0,0,0|1,0,0]=2 1845 B8R0.6 CNCCCC(C)CCl Amb25691992 [0,1,0,0,0,0|2,0,1]=4 1846 B8R0.6 CNCCCC(C)CN Amb25776699 [0,1,0,0,0,0|2,0,1]=4 1847 B8R0.6 CNCCCC(CO)C Amb17569924 [0,1,0,0,0,0|1,0,2]=4 1848 B8R0.6 CNCCCC(O)CO Amb25185204 [0,1,0,0,0,0|1,0,2]=4 1849 B8R0.6 CNCCCC(OC)C Amb17569936 [0,1,0,0,0,0|1,0,2]=4 1850 B8R0.6 CNCCCN(C)C=O Amb24644856 [0,1,0,0,0,0|2,0,0]=3 1851 B8R0.6 CNCCCN(C)N=O Amb24611717 [0,1,0,0,0,0|2,0,0]=3 1852 B8R0.6 CNCCCN(C)OC Amb25357801 [0,1,0,0,0,0|2,0,1]=4 1853 B8R0.6 CNCCC[C@@H](O)CO Amb24745507 [0,1,0,0,0,0|1,0,2]=4 1854 B8R0.6 CNCCC[C@H](O)CO Amb25747324 [0,1,0,0,0,0|1,0,2]=4 1855 B8R0.6 CNCCNC(=O)C#C Amb18523797 [0,1,0,0,0,0|2,0,1]=4 1856 B8R0.6 CNCCNC(=O)C=C Amb19027445 [0,1,0,0,0,0|2,0,1]=4 1857 B8R0.6 CNCCNC(=O)CC Amb18311203 [0,1,0,0,0,0|2,0,0]=3 1858 B8R0.6 CNCCNC(=O)CN Amb25321734 [0,1,0,0,0,0|2,0,0]=3 1859 B8R0.6 CNCCNC(=O)OC Amb19027453 [0,1,0,0,0,0|2,0,0]=3 1860 B8R0.6 CNCCNS(=O)CC Amb24582931 [0,1,0,0,0,0|3,0,0]=4 1861 B8R0.6 CNCC\C=C(\C)/C#C Amb24663962 [0,1,0,0,0,0|2,0,1]=4 1862 B8R0.6 CNCC\C=C(\C)/C=C Amb25137476 [0,1,0,0,0,0|2,0,1]=4 1863 B8R0.6 CN[C@@H](C)CNCCC Amb25351170 [0,1,0,0,0,0|2,0,1]=4 1864 B8R0.6 COC(=N)CCCCCl Amb25300747 [0,1,0,0,0,0|2,0,0]=3 1865 B8R0.6 COC(=N)COCCC Amb25783562 [0,1,0,0,0,0|2,0,0]=3 1866 B8R0.6 COC(=O)C#CCCBr Amb25691842 [0,1,0,0,0,0|1,0,2]=4 1867 B8R0.6 COC(=O)C#CCCO Amb22230912 [0,1,0,0,0,0|1,0,2]=4 1868 B8R0.6 COC(=O)CCCC=C Amb22730759 [0,1,0,0,0,0|0,0,2]=3 1869 B8R0.6 COC(=O)CCCCN Amb18642844 [0,1,0,0,0,0|1,0,0]=2 1870 B8R0.6 COC(=O)CCCCO Amb22641583 [0,1,0,0,0,0|1,0,0]=2 1871 B8R0.6 COC(=O)CCCON Amb25266351 [0,1,0,0,0,0|2,0,0]=3 1872 B8R0.6 COC(=O)CCCSC Amb19878350 [0,1,0,0,0,0|1,0,0]=2 1873 B8R0.6 COC(=O)CCC[Zn]Br Amb22898091 [0,1,0,0,0,0|2,0,0]=3 1874 B8R0.6 COC(=O)CCN=[N+]=[N-] Amb22900901 [0,1,0,0,0,0|3,0,0]=4 1875 B8R0.6 COC(=O)CCNC=O Amb22234963 [0,1,0,0,0,0|2,0,1]=4 1876 B8R0.6 COC(=O)CNOCC Amb24739353 [0,1,0,0,0,0|2,0,0]=3 1877 B8R0.6 COC(=O)COCC=O Amb25094456 [0,1,0,0,0,0|2,0,1]=4 1878 B8R0.6 COC(=O)COCCN Amb24401799 [0,1,0,0,0,0|2,0,0]=3 1879 B8R0.6 COC(=O)COCCO Amb24113538 [0,1,0,0,0,0|2,0,0]=3 1880 B8R0.6 COC(=O)CSCCBr Amb25662052 [0,1,0,0,0,0|2,0,0]=3 1881 B8R0.6 COC(=O)CSCCCl Amb24340126 [0,1,0,0,0,0|2,0,0]=3 1882 B8R0.6 COC(=O)CSCCF Amb25821146 [0,1,0,0,0,0|2,0,0]=3 1883 B8R0.6 COC(=O)CSCCN Amb19268671 [0,1,0,0,0,0|2,0,0]=3 1884 B8R0.6 COC(=O)C\C=C\CCl Amb25084500 [0,1,0,0,0,0|1,0,2]=4 1885 B8R0.6 COC(=O)C\C=C\CN Amb25146041 [0,1,0,0,0,0|1,0,2]=4 1886 B8R0.6 COC(=O)C\C=C\CO Amb24404592 [0,1,0,0,0,0|1,0,2]=4 1887 B8R0.6 COC(=O)NCCC#C Amb24477847 [0,1,0,0,0,0|1,0,2]=4 1888 B8R0.6 COC(=O)NCCC=O Amb18642833 [0,1,0,0,0,0|2,0,1]=4 1889 B8R0.6 COC(=O)NCCSC Amb24379130 [0,1,0,0,0,0|2,0,0]=3 1890 B8R0.6 COC(=O)NCOCC Amb24606808 [0,1,0,0,0,0|2,0,0]=3 1891 B8R0.6 COC(=O)NOCCC Amb24381046 [0,1,0,0,0,0|2,0,0]=3 1892 B8R0.6 COC(=O)NOCCO Amb24570213 [0,1,0,0,0,0|3,0,0]=4 1893 B8R0.6 COC(=O)OCCCBr Amb25361096 [0,1,0,0,0,0|2,0,0]=3 1894 B8R0.6 COC(=O)OCCCF Amb24088642 [0,1,0,0,0,0|2,0,0]=3 1895 B8R0.6 COC(=O)SSCCN Amb24443106 [0,1,0,0,0,0|3,0,0]=4 1896 B8R0.6 COC(=O)\C=C\CCBr Amb22756459 [0,1,0,0,0,0|1,0,2]=4 1897 B8R0.6 COC(=O)\C=C\CCCl Amb24514923 [0,1,0,0,0,0|1,0,2]=4 1898 B8R0.6 COC(=O)\C=C\CSC Amb25710380 [0,1,0,0,0,0|1,0,2]=4 1899 B8R0.6 COC(=S)CCCCCl Amb25145676 [0,1,0,0,0,0|1,1,0]=3 1900 B8R0.6 COC(C)CCCCO Amb25835593 [0,1,0,0,0,0|1,0,2]=4 1901 B8R0.6 COCCCC(=N)OC Amb25127148 [0,1,0,0,0,0|2,0,0]=3 1902 B8R0.6 COCCCC(=O)C=C Amb24479926 [0,1,0,0,0,0|1,0,1]=3 1903 B8R0.6 COCCCC(C)=NN Amb25847725 [0,1,0,0,0,0|2,0,0]=3 1904 B8R0.6 COCCCC(C)C#N Amb24692198 [0,1,0,0,0,0|2,0,1]=4 1905 B8R0.6 COCCCC(C)CBr Amb24692425 [0,1,0,0,0,0|2,0,1]=4 1906 B8R0.6 COCCCC(C)CCl Amb24340257 [0,1,0,0,0,0|2,0,1]=4 1907 B8R0.6 COCCCC(C)CO Amb24478636 [0,1,0,0,0,0|1,0,2]=4 1908 B8R0.6 COCCCC(C)NO Amb24739871 [0,1,0,0,0,0|1,0,2]=4 1909 B8R0.6 COCCCC(CN)C Amb17569944 [0,1,0,0,0,0|2,0,1]=4 1910 B8R0.6 COCCCC(Cl)CCl Amb25765569 [0,1,0,0,0,0|2,0,1]=4 1911 B8R0.6 COCCCC(N)=NN Amb25739824 [0,1,0,0,0,0|3,0,0]=4 1912 B8R0.6 COCCCC(NC)C Amb17569939 [0,1,0,0,0,0|2,0,1]=4 1913 B8R0.6 COCCCC(O)C=O Amb25792325 [0,1,0,0,0,0|2,0,1]=4 1914 B8R0.6 COCCCC(O)CCl Amb24594734 [0,1,0,0,0,0|1,0,2]=4 1915 B8R0.6 COCCNC(=O)C#N Amb25084589 [0,1,0,0,0,0|2,0,1]=4 1916 B8R0.6 COCCNC(=O)CBr Amb2090677 [0,1,0,0,0,0|2,0,0]=3 1917 B8R0.6 COCCNC(=O)CCl Amb1151070 [0,1,0,0,0,0|2,0,0]=3 1918 B8R0.6 COCCNC(=O)CN Amb1155607 [0,1,0,0,0,0|2,0,0]=3 1919 B8R0.6 COCCNC(=O)CN Amb19515050 [0,1,0,0,0,0|2,0,0]=3 1920 B8R0.6 COCCNC(=O)NC Amb2132783 [0,1,0,0,0,0|2,0,0]=3 1921 B8R0.6 COCCOC(=O)CBr Amb18602737 [0,1,0,0,0,0|2,0,0]=3 1922 B8R0.6 COCCOC(=O)CCl Amb18090807 [0,1,0,0,0,0|2,0,0]=3 1923 B8R0.6 COCCOC(=O)NC Amb24598834 [0,1,0,0,0,0|2,0,0]=3 1924 B8R0.6 COCCSC(=S)OC Amb25355506 [0,1,0,0,0,0|2,1,0]=4 1925 B8R0.6 COCOCC(=C)CO Amb24647254 [0,1,0,0,0,0|3,0,0]=4 1926 B8R0.6 COCOCC(=O)CC Amb24588919 [0,1,0,0,0,0|2,0,0]=3 1927 B8R0.6 COCOCC(=O)CCl Amb25106927 [0,1,0,0,0,0|2,0,0]=3 1928 B8R0.6 CSC(=O)NCCCO Amb24680355 [0,1,0,0,0,0|2,0,0]=3 1929 B8R0.6 CSC(=S)CCCCCl Amb25162182 [0,1,0,0,0,0|1,1,0]=3 1930 B8R0.6 CSC(=S)NCCCN Amb24737210 [0,1,0,0,0,0|2,1,0]=4 1931 B8R0.6 CSC(=S)NCCCO Amb24333906 [0,1,0,0,0,0|2,1,0]=4 1932 B8R0.6 CSC(=S)NCCCS Amb25696466 [0,1,0,0,0,0|2,1,0]=4 1933 B8R0.6 CSCCCC(=O)NN Amb24618925 [0,1,0,0,0,0|2,0,0]=3 1934 B8R0.6 CSCCCC(=O)NO Amb25805629 [0,1,0,0,0,0|2,0,0]=3 1935 B8R0.6 CSCCCC(C)CCl Amb25333579 [0,1,0,0,0,0|2,0,1]=4 1936 B8R0.6 CSCCCC(N)=NO Amb25324485 [0,1,0,0,0,0|2,0,1]=4 1937 B8R0.6 CSCCCC(N)CN Amb24670821 [0,1,0,0,0,0|2,0,1]=4 1938 B8R0.6 CSCCCC(O)CN Amb25809175 [0,1,0,0,0,0|1,0,2]=4 1939 B8R0.6 CSCCCN(C)C#N Amb25683634 [0,1,0,0,0,0|3,0,0]=4 1940 B8R0.6 CSCCCN(C)C=O Amb25784553 [0,1,0,0,0,0|2,0,0]=3 1941 B8R0.6 CSCCNC(=O)C#C Amb25758097 [0,1,0,0,0,0|2,0,1]=4 1942 B8R0.6 CSCCNC(=O)CBr Amb17324267 [0,1,0,0,0,0|2,0,0]=3 1943 B8R0.6 CSCCNC(=O)CN Amb24700731 [0,1,0,0,0,0|2,0,0]=3 1944 B8R0.6 CSCCOC(=O)C=C Amb17940077 [0,1,0,0,0,0|2,0,1]=4 1945 B8R0.6 CSCCOC(=O)CBr Amb24480366 [0,1,0,0,0,0|2,0,0]=3 1946 B8R0.6 CSCCOC(=O)CN Amb24386088 [0,1,0,0,0,0|2,0,0]=3 1947 B8R0.6 CSCCSC(=S)OC Amb25334460 [0,1,0,0,0,0|2,1,0]=4 1948 B8R0.6 CSCSCC(=O)NC Amb24516247 [0,1,0,0,0,0|2,0,0]=3 1949 B8R0.6 CSCSCC(=O)OC Amb25162165 [0,1,0,0,0,0|2,0,0]=3 1950 B8R0.6 CSCSCC(C)=CCl Amb25370145 [0,1,0,0,0,0|3,0,0]=4 1951 B8R0.6 C[C@@H](CCCCBr)C=C Amb24432223 [0,1,0,0,0,0|2,0,1]=4 1952 B8R0.6 C[C@H](CCCCO)CO Amb24407518 [0,1,0,0,0,0|1,0,2]=4 1953 B8R0.6 C[ClH]C(=O)CCCCBr Amb25242949 [0,1,0,0,0,0|1,0,0]=2 1954 B8R0.6 C\C(\C=C)=C\CCCO Amb24577088 [0,1,0,0,0,0|2,0,1]=4 1955 B8R0.6 C\C(\C=O)=C/CCC#C Amb25778083 [0,1,0,0,0,0|0,0,3]=4 1956 B8R0.6 C\C(\C=O)=C\CCC#C Amb25810816 [0,1,0,0,0,0|0,0,3]=4 1957 B8R0.6 C\C(\CBr)=C/CCCCl Amb25858000 [0,1,0,0,0,0|2,0,1]=4 1958 B8R0.6 C\C(\CO)=C/CCCN Amb24555629 [0,1,0,0,0,0|1,0,2]=4 1959 B8R0.6 C\C(\CO)=C\CCCBr Amb25288077 [0,1,0,0,0,0|1,0,2]=4 1960 B8R0.6 C\C=C\CCC(=O)C=C Amb25179659 [0,1,0,0,0,0|0,0,3]=4 1961 B8R0.6 C\C=C\CCC(=O)NC Amb25339401 [0,1,0,0,0,0|0,0,2]=3 1962 B8R0.6 C\C=C\CCC(=S)NC Amb24744454 [0,1,0,0,0,0|0,1,2]=4 1963 B8R0.6 C\C=C\CCC(C)C=O Amb24512913 [0,1,0,0,0,0|0,0,3]=4 1964 B8R0.6 C\C=C\CNC(=O)CBr Amb25347129 [0,1,0,0,0,0|1,0,2]=4 1965 B8R0.6 C\C=C\CNC(=O)CCl Amb24736998 [0,1,0,0,0,0|1,0,2]=4 1966 B8R0.6 C\C=C\CNC(=O)CN Amb24536460 [0,1,0,0,0,0|1,0,2]=4 1967 B8R0.6 C\C=C\COC(=O)CBr Amb25109230 [0,1,0,0,0,0|1,0,2]=4 1968 B8R0.6 C\C=C\COC(=O)CC Amb22347674 [0,1,0,0,0,0|1,0,2]=4 1969 B8R0.6 C\C=C\COC(=O)CN Amb24670444 [0,1,0,0,0,0|1,0,2]=4 1970 B8R0.6 C\C=C\CSC(=O)NC Amb24612366 [0,1,0,0,0,0|1,0,2]=4 1971 B8R0.6 ClCC(Cl)CCCCBr Amb24063181 [0,1,0,0,0,0|2,0,1]=4 1972 B8R0.6 ClCCCCC(Cl)CCl Amb24429183 [0,1,0,0,0,0|2,0,1]=4 1973 B8R0.6 ClCCCNC(=O)CCl Amb2125567 [0,1,0,0,0,0|2,0,0]=3 1974 B8R0.6 F\C=C(\F)/CCCCBr Amb25180560 [0,1,0,0,0,0|2,0,1]=4 1975 B8R0.6 N#CCCCC(=O)CS Amb24378946 [0,1,0,0,0,0|1,0,1]=3 1976 B8R0.6 N#CCCNC(=O)CBr Amb25724742 [0,1,0,0,0,0|2,0,1]=4 1977 B8R0.6 N#CCCOC(=O)CCl Amb24442379 [0,1,0,0,0,0|2,0,1]=4 1978 B8R0.6 NC(CCCCO)=NO Amb25250686 [0,1,0,0,0,0|2,0,1]=4 1979 B8R0.6 NC(CO)CCCCF Amb24689590 [0,1,0,0,0,0|2,0,1]=4 1980 B8R0.6 NCC(=O)NCCCF Amb24659357 [0,1,0,0,0,0|2,0,0]=3 1981 B8R0.6 NCC(=O)NCCCO Amb21953700 [0,1,0,0,0,0|2,0,0]=3 1982 B8R0.6 NCC(=O)OCCC#N Amb25146025 [0,1,0,0,0,0|2,0,1]=4 1983 B8R0.6 NCCCCC(=O)NN Amb18061874 [0,1,0,0,0,0|2,0,0]=3 1984 B8R0.6 NCCCCC(=O)NO Amb24333337 [0,1,0,0,0,0|2,0,0]=3 1985 B8R0.6 NCCCCC(=O)OC Amb13951283 [0,1,0,0,0,0|1,0,0]=2 1986 B8R0.6 NCCCCC(N)CBr Amb24480286 [0,1,0,0,0,0|2,0,1]=4 1987 B8R0.6 NCCCCC(N)CF Amb24746288 [0,1,0,0,0,0|2,0,1]=4 1988 B8R0.6 NCCCCC(O)CN Amb25237523 [0,1,0,0,0,0|1,0,2]=4 1989 B8R0.6 NCCCCC(O)CO Amb25146035 [0,1,0,0,0,0|1,0,2]=4 1990 B8R0.6 NCCCCC(OC)C Amb17569941 [0,1,0,0,0,0|1,0,2]=4 1991 B8R0.6 NCCCC[C@@H](N)CO Amb22745902 [0,1,0,0,0,0|2,0,1]=4 1992 B8R0.6 NCCCC[C@@H](N)CO Amb22899644 [0,1,0,0,0,0|2,0,1]=4 1993 B8R0.6 NCCCC[C@@H](N)CO Amb22899645 [0,1,0,0,0,0|2,0,1]=4 1994 B8R0.6 NCCCC[C@@H](N)CS Amb25303104 [0,1,0,0,0,0|2,0,1]=4 1995 B8R0.6 NCCCC[C@H](N)CBr Amb24557770 [0,1,0,0,0,0|2,0,1]=4 1996 B8R0.6 NCCCNC(=O)CCl Amb19011378 [0,1,0,0,0,0|2,0,0]=3 1997 B8R0.6 NCCCNC(=O)CN Amb19011430 [0,1,0,0,0,0|2,0,0]=3 1998 B8R0.6 NCCSCC(=O)NN Amb25132244 [0,1,0,0,0,0|3,0,0]=4 1999 B8R0.6 NNC(=O)CNCCO Amb18115220 [0,1,0,0,0,0|3,0,0]=4 2000 B8R0.6 NNC(=O)COCCO Amb24674170 [0,1,0,0,0,0|3,0,0]=4 2001 B8R0.6 NNC(=O)OCCCO Amb24365593 [0,1,0,0,0,0|3,0,0]=4 2002 B8R0.6 N[C@@H](CCCCO)CO Amb25146173 [0,1,0,0,0,0|2,0,1]=4 2003 B8R0.6 O=C(CBr)CCCCCl Amb25339355 [0,1,0,0,0,0|1,0,0]=2 2004 B8R0.6 O=C(CBr)NOCCF Amb22896512 [0,1,0,0,0,0|3,0,0]=4 2005 B8R0.6 O=C(CBr)OCCCCl Amb25117915 [0,1,0,0,0,0|2,0,0]=3 2006 B8R0.6 O=C(CCl)NCCCBr Amb25766846 [0,1,0,0,0,0|2,0,0]=3 2007 B8R0.6 O=C(CS)NCCCS Amb24393457 [0,1,0,0,0,0|2,0,0]=3 2008 B8R0.6 O=CCCCC(=O)C=O Amb25093725 [0,1,0,0,0,0|1,0,2]=4 2009 B8R0.6 O=CCCOC(=O)CBr Amb24727827 [0,1,0,0,0,0|2,0,1]=4 2010 B8R0.6 OCC(F)CCCCCl Amb24480364 [0,1,0,0,0,0|2,0,1]=4 2011 B8R0.6 OCCCCC(=O)NC Amb17231874 [0,1,0,0,0,0|1,0,0]=2 2012 B8R0.6 OCCCCC(CO)N Amb17593402 [0,1,0,0,0,0|2,0,1]=4 2013 B8R0.6 OCCCCC(Cl)CCl Amb24443036 [0,1,0,0,0,0|2,0,1]=4 2014 B8R0.6 OCCCCC(F)CBr Amb25708352 [0,1,0,0,0,0|2,0,1]=4 2015 B8R0.6 OCCCCC(NC)C Amb17569927 [0,1,0,0,0,0|2,0,1]=4 2016 B8R0.6 OCCCC[C@@H](O)CO Amb25800817 [0,1,0,0,0,0|1,0,2]=4 2017 B8R0.6 OCCCNC(=O)CBr Amb17329705 [0,1,0,0,0,0|2,0,0]=3 2018 B8R0.6 OCCCNC(=O)CS Amb24671061 [0,1,0,0,0,0|2,0,0]=3 2019 B8R0.6 OCCCOC(=O)CBr Amb25300340 [0,1,0,0,0,0|2,0,0]=3 2020 B8R0.6 OCCNNC(=O)CO Amb25823052 [0,1,0,0,0,0|3,0,0]=4 2021 B8R0.6 OCCOCC(=O)CO Amb25357331 [0,1,0,0,0,0|2,0,0]=3 2022 B8R0.6 OCCSCC(=O)C=O Amb25857344 [0,1,0,0,0,0|2,0,1]=4 2023 B8R0.6 OC[C@@H](F)CCCCCl Amb25068378 [0,1,0,0,0,0|2,0,1]=4 2024 B8R0.6 [C-]#[N+]CCNC(=O)OC Amb24728450 [0,1,0,0,0,0|2,0,1]=4 2025 B8R0.6 [C-]#[N+]CC\N=C(/C)\C=O Amb25735792 [0,1,0,0,0,0|2,0,1]=4 2026 B8R0.7 BrCCCCCC(=O)O Amb2081955 [0,1,0,0,0,0|1,0,0]=2 2027 B8R0.7 BrCCCCCC(C)C Amb16231055 [0,1,0,0,0,0|1,0,1]=3 2028 B8R0.7 C#CCCCCC(N)=N Amb24569257 [0,1,0,0,0,0|2,0,1]=4 2029 B8R0.7 C#CCCCCC(N)=O Amb25112030 [0,1,0,0,0,0|1,0,1]=3 2030 B8R0.7 C#CCCCNC(N)=O Amb25682160 [0,1,0,0,0,0|1,0,2]=4 2031 B8R0.7 C#CCCNCC(N)=O Amb25362968 [0,1,0,0,0,0|1,0,2]=4 2032 B8R0.7 C=C(Br)CNCCCN Amb18330318 [0,1,0,0,0,0|2,0,1]=4 2033 B8R0.7 C=C(Br)CNCCCO Amb19051448 [0,1,0,0,0,0|2,0,1]=4 2034 B8R0.7 C=C(Br)COCCCN Amb18324685 [0,1,0,0,0,0|2,0,1]=4 2035 B8R0.7 C=C(Br)COCCCO Amb24534702 [0,1,0,0,0,0|2,0,1]=4 2036 B8R0.7 C=C(Cl)CNCCCN Amb25180017 [0,1,0,0,0,0|2,0,1]=4 2037 B8R0.7 C=C(Cl)CNCCCO Amb25363015 [0,1,0,0,0,0|2,0,1]=4 2038 B8R0.7 C=C(Cl)COCCCO Amb25240270 [0,1,0,0,0,0|2,0,1]=4 2039 B8R0.7 C=C(Cl)CSCCCN Amb25094992 [0,1,0,0,0,0|2,0,1]=4 2040 B8R0.7 C=CCCCCC(=O)Cl Amb24528269 [0,1,0,0,0,0|1,0,1]=3 2041 B8R0.7 C=CCCCCC(N)=N Amb24622060 [0,1,0,0,0,0|2,0,1]=4 2042 B8R0.7 C=CCCCNC(N)=O Amb25834820 [0,1,0,0,0,0|1,0,2]=4 2043 B8R0.7 C=CCCNCC(N)=O Amb25746697 [0,1,0,0,0,0|1,0,2]=4 2044 B8R0.7 C=CCCNCC(O)=O Amb25308652 [0,1,0,0,0,0|1,0,2]=4 2045 B8R0.7 C=CCCOCC(N)=O Amb24502598 [0,1,0,0,0,0|1,0,2]=4 2046 B8R0.7 C=CCNCCC(N)=O Amb19960043 [0,1,0,0,0,0|1,0,2]=4 2047 B8R0.7 C=CCSCCC(N)=O Amb25828040 [0,1,0,0,0,0|1,0,2]=4 2048 B8R0.7 C=CNCCCC(O)=O Amb25146209 [0,1,0,0,0,0|1,0,2]=4 2049 B8R0.7 CC#CCCCC(C)=O Amb24591411 [0,1,0,0,0,0|0,0,1]=2 2050 B8R0.7 CC#CCCCC(C)Br Amb24360313 [0,1,0,0,0,0|1,0,2]=4 2051 B8R0.7 CC#CCCCC(C)Cl Amb24427469 [0,1,0,0,0,0|1,0,2]=4 2052 B8R0.7 CC#CCCCC(C)O Amb25280700 [0,1,0,0,0,0|0,0,3]=4 2053 B8R0.7 CC#CCCC[C@H](C)O Amb25794779 [0,1,0,0,0,0|0,0,3]=4 2054 B8R0.7 CC#CCCNC(N)=O Amb25829038 [0,1,0,0,0,0|1,0,2]=4 2055 B8R0.7 CC#CCCOC(N)=O Amb24658255 [0,1,0,0,0,0|1,0,2]=4 2056 B8R0.7 CC#CCNCC(N)=O Amb24759029 [0,1,0,0,0,0|1,0,2]=4 2057 B8R0.7 CC#CCOCC(C)=O Amb25112537 [0,1,0,0,0,0|0,0,2]=3 2058 B8R0.7 CC#CCSCC(C)=C Amb25217461 [0,1,0,0,0,0|1,0,2]=4 2059 B8R0.7 CC#CCSCC(O)=O Amb19021078 [0,1,0,0,0,0|1,0,2]=4 2060 B8R0.7 CC(=C)C#CCCCCl Amb24606806 [0,1,0,0,0,0|1,0,2]=4 2061 B8R0.7 CC(=C)CC#CCCO Amb24642389 [0,1,0,0,0,0|1,0,2]=4 2062 B8R0.7 CC(=C)CCC#CCBr Amb25295499 [0,1,0,0,0,0|1,0,2]=4 2063 B8R0.7 CC(=C)CCCCCN Amb24481805 [0,1,0,0,0,0|1,0,0]=2 2064 B8R0.7 CC(=C)CCNCCF Amb25315419 [0,1,0,0,0,0|2,0,0]=3 2065 B8R0.7 CC(=C)CCNCCN Amb24481806 [0,1,0,0,0,0|2,0,0]=3 2066 B8R0.7 CC(=C)CCNCCO Amb25189006 [0,1,0,0,0,0|2,0,0]=3 2067 B8R0.7 CC(=C)CCOCC#N Amb25304924 [0,1,0,0,0,0|2,0,1]=4 2068 B8R0.7 CC(=C)CCOCC=O Amb25275299 [0,1,0,0,0,0|2,0,1]=4 2069 B8R0.7 CC(=C)CCOCCCl Amb24684688 [0,1,0,0,0,0|2,0,0]=3 2070 B8R0.7 CC(=C)CCOCCS Amb25331620 [0,1,0,0,0,0|2,0,0]=3 2071 B8R0.7 CC(=C)CC\C=C\CBr Amb25756024 [0,1,0,0,0,0|1,0,2]=4 2072 B8R0.7 CC(=C)CC\C=C\CCl Amb24514925 [0,1,0,0,0,0|1,0,2]=4 2073 B8R0.7 CC(=C)CC\C=C\CO Amb25245055 [0,1,0,0,0,0|1,0,2]=4 2074 B8R0.7 CC(=C)COCCC=O Amb18642652 [0,1,0,0,0,0|2,0,1]=4 2075 B8R0.7 CC(=C)COCCCO Amb25185310 [0,1,0,0,0,0|2,0,0]=3 2076 B8R0.7 CC(=C)CSCCC=C Amb24529074 [0,1,0,0,0,0|1,0,2]=4 2077 B8R0.7 CC(=C)CSCCCF Amb24424364 [0,1,0,0,0,0|2,0,0]=3 2078 B8R0.7 CC(=C)\C=C\CCCBr Amb25264506 [0,1,0,0,0,0|1,0,2]=4 2079 B8R0.7 CC(=C)\C=C\CCCO Amb25266398 [0,1,0,0,0,0|1,0,2]=4 2080 B8R0.7 CC(=N)NCCCCF Amb24528163 [0,1,0,0,0,0|2,0,0]=3 2081 B8R0.7 CC(=N)NCCCCN Amb25716162 [0,1,0,0,0,0|2,0,0]=3 2082 B8R0.7 CC(=O)CCCC=C=C Amb24620056 [0,1,0,0,0,0|0,0,2]=3 2083 B8R0.7 CC(=O)CCCCC#C Amb25303675 [0,1,0,0,0,0|0,0,1]=2 2084 B8R0.7 CC(=O)CCCCC#N Amb18642300 [0,1,0,0,0,0|0,0,1]=2 2085 B8R0.7 CC(=O)CCCCC=C Amb24546961 [0,1,0,0,0,0|0,0,1]=2 2086 B8R0.7 CC(=O)CCCCC=O Amb18642609 [0,1,0,0,0,0|0,0,1]=2 2087 B8R0.7 CC(=O)CCCCCF Amb25373197 [0,1,0,0,0,0|0,0,0]=1 2088 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,1,0,0,0,0|0,0,0]=1 2089 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,1,0,0,0,0|0,0,0]=1 2090 B8R0.7 CC(=O)CCNCC=C Amb18642536 [0,1,0,0,0,0|0,0,2]=3 2091 B8R0.7 CC(=O)CCNCCO Amb24481900 [0,1,0,0,0,0|1,0,0]=2 2092 B8R0.7 CC(=O)CCOCCN Amb18628609 [0,1,0,0,0,0|1,0,0]=2 2093 B8R0.7 CC(=O)CCOCCO Amb24691100 [0,1,0,0,0,0|1,0,0]=2 2094 B8R0.7 CC(=O)CCSCC#N Amb18927970 [0,1,0,0,0,0|1,0,1]=3 2095 B8R0.7 CC(=O)CC\C=C/C=C Amb24736163 [0,1,0,0,0,0|0,0,3]=4 2096 B8R0.7 CC(=O)CC\C=C/CBr Amb24480047 [0,1,0,0,0,0|0,0,2]=3 2097 B8R0.7 CC(=O)CC\C=C\C#C Amb24633380 [0,1,0,0,0,0|0,0,3]=4 2098 B8R0.7 CC(=O)CC\C=C\C#N Amb18642112 [0,1,0,0,0,0|0,0,3]=4 2099 B8R0.7 CC(=O)CC\C=C\C=C Amb24686743 [0,1,0,0,0,0|0,0,3]=4 2100 B8R0.7 CC(=O)CC\C=C\CBr Amb24650377 [0,1,0,0,0,0|0,0,2]=3 2101 B8R0.7 CC(=O)CC\C=C\CO Amb24614693 [0,1,0,0,0,0|0,0,2]=3 2102 B8R0.7 CC(=O)COCCC#N Amb24357135 [0,1,0,0,0,0|1,0,1]=3 2103 B8R0.7 CC(=O)COCCCF Amb24696366 [0,1,0,0,0,0|1,0,0]=2 2104 B8R0.7 CC(=O)COCCCN Amb18630475 [0,1,0,0,0,0|1,0,0]=2 2105 B8R0.7 CC(=O)CSCCC=C Amb24481903 [0,1,0,0,0,0|0,0,2]=3 2106 B8R0.7 CC(=O)CSC\C=C\Cl Amb24748154 [0,1,0,0,0,0|1,0,2]=4 2107 B8R0.7 CC(=O)C\C=C/CC=C Amb24584479 [0,1,0,0,0,0|0,0,3]=4 2108 B8R0.7 CC(=O)C\C=C\CCBr Amb24357455 [0,1,0,0,0,0|0,0,2]=3 2109 B8R0.7 CC(=O)C\C=C\CCCl Amb25729220 [0,1,0,0,0,0|0,0,2]=3 2110 B8R0.7 CC(=O)NCC#CCBr Amb24480211 [0,1,0,0,0,0|1,0,2]=4 2111 B8R0.7 CC(=O)NCC#CCO Amb25757314 [0,1,0,0,0,0|1,0,2]=4 2112 B8R0.7 CC(=O)NCCC=C=C Amb24744549 [0,1,0,0,0,0|0,0,3]=4 2113 B8R0.7 CC(=O)NCCCC#C Amb24477716 [0,1,0,0,0,0|0,0,2]=3 2114 B8R0.7 CC(=O)NCCCC=O Amb22896811 [0,1,0,0,0,0|1,0,1]=3 2115 B8R0.7 CC(=O)NCCCCN Amb21520291 [0,1,0,0,0,0|1,0,0]=2 2116 B8R0.7 CC(=O)NCCNC=O Amb25707099 [0,1,0,0,0,0|2,0,1]=4 2117 B8R0.7 CC(=O)NCCSC=C Amb25111499 [0,1,0,0,0,0|1,0,2]=4 2118 B8R0.7 CC(=O)NCCSC=O Amb24670235 [0,1,0,0,0,0|2,0,1]=4 2119 B8R0.7 CC(=O)NCOCC=C Amb25184395 [0,1,0,0,0,0|1,0,2]=4 2120 B8R0.7 CC(=O)NC\C=C/CCl Amb25317905 [0,1,0,0,0,0|1,0,2]=4 2121 B8R0.7 CC(=O)NC\C=C\CCl Amb24469942 [0,1,0,0,0,0|1,0,2]=4 2122 B8R0.7 CC(=O)NC\C=C\CN Amb24394531 [0,1,0,0,0,0|1,0,2]=4 2123 B8R0.7 CC(=O)NC\C=C\CO Amb24476627 [0,1,0,0,0,0|1,0,2]=4 2124 B8R0.7 CC(=O)NNCCCN Amb25726088 [0,1,0,0,0,0|2,0,0]=3 2125 B8R0.7 CC(=O)NOCCC=C Amb25130346 [0,1,0,0,0,0|1,0,2]=4 2126 B8R0.7 CC(=O)OCC#CCCl Amb25778311 [0,1,0,0,0,0|1,0,2]=4 2127 B8R0.7 CC(=O)OCCCCF Amb24393797 [0,1,0,0,0,0|1,0,0]=2 2128 B8R0.7 CC(=O)OCCCCN Amb24657282 [0,1,0,0,0,0|1,0,0]=2 2129 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,1,0,0,0,0|1,0,0]=2 2130 B8R0.7 CC(=O)OCCCCS Amb24431588 [0,1,0,0,0,0|1,0,0]=2 2131 B8R0.7 CC(=O)OCCN=C=O Amb25779227 [0,1,0,0,0,0|2,0,1]=4 2132 B8R0.7 CC(=O)OCCN=C=S Amb24625539 [0,1,0,0,0,0|2,0,1]=4 2133 B8R0.7 CC(=O)OCCOC=C Amb24393798 [0,1,0,0,0,0|1,0,2]=4 2134 B8R0.7 CC(=O)OCCSC#N Amb25829998 [0,1,0,0,0,0|2,0,1]=4 2135 B8R0.7 CC(=O)OCOCCCl Amb25145955 [0,1,0,0,0,0|2,0,0]=3 2136 B8R0.7 CC(=O)OCSCCO Amb24733466 [0,1,0,0,0,0|2,0,0]=3 2137 B8R0.7 CC(=O)O\C=C\CCCl Amb24580407 [0,1,0,0,0,0|1,0,2]=4 2138 B8R0.7 CC(=O)SCC#CCCl Amb24385017 [0,1,0,0,0,0|1,0,2]=4 2139 B8R0.7 CC(=O)SCCCC=O Amb22524698 [0,1,0,0,0,0|1,0,1]=3 2140 B8R0.7 CC(=O)SCCCCBr Amb22641871 [0,1,0,0,0,0|1,0,0]=2 2141 B8R0.7 CC(=O)SCCCCN Amb24117263 [0,1,0,0,0,0|1,0,0]=2 2142 B8R0.7 CC(=O)SCCCCO Amb25049205 [0,1,0,0,0,0|1,0,0]=2 2143 B8R0.7 CC(=O)\C=C/CCC=C Amb25267525 [0,1,0,0,0,0|0,0,3]=4 2144 B8R0.7 CC(=O)\C=C/CCC=O Amb24557160 [0,1,0,0,0,0|0,0,3]=4 2145 B8R0.7 CC(=O)\C=C/NCCCl Amb24477726 [0,1,0,0,0,0|1,0,2]=4 2146 B8R0.7 CC(=O)\C=C\CCC#N Amb18642111 [0,1,0,0,0,0|0,0,3]=4 2147 B8R0.7 CC(=O)\C=C\CCC=O Amb18642401 [0,1,0,0,0,0|0,0,3]=4 2148 B8R0.7 CC(=O)\C=C\CCCBr Amb24480224 [0,1,0,0,0,0|0,0,2]=3 2149 B8R0.7 CC(=O)\C=C\NCCO Amb25146021 [0,1,0,0,0,0|1,0,2]=4 2150 B8R0.7 CC(=O)\C=C\OCCO Amb25318892 [0,1,0,0,0,0|1,0,2]=4 2151 B8R0.7 CC(=O)\C=C\SCCO Amb25116065 [0,1,0,0,0,0|1,0,2]=4 2152 B8R0.7 CC(=S)SCCCCCl Amb25708465 [0,1,0,0,0,0|1,1,0]=3 2153 B8R0.7 CC(Br)=CCCCC=O Amb24541185 [0,1,0,0,0,0|1,0,2]=4 2154 B8R0.7 CC(Br)=CCCCCO Amb24592453 [0,1,0,0,0,0|1,0,1]=3 2155 B8R0.7 CC(C)=C=CCCCN Amb25146200 [0,1,0,0,0,0|1,0,2]=4 2156 B8R0.7 CC(C)=CCCCC=C Amb22347884 [0,1,0,0,0,0|1,0,2]=4 2157 B8R0.7 CC(C)=CCCCC=O Amb18642458 [0,1,0,0,0,0|1,0,2]=4 2158 B8R0.7 CC(C)=CCNCCBr Amb24340225 [0,1,0,0,0,0|2,0,1]=4 2159 B8R0.7 CC(C)=CCOCCN Amb19020763 [0,1,0,0,0,0|2,0,1]=4 2160 B8R0.7 CC(C)=CCOCCO Amb24718314 [0,1,0,0,0,0|2,0,1]=4 2161 B8R0.7 CC(C)=CCSCCCl Amb25797160 [0,1,0,0,0,0|2,0,1]=4 2162 B8R0.7 CC(C)=NNCCCO Amb24380651 [0,1,0,0,0,0|3,0,0]=4 2163 B8R0.7 CC(C)CCCCC#C Amb24628581 [0,1,0,0,0,0|1,0,2]=4 2164 B8R0.7 CC(C)CCCCC#N Amb25079358 [0,1,0,0,0,0|1,0,2]=4 2165 B8R0.7 CC(C)CCCCC=O Amb18642674 [0,1,0,0,0,0|1,0,2]=4 2166 B8R0.7 CC(C)CCCCCN Amb18124327 [0,1,0,0,0,0|1,0,1]=3 2167 B8R0.7 CC(C)CCCCCO Amb22055777 [0,1,0,0,0,0|1,0,1]=3 2168 B8R0.7 CC(C)CCCCCS Amb25809917 [0,1,0,0,0,0|1,0,1]=3 2169 B8R0.7 CC(C)CCCC[Zn]Cl Amb22897836 [0,1,0,0,0,0|2,0,1]=4 2170 B8R0.7 CC(C)CCNCCBr Amb25721799 [0,1,0,0,0,0|2,0,1]=4 2171 B8R0.7 CC(C)CCNCCS Amb24481915 [0,1,0,0,0,0|2,0,1]=4 2172 B8R0.7 CC(C)CCSCCCl Amb24080319 [0,1,0,0,0,0|2,0,1]=4 2173 B8R0.7 CC(C)CCSCCS Amb25360167 [0,1,0,0,0,0|2,0,1]=4 2174 B8R0.7 CC(C)CNCCCF Amb25808343 [0,1,0,0,0,0|2,0,1]=4 2175 B8R0.7 CC(C)CNCCCI Amb25071160 [0,1,0,0,0,0|2,0,1]=4 2176 B8R0.7 CC(C)COCCCO Amb19317273 [0,1,0,0,0,0|2,0,1]=4 2177 B8R0.7 CC(C)CSCCCF Amb25720971 [0,1,0,0,0,0|2,0,1]=4 2178 B8R0.7 CC(C)NCCCCBr Amb18130023 [0,1,0,0,0,0|2,0,1]=4 2179 B8R0.7 CC(C)NCCCCI Amb24374889 [0,1,0,0,0,0|2,0,1]=4 2180 B8R0.7 CC(C)OCCCCCl Amb18181677 [0,1,0,0,0,0|2,0,1]=4 2181 B8R0.7 CC(C)OCCCCO Amb24704996 [0,1,0,0,0,0|2,0,1]=4 2182 B8R0.7 CC(C)SCCCCCl Amb18798740 [0,1,0,0,0,0|2,0,1]=4 2183 B8R0.7 CC(Cl)CCCCC=O Amb18643832 [0,1,0,0,0,0|1,0,2]=4 2184 B8R0.7 CC(Cl)CCCCCBr Amb25677474 [0,1,0,0,0,0|1,0,1]=3 2185 B8R0.7 CC(Cl)CCNCCF Amb24391977 [0,1,0,0,0,0|2,0,1]=4 2186 B8R0.7 CC(Cl)CCOCCBr Amb24350524 [0,1,0,0,0,0|2,0,1]=4 2187 B8R0.7 CC(F)CCOCCN Amb25178805 [0,1,0,0,0,0|2,0,1]=4 2188 B8R0.7 CC(F)CCSCCO Amb24475537 [0,1,0,0,0,0|2,0,1]=4 2189 B8R0.7 CC(F)COCCCN Amb24574356 [0,1,0,0,0,0|2,0,1]=4 2190 B8R0.7 CC(N)=NCCCC#C Amb25169218 [0,1,0,0,0,0|1,0,2]=4 2191 B8R0.7 CC(N)=NCCCC#N Amb25852379 [0,1,0,0,0,0|2,0,1]=4 2192 B8R0.7 CC(N)CCCCC#C Amb25147187 [0,1,0,0,0,0|1,0,2]=4 2193 B8R0.7 CC(N)CCCCC=C Amb22059559 [0,1,0,0,0,0|1,0,2]=4 2194 B8R0.7 CC(N)CCCCCBr Amb24419034 [0,1,0,0,0,0|1,0,1]=3 2195 B8R0.7 CC(N)CCCCCN Amb24401531 [0,1,0,0,0,0|1,0,1]=3 2196 B8R0.7 CC(N)CCCCCO Amb24386350 [0,1,0,0,0,0|1,0,1]=3 2197 B8R0.7 CC(N)CCNCCF Amb25260664 [0,1,0,0,0,0|2,0,1]=4 2198 B8R0.7 CC(N)CCNCCN Amb25757439 [0,1,0,0,0,0|2,0,1]=4 2199 B8R0.7 CC(N)CCSCCN Amb25707301 [0,1,0,0,0,0|2,0,1]=4 2200 B8R0.7 CC(N)CNCCCN Amb25052107 [0,1,0,0,0,0|2,0,1]=4 2201 B8R0.7 CC(O)CCCCC=C Amb25724721 [0,1,0,0,0,0|0,0,3]=4 2202 B8R0.7 CC(O)CCCCC=O Amb25366189 [0,1,0,0,0,0|0,0,3]=4 2203 B8R0.7 CC(O)CCCCCN Amb24761457 [0,1,0,0,0,0|0,0,2]=3 2204 B8R0.7 CC(O)CCNCCO Amb25274565 [0,1,0,0,0,0|1,0,2]=4 2205 B8R0.7 CC(O)CCSCCN Amb25347026 [0,1,0,0,0,0|1,0,2]=4 2206 B8R0.7 CC(O)CNCCCS Amb24524151 [0,1,0,0,0,0|1,0,2]=4 2207 B8R0.7 CC(O)COCCCO Amb25266204 [0,1,0,0,0,0|1,0,2]=4 2208 B8R0.7 CC(O)CSCCCN Amb25188929 [0,1,0,0,0,0|1,0,2]=4 2209 B8R0.7 CC(O)CSCCCO Amb25188928 [0,1,0,0,0,0|1,0,2]=4 2210 B8R0.7 CC(S)CNCCCN Amb25146055 [0,1,0,0,0,0|1,1,1]=4 2211 B8R0.7 CC(S)CSCCCO Amb24532907 [0,1,0,0,0,0|1,1,1]=4 2212 B8R0.7 CCC#CCCC(C)C Amb22230156 [0,1,0,0,0,0|1,0,2]=4 2213 B8R0.7 CCCC#CCC(=O)O Amb17593307 [0,1,0,0,0,0|1,0,1]=3 2214 B8R0.7 CCCC/C=C/C(O)=O Amb17778752 [0,1,0,0,0,0|1,0,1]=3 2215 B8R0.7 CCCC/C=C/C([O-])=O Amb17778116 [0,1,0,0,0,0|1,0,1]=3 2216 B8R0.7 CCCC=C=CC(C)=O Amb24061645 [0,1,0,0,0,0|0,0,2]=3 2217 B8R0.7 CCCC=C=CC(N)=O Amb25307861 [0,1,0,0,0,0|1,0,2]=4 2218 B8R0.7 CCCC=C=CC(O)=O Amb24407382 [0,1,0,0,0,0|1,0,2]=4 2219 B8R0.7 CCCC=NNC(N)=O Amb25690939 [0,1,0,0,0,0|2,0,1]=4 2220 B8R0.7 CCCCC#CC(=O)C Amb17593278 [0,1,0,0,0,0|0,0,1]=2 2221 B8R0.7 CCCCC#CC(C)Cl Amb25065847 [0,1,0,0,0,0|1,0,2]=4 2222 B8R0.7 CCCCC#C[C@H](C)O Amb25333630 [0,1,0,0,0,0|0,0,3]=4 2223 B8R0.7 CCCCCC=C(C)C Amb22730264 [0,1,0,0,0,0|1,0,0]=2 2224 B8R0.7 CCCCCC=C(F)F Amb10840486 [0,1,0,0,0,0|2,0,0]=3 2225 B8R0.7 CCCCCCB(F)F Amb24621934 [0,1,0,0,0,0|3,0,0]=4 2226 B8R0.7 CCCCCCC(Cl)Cl Amb17672867 [0,1,0,0,0,0|2,0,1]=4 2227 B8R0.7 CCCCCCC(N)O Amb25368398 [0,1,0,0,0,0|1,0,2]=4 2228 B8R0.7 CCCCCCC([O-])=O Amb22729026 [0,1,0,0,0,0|1,0,0]=2 2229 B8R0.7 CCCCCCP(Cl)Cl Amb23595443 [0,1,0,0,0,0|3,0,0]=4 2230 B8R0.7 CCCCCCS(O)=O Amb25213753 [0,1,0,0,0,0|2,0,0]=3 2231 B8R0.7 CCCCCC[C@@H](C)Cl Amb25322077 [0,1,0,0,0,0|1,0,1]=3 2232 B8R0.7 CCCCCC[C@H](C)Cl Amb25691447 [0,1,0,0,0,0|1,0,1]=3 2233 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [0,1,0,0,0,0|2,0,0]=3 2234 B8R0.7 CCCCCC[SiH](C)C Amb19893898 [0,1,0,0,0,0|1,1,0]=3 2235 B8R0.7 CCCCCC[SiH](Cl)Cl Amb22733063 [0,1,0,0,0,0|2,1,0]=4 2236 B8R0.7 CCCCCNC(=O)Cl Amb25087634 [0,1,0,0,0,0|1,0,0]=2 2237 B8R0.7 CCCCCNC(C)=O Amb17797593 [0,1,0,0,0,0|0,0,0]=1 2238 B8R0.7 CCCCCNC(C)=S Amb24364558 [0,1,0,0,0,0|0,1,0]=2 2239 B8R0.7 CCCCCNC(N)=N Amb19416708 [0,1,0,0,0,0|2,0,0]=3 2240 B8R0.7 CCCCCNC(S)=S Amb25032265 [0,1,0,0,0,0|1,1,0]=3 2241 B8R0.7 CCCCCNN(C)C Amb25094847 [0,1,0,0,0,0|2,0,0]=3 2242 B8R0.7 CCCCCOB(O)O Amb24716868 [0,1,0,0,0,0|2,0,1]=4 2243 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [0,1,0,0,0,0|1,0,0]=2 2244 B8R0.7 CCCCCOC(C)=O Amb22351262 [0,1,0,0,0,0|0,0,0]=1 2245 B8R0.7 CCCCCOC(C)Cl Amb25074170 [0,1,0,0,0,0|1,0,1]=3 2246 B8R0.7 CCCCCOC([S-])=S Amb22334083 [0,1,0,0,0,0|1,1,0]=3 2247 B8R0.7 CCCCCOS(O)=O Amb22730504 [0,1,0,0,0,0|2,0,0]=3 2248 B8R0.7 CCCCCO[N+]([O-])=O Amb22729008 [0,1,0,0,0,0|2,0,0]=3 2249 B8R0.7 CCCCCSC(N)=N Amb20675976 [0,1,0,0,0,0|2,0,0]=3 2250 B8R0.7 CCCCCSC(N)=N Amb23590643 [0,1,0,0,0,0|2,0,0]=3 2251 B8R0.7 CCCCN=CC(C)Cl Amb25731865 [0,1,0,0,0,0|1,0,2]=4 2252 B8R0.7 CCCCNCC(=C)Br Amb1772531 [0,1,0,0,0,0|1,0,1]=3 2253 B8R0.7 CCCCNCC(=C)Br Amb18320824 [0,1,0,0,0,0|1,0,1]=3 2254 B8R0.7 CCCCNCC(=C)C Amb17308646 [0,1,0,0,0,0|1,0,0]=2 2255 B8R0.7 CCCCNCC(=C)Cl Amb25717833 [0,1,0,0,0,0|1,0,1]=3 2256 B8R0.7 CCCCNCC(=O)N Amb1126543 [0,1,0,0,0,0|1,0,0]=2 2257 B8R0.7 CCCCNCC(C)Cl Amb24631280 [0,1,0,0,0,0|1,0,1]=3 2258 B8R0.7 CCCCNCC(C)S Amb18644348 [0,1,0,0,0,0|0,1,1]=3 2259 B8R0.7 CCCCNCC(Cl)Cl Amb25285881 [0,1,0,0,0,0|2,0,1]=4 2260 B8R0.7 CCCCNC[C@@H](C)N Amb25369720 [0,1,0,0,0,0|1,0,1]=3 2261 B8R0.7 CCCCNC[C@@H](C)O Amb25330080 [0,1,0,0,0,0|0,0,2]=3 2262 B8R0.7 CCCCNC[C@H](C)N Amb25334125 [0,1,0,0,0,0|1,0,1]=3 2263 B8R0.7 CCCCNNC(N)=N Amb25105209 [0,1,0,0,0,0|3,0,0]=4 2264 B8R0.7 CCCCNNC(N)=S Amb23590674 [0,1,0,0,0,0|2,1,0]=4 2265 B8R0.7 CCCCNOC(C)C Amb24578023 [0,1,0,0,0,0|2,0,1]=4 2266 B8R0.7 CCCCOCC(=O)Cl Amb25806749 [0,1,0,0,0,0|1,0,0]=2 2267 B8R0.7 CCCCOCC(C)=C Amb22641495 [0,1,0,0,0,0|1,0,0]=2 2268 B8R0.7 CCCCOCN(C)C Amb25798484 [0,1,0,0,0,0|2,0,0]=3 2269 B8R0.7 CCCCOC[C@H](C)O Amb25780304 [0,1,0,0,0,0|0,0,2]=3 2270 B8R0.7 CCCCONC(C)=O Amb25057412 [0,1,0,0,0,0|1,0,0]=2 2271 B8R0.7 CCCCONC(N)=N Amb25041461 [0,1,0,0,0,0|3,0,0]=4 2272 B8R0.7 CCCCSCC(=C)Br Amb25804377 [0,1,0,0,0,0|1,0,1]=3 2273 B8R0.7 CCCCSCC(=C)Cl Amb24403543 [0,1,0,0,0,0|1,0,1]=3 2274 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,1,0,0,0,0|1,0,0]=2 2275 B8R0.7 CCCCSC[C@@H](C)N Amb24711042 [0,1,0,0,0,0|1,0,1]=3 2276 B8R0.7 CCCCSC[C@@H](C)O Amb24644245 [0,1,0,0,0,0|0,0,2]=3 2277 B8R0.7 CCCCSC[C@H](C)O Amb25283172 [0,1,0,0,0,0|0,0,2]=3 2278 B8R0.7 CCCCSNC(N)=O Amb24744550 [0,1,0,0,0,0|2,0,0]=3 2279 B8R0.7 CCCCSSC(N)=N Amb24532843 [0,1,0,0,0,0|3,0,0]=4 2280 B8R0.7 CCCC[Hg]OC(C)=O Amb22360223 [0,1,0,0,0,0|1,0,0]=2 2281 B8R0.7 CCCC\C=C/C(N)=O Amb25839420 [0,1,0,0,0,0|1,0,1]=3 2282 B8R0.7 CCCC\C=C\C(C)=C Amb24559388 [0,1,0,0,0,0|1,0,1]=3 2283 B8R0.7 CCCC\C=C\C(C)=O Amb22043236 [0,1,0,0,0,0|0,0,1]=2 2284 B8R0.7 CCCC\C=C\C(C)C Amb24614606 [0,1,0,0,0,0|1,0,2]=4 2285 B8R0.7 CCCC\C=C\C(C)O Amb22052697 [0,1,0,0,0,0|0,0,3]=4 2286 B8R0.7 CCCC\C=C\C(N)=O Amb24616435 [0,1,0,0,0,0|1,0,1]=3 2287 B8R0.7 CCCNCC=C(C)C Amb24477771 [0,1,0,0,0,0|1,0,1]=3 2288 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,1,0,0,0,0|1,0,0]=2 2289 B8R0.7 CCCNCCC(=S)N Amb17232015 [0,1,0,0,0,0|1,1,0]=3 2290 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,1,0,0,0,0|0,0,0]=1 2291 B8R0.7 CCCNCCC(C)N Amb25778705 [0,1,0,0,0,0|1,0,1]=3 2292 B8R0.7 CCCNCCC(C)O Amb25361918 [0,1,0,0,0,0|0,0,2]=3 2293 B8R0.7 CCCNCCC(F)F Amb20667932 [0,1,0,0,0,0|2,0,1]=4 2294 B8R0.7 CCCNCCC(N)=N Amb24426195 [0,1,0,0,0,0|2,0,0]=3 2295 B8R0.7 CCCNCCC(N)=O Amb19960057 [0,1,0,0,0,0|1,0,0]=2 2296 B8R0.7 CCCNCCC(O)=O Amb18633174 [0,1,0,0,0,0|1,0,0]=2 2297 B8R0.7 CCCNCCN(C)C Amb1131117 [0,1,0,0,0,0|2,0,0]=3 2298 B8R0.7 CCCNCCN(C)C Amb19515715 [0,1,0,0,0,0|2,0,0]=3 2299 B8R0.7 CCCNCCN(C)C Amb22292471 [0,1,0,0,0,0|2,0,0]=3 2300 B8R0.7 CCCNCSC(C)=O Amb25190302 [0,1,0,0,0,0|1,0,0]=2 2301 B8R0.7 CCCNN=CC(C)=O Amb24739997 [0,1,0,0,0,0|1,0,1]=3 2302 B8R0.7 CCCNOCC(N)=O Amb25694035 [0,1,0,0,0,0|2,0,0]=3 2303 B8R0.7 CCCN\C=C/C(C)=O Amb25749455 [0,1,0,0,0,0|0,0,2]=3 2304 B8R0.7 CCCN\C=C\C(C)=O Amb25254846 [0,1,0,0,0,0|0,0,2]=3 2305 B8R0.7 CCCN\N=C\C(C)=O Amb24633726 [0,1,0,0,0,0|1,0,1]=3 2306 B8R0.7 CCCOCCC(Cl)Cl Amb25299432 [0,1,0,0,0,0|2,0,1]=4 2307 B8R0.7 CCCOCCN(C)C Amb24457325 [0,1,0,0,0,0|2,0,0]=3 2308 B8R0.7 CCCOCNC(N)=O Amb24349738 [0,1,0,0,0,0|2,0,0]=3 2309 B8R0.7 CCCOCSC(N)=N Amb25064257 [0,1,0,0,0,0|3,0,0]=4 2310 B8R0.7 CCCON=CC(N)=O Amb25324154 [0,1,0,0,0,0|2,0,1]=4 2311 B8R0.7 CCCONCC(=C)Cl Amb24697743 [0,1,0,0,0,0|2,0,1]=4 2312 B8R0.7 CCCONCC(C)=C Amb25708080 [0,1,0,0,0,0|2,0,0]=3 2313 B8R0.7 CCCONCC(C)O Amb24711848 [0,1,0,0,0,0|1,0,2]=4 2314 B8R0.7 CCCONCC(N)=O Amb24678243 [0,1,0,0,0,0|2,0,0]=3 2315 B8R0.7 CCCONC[C@@H](C)O Amb25349543 [0,1,0,0,0,0|1,0,2]=4 2316 B8R0.7 CCCONC[C@H](C)O Amb25749182 [0,1,0,0,0,0|1,0,2]=4 2317 B8R0.7 CCCO\C=C\C(C)=O Amb24647800 [0,1,0,0,0,0|0,0,2]=3 2318 B8R0.7 CCCO\C=C\C(O)=O Amb18642782 [0,1,0,0,0,0|1,0,2]=4 2319 B8R0.7 CCCSCCC(=S)N Amb17503250 [0,1,0,0,0,0|1,1,0]=3 2320 B8R0.7 CCCSCCC(C)=C Amb25780872 [0,1,0,0,0,0|1,0,0]=2 2321 B8R0.7 CCCSCCC(C)O Amb25773881 [0,1,0,0,0,0|0,0,2]=3 2322 B8R0.7 CCCSCCC(N)=O Amb24333543 [0,1,0,0,0,0|1,0,0]=2 2323 B8R0.7 CCCSCNC(C)=O Amb24681262 [0,1,0,0,0,0|1,0,0]=2 2324 B8R0.7 CCCSCNC(C)C Amb25146129 [0,1,0,0,0,0|2,0,1]=4 2325 B8R0.7 CCCSSCC(O)=O Amb25209982 [0,1,0,0,0,0|2,0,0]=3 2326 B8R0.7 CCCS\C=C/C(O)=O Amb18644291 [0,1,0,0,0,0|1,0,2]=4 2327 B8R0.7 CCCS\C=C/C([O-])=O Amb19816096 [0,1,0,0,0,0|1,0,2]=4 2328 B8R0.7 CCCS\C=C\C(O)=O Amb25051625 [0,1,0,0,0,0|1,0,2]=4 2329 B8R0.7 CCC\C=C\CC(C)=O Amb24736384 [0,1,0,0,0,0|0,0,1]=2 2330 B8R0.7 CCC\C=C\CC(C)N Amb25113454 [0,1,0,0,0,0|1,0,2]=4 2331 B8R0.7 CCC\C=C\CC(N)=O Amb25328428 [0,1,0,0,0,0|1,0,1]=3 2332 B8R0.7 CCC\C=C\CC(O)=O Amb18642602 [0,1,0,0,0,0|1,0,1]=3 2333 B8R0.7 CCC\C=C\C[C@H](C)O Amb24458574 [0,1,0,0,0,0|0,0,3]=4 2334 B8R0.7 CCC\C=C\NC(C)=O Amb25785327 [0,1,0,0,0,0|0,0,2]=3 2335 B8R0.7 CCNCCC=C(C)C Amb18312577 [0,1,0,0,0,0|1,0,1]=3 2336 B8R0.7 CCNCCCC(C)=C Amb24478670 [0,1,0,0,0,0|1,0,0]=2 2337 B8R0.7 CCNCCCC(C)=O Amb24093735 [0,1,0,0,0,0|0,0,0]=1 2338 B8R0.7 CCNCCCC(N)=O Amb24709859 [0,1,0,0,0,0|1,0,0]=2 2339 B8R0.7 CCNCCCN(C)C Amb22284529 [0,1,0,0,0,0|2,0,0]=3 2340 B8R0.7 CCNCCNC(N)=N Amb25265557 [0,1,0,0,0,0|3,0,0]=4 2341 B8R0.7 CCNCCNC(N)=O Amb18312910 [0,1,0,0,0,0|2,0,0]=3 2342 B8R0.7 CCNCCNS(C)=O Amb24647641 [0,1,0,0,0,0|2,0,0]=3 2343 B8R0.7 CCNCCOC(C)=O Amb25313154 [0,1,0,0,0,0|1,0,0]=2 2344 B8R0.7 CCNCCOC(N)=O Amb24402750 [0,1,0,0,0,0|2,0,0]=3 2345 B8R0.7 CCNCCSC(C)C Amb25137637 [0,1,0,0,0,0|2,0,1]=4 2346 B8R0.7 CCNCCSC(N)=N Amb25265150 [0,1,0,0,0,0|3,0,0]=4 2347 B8R0.7 CCOCC#CC(O)=O Amb24409938 [0,1,0,0,0,0|1,0,2]=4 2348 B8R0.7 CCOCCCB(O)O Amb25286037 [0,1,0,0,0,0|2,0,1]=4 2349 B8R0.7 CCOCCCC(C)Br Amb18329738 [0,1,0,0,0,0|1,0,1]=3 2350 B8R0.7 CCOCCCC(C)Cl Amb18792891 [0,1,0,0,0,0|1,0,1]=3 2351 B8R0.7 CCOCCCC(C)O Amb24414472 [0,1,0,0,0,0|0,0,2]=3 2352 B8R0.7 CCOCCCC(N)=O Amb25841206 [0,1,0,0,0,0|1,0,0]=2 2353 B8R0.7 CCOCCNC(C)=O Amb24389255 [0,1,0,0,0,0|1,0,0]=2 2354 B8R0.7 CCOCCNN(C)C Amb25094846 [0,1,0,0,0,0|3,0,0]=4 2355 B8R0.7 CCOCCOC(=O)Cl Amb22228804 [0,1,0,0,0,0|2,0,0]=3 2356 B8R0.7 CCOCCOC(C)Br Amb24563842 [0,1,0,0,0,0|2,0,1]=4 2357 B8R0.7 CCOCCOC(N)=N Amb25327328 [0,1,0,0,0,0|3,0,0]=4 2358 B8R0.7 CCOCCSC(C)C Amb25706742 [0,1,0,0,0,0|2,0,1]=4 2359 B8R0.7 CCOCCSC(N)=N Amb20675990 [0,1,0,0,0,0|3,0,0]=4 2360 B8R0.7 CCOCCSC(N)=N Amb24744421 [0,1,0,0,0,0|3,0,0]=4 2361 B8R0.7 CCOCOCC(O)=O Amb25682215 [0,1,0,0,0,0|2,0,0]=3 2362 B8R0.7 CCOCOC[C@H](C)O Amb25810260 [0,1,0,0,0,0|1,0,2]=4 2363 B8R0.7 CCOCSCC(C)=O Amb24582309 [0,1,0,0,0,0|1,0,0]=2 2364 B8R0.7 CCOCSCC(C)C Amb25681578 [0,1,0,0,0,0|2,0,1]=4 2365 B8R0.7 CCOCSCC(C)N Amb24402491 [0,1,0,0,0,0|2,0,1]=4 2366 B8R0.7 CCOCSCC(O)=O Amb25147004 [0,1,0,0,0,0|2,0,0]=3 2367 B8R0.7 CCOC\C=C\C(C)=O Amb25347398 [0,1,0,0,0,0|0,0,2]=3 2368 B8R0.7 CCOC\C=C\C(O)=O Amb19020649 [0,1,0,0,0,0|1,0,2]=4 2369 B8R0.7 CCONCCC(C)=O Amb24614074 [0,1,0,0,0,0|1,0,0]=2 2370 B8R0.7 CCONCCC(C)O Amb24687129 [0,1,0,0,0,0|1,0,2]=4 2371 B8R0.7 CCSCCCB(O)O Amb24351131 [0,1,0,0,0,0|2,0,1]=4 2372 B8R0.7 CCSCCCC(C)Br Amb24360988 [0,1,0,0,0,0|1,0,1]=3 2373 B8R0.7 CCSCCCC(C)Cl Amb25307915 [0,1,0,0,0,0|1,0,1]=3 2374 B8R0.7 CCSCCCN(C)C Amb25362991 [0,1,0,0,0,0|2,0,0]=3 2375 B8R0.7 CCSCCNC(C)=N Amb24442516 [0,1,0,0,0,0|2,0,0]=3 2376 B8R0.7 CCSCCNC(C)C Amb25267997 [0,1,0,0,0,0|2,0,1]=4 2377 B8R0.7 CCSCCOC(=O)Cl Amb24382779 [0,1,0,0,0,0|2,0,0]=3 2378 B8R0.7 CCSCCOC(C)=O Amb24459072 [0,1,0,0,0,0|1,0,0]=2 2379 B8R0.7 CCSCCSC(C)C Amb24419370 [0,1,0,0,0,0|2,0,1]=4 2380 B8R0.7 CCSCSCC(C)C Amb24632276 [0,1,0,0,0,0|2,0,1]=4 2381 B8R0.7 CCSC\C=C\C(O)=O Amb19020657 [0,1,0,0,0,0|1,0,2]=4 2382 B8R0.7 CC\C=C/CCC(C)=O Amb25691996 [0,1,0,0,0,0|0,0,1]=2 2383 B8R0.7 CC\C=C/CCC(C)N Amb24447019 [0,1,0,0,0,0|1,0,2]=4 2384 B8R0.7 CC\C=C/CCC(N)=O Amb24658221 [0,1,0,0,0,0|1,0,1]=3 2385 B8R0.7 CC\C=C/CCC(O)=O Amb25831265 [0,1,0,0,0,0|1,0,1]=3 2386 B8R0.7 CC\C=C/SCC(C)=O Amb24615236 [0,1,0,0,0,0|0,0,2]=3 2387 B8R0.7 CC\C=C\C=CC(C)=O Amb25258167 [0,1,0,0,0,0|0,0,3]=4 2388 B8R0.7 CC\C=C\C=C\C(C)=O Amb24667251 [0,1,0,0,0,0|0,0,3]=4 2389 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [0,1,0,0,0,0|0,0,1]=2 2390 B8R0.7 CC\C=C\CCC(C)C Amb25811237 [0,1,0,0,0,0|1,0,2]=4 2391 B8R0.7 CC\C=C\CCC(C)O Amb22055975 [0,1,0,0,0,0|0,0,3]=4 2392 B8R0.7 CC\C=C\CCC(O)=O Amb18642608 [0,1,0,0,0,0|1,0,1]=3 2393 B8R0.7 CC\C=C\OCC(C)=O Amb25235223 [0,1,0,0,0,0|0,0,2]=3 2394 B8R0.7 CC\C=C\SCC(O)=O Amb25188909 [0,1,0,0,0,0|1,0,2]=4 2395 B8R0.7 CN(C)CCCCC#C Amb18116187 [0,1,0,0,0,0|2,0,1]=4 2396 B8R0.7 CN(C)CCCCC=O Amb25276429 [0,1,0,0,0,0|2,0,1]=4 2397 B8R0.7 CN(C)CCCCCCl Amb25842969 [0,1,0,0,0,0|2,0,0]=3 2398 B8R0.7 CN(C)CCCCCS Amb25730651 [0,1,0,0,0,0|2,0,0]=3 2399 B8R0.7 CN(C)CCCSCCl Amb25213226 [0,1,0,0,0,0|3,0,0]=4 2400 B8R0.7 CN(C)CCNCCBr Amb21893203 [0,1,0,0,0,0|3,0,0]=4 2401 B8R0.7 CN(C)CCNCCF Amb24428465 [0,1,0,0,0,0|3,0,0]=4 2402 B8R0.7 CN(C)CCNCCI Amb25042285 [0,1,0,0,0,0|3,0,0]=4 2403 B8R0.7 CN(C)CCNCCO Amb22282365 [0,1,0,0,0,0|3,0,0]=4 2404 B8R0.7 CN(C)CCNCCS Amb25824145 [0,1,0,0,0,0|3,0,0]=4 2405 B8R0.7 CN(C)CCOCCBr Amb25855974 [0,1,0,0,0,0|3,0,0]=4 2406 B8R0.7 CN(C)CCOCCCl Amb20668192 [0,1,0,0,0,0|3,0,0]=4 2407 B8R0.7 CN(C)CCOCCCl Amb22059291 [0,1,0,0,0,0|3,0,0]=4 2408 B8R0.7 CN(C)CCOCCN Amb22371058 [0,1,0,0,0,0|3,0,0]=4 2409 B8R0.7 CN(C)CCOCCS Amb24576341 [0,1,0,0,0,0|3,0,0]=4 2410 B8R0.7 CN(C)CCSCCS Amb25188951 [0,1,0,0,0,0|3,0,0]=4 2411 B8R0.7 CN(C)NCCCCF Amb24482005 [0,1,0,0,0,0|3,0,0]=4 2412 B8R0.7 CN(N)CCNCCO Amb25090381 [0,1,0,0,0,0|3,0,0]=4 2413 B8R0.7 CN(N)CCOCCO Amb25680974 [0,1,0,0,0,0|3,0,0]=4 2414 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,1,0,0,0,0|1,0,0]=2 2415 B8R0.7 CNCCCCC(C)=O Amb18642717 [0,1,0,0,0,0|0,0,0]=1 2416 B8R0.7 CNCCCCC(C)C Amb25769955 [0,1,0,0,0,0|1,0,1]=3 2417 B8R0.7 CNCCCCC(C)N Amb24360546 [0,1,0,0,0,0|1,0,1]=3 2418 B8R0.7 CNCCCCC(O)=O Amb24340485 [0,1,0,0,0,0|1,0,0]=2 2419 B8R0.7 CNCCCCC(O)C Amb17569923 [0,1,0,0,0,0|0,0,2]=3 2420 B8R0.7 CNCCCCN(C)C Amb19515495 [0,1,0,0,0,0|2,0,0]=3 2421 B8R0.7 CNCCCCS(C)=O Amb25250841 [0,1,0,0,0,0|1,0,0]=2 2422 B8R0.7 CNCCCN=C(C)C Amb25113072 [0,1,0,0,0,0|2,0,0]=3 2423 B8R0.7 CNCCCNC(C)=O Amb19346187 [0,1,0,0,0,0|1,0,0]=2 2424 B8R0.7 CNCCCNC(C)=S Amb25222760 [0,1,0,0,0,0|1,1,0]=3 2425 B8R0.7 CNCCCNC(C)C Amb20171815 [0,1,0,0,0,0|2,0,1]=4 2426 B8R0.7 CNCCCNC(N)=N Amb25301744 [0,1,0,0,0,0|3,0,0]=4 2427 B8R0.7 CNCCCOC(C)C Amb19374841 [0,1,0,0,0,0|2,0,1]=4 2428 B8R0.7 CNCCCSC(C)=O Amb25197778 [0,1,0,0,0,0|1,0,0]=2 2429 B8R0.7 CNCCCSC(C)C Amb25732203 [0,1,0,0,0,0|2,0,1]=4 2430 B8R0.7 CNCCCSC(N)=N Amb24713893 [0,1,0,0,0,0|3,0,0]=4 2431 B8R0.7 CNCCNCC(O)=O Amb25211792 [0,1,0,0,0,0|2,0,0]=3 2432 B8R0.7 CNCCNN=C(C)C Amb25294482 [0,1,0,0,0,0|3,0,0]=4 2433 B8R0.7 CNCCOCC(=C)Br Amb18324681 [0,1,0,0,0,0|2,0,1]=4 2434 B8R0.7 CNCCOCC(=C)Cl Amb25716286 [0,1,0,0,0,0|2,0,1]=4 2435 B8R0.7 CNCCOCC(C)=O Amb18111838 [0,1,0,0,0,0|1,0,0]=2 2436 B8R0.7 CNCCOCC(C)O Amb25822559 [0,1,0,0,0,0|1,0,2]=4 2437 B8R0.7 CNCCOCC(O)=O Amb18630741 [0,1,0,0,0,0|2,0,0]=3 2438 B8R0.7 CNCCSCC(=C)Br Amb25180138 [0,1,0,0,0,0|2,0,1]=4 2439 B8R0.7 CNCCSCC(C)C Amb25267324 [0,1,0,0,0,0|2,0,1]=4 2440 B8R0.7 COCCCCC(C)Br Amb18329732 [0,1,0,0,0,0|1,0,1]=3 2441 B8R0.7 COCCCCC(C)Cl Amb18180118 [0,1,0,0,0,0|1,0,1]=3 2442 B8R0.7 COCCCCC(C)O Amb25235448 [0,1,0,0,0,0|0,0,2]=3 2443 B8R0.7 COCCCCC(Cl)Cl Amb24480116 [0,1,0,0,0,0|2,0,1]=4 2444 B8R0.7 COCCCCC(N)=N Amb25761704 [0,1,0,0,0,0|2,0,0]=3 2445 B8R0.7 COCCCCC(N)=S Amb25762220 [0,1,0,0,0,0|1,1,0]=3 2446 B8R0.7 COCCCCC(N)C Amb17569945 [0,1,0,0,0,0|1,0,1]=3 2447 B8R0.7 COCCCCN(C)C Amb23510255 [0,1,0,0,0,0|2,0,0]=3 2448 B8R0.7 COCCCNC(=O)N Amb1105274 [0,1,0,0,0,0|2,0,0]=3 2449 B8R0.7 COCCCNC(C)=S Amb25187817 [0,1,0,0,0,0|1,1,0]=3 2450 B8R0.7 COCCCNC(N)=N Amb19515413 [0,1,0,0,0,0|3,0,0]=4 2451 B8R0.7 COCCCNC(N)=N Amb22058724 [0,1,0,0,0,0|3,0,0]=4 2452 B8R0.7 COCCCOC(C)=O Amb22732978 [0,1,0,0,0,0|1,0,0]=2 2453 B8R0.7 COCCCSC(N)=N Amb25046904 [0,1,0,0,0,0|3,0,0]=4 2454 B8R0.7 COCCNCC(=C)Br Amb19051447 [0,1,0,0,0,0|2,0,1]=4 2455 B8R0.7 COCCNCC(=C)C Amb17308973 [0,1,0,0,0,0|2,0,0]=3 2456 B8R0.7 COCCNCC(=C)Cl Amb25235791 [0,1,0,0,0,0|2,0,1]=4 2457 B8R0.7 COCCNCC(=O)N Amb13951972 [0,1,0,0,0,0|2,0,0]=3 2458 B8R0.7 COCCNCC(=S)N Amb17232047 [0,1,0,0,0,0|2,1,0]=4 2459 B8R0.7 COCCNCC(C)Cl Amb25134320 [0,1,0,0,0,0|2,0,1]=4 2460 B8R0.7 COCCNCC(C)N Amb24645044 [0,1,0,0,0,0|2,0,1]=4 2461 B8R0.7 COCCNCC(N)=N Amb25046238 [0,1,0,0,0,0|3,0,0]=4 2462 B8R0.7 COCCNCC(O)=O Amb19514667 [0,1,0,0,0,0|2,0,0]=3 2463 B8R0.7 COCCNC[C@@H](C)O Amb25330006 [0,1,0,0,0,0|1,0,2]=4 2464 B8R0.7 COCCOCC(C)N Amb19375047 [0,1,0,0,0,0|2,0,1]=4 2465 B8R0.7 COCCOC[C@H](C)N Amb25124172 [0,1,0,0,0,0|2,0,1]=4 2466 B8R0.7 COCCONS(C)=O Amb24662909 [0,1,0,0,0,0|3,0,0]=4 2467 B8R0.7 COCCSCC(=C)Br Amb25248642 [0,1,0,0,0,0|2,0,1]=4 2468 B8R0.7 COCCSCC(C)=C Amb25271717 [0,1,0,0,0,0|2,0,0]=3 2469 B8R0.7 COCCSCC(C)N Amb24478624 [0,1,0,0,0,0|2,0,1]=4 2470 B8R0.7 COCCSCC(C)O Amb18179365 [0,1,0,0,0,0|1,0,2]=4 2471 B8R0.7 COCC[Hg]OC(C)=O Amb22734640 [0,1,0,0,0,0|2,0,0]=3 2472 B8R0.7 COCC\C=C\C(O)=O Amb24532833 [0,1,0,0,0,0|1,0,2]=4 2473 B8R0.7 COCOCCC(C)=O Amb25809981 [0,1,0,0,0,0|1,0,0]=2 2474 B8R0.7 COCOCCC(C)O Amb25265793 [0,1,0,0,0,0|1,0,2]=4 2475 B8R0.7 COCSCCC(C)N Amb24366533 [0,1,0,0,0,0|2,0,1]=4 2476 B8R0.7 COC\C=C\CC(C)=O Amb24621937 [0,1,0,0,0,0|0,0,2]=3 2477 B8R0.7 CONCCC=C(C)C Amb22897017 [0,1,0,0,0,0|2,0,1]=4 2478 B8R0.7 CONCCCC(C)C Amb24481636 [0,1,0,0,0,0|2,0,1]=4 2479 B8R0.7 CONCCCC(C)O Amb24361285 [0,1,0,0,0,0|1,0,2]=4 2480 B8R0.7 CONCCCC(O)=O Amb24647348 [0,1,0,0,0,0|2,0,0]=3 2481 B8R0.7 CONCCCN(C)C Amb25355496 [0,1,0,0,0,0|3,0,0]=4 2482 B8R0.7 CS(=O)CCCCC#N Amb25711714 [0,1,0,0,0,0|1,0,1]=3 2483 B8R0.7 CS(=O)CCCCCN Amb25133466 [0,1,0,0,0,0|1,0,0]=2 2484 B8R0.7 CS(=O)CCCCCO Amb25243806 [0,1,0,0,0,0|1,0,0]=2 2485 B8R0.7 CS(=O)CCCNC=O Amb24481711 [0,1,0,0,0,0|2,0,1]=4 2486 B8R0.7 CS(=O)CCNCC#C Amb24465548 [0,1,0,0,0,0|1,0,2]=4 2487 B8R0.7 CS(=O)CCNCC#N Amb25316699 [0,1,0,0,0,0|2,0,1]=4 2488 B8R0.7 CS(=O)CCNCC=C Amb24421806 [0,1,0,0,0,0|1,0,2]=4 2489 B8R0.7 CS(=O)CCNCCBr Amb24538846 [0,1,0,0,0,0|2,0,0]=3 2490 B8R0.7 CS(=O)CCNCCI Amb24538847 [0,1,0,0,0,0|2,0,0]=3 2491 B8R0.7 CS(=O)CCNCCN Amb25140378 [0,1,0,0,0,0|2,0,0]=3 2492 B8R0.7 CS(=O)CCSCCCl Amb24538537 [0,1,0,0,0,0|2,0,0]=3 2493 B8R0.7 CS(=O)CCSCCO Amb24538899 [0,1,0,0,0,0|2,0,0]=3 2494 B8R0.7 CS(=O)NCCCCN Amb24565136 [0,1,0,0,0,0|2,0,0]=3 2495 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,1,0,0,0,0|1,0,0]=2 2496 B8R0.7 CSCCCCC(C)Cl Amb25767186 [0,1,0,0,0,0|1,0,1]=3 2497 B8R0.7 CSCCCCC(N)=N Amb24332089 [0,1,0,0,0,0|2,0,0]=3 2498 B8R0.7 CSCCCNC(C)=O Amb24546713 [0,1,0,0,0,0|1,0,0]=2 2499 B8R0.7 CSCCCNC(N)=N Amb25255905 [0,1,0,0,0,0|3,0,0]=4 2500 B8R0.7 CSCCCNC(N)=O Amb25265571 [0,1,0,0,0,0|2,0,0]=3 2501 B8R0.7 CSCCCNC(N)=S Amb25742221 [0,1,0,0,0,0|2,1,0]=4 2502 B8R0.7 CSCCCNC(S)=S Amb25200265 [0,1,0,0,0,0|2,1,0]=4 2503 B8R0.7 CSCCCNN(C)C Amb25232903 [0,1,0,0,0,0|3,0,0]=4 2504 B8R0.7 CSCCCOC(=O)Cl Amb25810712 [0,1,0,0,0,0|2,0,0]=3 2505 B8R0.7 CSCCCOC(C)C Amb25303215 [0,1,0,0,0,0|2,0,1]=4 2506 B8R0.7 CSCCCSC(N)=N Amb24481620 [0,1,0,0,0,0|3,0,0]=4 2507 B8R0.7 CSCCNCC(C)Cl Amb25810148 [0,1,0,0,0,0|2,0,1]=4 2508 B8R0.7 CSCCNCC(C)O Amb25681928 [0,1,0,0,0,0|1,0,2]=4 2509 B8R0.7 CSCCNCC(O)=O Amb24401934 [0,1,0,0,0,0|2,0,0]=3 2510 B8R0.7 CSCCNC[C@H](C)O Amb25758316 [0,1,0,0,0,0|1,0,2]=4 2511 B8R0.7 CSCCOCC(=C)Br Amb25095072 [0,1,0,0,0,0|2,0,1]=4 2512 B8R0.7 CSCCOCC(C)=O Amb24333557 [0,1,0,0,0,0|1,0,0]=2 2513 B8R0.7 CSCCOCC(N)=O Amb24730448 [0,1,0,0,0,0|2,0,0]=3 2514 B8R0.7 CSCCSCC(C)N Amb24518046 [0,1,0,0,0,0|2,0,1]=4 2515 B8R0.7 CSCCSCC(C)O Amb24504419 [0,1,0,0,0,0|1,0,2]=4 2516 B8R0.7 CSCCSC[C@@H](C)O Amb25110231 [0,1,0,0,0,0|1,0,2]=4 2517 B8R0.7 CSCCSC[C@H](C)N Amb25110125 [0,1,0,0,0,0|2,0,1]=4 2518 B8R0.7 CSC\C=C/CC(O)=O Amb18644292 [0,1,0,0,0,0|1,0,2]=4 2519 B8R0.7 CSSCCCC(O)=O Amb25269470 [0,1,0,0,0,0|2,0,0]=3 2520 B8R0.7 CSSCCNC(N)=O Amb24748373 [0,1,0,0,0,0|3,0,0]=4 2521 B8R0.7 C[C@@H](N)COCCCO Amb24569226 [0,1,0,0,0,0|2,0,1]=4 2522 B8R0.7 C[C@@H](N)CSCCCO Amb25349579 [0,1,0,0,0,0|2,0,1]=4 2523 B8R0.7 C[C@@H](O)CCCCC#N Amb24642619 [0,1,0,0,0,0|0,0,3]=4 2524 B8R0.7 C[C@@H](O)CCCCC=O Amb22896766 [0,1,0,0,0,0|0,0,3]=4 2525 B8R0.7 C[C@@H](O)CNCCCO Amb25031240 [0,1,0,0,0,0|1,0,2]=4 2526 B8R0.7 C[C@H](N)CSCCCO Amb24481867 [0,1,0,0,0,0|2,0,1]=4 2527 B8R0.7 C[C@H](O)CCCCC#N Amb24592518 [0,1,0,0,0,0|0,0,3]=4 2528 B8R0.7 C[C@H](O)CNCCCO Amb25352476 [0,1,0,0,0,0|1,0,2]=4 2529 B8R0.7 C[C@H](O)CSCCCO Amb24672393 [0,1,0,0,0,0|1,0,2]=4 2530 B8R0.7 C\C(\Br)=C/CCCC=O Amb25282714 [0,1,0,0,0,0|1,0,2]=4 2531 B8R0.7 C\C(\Cl)=C\CCCC=O Amb24383194 [0,1,0,0,0,0|1,0,2]=4 2532 B8R0.7 C\C(\N)=N\CCCC=C Amb25761881 [0,1,0,0,0,0|1,0,2]=4 2533 B8R0.7 C\C=C/CCCC(O)=O Amb25314407 [0,1,0,0,0,0|1,0,1]=3 2534 B8R0.7 C\C=C/OCCC(C)=O Amb25188590 [0,1,0,0,0,0|0,0,2]=3 2535 B8R0.7 C\C=C\C=C/CC(C)=O Amb25837209 [0,1,0,0,0,0|0,0,3]=4 2536 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [0,1,0,0,0,0|0,0,1]=2 2537 B8R0.7 C\C=C\CCCC(N)=O Amb24358851 [0,1,0,0,0,0|1,0,1]=3 2538 B8R0.7 C\C=C\CCCC(O)=O Amb18642615 [0,1,0,0,0,0|1,0,1]=3 2539 B8R0.7 C\C=C\CCNS(C)=O Amb25177401 [0,1,0,0,0,0|1,0,2]=4 2540 B8R0.7 C\C=C\CNCC(C)=C Amb25338570 [0,1,0,0,0,0|1,0,2]=4 2541 B8R0.7 C\C=C\COCC(C)=O Amb25771575 [0,1,0,0,0,0|0,0,2]=3 2542 B8R0.7 C\C=C\COCC(N)=O Amb24573219 [0,1,0,0,0,0|1,0,2]=4 2543 B8R0.7 C\C=C\CSCC(C)=C Amb25261084 [0,1,0,0,0,0|1,0,2]=4 2544 B8R0.7 C\C=C\OCCC(C)=O Amb24631670 [0,1,0,0,0,0|0,0,2]=3 2545 B8R0.7 ClCCCCC=C(Cl)Cl Amb25707298 [0,1,0,0,0,0|2,0,1]=4 2546 B8R0.7 ClCCCCCC(=O)Cl Amb10844967 [0,1,0,0,0,0|1,0,0]=2 2547 B8R0.7 ClCCCCN=C(Cl)Cl Amb25162199 [0,1,0,0,0,0|3,0,0]=4 2548 B8R0.7 ClCCNCCC(C)C Amb17334287 [0,1,0,0,0,0|2,0,1]=4 2549 B8R0.7 ClCCNCCN(C)C Amb17334305 [0,1,0,0,0,0|3,0,0]=4 2550 B8R0.7 FC(F)CCCCCBr Amb24459890 [0,1,0,0,0,0|2,0,1]=4 2551 B8R0.7 N#CCCCCC(=O)O Amb17593332 [0,1,0,0,0,0|1,0,1]=3 2552 B8R0.7 N#CCCCCC(=O)[Zn+] Amb24062904 [0,1,0,0,0,0|1,0,1]=3 2553 B8R0.7 N#CCCCCN(C)C Amb1089735 [0,1,0,0,0,0|2,0,1]=4 2554 B8R0.7 N#CCCCCN(C)C Amb2099818 [0,1,0,0,0,0|2,0,1]=4 2555 B8R0.7 N#CCCCSC(=O)C Amb17607671 [0,1,0,0,0,0|1,0,1]=3 2556 B8R0.7 N#CCCSCC(=C)C Amb17502399 [0,1,0,0,0,0|2,0,1]=4 2557 B8R0.7 N#CCCSCC(=O)C Amb17502392 [0,1,0,0,0,0|1,0,1]=3 2558 B8R0.7 N#CCCSCC(=O)O Amb17502363 [0,1,0,0,0,0|2,0,1]=4 2559 B8R0.7 NC(=N)CCCCCF Amb24693216 [0,1,0,0,0,0|2,0,0]=3 2560 B8R0.7 NC(=N)NCCCCF Amb24504709 [0,1,0,0,0,0|3,0,0]=4 2561 B8R0.7 NC(=N)NCCCCO Amb25145971 [0,1,0,0,0,0|3,0,0]=4 2562 B8R0.7 NC(=N)SCCCCO Amb25213983 [0,1,0,0,0,0|3,0,0]=4 2563 B8R0.7 NC(=O)CCCCC#N Amb24108037 [0,1,0,0,0,0|1,0,1]=3 2564 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,1,0,0,0,0|1,0,0]=2 2565 B8R0.7 NC(=O)CCCN=C=S Amb19514658 [0,1,0,0,0,0|2,0,1]=4 2566 B8R0.7 NC(=O)CCCNC#N Amb25137903 [0,1,0,0,0,0|2,0,1]=4 2567 B8R0.7 NC(=O)CCCNC=O Amb24725181 [0,1,0,0,0,0|2,0,1]=4 2568 B8R0.7 NC(=O)CCC\C=C\Br Amb24480015 [0,1,0,0,0,0|1,0,2]=4 2569 B8R0.7 NC(=O)CCC\C=C\Cl Amb24409832 [0,1,0,0,0,0|1,0,2]=4 2570 B8R0.7 NC(=O)CCNCCF Amb25073678 [0,1,0,0,0,0|2,0,0]=3 2571 B8R0.7 NC(=O)CCNCCO Amb19960060 [0,1,0,0,0,0|2,0,0]=3 2572 B8R0.7 NC(=O)CCNCCS Amb18644377 [0,1,0,0,0,0|2,0,0]=3 2573 B8R0.7 NC(=O)CCSCCS Amb25248299 [0,1,0,0,0,0|2,0,0]=3 2574 B8R0.7 NC(=O)CNCCCF Amb24687040 [0,1,0,0,0,0|2,0,0]=3 2575 B8R0.7 NC(=O)CONCCO Amb25133744 [0,1,0,0,0,0|3,0,0]=4 2576 B8R0.7 NC(=O)CSCCC#N Amb18263954 [0,1,0,0,0,0|2,0,1]=4 2577 B8R0.7 NC(=O)CSCCC=O Amb25784424 [0,1,0,0,0,0|2,0,1]=4 2578 B8R0.7 NC(=O)NCCCCO Amb25146104 [0,1,0,0,0,0|2,0,0]=3 2579 B8R0.7 NC(=O)NOCCCF Amb25739360 [0,1,0,0,0,0|3,0,0]=4 2580 B8R0.7 NC(=S)CCCCCBr Amb24596794 [0,1,0,0,0,0|1,1,0]=3 2581 B8R0.7 NC(=S)CCCCCO Amb24562810 [0,1,0,0,0,0|1,1,0]=3 2582 B8R0.7 NC(=S)NCCCCO Amb25236767 [0,1,0,0,0,0|2,1,0]=4 2583 B8R0.7 NCCCCC=C(Cl)Cl Amb25786790 [0,1,0,0,0,0|2,0,1]=4 2584 B8R0.7 NCCCCC=C(F)F Amb25063284 [0,1,0,0,0,0|2,0,1]=4 2585 B8R0.7 NCCCCCB(O)O Amb25049233 [0,1,0,0,0,0|2,0,1]=4 2586 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [0,1,0,0,0,0|1,0,0]=2 2587 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,1,0,0,0,0|1,0,0]=2 2588 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,1,0,0,0,0|1,0,0]=2 2589 B8R0.7 NCCCCCC(Cl)Cl Amb25188938 [0,1,0,0,0,0|2,0,1]=4 2590 B8R0.7 NCCCCN=C(N)N Amb16184046 [0,1,0,0,0,0|3,0,0]=4 2591 B8R0.7 NCCCCNC(=O)C Amb17053700 [0,1,0,0,0,0|1,0,0]=2 2592 B8R0.7 NCCCCNC(=O)S Amb25328775 [0,1,0,0,0,0|2,0,0]=3 2593 B8R0.7 NCCCCNC(C)C Amb17334116 [0,1,0,0,0,0|2,0,1]=4 2594 B8R0.7 NCCCCNC(N)=N Amb19929571 [0,1,0,0,0,0|3,0,0]=4 2595 B8R0.7 NCCCCNC(N)=N Amb22264641 [0,1,0,0,0,0|3,0,0]=4 2596 B8R0.7 NCCCCNC(N)=O Amb19026975 [0,1,0,0,0,0|2,0,0]=3 2597 B8R0.7 NCCCCNC(N)=O Amb19374296 [0,1,0,0,0,0|2,0,0]=3 2598 B8R0.7 NCCCCOC(=O)Cl Amb25320806 [0,1,0,0,0,0|2,0,0]=3 2599 B8R0.7 NCCCCSC(C)C Amb17500947 [0,1,0,0,0,0|2,0,1]=4 2600 B8R0.7 NCCCCSC(N)=N Amb25349389 [0,1,0,0,0,0|3,0,0]=4 2601 B8R0.7 NCCCNCC(C)C Amb17315266 [0,1,0,0,0,0|2,0,1]=4 2602 B8R0.7 NCCCNCC(O)=O Amb22733138 [0,1,0,0,0,0|2,0,0]=3 2603 B8R0.7 NCCCNCC(O)=O Amb25848815 [0,1,0,0,0,0|2,0,0]=3 2604 B8R0.7 NCCCOCC(C)C Amb1154609 [0,1,0,0,0,0|2,0,1]=4 2605 B8R0.7 NCCCOCC(N)=O Amb24433775 [0,1,0,0,0,0|2,0,0]=3 2606 B8R0.7 NCCCOCC(O)=O Amb18111435 [0,1,0,0,0,0|2,0,0]=3 2607 B8R0.7 NCCCSCC(=C)C Amb17500707 [0,1,0,0,0,0|2,0,0]=3 2608 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,1,0,0,0,0|2,0,0]=3 2609 B8R0.7 NCCCSCC(N)=O Amb25194513 [0,1,0,0,0,0|2,0,0]=3 2610 B8R0.7 NCCC\C=C\C(O)=O Amb22054306 [0,1,0,0,0,0|1,0,2]=4 2611 B8R0.7 NCCC\C=C\C(O)=O Amb25221789 [0,1,0,0,0,0|1,0,2]=4 2612 B8R0.7 NCCNCCC(C)C Amb17091048 [0,1,0,0,0,0|2,0,1]=4 2613 B8R0.7 NCCNCCC(O)=O Amb20668304 [0,1,0,0,0,0|2,0,0]=3 2614 B8R0.7 NCCNCCC(O)=O Amb22058790 [0,1,0,0,0,0|2,0,0]=3 2615 B8R0.7 NCCNOCC(N)=O Amb25257314 [0,1,0,0,0,0|3,0,0]=4 2616 B8R0.7 NCCOCCC(O)=O Amb18630461 [0,1,0,0,0,0|2,0,0]=3 2617 B8R0.7 NCCSCCC(O)=O Amb21988844 [0,1,0,0,0,0|2,0,0]=3 2618 B8R0.7 NC\C=C\CCC(O)=O Amb24411351 [0,1,0,0,0,0|1,0,2]=4 2619 B8R0.7 NOCCCCC(=O)O Amb10975955 [0,1,0,0,0,0|2,0,0]=3 2620 B8R0.7 NOCCCNC(=O)C Amb17138378 [0,1,0,0,0,0|2,0,0]=3 2621 B8R0.7 O=C(Cl)CCSCCCl Amb25361104 [0,1,0,0,0,0|2,0,0]=3 2622 B8R0.7 O=C(Cl)COCCCCl Amb25059159 [0,1,0,0,0,0|2,0,0]=3 2623 B8R0.7 O=C(Cl)CSCCCCl Amb24479935 [0,1,0,0,0,0|2,0,0]=3 2624 B8R0.7 O=C(Cl)\C=C\CCCBr Amb24707452 [0,1,0,0,0,0|1,0,2]=4 2625 B8R0.7 O=C(F)OCCCCCl Amb24416872 [0,1,0,0,0,0|2,0,0]=3 2626 B8R0.7 O=CCCCOC(=O)C Amb17593367 [0,1,0,0,0,0|1,0,1]=3 2627 B8R0.7 O=COCCCC(=O)C Amb1033032 [0,1,0,0,0,0|1,0,1]=3 2628 B8R0.7 OB(O)CCCCCBr Amb21856239 [0,1,0,0,0,0|2,0,1]=4 2629 B8R0.7 OB(O)CCCCCCl Amb25047934 [0,1,0,0,0,0|2,0,1]=4 2630 B8R0.7 OC(=O)C#CCCCCl Amb24347497 [0,1,0,0,0,0|1,0,2]=4 2631 B8R0.7 OC(=O)CCCCC=O Amb18642763 [0,1,0,0,0,0|1,0,1]=3 2632 B8R0.7 OC(=O)CCCCCCl Amb18796646 [0,1,0,0,0,0|1,0,0]=2 2633 B8R0.7 OC(=O)CCCCCI Amb22736492 [0,1,0,0,0,0|1,0,0]=2 2634 B8R0.7 OC(=O)CCCCCS Amb18644374 [0,1,0,0,0,0|1,0,0]=2 2635 B8R0.7 OC(=O)CCCNC=O Amb18305404 [0,1,0,0,0,0|2,0,1]=4 2636 B8R0.7 OC(=O)CCC\C=C\Br Amb24518554 [0,1,0,0,0,0|1,0,2]=4 2637 B8R0.7 OC(=O)CCC\C=C\Cl Amb18644381 [0,1,0,0,0,0|1,0,2]=4 2638 B8R0.7 OC(=O)CCNCN=O Amb25311838 [0,1,0,0,0,0|3,0,0]=4 2639 B8R0.7 OC(=O)CCOCCBr Amb24057757 [0,1,0,0,0,0|2,0,0]=3 2640 B8R0.7 OC(=O)CCSCCCl Amb24097450 [0,1,0,0,0,0|2,0,0]=3 2641 B8R0.7 OC(=O)CCSCCS Amb18126456 [0,1,0,0,0,0|2,0,0]=3 2642 B8R0.7 OC(=O)CC\C=C\CBr Amb24635578 [0,1,0,0,0,0|1,0,2]=4 2643 B8R0.7 OC(=O)CNCCCBr Amb25765814 [0,1,0,0,0,0|2,0,0]=3 2644 B8R0.7 OC(=O)CNCCCS Amb25268354 [0,1,0,0,0,0|2,0,0]=3 2645 B8R0.7 OC(=O)COCCCBr Amb24594816 [0,1,0,0,0,0|2,0,0]=3 2646 B8R0.7 OC(=O)COCCCF Amb24481828 [0,1,0,0,0,0|2,0,0]=3 2647 B8R0.7 OC(=O)CSCCCBr Amb25771711 [0,1,0,0,0,0|2,0,0]=3 2648 B8R0.7 OC(=O)CSCCCCl Amb18126548 [0,1,0,0,0,0|2,0,0]=3 2649 B8R0.7 OC(=O)CSCCCF Amb25676986 [0,1,0,0,0,0|2,0,0]=3 2650 B8R0.7 OC(=O)\C=C\CCCBr Amb24446659 [0,1,0,0,0,0|1,0,2]=4 2651 B8R0.7 OC(=O)\C=C\CCCCl Amb18644386 [0,1,0,0,0,0|1,0,2]=4 2652 B8R0.7 OCCCCCC(Cl)Cl Amb25684810 [0,1,0,0,0,0|2,0,1]=4 2653 B8R0.7 OCCCCCN(C)C Amb17334131 [0,1,0,0,0,0|2,0,0]=3 2654 B8R0.7 OCCCCNC(=O)C Amb17102977 [0,1,0,0,0,0|1,0,0]=2 2655 B8R0.7 OCCCCNC(C)C Amb17334129 [0,1,0,0,0,0|2,0,1]=4 2656 B8R0.7 OCCCNCC(O)C Amb17308669 [0,1,0,0,0,0|1,0,2]=4 2657 B8R0.7 OCCCSCC(=C)C Amb17502851 [0,1,0,0,0,0|2,0,0]=3 2658 B8R0.7 OCCCSCC(=O)C Amb17502845 [0,1,0,0,0,0|1,0,0]=2 2659 B8R0.7 OCCC\C=C\C(O)=O Amb18642790 [0,1,0,0,0,0|1,0,2]=4 2660 B8R0.7 OCCNCCC(=O)O Amb1110010 [0,1,0,0,0,0|2,0,0]=3 2661 B8R0.7 OCCNCCN(C)C Amb1017223 [0,1,0,0,0,0|3,0,0]=4 2662 B8R0.7 OCCOCCC(C)C Amb10609610 [0,1,0,0,0,0|2,0,1]=4 2663 B8R0.7 OC\C=C\CCC(O)=O Amb24639124 [0,1,0,0,0,0|1,0,2]=4 2664 B8R0.7 OP(=O)OCCCCBr Amb25322865 [0,1,0,0,0,0|3,0,0]=4 2665 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [0,1,0,0,0,0|3,0,0]=4 2666 B8R0.7 [O-]C(=O)CCCCCO Amb22491268 [0,1,0,0,0,0|1,0,0]=2 2667 B8R0.7 [O-]P(=O)CCOCCCl Amb25232545 [0,1,0,0,0,0|3,0,0]=4 2668 B8R0.7 [O-][N+](=O)OCCCCO Amb21929397 [0,1,0,0,0,0|3,0,0]=4 2669 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [0,1,0,0,0,0|1,0,2]=4 2670 B8R0.8 C#CCC[C@@H](N)C(N)=O Amb25368154 [0,1,0,0,0,0|1,0,2]=4 2671 B8R0.8 C#CCC[C@@H](N)C(O)=O Amb24088809 [0,1,0,0,0,0|1,0,2]=4 2672 B8R0.8 C#CCC[C@H](N)C(O)=O Amb24088866 [0,1,0,0,0,0|1,0,2]=4 2673 B8R0.8 C=C(CCCN)C(O)=O Amb18642697 [0,1,0,0,0,0|2,0,1]=4 2674 B8R0.8 C=CCCC(C(=C)C)O Amb17593327 [0,1,0,0,0,0|1,0,2]=4 2675 B8R0.8 C=CCCC(Cl)C(O)=O Amb25041973 [0,1,0,0,0,0|1,0,2]=4 2676 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [0,1,0,0,0,0|1,0,2]=4 2677 B8R0.8 C=CCCC(N)C(O)=O Amb24383848 [0,1,0,0,0,0|1,0,2]=4 2678 B8R0.8 C=CCC[C@@H](N)C(O)=O Amb23439045 [0,1,0,0,0,0|1,0,2]=4 2679 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [0,1,0,0,0,0|1,0,2]=4 2680 B8R0.8 CC#CCC(N)C(O)=O Amb18988250 [0,1,0,0,0,0|1,0,2]=4 2681 B8R0.8 CC#CCC(O)C(O)=O Amb25213344 [0,1,0,0,0,0|1,0,2]=4 2682 B8R0.8 CC#CC[C@@H](C)C(O)=O Amb24589724 [0,1,0,0,0,0|1,0,2]=4 2683 B8R0.8 CC#CC[C@@H](N)C(N)=O Amb25324867 [0,1,0,0,0,0|1,0,2]=4 2684 B8R0.8 CC#CC[C@@H](N)C(O)=O Amb22746783 [0,1,0,0,0,0|1,0,2]=4 2685 B8R0.8 CC#CC[C@H](O)C(C)=O Amb24340259 [0,1,0,0,0,0|0,0,2]=3 2686 B8R0.8 CC(=C)C(=C)CCCO Amb25795509 [0,1,0,0,0,0|2,0,1]=4 2687 B8R0.8 CC(=C)C(=O)CCCCl Amb24618121 [0,1,0,0,0,0|2,0,1]=4 2688 B8R0.8 CC(=C)C(=O)CCNC Amb24671028 [0,1,0,0,0,0|2,0,1]=4 2689 B8R0.8 CC(=C)C(=O)CCOC Amb24399603 [0,1,0,0,0,0|2,0,1]=4 2690 B8R0.8 CC(=C)C(=O)CCSC Amb25830271 [0,1,0,0,0,0|2,0,1]=4 2691 B8R0.8 CC(=C)C(=O)CNCC Amb24460074 [0,1,0,0,0,0|2,0,1]=4 2692 B8R0.8 CC(=C)C(=O)COCC Amb24478676 [0,1,0,0,0,0|2,0,1]=4 2693 B8R0.8 CC(=C)C(=O)OCCC Amb17933169 [0,1,0,0,0,0|2,0,1]=4 2694 B8R0.8 CC(=C)C(Br)CCCCl Amb25240770 [0,1,0,0,0,0|2,0,0]=3 2695 B8R0.8 CC(=C)C(Cl)CCC=C Amb24595446 [0,1,0,0,0,0|1,0,2]=4 2696 B8R0.8 CC(=C)C(O)CCCCl Amb24417085 [0,1,0,0,0,0|2,0,0]=3 2697 B8R0.8 CC(=C=NCC)C(C)=O Amb25145508 [0,1,0,0,0,0|1,0,2]=4 2698 B8R0.8 CC(=NCCC)C(N)=O Amb25372262 [0,1,0,0,0,0|2,0,1]=4 2699 B8R0.8 CC(=O)C(=C)COCC Amb25202647 [0,1,0,0,0,0|1,0,1]=3 2700 B8R0.8 CC(=O)C(=C)C\C=C\C Amb24690625 [0,1,0,0,0,0|0,0,3]=4 2701 B8R0.8 CC(=O)C(=C)OCCN Amb22015303 [0,1,0,0,0,0|2,0,1]=4 2702 B8R0.8 CC(=O)C(=C)\C=C\CC Amb25074493 [0,1,0,0,0,0|0,0,3]=4 2703 B8R0.8 CC(=O)C(=O)CSCC Amb24378469 [0,1,0,0,0,0|1,0,1]=3 2704 B8R0.8 CC(=O)C(=O)NCCO Amb25803555 [0,1,0,0,0,0|2,0,1]=4 2705 B8R0.8 CC(=O)C(=O)OCCC Amb25838665 [0,1,0,0,0,0|1,0,1]=3 2706 B8R0.8 CC(=O)C(Br)=COCC Amb24097521 [0,1,0,0,0,0|1,0,2]=4 2707 B8R0.8 CC(=O)C(Br)CCCO Amb25146214 [0,1,0,0,0,0|1,0,0]=2 2708 B8R0.8 CC(=O)C(C)=CCCO Amb24617765 [0,1,0,0,0,0|1,0,2]=4 2709 B8R0.8 CC(=O)C(C)=NCCO Amb24625306 [0,1,0,0,0,0|2,0,1]=4 2710 B8R0.8 CC(=O)C(Cl)CCC#N Amb25116247 [0,1,0,0,0,0|1,0,1]=3 2711 B8R0.8 CC(=O)C(Cl)CCCCl Amb24340131 [0,1,0,0,0,0|1,0,0]=2 2712 B8R0.8 CC(=O)C(Cl)OCCO Amb25696998 [0,1,0,0,0,0|2,0,0]=3 2713 B8R0.8 CC(=O)C(O)CCCO Amb24364072 [0,1,0,0,0,0|1,0,0]=2 2714 B8R0.8 CC(=O)\C(\Br)=C/OCC Amb25715760 [0,1,0,0,0,0|1,0,2]=4 2715 B8R0.8 CC(=O)\C(\C)=C\CCO Amb25735231 [0,1,0,0,0,0|1,0,2]=4 2716 B8R0.8 CC(=O)\C(\Cl)=C\CCC Amb24388360 [0,1,0,0,0,0|0,0,2]=3 2717 B8R0.8 CC(=O)\C(\Cl)=C\OCC Amb25272669 [0,1,0,0,0,0|1,0,2]=4 2718 B8R0.8 CC(C(=O)O)CNCC Amb13952782 [0,1,0,0,0,0|2,0,0]=3 2719 B8R0.8 CC(C(=O)O)SCCN Amb17500447 [0,1,0,0,0,0|3,0,0]=4 2720 B8R0.8 CC(C(=S)N)CNCC Amb17232021 [0,1,0,0,0,0|2,1,0]=4 2721 B8R0.8 CC(C)=C(C)CCCC Amb22228294 [0,1,0,0,0,0|1,0,1]=3 2722 B8R0.8 CC(C)C(Br)CCCC Amb18330349 [0,1,0,0,0,0|1,0,1]=3 2723 B8R0.8 CC(C)C(C)CCCC Amb22228295 [0,1,0,0,0,0|1,0,1]=3 2724 B8R0.8 CC(C)C(C)CCCCl Amb25102017 [0,1,0,0,0,0|2,0,1]=4 2725 B8R0.8 CC(C)C(C)CCNC Amb25757225 [0,1,0,0,0,0|2,0,1]=4 2726 B8R0.8 CC(C)C(C)CNCC Amb19023894 [0,1,0,0,0,0|2,0,1]=4 2727 B8R0.8 CC(C)C(C)NCCC Amb21959690 [0,1,0,0,0,0|2,0,1]=4 2728 B8R0.8 CC(C)C(Cl)CCCC Amb24340089 [0,1,0,0,0,0|1,0,1]=3 2729 B8R0.8 CC(C)C(Cl)CCOC Amb24363842 [0,1,0,0,0,0|2,0,1]=4 2730 B8R0.8 CC(C)C(Cl)COCC Amb25206813 [0,1,0,0,0,0|2,0,1]=4 2731 B8R0.8 CC(C)C(Cl)OCCC Amb24479988 [0,1,0,0,0,0|2,0,1]=4 2732 B8R0.8 CC(C)C(N)CCCO Amb25755920 [0,1,0,0,0,0|2,0,1]=4 2733 B8R0.8 CC(C)C(N)CCOC Amb18523844 [0,1,0,0,0,0|2,0,1]=4 2734 B8R0.8 CC(C)C(N)CNCC Amb19009736 [0,1,0,0,0,0|2,0,1]=4 2735 B8R0.8 CC(C)C(N)COCC Amb21954013 [0,1,0,0,0,0|2,0,1]=4 2736 B8R0.8 CC(C)C(N)CSCC Amb25147065 [0,1,0,0,0,0|2,0,1]=4 2737 B8R0.8 CC(C)C(O)CCCN Amb18203175 [0,1,0,0,0,0|2,0,1]=4 2738 B8R0.8 CC(C)C(O)CCOC Amb20622333 [0,1,0,0,0,0|2,0,1]=4 2739 B8R0.8 CC(C)C(O)CCSC Amb24723193 [0,1,0,0,0,0|2,0,1]=4 2740 B8R0.8 CC(C)C(O)CNCC Amb19031267 [0,1,0,0,0,0|2,0,1]=4 2741 B8R0.8 CC(C)C(O)CSCC Amb25820631 [0,1,0,0,0,0|2,0,1]=4 2742 B8R0.8 CC(C)[C@@H](N)COCC Amb18529652 [0,1,0,0,0,0|2,0,1]=4 2743 B8R0.8 CC(C)[C@@H](O)CCCC Amb24704256 [0,1,0,0,0,0|1,0,1]=3 2744 B8R0.8 CC(C)[C@H](N)CCCC Amb25103904 [0,1,0,0,0,0|1,0,1]=3 2745 B8R0.8 CC(C)[C@H](N)CSCC Amb25032228 [0,1,0,0,0,0|2,0,1]=4 2746 B8R0.8 CC(CC=C=C)C(C)=O Amb25341992 [0,1,0,0,0,0|0,0,3]=4 2747 B8R0.8 CC(CCC#N)C(N)=O Amb18642432 [0,1,0,0,0,0|2,0,1]=4 2748 B8R0.8 CC(CCC#N)C(O)=O Amb24462559 [0,1,0,0,0,0|2,0,1]=4 2749 B8R0.8 CC(CCC=C)C(O)=O Amb18642656 [0,1,0,0,0,0|1,0,2]=4 2750 B8R0.8 CC(CCC=O)C(C)=C Amb18642472 [0,1,0,0,0,0|2,0,1]=4 2751 B8R0.8 CC(CCC=O)C(C)=O Amb18642650 [0,1,0,0,0,0|1,0,1]=3 2752 B8R0.8 CC(CCC=O)C(O)=O Amb18642767 [0,1,0,0,0,0|2,0,1]=4 2753 B8R0.8 CC(CCCBr)C(=O)Cl Amb24722839 [0,1,0,0,0,0|2,0,0]=3 2754 B8R0.8 CC(CCCBr)C(C)=O Amb25362168 [0,1,0,0,0,0|1,0,0]=2 2755 B8R0.8 CC(CCCBr)C(O)=O Amb25321670 [0,1,0,0,0,0|2,0,0]=3 2756 B8R0.8 CC(CCCF)C(O)=O Amb25244585 [0,1,0,0,0,0|2,0,0]=3 2757 B8R0.8 CC(CCCN)C(C)=O Amb25774001 [0,1,0,0,0,0|1,0,0]=2 2758 B8R0.8 CC(CCCN)C(O)=O Amb25146072 [0,1,0,0,0,0|2,0,0]=3 2759 B8R0.8 CC(CCCO)C(=O)S Amb25221473 [0,1,0,0,0,0|2,0,0]=3 2760 B8R0.8 CC(CCCS)C(C)=O Amb25807409 [0,1,0,0,0,0|1,0,0]=2 2761 B8R0.8 CC(CCOC)C(C)Br Amb18329731 [0,1,0,0,0,0|2,0,1]=4 2762 B8R0.8 CC(CCOC)C(C)Cl Amb18180170 [0,1,0,0,0,0|2,0,1]=4 2763 B8R0.8 CC(CCOC)C(C)N Amb18305138 [0,1,0,0,0,0|2,0,1]=4 2764 B8R0.8 CC(CCSC)C(C)Cl Amb24481619 [0,1,0,0,0,0|2,0,1]=4 2765 B8R0.8 CC(CNC=O)C(C)=O Amb24095657 [0,1,0,0,0,0|2,0,1]=4 2766 B8R0.8 CC(CSC#N)C(C)=O Amb24424880 [0,1,0,0,0,0|2,0,1]=4 2767 B8R0.8 CC(Cl)C(Cl)CCCC Amb25243246 [0,1,0,0,0,0|1,0,1]=3 2768 B8R0.8 CC(N)C(N)CCCC Amb25162797 [0,1,0,0,0,0|1,0,1]=3 2769 B8R0.8 CC(N)C(O)CCCC Amb25145481 [0,1,0,0,0,0|1,0,1]=3 2770 B8R0.8 CC(N)C(O)CCSC Amb25786925 [0,1,0,0,0,0|2,0,1]=4 2771 B8R0.8 CC(N)C(S)CCCC Amb25840125 [0,1,0,0,0,0|1,0,1]=3 2772 B8R0.8 CC(NCC=C)C(C)=O Amb18642525 [0,1,0,0,0,0|1,0,2]=4 2773 B8R0.8 CC(NCCCl)C(O)=O Amb25145942 [0,1,0,0,0,0|3,0,0]=4 2774 B8R0.8 CC(NCCN)C(O)=O Amb18523860 [0,1,0,0,0,0|3,0,0]=4 2775 B8R0.8 CC(NCCO)C(C)=O Amb18627404 [0,1,0,0,0,0|2,0,0]=3 2776 B8R0.8 CC(O)C(N)CCCC Amb24351619 [0,1,0,0,0,0|0,0,2]=3 2777 B8R0.8 CC(O)C(O)CCCC Amb25128970 [0,1,0,0,0,0|0,0,2]=3 2778 B8R0.8 CC(O)C(O)COCC Amb25297486 [0,1,0,0,0,0|1,0,2]=4 2779 B8R0.8 CC(OCC#C)C(C)=O Amb24339753 [0,1,0,0,0,0|1,0,2]=4 2780 B8R0.8 CC(OCC=O)C(C)=O Amb24340213 [0,1,0,0,0,0|2,0,1]=4 2781 B8R0.8 CC(OCCCl)C(O)=O Amb24481693 [0,1,0,0,0,0|3,0,0]=4 2782 B8R0.8 CC(OCCN)C(C)=O Amb18111235 [0,1,0,0,0,0|2,0,0]=3 2783 B8R0.8 CC(OCCN)C(N)=O Amb19020756 [0,1,0,0,0,0|3,0,0]=4 2784 B8R0.8 CC(OCCN)C(O)=O Amb18630157 [0,1,0,0,0,0|3,0,0]=4 2785 B8R0.8 CC(OCCN)C(O)=O Amb22546285 [0,1,0,0,0,0|3,0,0]=4 2786 B8R0.8 CC(SCC#N)C(C)=O Amb18265535 [0,1,0,0,0,0|2,0,1]=4 2787 B8R0.8 CC(SCC=C)C(C)=O Amb24584385 [0,1,0,0,0,0|1,0,2]=4 2788 B8R0.8 CC(SCCCl)C(C)=O Amb25726472 [0,1,0,0,0,0|2,0,0]=3 2789 B8R0.8 CC(SCCF)C(C)=O Amb25315458 [0,1,0,0,0,0|2,0,0]=3 2790 B8R0.8 CC(SCCF)C(O)=O Amb25314013 [0,1,0,0,0,0|3,0,0]=4 2791 B8R0.8 CCC#CC(O)C(O)=O Amb25245439 [0,1,0,0,0,0|1,0,2]=4 2792 B8R0.8 CCCCC(=C)C(N)=O Amb24574376 [0,1,0,0,0,0|1,0,1]=3 2793 B8R0.8 CCCCC(=C)C(O)=O Amb18642649 [0,1,0,0,0,0|1,0,1]=3 2794 B8R0.8 CCCCC(=N)C(C)C Amb25680717 [0,1,0,0,0,0|1,0,2]=4 2795 B8R0.8 CCCCC(=O)C(=C)F Amb25298399 [0,1,0,0,0,0|1,0,2]=4 2796 B8R0.8 CCCCC(=O)C(C)Br Amb24692778 [0,1,0,0,0,0|1,0,2]=4 2797 B8R0.8 CCCCC(=O)C(Cl)C Amb17593705 [0,1,0,0,0,0|1,0,2]=4 2798 B8R0.8 CCCCC(=O)C(N)=N Amb24543892 [0,1,0,0,0,0|2,0,1]=4 2799 B8R0.8 CCCCC(=O)C(O)=O Amb18642761 [0,1,0,0,0,0|1,0,1]=3 2800 B8R0.8 CCCCC(=O)C(O)=O Amb22348245 [0,1,0,0,0,0|1,0,1]=3 2801 B8R0.8 CCCCC(=O)[C@@H](C)N Amb22748987 [0,1,0,0,0,0|1,0,2]=4 2802 B8R0.8 CCCCC(=O)[C@@H](C)O Amb25829551 [0,1,0,0,0,0|0,0,3]=4 2803 B8R0.8 CCCCC(=O)[C@H](C)O Amb25097116 [0,1,0,0,0,0|0,0,3]=4 2804 B8R0.8 CCCCC(=O)[C@H](C)[NH3+] Amb22503703 [0,1,0,0,0,0|1,0,2]=4 2805 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [0,1,0,0,0,0|1,0,0]=2 2806 B8R0.8 CCCCC(Br)C(C)=C Amb25718999 [0,1,0,0,0,0|1,0,0]=2 2807 B8R0.8 CCCCC(Br)C(N)=N Amb25109246 [0,1,0,0,0,0|2,0,0]=3 2808 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [0,1,0,0,0,0|1,0,0]=2 2809 B8R0.8 CCCCC(Br)[N+]([O-])=O Amb24626944 [0,1,0,0,0,0|2,0,0]=3 2810 B8R0.8 CCCCC(C(=O)C)N Amb1099238 [0,1,0,0,0,0|0,0,0]=1 2811 B8R0.8 CCCCC(C(=O)Cl)Br Amb17569836 [0,1,0,0,0,0|1,0,0]=2 2812 B8R0.8 CCCCC(C(=O)O)Cl Amb17593750 [0,1,0,0,0,0|1,0,0]=2 2813 B8R0.8 CCCCC(C)C(C)Br Amb18330354 [0,1,0,0,0,0|1,0,1]=3 2814 B8R0.8 CCCCC(C)C(C)N Amb19007570 [0,1,0,0,0,0|1,0,1]=3 2815 B8R0.8 CCCCC(C)C(N)=N Amb24452705 [0,1,0,0,0,0|2,0,0]=3 2816 B8R0.8 CCCCC(C)N(C)N Amb25824768 [0,1,0,0,0,0|2,0,0]=3 2817 B8R0.8 CCCCC(Cl)B(O)O Amb25102593 [0,1,0,0,0,0|2,0,1]=4 2818 B8R0.8 CCCCC(Cl)C(=O)Cl Amb24634189 [0,1,0,0,0,0|1,0,0]=2 2819 B8R0.8 CCCCC(F)C(O)=O Amb25238781 [0,1,0,0,0,0|1,0,0]=2 2820 B8R0.8 CCCCC(I)C(C)=O Amb25314130 [0,1,0,0,0,0|0,0,0]=1 2821 B8R0.8 CCCCC(N)C(C)=C Amb24353636 [0,1,0,0,0,0|1,0,0]=2 2822 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [0,1,0,0,0,0|0,0,0]=1 2823 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [0,1,0,0,0,0|1,0,0]=2 2824 B8R0.8 CCCCC(N)C(N)=S Amb24764229 [0,1,0,0,0,0|1,1,0]=3 2825 B8R0.8 CCCCC(N)P(O)O Amb24433379 [0,1,0,0,0,0|2,0,1]=4 2826 B8R0.8 CCCCC(O)C(=C)Cl Amb24379883 [0,1,0,0,0,0|1,0,1]=3 2827 B8R0.8 CCCCC(O)C(F)Br Amb25853521 [0,1,0,0,0,0|2,0,1]=4 2828 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [0,1,0,0,0,0|1,0,0]=2 2829 B8R0.8 CCCCC(O)N(C)C Amb24478022 [0,1,0,0,0,0|2,0,0]=3 2830 B8R0.8 CCCCC(S)C(O)=O Amb25323873 [0,1,0,0,0,0|1,0,0]=2 2831 B8R0.8 CCCCN(C)C(C)=N Amb24638724 [0,1,0,0,0,0|2,0,0]=3 2832 B8R0.8 CCCCN(Cl)C(N)=O Amb25147019 [0,1,0,0,0,0|2,0,0]=3 2833 B8R0.8 CCCCN(N)C(N)=S Amb24383128 [0,1,0,0,0,0|2,1,0]=4 2834 B8R0.8 CCCC[C@@H](Br)C(=O)Cl Amb24695956 [0,1,0,0,0,0|1,0,0]=2 2835 B8R0.8 CCCC[C@@H](Br)C(O)=O Amb24377169 [0,1,0,0,0,0|1,0,0]=2 2836 B8R0.8 CCCC[C@@H](C(=O)O)N Amb1995007 [0,1,0,0,0,0|1,0,0]=2 2837 B8R0.8 CCCC[C@@H](C)C(C)=O Amb25318801 [0,1,0,0,0,0|0,0,0]=1 2838 B8R0.8 CCCC[C@@H](C)C(O)=O Amb24590691 [0,1,0,0,0,0|1,0,0]=2 2839 B8R0.8 CCCC[C@@H](C)[C@@H](C)N Amb24676999 [0,1,0,0,0,0|1,0,1]=3 2840 B8R0.8 CCCC[C@@H](C)[C@@H](C)O Amb24332094 [0,1,0,0,0,0|0,0,2]=3 2841 B8R0.8 CCCC[C@@H](C)[C@H](C)N Amb25806984 [0,1,0,0,0,0|1,0,1]=3 2842 B8R0.8 CCCC[C@@H](Cl)B(F)F Amb24380780 [0,1,0,0,0,0|3,0,0]=4 2843 B8R0.8 CCCC[C@@H](N)C(N)=O Amb23438981 [0,1,0,0,0,0|1,0,0]=2 2844 B8R0.8 CCCC[C@@H](S)C(O)=O Amb24478188 [0,1,0,0,0,0|1,0,0]=2 2845 B8R0.8 CCCC[C@H](C(=O)O)N Amb1995006 [0,1,0,0,0,0|1,0,0]=2 2846 B8R0.8 CCCC[C@H](C)C(C)=O Amb25767789 [0,1,0,0,0,0|0,0,0]=1 2847 B8R0.8 CCCC[C@H](C)C(O)=O Amb25850678 [0,1,0,0,0,0|1,0,0]=2 2848 B8R0.8 CCCC[C@H](C)[C@H](C)N Amb25118326 [0,1,0,0,0,0|1,0,1]=3 2849 B8R0.8 CCCC[C@H](N)C(N)=O Amb25361837 [0,1,0,0,0,0|1,0,0]=2 2850 B8R0.8 CCCC[C@H](O)C(C)=O Amb24691364 [0,1,0,0,0,0|0,0,0]=1 2851 B8R0.8 CCCNC(=O)C(=O)C Amb17399819 [0,1,0,0,0,0|1,0,1]=3 2852 B8R0.8 CCCNC(C)C(C)=O Amb18642716 [0,1,0,0,0,0|1,0,0]=2 2853 B8R0.8 CCCNC(C)C(C)O Amb25368854 [0,1,0,0,0,0|1,0,2]=4 2854 B8R0.8 CCCNC(C)C(C)S Amb18644349 [0,1,0,0,0,0|1,1,1]=4 2855 B8R0.8 CCCOC(=C)C(O)=O Amb18642781 [0,1,0,0,0,0|2,0,1]=4 2856 B8R0.8 CCCOC(=O)C(N)=O Amb25146150 [0,1,0,0,0,0|2,0,1]=4 2857 B8R0.8 CCCOC(C)C(C)Br Amb25055384 [0,1,0,0,0,0|2,0,1]=4 2858 B8R0.8 CCCOC(C)C(C)Cl Amb24711484 [0,1,0,0,0,0|2,0,1]=4 2859 B8R0.8 CCCOC(C)C(C)N Amb18306548 [0,1,0,0,0,0|2,0,1]=4 2860 B8R0.8 CCCOC(C)C(N)=S Amb25374593 [0,1,0,0,0,0|2,1,0]=4 2861 B8R0.8 CCCOC(C)[C@H](C)O Amb25350058 [0,1,0,0,0,0|1,0,2]=4 2862 B8R0.8 CCCO[C@@H](C)[C@H](C)O Amb25205054 [0,1,0,0,0,0|1,0,2]=4 2863 B8R0.8 CCCO[C@H](C)C(O)=O Amb25721817 [0,1,0,0,0,0|2,0,0]=3 2864 B8R0.8 CCCSC(C)C(N)=N Amb24502242 [0,1,0,0,0,0|3,0,0]=4 2865 B8R0.8 CCC\C=C(/N)\C(N)=O Amb25146004 [0,1,0,0,0,0|1,0,2]=4 2866 B8R0.8 CCC\C=C(\C(=O)C)/C Amb17593317 [0,1,0,0,0,0|0,0,2]=3 2867 B8R0.8 CCC\C=C(\N)/C(N)=O Amb24515061 [0,1,0,0,0,0|1,0,2]=4 2868 B8R0.8 CCNCC(=C)C(O)=O Amb24368916 [0,1,0,0,0,0|2,0,1]=4 2869 B8R0.8 CCNCC(C)C(C)=O Amb18642729 [0,1,0,0,0,0|1,0,0]=2 2870 B8R0.8 CCNCC(C)C(C)N Amb24481815 [0,1,0,0,0,0|2,0,1]=4 2871 B8R0.8 CCNCC(C)S(C)=O Amb25048742 [0,1,0,0,0,0|2,0,0]=3 2872 B8R0.8 CCNCC(N)C(N)=O Amb25841908 [0,1,0,0,0,0|2,0,0]=3 2873 B8R0.8 CCOCC(=C)C(N)=O Amb25190415 [0,1,0,0,0,0|2,0,1]=4 2874 B8R0.8 CCOCC(C)C(C)=O Amb24621069 [0,1,0,0,0,0|1,0,0]=2 2875 B8R0.8 CCOCC(C)C(C)Br Amb25139698 [0,1,0,0,0,0|2,0,1]=4 2876 B8R0.8 CCOCC(C)C(C)N Amb25046418 [0,1,0,0,0,0|2,0,1]=4 2877 B8R0.8 CCOCC(C)C(C)O Amb24529048 [0,1,0,0,0,0|1,0,2]=4 2878 B8R0.8 CCOCC(Cl)C(O)=O Amb24481790 [0,1,0,0,0,0|2,0,0]=3 2879 B8R0.8 CCOCC(O)C(=C)Cl Amb24569972 [0,1,0,0,0,0|2,0,1]=4 2880 B8R0.8 CCOCC(O)C(C)=C Amb24737020 [0,1,0,0,0,0|2,0,0]=3 2881 B8R0.8 CCOCC(O)C(O)=O Amb25804394 [0,1,0,0,0,0|2,0,0]=3 2882 B8R0.8 CCOC[C@@H](C)C(O)=O Amb25790635 [0,1,0,0,0,0|2,0,0]=3 2883 B8R0.8 CCOC[C@H](C(C)C)N Amb17061643 [0,1,0,0,0,0|2,0,1]=4 2884 B8R0.8 CCOC[C@H](N)C(O)=O Amb22737184 [0,1,0,0,0,0|2,0,0]=3 2885 B8R0.8 CCOC[C@H](N)C(O)=O Amb24478577 [0,1,0,0,0,0|2,0,0]=3 2886 B8R0.8 CCOC[C@H](O)C(O)=O Amb24340099 [0,1,0,0,0,0|2,0,0]=3 2887 B8R0.8 CCSCC(=O)C(O)=O Amb24670679 [0,1,0,0,0,0|2,0,1]=4 2888 B8R0.8 CCSCC(N)C(N)=O Amb24761235 [0,1,0,0,0,0|2,0,0]=3 2889 B8R0.8 CCSC[C@@H](N)C(O)=O Amb22800347 [0,1,0,0,0,0|2,0,0]=3 2890 B8R0.8 CCSC[C@H](C)N(C)C Amb24631751 [0,1,0,0,0,0|3,0,0]=4 2891 B8R0.8 CCSC[C@H](N)C(N)=O Amb24393154 [0,1,0,0,0,0|2,0,0]=3 2892 B8R0.8 CC\C=C\C(Br)C(=O)Cl Amb24480332 [0,1,0,0,0,0|1,0,2]=4 2893 B8R0.8 CC\C=C\C(C)C(C)=O Amb25295311 [0,1,0,0,0,0|0,0,2]=3 2894 B8R0.8 CC\C=C\C(C)C(O)=O Amb18642633 [0,1,0,0,0,0|1,0,2]=4 2895 B8R0.8 CC\C=C\C(N)C(O)=O Amb18642708 [0,1,0,0,0,0|1,0,2]=4 2896 B8R0.8 CN(C(=O)C)CCC#N Amb1035868 [0,1,0,0,0,0|2,0,1]=4 2897 B8R0.8 CN(C(=O)Cl)CCCC Amb17563097 [0,1,0,0,0,0|2,0,0]=3 2898 B8R0.8 CN(CCCN)S(C)=O Amb25335252 [0,1,0,0,0,0|3,0,0]=4 2899 B8R0.8 CN(CCCO)S(C)=O Amb24659504 [0,1,0,0,0,0|3,0,0]=4 2900 B8R0.8 CNCCC(C)C(O)=O Amb24641803 [0,1,0,0,0,0|2,0,0]=3 2901 B8R0.8 CNCCC(C)N(C)C Amb18523834 [0,1,0,0,0,0|3,0,0]=4 2902 B8R0.8 CNCCC(C)S(C)=O Amb24481747 [0,1,0,0,0,0|2,0,0]=3 2903 B8R0.8 CNCCC(O)C(O)=O Amb24540612 [0,1,0,0,0,0|2,0,0]=3 2904 B8R0.8 CNCCN(C)C(C)=O Amb20669225 [0,1,0,0,0,0|2,0,0]=3 2905 B8R0.8 CNCC[C@H](N)C(O)=O Amb24427654 [0,1,0,0,0,0|2,0,0]=3 2906 B8R0.8 COCCC(C)C(N)=O Amb24760323 [0,1,0,0,0,0|2,0,0]=3 2907 B8R0.8 COCCC(C)C(N)=S Amb25320570 [0,1,0,0,0,0|2,1,0]=4 2908 B8R0.8 COCCC(C)C(O)=O Amb18523823 [0,1,0,0,0,0|2,0,0]=3 2909 B8R0.8 COCCC(C)N(C)C Amb25138576 [0,1,0,0,0,0|3,0,0]=4 2910 B8R0.8 COCCC(Cl)C(C)=O Amb25707829 [0,1,0,0,0,0|1,0,0]=2 2911 B8R0.8 COCCC(N)C(C)=C Amb24532850 [0,1,0,0,0,0|2,0,0]=3 2912 B8R0.8 COCCC(N)C(C)=O Amb24496676 [0,1,0,0,0,0|1,0,0]=2 2913 B8R0.8 COCCC(N)C(N)=O Amb18311365 [0,1,0,0,0,0|2,0,0]=3 2914 B8R0.8 COCCC(O)C(=O)Cl Amb25781911 [0,1,0,0,0,0|2,0,0]=3 2915 B8R0.8 COCCN(C)C(C)=O Amb24072025 [0,1,0,0,0,0|2,0,0]=3 2916 B8R0.8 COCC[C@@H](C(=O)O)N Amb16183872 [0,1,0,0,0,0|2,0,0]=3 2917 B8R0.8 COCC[C@H](C(=O)O)N Amb16183870 [0,1,0,0,0,0|2,0,0]=3 2918 B8R0.8 COCC[C@H](C)C(O)=O Amb24392969 [0,1,0,0,0,0|2,0,0]=3 2919 B8R0.8 COCC[C@H](N)C(O)=O Amb24054991 [0,1,0,0,0,0|2,0,0]=3 2920 B8R0.8 COCOC(C)C(C)=O Amb24563208 [0,1,0,0,0,0|2,0,0]=3 2921 B8R0.8 COCO[C@@H](C)C(C)=O Amb25096675 [0,1,0,0,0,0|2,0,0]=3 2922 B8R0.8 COCO[C@@H](C)C(O)=O Amb25682837 [0,1,0,0,0,0|3,0,0]=4 2923 B8R0.8 COCO[C@H](C)C(O)=O Amb25706272 [0,1,0,0,0,0|3,0,0]=4 2924 B8R0.8 CONCC(C)C(N)=O Amb24440524 [0,1,0,0,0,0|3,0,0]=4 2925 B8R0.8 CONCC(N)C(O)=O Amb24392137 [0,1,0,0,0,0|3,0,0]=4 2926 B8R0.8 CONC[C@H](N)C(O)=O Amb25376688 [0,1,0,0,0,0|3,0,0]=4 2927 B8R0.8 CO\C=C/C(C)C(C)=O Amb25723165 [0,1,0,0,0,0|1,0,2]=4 2928 B8R0.8 CPOCC(N)C(O)=O Amb24423934 [0,1,0,0,0,0|3,0,0]=4 2929 B8R0.8 CSCCC(=O)C(O)=O Amb18643588 [0,1,0,0,0,0|2,0,1]=4 2930 B8R0.8 CSCCC(=O)C(O)=O Amb22274154 [0,1,0,0,0,0|2,0,1]=4 2931 B8R0.8 CSCCC(Br)C(O)=O Amb24682715 [0,1,0,0,0,0|2,0,0]=3 2932 B8R0.8 CSCCC(C(=O)Cl)N Amb17142908 [0,1,0,0,0,0|2,0,0]=3 2933 B8R0.8 CSCCC(C(=O)N)N Amb17142872 [0,1,0,0,0,0|2,0,0]=3 2934 B8R0.8 CSCCC(C(=O)O)N Amb1154122 [0,1,0,0,0,0|2,0,0]=3 2935 B8R0.8 CSCCC(C)C(C)=O Amb24650560 [0,1,0,0,0,0|1,0,0]=2 2936 B8R0.8 CSCCC(C)C(O)=O Amb24739356 [0,1,0,0,0,0|2,0,0]=3 2937 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [0,1,0,0,0,0|2,0,0]=3 2938 B8R0.8 CSCCC(N)C(=O)S Amb24407336 [0,1,0,0,0,0|2,0,0]=3 2939 B8R0.8 CSCCC(N)C(C)=C Amb25042760 [0,1,0,0,0,0|2,0,0]=3 2940 B8R0.8 CSCCC(N)C(O)=O Amb22168296 [0,1,0,0,0,0|2,0,0]=3 2941 B8R0.8 CSCCC(N)C(O)=O Amb22732346 [0,1,0,0,0,0|2,0,0]=3 2942 B8R0.8 CSCCC(N)P(O)=O Amb25362071 [0,1,0,0,0,0|3,0,0]=4 2943 B8R0.8 CSCCC(N)[13C](O)=O Amb22336208 [0,1,0,0,0,0|2,0,0]=3 2944 B8R0.8 CSCCC(O)C(C)=O Amb24741882 [0,1,0,0,0,0|1,0,0]=2 2945 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [0,1,0,0,0,0|2,0,0]=3 2946 B8R0.8 CSCCC(O)C(O)=O Amb18304609 [0,1,0,0,0,0|2,0,0]=3 2947 B8R0.8 CSCCN(C)C(=O)Cl Amb25214303 [0,1,0,0,0,0|3,0,0]=4 2948 B8R0.8 CSCCN(C)C(C)=N Amb25198272 [0,1,0,0,0,0|3,0,0]=4 2949 B8R0.8 CSCCN(C)C(C)=O Amb24096774 [0,1,0,0,0,0|2,0,0]=3 2950 B8R0.8 CSCCN(C)C(C)=S Amb24096775 [0,1,0,0,0,0|2,1,0]=4 2951 B8R0.8 CSCC[C@@H](Cl)C(=O)Cl Amb24544524 [0,1,0,0,0,0|2,0,0]=3 2952 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [0,1,0,0,0,0|2,0,0]=3 2953 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [0,1,0,0,0,0|2,0,0]=3 2954 B8R0.8 CSCC[C@@H](O)C(O)=O Amb25124092 [0,1,0,0,0,0|2,0,0]=3 2955 B8R0.8 CSCC[C@@H](S)C(O)=O Amb24340077 [0,1,0,0,0,0|2,0,0]=3 2956 B8R0.8 CSCC[C@H](Br)C(O)=O Amb25239326 [0,1,0,0,0,0|2,0,0]=3 2957 B8R0.8 CSCC[C@H](Cl)C(=O)Cl Amb25135376 [0,1,0,0,0,0|2,0,0]=3 2958 B8R0.8 CSCC[C@H](N)C(O)=O Amb17942996 [0,1,0,0,0,0|2,0,0]=3 2959 B8R0.8 CSCC[C@H](N)C(O)=O Amb22351191 [0,1,0,0,0,0|2,0,0]=3 2960 B8R0.8 CSCC[C@H](N)P(O)=O Amb25826489 [0,1,0,0,0,0|3,0,0]=4 2961 B8R0.8 CSCC[C@H]([15NH2])C(O)=O Amb22353588 [0,1,0,0,0,0|2,0,0]=3 2962 B8R0.8 CSCSC(C)C(C)=O Amb25162557 [0,1,0,0,0,0|2,0,0]=3 2963 B8R0.8 CSOC[C@H](N)C(O)=O Amb24428229 [0,1,0,0,0,0|3,0,0]=4 2964 B8R0.8 CS[13CH2][13CH2][13CH]([13C](=O)O)O Amb17615592 [0,1,0,0,0,0|2,0,0]=3 2965 B8R0.8 C[C@@H](CCC=C)C(C)=O Amb25114180 [0,1,0,0,0,0|0,0,2]=3 2966 B8R0.8 C[C@@H](CCCBr)C(O)=O Amb24480227 [0,1,0,0,0,0|2,0,0]=3 2967 B8R0.8 C[C@@H](Cl)[C@H](Cl)CCCO Amb24740916 [0,1,0,0,0,0|2,0,1]=4 2968 B8R0.8 C[C@@H](O)[C@@H](O)CCCO Amb24466205 [0,1,0,0,0,0|1,0,2]=4 2969 B8R0.8 C[C@@H](O)[C@H](Br)CCCC Amb25124035 [0,1,0,0,0,0|0,0,2]=3 2970 B8R0.8 C[C@@H](O)[C@H](C)CCCO Amb25233241 [0,1,0,0,0,0|1,0,2]=4 2971 B8R0.8 C[C@H](C(=O)O)CSCC Amb10844108 [0,1,0,0,0,0|2,0,0]=3 2972 B8R0.8 C[C@H](CCC#N)C(O)=O Amb25790580 [0,1,0,0,0,0|2,0,1]=4 2973 B8R0.8 C[C@H](CCC=C)C(O)=O Amb24337306 [0,1,0,0,0,0|1,0,2]=4 2974 B8R0.8 C[C@H](CCCBr)C(O)=O Amb24480175 [0,1,0,0,0,0|2,0,0]=3 2975 B8R0.8 C[C@H](N)[C@@H](N)CCCC Amb25341415 [0,1,0,0,0,0|1,0,1]=3 2976 B8R0.8 C[C@H](O)[C@@H](O)CCCC Amb24334203 [0,1,0,0,0,0|0,0,2]=3 2977 B8R0.8 C[C@H](O)[C@@H](O)CCCO Amb24575511 [0,1,0,0,0,0|1,0,2]=4 2978 B8R0.8 C[C@H](O)[C@H](Br)CCCC Amb25064520 [0,1,0,0,0,0|0,0,2]=3 2979 B8R0.8 C[C@H](O)[C@H](N)CCCC Amb25378726 [0,1,0,0,0,0|0,0,2]=3 2980 B8R0.8 C[C@H](O)[C@H](O)CCCO Amb24686400 [0,1,0,0,0,0|1,0,2]=4 2981 B8R0.8 C[Se]CCC(N)C(O)=O Amb20619393 [0,1,0,0,0,0|2,0,0]=3 2982 B8R0.8 C[Se]CC[C@H](C(=O)O)N Amb10601590 [0,1,0,0,0,0|2,0,0]=3 2983 B8R0.8 C\C(=C/CCC)\C(=O)O Amb10844998 [0,1,0,0,0,0|1,0,2]=4 2984 B8R0.8 C\C(=C/NCC)\C(C)=O Amb25767856 [0,1,0,0,0,0|1,0,2]=4 2985 B8R0.8 C\C(=C\CCC)\C(O)=O Amb25032199 [0,1,0,0,0,0|1,0,2]=4 2986 B8R0.8 C\C(=N\OCC)\C(C)=O Amb25188961 [0,1,0,0,0,0|2,0,1]=4 2987 B8R0.8 C\C=C/CC(F)C(C)=O Amb25829411 [0,1,0,0,0,0|0,0,2]=3 2988 B8R0.8 C\C=C/CC(O)C(C)=O Amb24551722 [0,1,0,0,0,0|0,0,2]=3 2989 B8R0.8 C\C=C/C[C@H](N)C(O)=O Amb24713154 [0,1,0,0,0,0|1,0,2]=4 2990 B8R0.8 C\C=C/C[C@H](O)C(C)=O Amb25087742 [0,1,0,0,0,0|0,0,2]=3 2991 B8R0.8 C\C=C\CC(C)C(O)=O Amb18642630 [0,1,0,0,0,0|1,0,2]=4 2992 B8R0.8 C\C=C\CC(F)C(C)=O Amb24516319 [0,1,0,0,0,0|0,0,2]=3 2993 B8R0.8 C\C=C\CC(O)C(C)=C Amb25712094 [0,1,0,0,0,0|1,0,2]=4 2994 B8R0.8 C\C=C\CC(O)C(C)=O Amb25707027 [0,1,0,0,0,0|0,0,2]=3 2995 B8R0.8 C\C=C\CC(O)C(O)=O Amb18642742 [0,1,0,0,0,0|1,0,2]=4 2996 B8R0.8 C\C=C\C[C@@H](N)C(O)=O Amb24632390 [0,1,0,0,0,0|1,0,2]=4 2997 B8R0.8 NC(=O)C(Cl)CCCCl Amb24480056 [0,1,0,0,0,0|2,0,0]=3 2998 B8R0.8 NC(=O)C(O)CCCO Amb25104583 [0,1,0,0,0,0|2,0,0]=3 2999 B8R0.8 NC(=O)[C@@H](O)CCCO Amb25804971 [0,1,0,0,0,0|2,0,0]=3 3000 B8R0.8 NC(C(=O)O)CCON Amb17593409 [0,1,0,0,0,0|3,0,0]=4 3001 B8R0.8 NC(CCC#N)C(O)=O Amb18642589 [0,1,0,0,0,0|2,0,1]=4 3002 B8R0.8 NC(CCC=O)C(O)=O Amb24340141 [0,1,0,0,0,0|2,0,1]=4 3003 B8R0.8 NC(CCCBr)C(O)=O Amb24480263 [0,1,0,0,0,0|2,0,0]=3 3004 B8R0.8 NC(CCCBr)P(O)=O Amb24377501 [0,1,0,0,0,0|3,0,0]=4 3005 B8R0.8 NC(CCCCl)C(O)=O Amb24472387 [0,1,0,0,0,0|2,0,0]=3 3006 B8R0.8 NC(CCCF)C(O)=O Amb25366994 [0,1,0,0,0,0|2,0,0]=3 3007 B8R0.8 NC(CCCO)C(O)=O Amb18642915 [0,1,0,0,0,0|2,0,0]=3 3008 B8R0.8 NC(CCCO)C(O)=O Amb22900028 [0,1,0,0,0,0|2,0,0]=3 3009 B8R0.8 NC(CCCO)P(O)=O Amb25726221 [0,1,0,0,0,0|3,0,0]=4 3010 B8R0.8 NC(COCO)C(O)=O Amb24731952 [0,1,0,0,0,0|3,0,0]=4 3011 B8R0.8 NCCCC(=O)C(O)=O Amb24081348 [0,1,0,0,0,0|2,0,1]=4 3012 B8R0.8 NCCCC(C(=O)O)Br Amb17595166 [0,1,0,0,0,0|2,0,0]=3 3013 B8R0.8 NCCCC(C(C)C)C Amb17569922 [0,1,0,0,0,0|2,0,1]=4 3014 B8R0.8 NCCCC(Cl)C(O)=O Amb24626933 [0,1,0,0,0,0|2,0,0]=3 3015 B8R0.8 NCCCC(N(C)C)C Amb17078915 [0,1,0,0,0,0|3,0,0]=4 3016 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [0,1,0,0,0,0|2,0,0]=3 3017 B8R0.8 NCCCC(N)C(O)=O Amb22489477 [0,1,0,0,0,0|2,0,0]=3 3018 B8R0.8 NCCCC(N)C(O)=O Amb22492665 [0,1,0,0,0,0|2,0,0]=3 3019 B8R0.8 NCCCC(O)C(O)=O Amb18124377 [0,1,0,0,0,0|2,0,0]=3 3020 B8R0.8 NCCC[C@@H](N)C(O)=O Amb22801212 [0,1,0,0,0,0|2,0,0]=3 3021 B8R0.8 NCCC[C@@H](O)C(O)=O Amb24459740 [0,1,0,0,0,0|2,0,0]=3 3022 B8R0.8 NCCC[C@@H]([NH3+])C(=O)O Amb10807472 [0,1,0,0,0,0|2,0,0]=3 3023 B8R0.8 NCCC[C@H](N)C(N)=O Amb24658293 [0,1,0,0,0,0|2,0,0]=3 3024 B8R0.8 NCCC[C@H](N)C(O)=O Amb20240598 [0,1,0,0,0,0|2,0,0]=3 3025 B8R0.8 NCCSC(F)C(O)=O Amb24478685 [0,1,0,0,0,0|3,0,0]=4 3026 B8R0.8 NOCCC(N)C(O)=O Amb21858490 [0,1,0,0,0,0|3,0,0]=4 3027 B8R0.8 NOCC[C@@H](N)C(O)=O Amb22745427 [0,1,0,0,0,0|3,0,0]=4 3028 B8R0.8 NOCC[C@@H](N)C(O)=O Amb22751695 [0,1,0,0,0,0|3,0,0]=4 3029 B8R0.8 N[C@@H](CCC=O)C(O)=O Amb25378080 [0,1,0,0,0,0|2,0,1]=4 3030 B8R0.8 N[C@@H](CCCN)C(O)=O Amb22746434 [0,1,0,0,0,0|2,0,0]=3 3031 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24117852 [0,1,0,0,0,0|3,0,0]=4 3032 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24666196 [0,1,0,0,0,0|3,0,0]=4 3033 B8R0.8 N[C@H](C(=O)O)CCC#N Amb16183912 [0,1,0,0,0,0|2,0,1]=4 3034 B8R0.8 N[C@H](CCC#N)C(O)=O Amb25063958 [0,1,0,0,0,0|2,0,1]=4 3035 B8R0.8 N[C@H](CCC=O)C(O)=O Amb24477812 [0,1,0,0,0,0|2,0,1]=4 3036 B8R0.8 O=C(Cl)C(Br)CCCBr Amb24387005 [0,1,0,0,0,0|2,0,0]=3 3037 B8R0.8 OC(=O)C(=O)CCCBr Amb24711405 [0,1,0,0,0,0|2,0,1]=4 3038 B8R0.8 OC(=O)C(=O)CCCCl Amb25274323 [0,1,0,0,0,0|2,0,1]=4 3039 B8R0.8 OC(=O)C(Br)CCCBr Amb22001929 [0,1,0,0,0,0|2,0,0]=3 3040 B8R0.8 OC(=O)C(CCCCl)Br Amb17595866 [0,1,0,0,0,0|2,0,0]=3 3041 B8R0.8 OC(=O)C(F)CCCCl Amb24683810 [0,1,0,0,0,0|2,0,0]=3 3042 B8R0.8 OCCCC(Cl)C(O)=O Amb25760339 [0,1,0,0,0,0|2,0,0]=3 3043 B8R0.8 OCCCC(O)C(O)=O Amb18642939 [0,1,0,0,0,0|2,0,0]=3 3044 B8R0.8 OCCC[C@@H](C(=O)O)N Amb16183887 [0,1,0,0,0,0|2,0,0]=3 3045 B8R0.8 OCCC[C@H](O)C(O)=O Amb24744314 [0,1,0,0,0,0|2,0,0]=3 3046 B8R0.8 [13CH3]SCCC(N)C(O)=O Amb22351494 [0,1,0,0,0,0|2,0,0]=3 3047 B8R0.8 [13CH3][Se]CCC(N)C(O)=O Amb22367237 [0,1,0,0,0,0|2,0,0]=3 3048 B8R0.8 [O-][N+](=O)C(Cl)CCCF Amb24340292 [0,1,0,0,0,0|3,0,0]=4 3049 B8R0.9 C#CC(N)CCC(O)=O Amb22352566 [0,1,0,0,0,0|1,0,2]=4 3050 B8R0.9 C=CC(N)CCC(O)=O Amb22056347 [0,1,0,0,0,0|1,0,2]=4 3051 B8R0.9 C=CC(O)CCC(O)=O Amb25785193 [0,1,0,0,0,0|1,0,2]=4 3052 B8R0.9 C=C[C@H](N)CCC(O)=O Amb25694354 [0,1,0,0,0,0|1,0,2]=4 3053 B8R0.9 CC(=C)CCC(=C)CBr Amb24495609 [0,1,0,0,0,0|2,0,1]=4 3054 B8R0.9 CC(=C)CCC(N)CO Amb25775333 [0,1,0,0,0,0|2,0,0]=3 3055 B8R0.9 CC(=C)CCC(O)CBr Amb25101568 [0,1,0,0,0,0|2,0,0]=3 3056 B8R0.9 CC(=C)CCC(O)CCl Amb25378826 [0,1,0,0,0,0|2,0,0]=3 3057 B8R0.9 CC(=C)CC[C@@H](O)C=C Amb24733257 [0,1,0,0,0,0|1,0,2]=4 3058 B8R0.9 CC(=C)CC[C@@H](O)CO Amb25099425 [0,1,0,0,0,0|2,0,0]=3 3059 B8R0.9 CC(=C)CC[C@H](O)CO Amb24732167 [0,1,0,0,0,0|2,0,0]=3 3060 B8R0.9 CC(=C)COC(=O)CC Amb25345772 [0,1,0,0,0,0|2,0,1]=4 3061 B8R0.9 CC(=O)CCC(=C)C#N Amb25086729 [0,1,0,0,0,0|1,0,2]=4 3062 B8R0.9 CC(=O)CCC(=C)C=O Amb24640352 [0,1,0,0,0,0|1,0,2]=4 3063 B8R0.9 CC(=O)CCC(=C)CC Amb24433642 [0,1,0,0,0,0|0,0,1]=2 3064 B8R0.9 CC(=O)CCC(=O)C=C Amb10562681 [0,1,0,0,0,0|0,0,3]=4 3065 B8R0.9 CC(=O)CCC(=O)C=O Amb25224384 [0,1,0,0,0,0|1,0,2]=4 3066 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,1,0,0,0,0|2,0,1]=4 3067 B8R0.9 CC(=O)CCC(Br)CCl Amb24480346 [0,1,0,0,0,0|1,0,0]=2 3068 B8R0.9 CC(=O)CCC(Cl)C=O Amb25275061 [0,1,0,0,0,0|1,0,1]=3 3069 B8R0.9 CC(=O)CCC(Cl)CO Amb25274671 [0,1,0,0,0,0|1,0,0]=2 3070 B8R0.9 CC(=O)CCC(F)CBr Amb25201516 [0,1,0,0,0,0|1,0,0]=2 3071 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,1,0,0,0,0|1,0,0]=2 3072 B8R0.9 CC(=O)CCC(N)CO Amb25257834 [0,1,0,0,0,0|1,0,0]=2 3073 B8R0.9 CC(=O)CCC(O)C=C Amb24614737 [0,1,0,0,0,0|0,0,2]=3 3074 B8R0.9 CC(=O)CCC(O)CCl Amb25118823 [0,1,0,0,0,0|1,0,0]=2 3075 B8R0.9 CC(=O)CNC(=O)CC Amb25292227 [0,1,0,0,0,0|1,0,1]=3 3076 B8R0.9 CC(=O)CNC(=O)CN Amb25837037 [0,1,0,0,0,0|2,0,1]=4 3077 B8R0.9 CC(=O)CNC(=O)NC Amb25228227 [0,1,0,0,0,0|2,0,1]=4 3078 B8R0.9 CC(=O)COC(=O)OC Amb25177471 [0,1,0,0,0,0|2,0,1]=4 3079 B8R0.9 CC(=O)CSC(=O)OC Amb25318847 [0,1,0,0,0,0|2,0,1]=4 3080 B8R0.9 CC(=O)NCC(=O)CBr Amb24590234 [0,1,0,0,0,0|2,0,1]=4 3081 B8R0.9 CC(=O)NCC(=O)CC Amb23555728 [0,1,0,0,0,0|1,0,1]=3 3082 B8R0.9 CC(=O)NCC(=S)OC Amb25041236 [0,1,0,0,0,0|2,0,1]=4 3083 B8R0.9 CC(=O)NCC(F)CBr Amb24676009 [0,1,0,0,0,0|2,0,0]=3 3084 B8R0.9 CC(=O)NCC(N)CO Amb25276356 [0,1,0,0,0,0|2,0,0]=3 3085 B8R0.9 CC(=O)NCC(O)CCl Amb22235217 [0,1,0,0,0,0|2,0,0]=3 3086 B8R0.9 CC(=O)NCC(O)CN Amb25139837 [0,1,0,0,0,0|2,0,0]=3 3087 B8R0.9 CC(=O)NCC(O)CO Amb24359036 [0,1,0,0,0,0|2,0,0]=3 3088 B8R0.9 CC(=O)NC[C@@H](O)CCl Amb22746506 [0,1,0,0,0,0|2,0,0]=3 3089 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,1,0,0,0,0|2,0,0]=3 3090 B8R0.9 CC(=O)NN=C(N)CC Amb24477734 [0,1,0,0,0,0|2,0,1]=4 3091 B8R0.9 CC(=O)OCC(=C)CBr Amb25685305 [0,1,0,0,0,0|2,0,1]=4 3092 B8R0.9 CC(=O)OCC(=C)CC Amb24571642 [0,1,0,0,0,0|1,0,1]=3 3093 B8R0.9 CC(=O)OCC(=C)CCl Amb24409101 [0,1,0,0,0,0|2,0,1]=4 3094 B8R0.9 CC(=O)OCC(=O)CCl Amb19944668 [0,1,0,0,0,0|2,0,1]=4 3095 B8R0.9 CC(=O)OCC(=O)CF Amb25744125 [0,1,0,0,0,0|2,0,1]=4 3096 B8R0.9 CC(=O)OCC(=O)CS Amb24456592 [0,1,0,0,0,0|2,0,1]=4 3097 B8R0.9 CC(=O)OCC(Br)C=C Amb24480093 [0,1,0,0,0,0|1,0,2]=4 3098 B8R0.9 CC(=O)OCC(Br)CCl Amb24713634 [0,1,0,0,0,0|2,0,0]=3 3099 B8R0.9 CC(=O)OCC(CCl)O Amb17593815 [0,1,0,0,0,0|2,0,0]=3 3100 B8R0.9 CC(=O)OCC(Cl)CBr Amb25113223 [0,1,0,0,0,0|2,0,0]=3 3101 B8R0.9 CC(=O)OCC(Cl)CCl Amb24415406 [0,1,0,0,0,0|2,0,0]=3 3102 B8R0.9 CC(=O)OCC(F)CBr Amb25275153 [0,1,0,0,0,0|2,0,0]=3 3103 B8R0.9 CC(=O)OCC(O)CBr Amb24443015 [0,1,0,0,0,0|2,0,0]=3 3104 B8R0.9 CC(=O)OCC(O)CF Amb24386984 [0,1,0,0,0,0|2,0,0]=3 3105 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,1,0,0,0,0|2,0,0]=3 3106 B8R0.9 CC(=O)OC[C@@H](Cl)CCl Amb24470042 [0,1,0,0,0,0|2,0,0]=3 3107 B8R0.9 CC(=O)OC[C@@H](O)CBr Amb25232647 [0,1,0,0,0,0|2,0,0]=3 3108 B8R0.9 CC(=O)OC[C@H](Cl)CCl Amb25300289 [0,1,0,0,0,0|2,0,0]=3 3109 B8R0.9 CC(=O)OC[C@H](O)C=C Amb24395445 [0,1,0,0,0,0|1,0,2]=4 3110 B8R0.9 CC(=O)ON=C(N)CC Amb24532432 [0,1,0,0,0,0|2,0,1]=4 3111 B8R0.9 CC(=O)ONC(=O)CC Amb22232333 [0,1,0,0,0,0|2,0,1]=4 3112 B8R0.9 CC(=O)SCC(Cl)CCl Amb24572286 [0,1,0,0,0,0|2,0,0]=3 3113 B8R0.9 CC(=O)SCC(N)CO Amb25245383 [0,1,0,0,0,0|2,0,0]=3 3114 B8R0.9 CC(=O)SCC(O)CO Amb25105864 [0,1,0,0,0,0|2,0,0]=3 3115 B8R0.9 CC(=O)\C=C/C(=O)CC Amb24649767 [0,1,0,0,0,0|0,0,3]=4 3116 B8R0.9 CC(=O)\C=C/[C@H](O)CO Amb25735081 [0,1,0,0,0,0|1,0,2]=4 3117 B8R0.9 CC(Br)=CCC(O)CO Amb25846160 [0,1,0,0,0,0|2,0,1]=4 3118 B8R0.9 CC(C#N)SCC(C)=O Amb25134370 [0,1,0,0,0,0|2,0,1]=4 3119 B8R0.9 CC(C)=CCC(N)CO Amb25320777 [0,1,0,0,0,0|2,0,1]=4 3120 B8R0.9 CC(C)=CCC(O)CCl Amb24653595 [0,1,0,0,0,0|2,0,1]=4 3121 B8R0.9 CC(C)=CC[C@H](O)CCl Amb25836400 [0,1,0,0,0,0|2,0,1]=4 3122 B8R0.9 CC(C)CCC(Br)CC Amb18330345 [0,1,0,0,0,0|1,0,1]=3 3123 B8R0.9 CC(C)CCC(C)CC Amb22228305 [0,1,0,0,0,0|1,0,1]=3 3124 B8R0.9 CC(C)CCC(C)CCl Amb25774761 [0,1,0,0,0,0|2,0,1]=4 3125 B8R0.9 CC(C)CCC(C)CO Amb24478637 [0,1,0,0,0,0|2,0,1]=4 3126 B8R0.9 CC(C)CCC(Cl)CC Amb25839524 [0,1,0,0,0,0|1,0,1]=3 3127 B8R0.9 CC(C)CCC(F)CN Amb24481735 [0,1,0,0,0,0|2,0,1]=4 3128 B8R0.9 CC(C)CCC(N)CN Amb25336845 [0,1,0,0,0,0|2,0,1]=4 3129 B8R0.9 CC(C)CCC(N)CO Amb18832528 [0,1,0,0,0,0|2,0,1]=4 3130 B8R0.9 CC(C)CCC(O)CC Amb19944686 [0,1,0,0,0,0|1,0,1]=3 3131 B8R0.9 CC(C)CCC(O)OC Amb25320255 [0,1,0,0,0,0|2,0,1]=4 3132 B8R0.9 CC(C)CC[C@@H](O)CC Amb25267597 [0,1,0,0,0,0|1,0,1]=3 3133 B8R0.9 CC(C)CC[C@H](C)CO Amb25781634 [0,1,0,0,0,0|2,0,1]=4 3134 B8R0.9 CC(C)NCC(Cl)CC Amb24481752 [0,1,0,0,0,0|2,0,1]=4 3135 B8R0.9 CC(C)NCC(N)CC Amb18305275 [0,1,0,0,0,0|2,0,1]=4 3136 B8R0.9 CC(C)NCC(O)CC Amb18304016 [0,1,0,0,0,0|2,0,1]=4 3137 B8R0.9 CC(C)NC[C@@H](C)CC Amb25711431 [0,1,0,0,0,0|2,0,1]=4 3138 B8R0.9 CC(C)NC[C@H](N)CC Amb25141281 [0,1,0,0,0,0|2,0,1]=4 3139 B8R0.9 CC(C)OCC(Cl)CC Amb25115336 [0,1,0,0,0,0|2,0,1]=4 3140 B8R0.9 CC(C)OCC(O)CC Amb25372259 [0,1,0,0,0,0|2,0,1]=4 3141 B8R0.9 CC(C)OC[C@@H](N)CC Amb25310367 [0,1,0,0,0,0|2,0,1]=4 3142 B8R0.9 CC(C)SCC(C)CC Amb24642898 [0,1,0,0,0,0|2,0,1]=4 3143 B8R0.9 CC(C)SC[C@@H](N)CC Amb24481833 [0,1,0,0,0,0|2,0,1]=4 3144 B8R0.9 CC(C)SC[C@H](O)CC Amb24363374 [0,1,0,0,0,0|2,0,1]=4 3145 B8R0.9 CC(CBr)CCC(O)=O Amb25806134 [0,1,0,0,0,0|2,0,0]=3 3146 B8R0.9 CC(CBr)COC(C)=O Amb22386917 [0,1,0,0,0,0|2,0,0]=3 3147 B8R0.9 CC(CC)=NNC(C)=O Amb24732912 [0,1,0,0,0,0|2,0,1]=4 3148 B8R0.9 CC(CCC(C)=C)C=O Amb18642470 [0,1,0,0,0,0|2,0,1]=4 3149 B8R0.9 CC(CCC(C)=C)NN Amb24360588 [0,1,0,0,0,0|3,0,0]=4 3150 B8R0.9 CC(CCC(C)=O)=CCl Amb24581923 [0,1,0,0,0,0|1,0,2]=4 3151 B8R0.9 CC(CCC(C)=O)=NO Amb24760824 [0,1,0,0,0,0|2,0,1]=4 3152 B8R0.9 CC(CCC(C)=O)C#N Amb18642304 [0,1,0,0,0,0|1,0,1]=3 3153 B8R0.9 CC(CCC(C)=O)C=O Amb18642612 [0,1,0,0,0,0|1,0,1]=3 3154 B8R0.9 CC(CCC(C)N)OC Amb25093976 [0,1,0,0,0,0|2,0,1]=4 3155 B8R0.9 CC(CCC(N)=O)C#N Amb25146074 [0,1,0,0,0,0|2,0,1]=4 3156 B8R0.9 CC(CCC(N)=O)CN Amb24745140 [0,1,0,0,0,0|2,0,0]=3 3157 B8R0.9 CC(CCC(O)=O)C#N Amb18642500 [0,1,0,0,0,0|2,0,1]=4 3158 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [0,1,0,0,0,0|1,0,2]=4 3159 B8R0.9 CC(CCl)CCC(C)=C Amb25068704 [0,1,0,0,0,0|2,0,0]=3 3160 B8R0.9 CC(CCl)OCC(C)=O Amb25118198 [0,1,0,0,0,0|2,0,0]=3 3161 B8R0.9 CC(CCl)OCC(N)=O Amb25789772 [0,1,0,0,0,0|3,0,0]=4 3162 B8R0.9 CC(CN)CCC(O)=O Amb22059189 [0,1,0,0,0,0|2,0,0]=3 3163 B8R0.9 CC(CN)CNC(C)=O Amb18300590 [0,1,0,0,0,0|2,0,0]=3 3164 B8R0.9 CC(CN)OCC(C)=C Amb18630505 [0,1,0,0,0,0|3,0,0]=4 3165 B8R0.9 CC(CN)OCC(C)=O Amb18110559 [0,1,0,0,0,0|2,0,0]=3 3166 B8R0.9 CC(CN)OCC(O)=O Amb18629591 [0,1,0,0,0,0|3,0,0]=4 3167 B8R0.9 CC(CN)SCC(N)=O Amb24753382 [0,1,0,0,0,0|3,0,0]=4 3168 B8R0.9 CC(CNC(N)=O)CN Amb18994081 [0,1,0,0,0,0|3,0,0]=4 3169 B8R0.9 CC(CO)CCC(C)=C Amb24389869 [0,1,0,0,0,0|2,0,0]=3 3170 B8R0.9 CC(CO)CN=C(C)N Amb24349921 [0,1,0,0,0,0|3,0,0]=4 3171 B8R0.9 CC(CO)CNC(C)=O Amb25050315 [0,1,0,0,0,0|2,0,0]=3 3172 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,1,0,0,0,0|3,0,0]=4 3173 B8R0.9 CC(CO)CSC(C)=O Amb24466300 [0,1,0,0,0,0|2,0,0]=3 3174 B8R0.9 CC(CO)NCC(C)=C Amb25289088 [0,1,0,0,0,0|3,0,0]=4 3175 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [0,1,0,0,0,0|3,0,0]=4 3176 B8R0.9 CC(CO)SCC(C)=O Amb25195670 [0,1,0,0,0,0|2,0,0]=3 3177 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [0,1,0,0,0,0|3,0,0]=4 3178 B8R0.9 CC(COC(C)=O)C#N Amb24395253 [0,1,0,0,0,0|2,0,1]=4 3179 B8R0.9 CC(COC(C)=O)C=O Amb18642789 [0,1,0,0,0,0|2,0,1]=4 3180 B8R0.9 CC(COC(C)=O)NN Amb24439584 [0,1,0,0,0,0|3,0,0]=4 3181 B8R0.9 CC(N)CCC(N)CF Amb24670747 [0,1,0,0,0,0|2,0,1]=4 3182 B8R0.9 CC(O)CCC(Cl)CC Amb24480214 [0,1,0,0,0,0|0,0,2]=3 3183 B8R0.9 CC(O)CCC(O)CC Amb25090764 [0,1,0,0,0,0|0,0,2]=3 3184 B8R0.9 CC(O)CCC(O)CF Amb24536636 [0,1,0,0,0,0|1,0,2]=4 3185 B8R0.9 CC(ON)CNC(=O)C Amb17138377 [0,1,0,0,0,0|3,0,0]=4 3186 B8R0.9 CCC(=O)CCC(=O)C Amb17593347 [0,1,0,0,0,0|0,0,1]=2 3187 B8R0.9 CCC(=O)CCC(=O)Cl Amb24420925 [0,1,0,0,0,0|1,0,1]=3 3188 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,1,0,0,0,0|1,0,1]=3 3189 B8R0.9 CCC(=O)CCC(C)Cl Amb24571703 [0,1,0,0,0,0|1,0,2]=4 3190 B8R0.9 CCC(=O)CCC(N)=O Amb24669836 [0,1,0,0,0,0|1,0,1]=3 3191 B8R0.9 CCC(=O)CCN(C)C Amb24444934 [0,1,0,0,0,0|2,0,1]=4 3192 B8R0.9 CCC(=O)CCP(O)=O Amb24748238 [0,1,0,0,0,0|2,0,1]=4 3193 B8R0.9 CCC(=O)CC[N+]([O-])=O Amb25236332 [0,1,0,0,0,0|2,0,1]=4 3194 B8R0.9 CCC(=O)NCC(=O)N Amb17231864 [0,1,0,0,0,0|2,0,1]=4 3195 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,1,0,0,0,0|2,0,1]=4 3196 B8R0.9 CCC(=O)OCC(O)=O Amb18642872 [0,1,0,0,0,0|2,0,1]=4 3197 B8R0.9 CCC(=S)SCC(O)=O Amb24480232 [0,1,0,0,0,0|2,0,1]=4 3198 B8R0.9 CCC(Br)CCC(=O)Cl Amb25352038 [0,1,0,0,0,0|1,0,0]=2 3199 B8R0.9 CCC(Br)CCC(C)=O Amb24480025 [0,1,0,0,0,0|0,0,0]=1 3200 B8R0.9 CCC(Br)\C=C\C(C)=O Amb25800220 [0,1,0,0,0,0|0,0,2]=3 3201 B8R0.9 CCC(Br)\C=C\C(O)=O Amb18651360 [0,1,0,0,0,0|1,0,2]=4 3202 B8R0.9 CCC(C)=CCC(C)=O Amb24736154 [0,1,0,0,0,0|0,0,2]=3 3203 B8R0.9 CCC(C)C=CC(C)=O Amb24062970 [0,1,0,0,0,0|0,0,2]=3 3204 B8R0.9 CCC(C)CCB(O)O Amb25063737 [0,1,0,0,0,0|2,0,1]=4 3205 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,1,0,0,0,0|0,0,0]=1 3206 B8R0.9 CCC(C)CCC(C)Br Amb19078823 [0,1,0,0,0,0|1,0,1]=3 3207 B8R0.9 CCC(C)CCC(C)Cl Amb25361898 [0,1,0,0,0,0|1,0,1]=3 3208 B8R0.9 CCC(C)CCC(C)O Amb22732215 [0,1,0,0,0,0|0,0,2]=3 3209 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,1,0,0,0,0|1,0,0]=2 3210 B8R0.9 CCC(C)CNC(C)=N Amb25770210 [0,1,0,0,0,0|2,0,0]=3 3211 B8R0.9 CCC(C)CNC(N)=N Amb25810483 [0,1,0,0,0,0|3,0,0]=4 3212 B8R0.9 CCC(C)CNC(N)=S Amb24436213 [0,1,0,0,0,0|2,1,0]=4 3213 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,1,0,0,0,0|2,0,0]=3 3214 B8R0.9 CCC(C)COC(C)=O Amb20621577 [0,1,0,0,0,0|1,0,0]=2 3215 B8R0.9 CCC(C)COC(N)=O Amb25188918 [0,1,0,0,0,0|2,0,0]=3 3216 B8R0.9 CCC(C)CSC(N)=N Amb25306741 [0,1,0,0,0,0|3,0,0]=4 3217 B8R0.9 CCC(C)NCC(=C)Br Amb19005214 [0,1,0,0,0,0|2,0,1]=4 3218 B8R0.9 CCC(C)NCC(=C)Cl Amb19004829 [0,1,0,0,0,0|2,0,1]=4 3219 B8R0.9 CCC(C)NCC(C)=O Amb25062894 [0,1,0,0,0,0|1,0,0]=2 3220 B8R0.9 CCC(C)NCC(C)Cl Amb24363856 [0,1,0,0,0,0|2,0,1]=4 3221 B8R0.9 CCC(C)NCC(C)N Amb19009701 [0,1,0,0,0,0|2,0,1]=4 3222 B8R0.9 CCC(C)NC[C@H](C)N Amb24750100 [0,1,0,0,0,0|2,0,1]=4 3223 B8R0.9 CCC(C)OCC(=C)Br Amb24740504 [0,1,0,0,0,0|2,0,1]=4 3224 B8R0.9 CCC(C)OCC(C)N Amb19018764 [0,1,0,0,0,0|2,0,1]=4 3225 B8R0.9 CCC(C)OCC(N)=N Amb24501524 [0,1,0,0,0,0|3,0,0]=4 3226 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,1,0,0,0,0|2,0,0]=3 3227 B8R0.9 CCC(C)OC[C@@H](C)N Amb24374473 [0,1,0,0,0,0|2,0,1]=4 3228 B8R0.9 CCC(C)OC[C@H](C)N Amb24711079 [0,1,0,0,0,0|2,0,1]=4 3229 B8R0.9 CCC(C)ON=C(C)C Amb25682628 [0,1,0,0,0,0|3,0,0]=4 3230 B8R0.9 CCC(C)ONC(C)=O Amb24360136 [0,1,0,0,0,0|2,0,0]=3 3231 B8R0.9 CCC(C)ONC(N)=O Amb24618660 [0,1,0,0,0,0|3,0,0]=4 3232 B8R0.9 CCC(C)SCC(=C)Br Amb25696158 [0,1,0,0,0,0|2,0,1]=4 3233 B8R0.9 CCC(C)SCC(C)O Amb24738776 [0,1,0,0,0,0|1,0,2]=4 3234 B8R0.9 CCC(C)SC[C@@H](C)O Amb25283171 [0,1,0,0,0,0|1,0,2]=4 3235 B8R0.9 CCC(C)\C=C\C(O)=O Amb18988312 [0,1,0,0,0,0|1,0,2]=4 3236 B8R0.9 CCC(CSC(C)C)N Amb17485964 [0,1,0,0,0,0|2,0,1]=4 3237 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [0,1,0,0,0,0|1,0,2]=4 3238 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,1,0,0,0,0|1,0,0]=2 3239 B8R0.9 CCC(Cl)CCC(C)=C Amb24387453 [0,1,0,0,0,0|1,0,0]=2 3240 B8R0.9 CCC(Cl)CCC(Cl)Cl Amb24649988 [0,1,0,0,0,0|2,0,1]=4 3241 B8R0.9 CCC(Cl)CNC(C)=O Amb25292231 [0,1,0,0,0,0|1,0,0]=2 3242 B8R0.9 CCC(Cl)COC(N)=O Amb22274267 [0,1,0,0,0,0|2,0,0]=3 3243 B8R0.9 CCC(Cl)\C=C\C(C)=O Amb25060704 [0,1,0,0,0,0|0,0,2]=3 3244 B8R0.9 CCC(Cl)\C=C\C(O)=O Amb24714953 [0,1,0,0,0,0|1,0,2]=4 3245 B8R0.9 CCC(F)COC(C)=O Amb24361428 [0,1,0,0,0,0|1,0,0]=2 3246 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,1,0,0,0,0|1,0,0]=2 3247 B8R0.9 CCC(N)CCN(C)C Amb18203193 [0,1,0,0,0,0|2,0,0]=3 3248 B8R0.9 CCC(N)CCS(C)=O Amb25281105 [0,1,0,0,0,0|1,0,0]=2 3249 B8R0.9 CCC(N)CNC(C)=O Amb25256213 [0,1,0,0,0,0|1,0,0]=2 3250 B8R0.9 CCC(N)CNS(C)=O Amb25263509 [0,1,0,0,0,0|2,0,0]=3 3251 B8R0.9 CCC(NCC(=C)C)C Amb17308623 [0,1,0,0,0,0|2,0,0]=3 3252 B8R0.9 CCC(O)C#CC(N)=O Amb25070339 [0,1,0,0,0,0|1,0,2]=4 3253 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,1,0,0,0,0|2,0,1]=4 3254 B8R0.9 CCC(O)CCC(C)=C Amb25073903 [0,1,0,0,0,0|1,0,0]=2 3255 B8R0.9 CCC(O)CCC(C)=O Amb24586292 [0,1,0,0,0,0|0,0,0]=1 3256 B8R0.9 CCC(O)CNC(C)=O Amb24715716 [0,1,0,0,0,0|1,0,0]=2 3257 B8R0.9 CCC(O)CNS(C)=O Amb25176378 [0,1,0,0,0,0|2,0,0]=3 3258 B8R0.9 CCC(O)NCC(O)=O Amb24445948 [0,1,0,0,0,0|2,0,0]=3 3259 B8R0.9 CCC(O)\C=C\C(C)=O Amb25107127 [0,1,0,0,0,0|0,0,2]=3 3260 B8R0.9 CCC(O)\C=C\C(O)=O Amb25328660 [0,1,0,0,0,0|1,0,2]=4 3261 B8R0.9 CCC(S)\C=C\C(O)=O Amb18124688 [0,1,0,0,0,0|1,0,2]=4 3262 B8R0.9 CCN(C)CCC(C)=C Amb24501501 [0,1,0,0,0,0|2,0,0]=3 3263 B8R0.9 CCN(C)CCC(C)Br Amb24458693 [0,1,0,0,0,0|2,0,1]=4 3264 B8R0.9 CCN(C)CCC(C)Cl Amb24481799 [0,1,0,0,0,0|2,0,1]=4 3265 B8R0.9 CCN(C)CCC(C)O Amb25306759 [0,1,0,0,0,0|1,0,2]=4 3266 B8R0.9 CCN(C)\C=C/C(C)=O Amb25724295 [0,1,0,0,0,0|1,0,2]=4 3267 B8R0.9 CCN(C)\C=C\C(C)=O Amb24634600 [0,1,0,0,0,0|1,0,2]=4 3268 B8R0.9 CCS(=O)CCC(C)=O Amb25765620 [0,1,0,0,0,0|1,0,0]=2 3269 B8R0.9 CCS(=O)CCC(C)C Amb24448788 [0,1,0,0,0,0|2,0,1]=4 3270 B8R0.9 CCS(=O)CCC(C)N Amb24383525 [0,1,0,0,0,0|2,0,1]=4 3271 B8R0.9 CCS(=O)NCC(C)=C Amb24557350 [0,1,0,0,0,0|3,0,0]=4 3272 B8R0.9 CCS(=O)NCC(C)=O Amb25177389 [0,1,0,0,0,0|2,0,0]=3 3273 B8R0.9 CC[C@@H](C)CCC(C)=O Amb24749043 [0,1,0,0,0,0|0,0,0]=1 3274 B8R0.9 CC[C@@H](C)CC[C@@H](C)O Amb22896942 [0,1,0,0,0,0|0,0,2]=3 3275 B8R0.9 CC[C@@H](C)CC[C@H](C)O Amb22896941 [0,1,0,0,0,0|0,0,2]=3 3276 B8R0.9 CC[C@@H](C)COC(N)=O Amb24586795 [0,1,0,0,0,0|2,0,0]=3 3277 B8R0.9 CC[C@@H](C)\C=C\C(O)=O Amb24117189 [0,1,0,0,0,0|1,0,2]=4 3278 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,1,0,0,0,0|1,0,0]=2 3279 B8R0.9 CC[C@@H](O)C#CC(O)=O Amb25785824 [0,1,0,0,0,0|1,0,2]=4 3280 B8R0.9 CC[C@@H](O)CNN(C)C Amb24673375 [0,1,0,0,0,0|3,0,0]=4 3281 B8R0.9 CC[C@H](C)CCN(C)C Amb25263133 [0,1,0,0,0,0|2,0,0]=3 3282 B8R0.9 CC[C@H](C)CC[C@@H](C)O Amb25055436 [0,1,0,0,0,0|0,0,2]=3 3283 B8R0.9 CC[C@H](C)COC(N)=O Amb24333141 [0,1,0,0,0,0|2,0,0]=3 3284 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,1,0,0,0,0|2,0,0]=3 3285 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,1,0,0,0,0|2,0,0]=3 3286 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,1,0,0,0,0|1,0,0]=2 3287 B8R0.9 CC[C@H](N)CCN(C)C Amb24481832 [0,1,0,0,0,0|2,0,0]=3 3288 B8R0.9 CC[C@H](N)CSC(N)=N Amb25328324 [0,1,0,0,0,0|3,0,0]=4 3289 B8R0.9 CC[C@H](O)C#CC(C)=C Amb25285633 [0,1,0,0,0,0|1,0,2]=4 3290 B8R0.9 CC[C@H](O)CCC(N)=O Amb25785287 [0,1,0,0,0,0|1,0,0]=2 3291 B8R0.9 CC[C@H](O)CNN(C)C Amb25333026 [0,1,0,0,0,0|3,0,0]=4 3292 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,1,0,0,0,0|2,0,0]=3 3293 B8R0.9 CC\C(\C)=C/CC(C)=O Amb24333826 [0,1,0,0,0,0|0,0,2]=3 3294 B8R0.9 CC\C(\C)=C\CC(C)=O Amb25773428 [0,1,0,0,0,0|0,0,2]=3 3295 B8R0.9 CN(C)CCC(O)CN Amb18124365 [0,1,0,0,0,0|3,0,0]=4 3296 B8R0.9 CN(C)CCN(C)CC Amb24065168 [0,1,0,0,0,0|3,0,0]=4 3297 B8R0.9 CNC(=O)CCC(=O)C Amb17334107 [0,1,0,0,0,0|1,0,1]=3 3298 B8R0.9 CNC(=O)CCC(=O)N Amb17334114 [0,1,0,0,0,0|2,0,1]=4 3299 B8R0.9 CNC(=O)CCS(C)=O Amb24476726 [0,1,0,0,0,0|2,0,1]=4 3300 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,1,0,0,0,0|2,0,0]=3 3301 B8R0.9 CNC(C)CCN(C)C Amb24612965 [0,1,0,0,0,0|3,0,0]=4 3302 B8R0.9 CNC(C)CNC(N)=O Amb24405703 [0,1,0,0,0,0|3,0,0]=4 3303 B8R0.9 CNC(C)CNS(C)=O Amb24753150 [0,1,0,0,0,0|3,0,0]=4 3304 B8R0.9 COC(=O)CCC(=O)C Amb13777321 [0,1,0,0,0,0|1,0,1]=3 3305 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,1,0,0,0,0|2,0,1]=4 3306 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,1,0,0,0,0|2,0,0]=3 3307 B8R0.9 COC(C)CNC(C)=O Amb24574997 [0,1,0,0,0,0|2,0,0]=3 3308 B8R0.9 COC(C)CNS(C)=O Amb25359541 [0,1,0,0,0,0|3,0,0]=4 3309 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,1,0,0,0,0|2,0,0]=3 3310 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,1,0,0,0,0|2,0,0]=3 3311 B8R0.9 COC(C)OCC(O)=O Amb24417299 [0,1,0,0,0,0|3,0,0]=4 3312 B8R0.9 COC(Cl)CCN(C)C Amb24547760 [0,1,0,0,0,0|3,0,0]=4 3313 B8R0.9 CON(C)CCC(C)=C Amb24718119 [0,1,0,0,0,0|3,0,0]=4 3314 B8R0.9 COP(O)CCC(O)=O Amb22734636 [0,1,0,0,0,0|3,0,0]=4 3315 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,1,0,0,0,0|2,0,0]=3 3316 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,1,0,0,0,0|2,0,0]=3 3317 B8R0.9 CSC(C)CNC(C)=O Amb25744770 [0,1,0,0,0,0|2,0,0]=3 3318 B8R0.9 CSC(C)CNC(N)=O Amb25688045 [0,1,0,0,0,0|3,0,0]=4 3319 B8R0.9 C[C@@H](CBr)CCC(O)=O Amb24458738 [0,1,0,0,0,0|2,0,0]=3 3320 B8R0.9 C[C@@H](CBr)COC(C)=O Amb24373843 [0,1,0,0,0,0|2,0,0]=3 3321 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,1,0,0,0,0|1,0,0]=2 3322 B8R0.9 C[C@@H](CCC(C)=O)C=O Amb24441758 [0,1,0,0,0,0|1,0,1]=3 3323 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [0,1,0,0,0,0|1,0,2]=4 3324 B8R0.9 C[C@@H](CO)NCC(C)=O Amb24693447 [0,1,0,0,0,0|2,0,0]=3 3325 B8R0.9 C[C@@H](O)CC[C@H](C)CO Amb25271414 [0,1,0,0,0,0|1,0,2]=4 3326 B8R0.9 C[C@@H](O)CC[C@H](O)CO Amb25346392 [0,1,0,0,0,0|1,0,2]=4 3327 B8R0.9 C[C@H](CCC(O)=O)C#C Amb25250566 [0,1,0,0,0,0|1,0,2]=4 3328 B8R0.9 C[C@H](CO)CC=C(C)C Amb25044656 [0,1,0,0,0,0|2,0,1]=4 3329 B8R0.9 C[C@H](CO)CNC(N)=O Amb25715034 [0,1,0,0,0,0|3,0,0]=4 3330 B8R0.9 C[C@H](CO)COC(C)=O Amb25846526 [0,1,0,0,0,0|2,0,0]=3 3331 B8R0.9 C[C@H](CO)SCC(C)=C Amb25052251 [0,1,0,0,0,0|3,0,0]=4 3332 B8R0.9 C[C@H](O)CC[C@H](O)CC Amb25794691 [0,1,0,0,0,0|0,0,2]=3 3333 B8R0.9 C[C@H](O)CC[C@H](O)CO Amb24363660 [0,1,0,0,0,0|1,0,2]=4 3334 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [0,1,0,0,0,0|1,0,2]=4 3335 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [0,1,0,0,0,0|0,0,2]=3 3336 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [0,1,0,0,0,0|0,0,2]=3 3337 B8R0.9 C\C(\CCC(C)=O)=N/O Amb24422445 [0,1,0,0,0,0|2,0,1]=4 3338 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [0,1,0,0,0,0|1,0,2]=4 3339 B8R0.9 C\C(\Cl)=C\CC(=O)CC Amb25377805 [0,1,0,0,0,0|1,0,2]=4 3340 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [0,1,0,0,0,0|1,0,2]=4 3341 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [0,1,0,0,0,0|1,0,2]=4 3342 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [0,1,0,0,0,0|1,0,2]=4 3343 B8R0.9 C\N=[N+](\[O-])/COC(C)=O Amb25339097 [0,1,0,0,0,0|3,0,0]=4 3344 B8R0.9 NC(=O)NCC(O)CO Amb25146091 [0,1,0,0,0,0|3,0,0]=4 3345 B8R0.9 NC(=O)NCC(S)CS Amb25337646 [0,1,0,0,0,0|3,0,0]=4 3346 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,1,0,0,0,0|3,0,0]=4 3347 B8R0.9 NC(=O)OCC(O)CO Amb24683881 [0,1,0,0,0,0|3,0,0]=4 3348 B8R0.9 NC(C=C)CCC(=O)O Amb10843623 [0,1,0,0,0,0|1,0,2]=4 3349 B8R0.9 NC(CCC(N)=O)C#N Amb24340237 [0,1,0,0,0,0|2,0,1]=4 3350 B8R0.9 NC(CCC(O)=O)CO Amb18642916 [0,1,0,0,0,0|2,0,0]=3 3351 B8R0.9 NC(CF)CCC(N)=O Amb24599972 [0,1,0,0,0,0|2,0,0]=3 3352 B8R0.9 NC(CF)CCC(O)=O Amb19148378 [0,1,0,0,0,0|2,0,0]=3 3353 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,1,0,0,0,0|2,0,1]=4 3354 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,1,0,0,0,0|2,0,1]=4 3355 B8R0.9 NCC(CCN(C)C)C Amb17334118 [0,1,0,0,0,0|3,0,0]=4 3356 B8R0.9 NCC(N)CCC(O)=O Amb19328773 [0,1,0,0,0,0|2,0,0]=3 3357 B8R0.9 NCC(O)CCC(N)=O Amb24340194 [0,1,0,0,0,0|2,0,0]=3 3358 B8R0.9 NCC(O)CCC(O)=O Amb18124376 [0,1,0,0,0,0|2,0,0]=3 3359 B8R0.9 NCC(O)CCP(O)=O Amb24760103 [0,1,0,0,0,0|3,0,0]=4 3360 B8R0.9 NC[C@H](O)CCC(O)=O Amb24383262 [0,1,0,0,0,0|2,0,0]=3 3361 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,1,0,0,0,0|2,0,1]=4 3362 B8R0.9 N[C@@H](CCC(N)=O)C=O Amb25104754 [0,1,0,0,0,0|2,0,1]=4 3363 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [0,1,0,0,0,0|2,0,1]=4 3364 B8R0.9 N[C@@H](CCC(O)=O)CO Amb24685421 [0,1,0,0,0,0|2,0,0]=3 3365 B8R0.9 N[C@H](C=C)CCC(=O)O Amb17621248 [0,1,0,0,0,0|1,0,2]=4 3366 B8R0.9 N[C@H](CCC(O)=O)CO Amb25352213 [0,1,0,0,0,0|2,0,0]=3 3367 B8R0.9 N[C@H](CF)CCC(O)=O Amb25339395 [0,1,0,0,0,0|2,0,0]=3 3368 B8R0.9 N[C@H](CO)CCC(N)=O Amb24368577 [0,1,0,0,0,0|2,0,0]=3 3369 B8R0.9 N[C@H](CS)CCC(O)=O Amb25348403 [0,1,0,0,0,0|2,0,0]=3 3370 B8R0.9 OC(=O)CCC(=O)CBr Amb18652012 [0,1,0,0,0,0|2,0,1]=4 3371 B8R0.9 OC(=O)CCC(=O)CCl Amb25736440 [0,1,0,0,0,0|2,0,1]=4 3372 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,1,0,0,0,0|2,0,1]=4 3373 B8R0.9 OC(=O)CCC(Br)CBr Amb24575822 [0,1,0,0,0,0|2,0,0]=3 3374 B8R0.9 OC(=O)CCC([NH3+])C=C Amb10845648 [0,1,0,0,0,0|1,0,2]=4 3375 B8R0.9 OCC(O)CCC(O)=O Amb18124400 [0,1,0,0,0,0|2,0,0]=3 3376 B8R0.9 OC[C@H](O)CCC(O)=O Amb24528896 [0,1,0,0,0,0|2,0,0]=3 3377 B8R0.9 [O-][N+](=O)CC[C@H](CO)C Amb13883660 [0,1,0,0,0,0|3,0,0]=4 3378 B8R0.21 BrCCCCS(=O)(=O)N Amb10601761 [0,1,0,0,0,0|3,0,0]=4 3379 B8R0.21 BrCCCCS(=O)(=O)O Amb10601732 [0,1,0,0,0,0|3,0,0]=4 3380 B8R0.21 CC(C)(Br)CCCCCl Amb25843151 [0,1,0,0,0,0|2,0,1]=4 3381 B8R0.21 CC(C)(C)CCCCBr Amb18321785 [0,1,0,0,0,0|2,0,1]=4 3382 B8R0.21 CC(C)(C)CCCCN Amb18523845 [0,1,0,0,0,0|2,0,1]=4 3383 B8R0.21 CC(C)(Cl)CCCCCl Amb25808046 [0,1,0,0,0,0|2,0,1]=4 3384 B8R0.21 CC(C)(F)CCCCBr Amb25146220 [0,1,0,0,0,0|2,0,1]=4 3385 B8R0.21 CC(C)(O)CCCCBr Amb25213849 [0,1,0,0,0,0|1,0,2]=4 3386 B8R0.21 CC(C)(O)CCCCCl Amb24427255 [0,1,0,0,0,0|1,0,2]=4 3387 B8R0.21 CCCCCC(C)(C)C Amb22228233 [0,1,0,0,0,0|1,0,1]=3 3388 B8R0.21 CCCCCC(C)(C)N Amb17772294 [0,1,0,0,0,0|1,0,1]=3 3389 B8R0.21 CCCCCC(C)(Cl)Cl Amb25243367 [0,1,0,0,0,0|1,0,1]=3 3390 B8R0.21 CCCCCC(F)(F)F Amb16185858 [0,1,0,0,0,0|2,0,1]=4 3391 B8R0.21 CCCCCS(=O)(=O)N Amb16191925 [0,1,0,0,0,0|2,0,0]=3 3392 B8R0.21 CCCCCS(=O)(=O)O Amb10844728 [0,1,0,0,0,0|2,0,0]=3 3393 B8R0.21 CCCCCS(O)(=O)=O Amb22348176 [0,1,0,0,0,0|2,0,0]=3 3394 B8R0.21 CCCCC[B-](F)(F)F Amb13890327 [0,1,0,0,0,0|3,0,0]=4 3395 B8R0.21 CCCCC[Si](C)(C)Cl Amb19893992 [0,1,0,0,0,0|1,1,0]=3 3396 B8R0.21 CCCCC[Si](C)(Cl)Cl Amb19893987 [0,1,0,0,0,0|1,1,0]=3 3397 B8R0.21 CCCCC[Si](Cl)(Cl)Cl Amb19893531 [0,1,0,0,0,0|2,1,0]=4 3398 B8R0.21 CCCCNC(C)(C)C Amb1124582 [0,1,0,0,0,0|2,0,1]=4 3399 B8R0.21 CCCCNP(=O)(Cl)Cl Amb22054608 [0,1,0,0,0,0|3,0,0]=4 3400 B8R0.21 CCCCNP(=O)(N)N Amb17610387 [0,1,0,0,0,0|3,0,0]=4 3401 B8R0.21 CCCCNS(=O)(=O)Cl Amb17193917 [0,1,0,0,0,0|3,0,0]=4 3402 B8R0.21 CCCCNS(N)(=O)=O Amb22436420 [0,1,0,0,0,0|3,0,0]=4 3403 B8R0.21 CCCCOC(C)(C)Br Amb24425421 [0,1,0,0,0,0|2,0,1]=4 3404 B8R0.21 CCCCOP(=O)(Cl)Cl Amb25369293 [0,1,0,0,0,0|3,0,0]=4 3405 B8R0.21 CCCCOP(C)(O)=O Amb25249300 [0,1,0,0,0,0|2,0,0]=3 3406 B8R0.21 CCCCOP(O)(O)=O Amb24419212 [0,1,0,0,0,0|3,0,0]=4 3407 B8R0.21 CCCCOP([O-])([O-])=O Amb24090708 [0,1,0,0,0,0|3,0,0]=4 3408 B8R0.21 CCCCOS(O)(=O)=O Amb22169780 [0,1,0,0,0,0|3,0,0]=4 3409 B8R0.21 CCCCO[Si](C)(C)Cl Amb24394389 [0,1,0,0,0,0|2,1,0]=4 3410 B8R0.21 CCCCSS(=O)(=O)C Amb17610372 [0,1,0,0,0,0|2,0,0]=3 3411 B8R0.21 CCCNCC(C)(C)F Amb25702250 [0,1,0,0,0,0|2,0,1]=4 3412 B8R0.21 CCCNCC(C)(C)N Amb18305953 [0,1,0,0,0,0|2,0,1]=4 3413 B8R0.21 CCCNCC(C)(C)N Amb24074586 [0,1,0,0,0,0|2,0,1]=4 3414 B8R0.21 CCCNCC(C)(C)O Amb18033968 [0,1,0,0,0,0|1,0,2]=4 3415 B8R0.21 CCCNCP(C)(C)=O Amb25146176 [0,1,0,0,0,0|2,0,0]=3 3416 B8R0.21 CCCNCP(C)(O)=O Amb25109293 [0,1,0,0,0,0|2,0,0]=3 3417 B8R0.21 CCCNCP(O)(O)=O Amb25691405 [0,1,0,0,0,0|3,0,0]=4 3418 B8R0.21 CCCNCS(O)(=O)=O Amb25363927 [0,1,0,0,0,0|3,0,0]=4 3419 B8R0.21 CCCNC[Si](C)(C)C Amb24697608 [0,1,0,0,0,0|2,1,0]=4 3420 B8R0.21 CCCOCC(C)(C)O Amb24356319 [0,1,0,0,0,0|1,0,2]=4 3421 B8R0.21 CCCOCC(N)(C)C Amb17485993 [0,1,0,0,0,0|2,0,1]=4 3422 B8R0.21 CCCSCC(C)(C)O Amb24565646 [0,1,0,0,0,0|1,0,2]=4 3423 B8R0.21 CCCSCC(N)(C)C Amb17485963 [0,1,0,0,0,0|2,0,1]=4 3424 B8R0.21 CCNCCC(C)(C)N Amb24385792 [0,1,0,0,0,0|2,0,1]=4 3425 B8R0.21 CCNCCC(C)(F)F Amb25692094 [0,1,0,0,0,0|2,0,1]=4 3426 B8R0.21 CCNCCS(C)(=O)=O Amb18523815 [0,1,0,0,0,0|2,0,0]=3 3427 B8R0.21 CCNCCS(O)(=O)=O Amb25771837 [0,1,0,0,0,0|3,0,0]=4 3428 B8R0.21 CCNCC[Si](C)(C)C Amb25107770 [0,1,0,0,0,0|2,1,0]=4 3429 B8R0.21 CCOCCC(C)(C)N Amb19026063 [0,1,0,0,0,0|2,0,1]=4 3430 B8R0.21 CCOCCS(=O)(=O)Br Amb24391976 [0,1,0,0,0,0|3,0,0]=4 3431 B8R0.21 CCOCCS(=O)(=O)F Amb25722585 [0,1,0,0,0,0|3,0,0]=4 3432 B8R0.21 CCOCCS(C)(=O)=O Amb24422227 [0,1,0,0,0,0|2,0,0]=3 3433 B8R0.21 CCOCC[N+](C)(C)C Amb24545925 [0,1,0,0,0,0|3,0,0]=4 3434 B8R0.21 CCSCCC(C)(C)N Amb24717225 [0,1,0,0,0,0|2,0,1]=4 3435 B8R0.21 CNCCCC(C)(C)C Amb18312573 [0,1,0,0,0,0|2,0,1]=4 3436 B8R0.21 CNCCCC(C)(C)N Amb25785246 [0,1,0,0,0,0|2,0,1]=4 3437 B8R0.21 CNCCCC(C)(F)F Amb24691652 [0,1,0,0,0,0|2,0,1]=4 3438 B8R0.21 CNCCCC(O)(C)C Amb17569928 [0,1,0,0,0,0|1,0,2]=4 3439 B8R0.21 CNCCCS(C)(=O)=O Amb18304934 [0,1,0,0,0,0|2,0,0]=3 3440 B8R0.21 CNCCCS(O)(=O)=O Amb25690771 [0,1,0,0,0,0|3,0,0]=4 3441 B8R0.21 CNCCC[N+](C)(C)C Amb24694176 [0,1,0,0,0,0|3,0,0]=4 3442 B8R0.21 CNCCNS(C)(=O)=O Amb19410469 [0,1,0,0,0,0|3,0,0]=4 3443 B8R0.21 CNCCOP(C)(O)=O Amb25691478 [0,1,0,0,0,0|3,0,0]=4 3444 B8R0.21 CNCCOS(C)(=O)=S Amb24065158 [0,1,0,0,0,0|3,0,0]=4 3445 B8R0.21 CNCCSS(=O)(=O)C Amb17617161 [0,1,0,0,0,0|3,0,0]=4 3446 B8R0.21 CNCCSS(C)(=O)=O Amb25249229 [0,1,0,0,0,0|3,0,0]=4 3447 B8R0.21 COCCCC(N)(C)C Amb17569949 [0,1,0,0,0,0|2,0,1]=4 3448 B8R0.21 COCCCS(=O)(=O)Cl Amb18538494 [0,1,0,0,0,0|3,0,0]=4 3449 B8R0.21 COCCCS(=O)(=O)F Amb20623730 [0,1,0,0,0,0|3,0,0]=4 3450 B8R0.21 COCCCS(N)(=O)=O Amb18791542 [0,1,0,0,0,0|3,0,0]=4 3451 B8R0.21 COCCCS(O)(=O)=O Amb22523485 [0,1,0,0,0,0|3,0,0]=4 3452 B8R0.21 COCCOS(=O)(=O)C Amb15692334 [0,1,0,0,0,0|3,0,0]=4 3453 B8R0.21 CP(C)(=O)CCCCBr Amb25076331 [0,1,0,0,0,0|2,0,0]=3 3454 B8R0.21 CS(=O)(=O)CCCC=O Amb18181110 [0,1,0,0,0,0|2,0,1]=4 3455 B8R0.21 CS(=O)(=O)CCCCBr Amb24401565 [0,1,0,0,0,0|2,0,0]=3 3456 B8R0.21 CS(=O)(=O)CCCCO Amb18180175 [0,1,0,0,0,0|2,0,0]=3 3457 B8R0.21 CS(=O)(=O)CCCNN Amb21618681 [0,1,0,0,0,0|3,0,0]=4 3458 B8R0.21 CS(=O)(=O)CCSCCl Amb25085069 [0,1,0,0,0,0|3,0,0]=4 3459 B8R0.21 CS(=O)(=O)CSCCO Amb24386898 [0,1,0,0,0,0|3,0,0]=4 3460 B8R0.21 CS(=O)(=O)NCCCF Amb25251719 [0,1,0,0,0,0|3,0,0]=4 3461 B8R0.21 CS(=O)(=O)NCCCI Amb25032186 [0,1,0,0,0,0|3,0,0]=4 3462 B8R0.21 CS(=O)(=O)OCCCN Amb18626294 [0,1,0,0,0,0|3,0,0]=4 3463 B8R0.21 CS(=O)(=O)OCCCO Amb25283131 [0,1,0,0,0,0|3,0,0]=4 3464 B8R0.21 CSCCCC(C)(C)C Amb25805630 [0,1,0,0,0,0|2,0,1]=4 3465 B8R0.21 CSCCCS(N)(=O)=O Amb25032148 [0,1,0,0,0,0|3,0,0]=4 3466 B8R0.21 C[Si](C)(C)CCCCN Amb25146183 [0,1,0,0,0,0|2,1,0]=4 3467 B8R0.21 C[Si](C)(C)CCCCO Amb22366478 [0,1,0,0,0,0|2,1,0]=4 3468 B8R0.21 C[Si](C)(Cl)CCCCBr Amb19894226 [0,1,0,0,0,0|2,1,0]=4 3469 B8R0.21 C[Si](C)(Cl)CCCCN Amb24763570 [0,1,0,0,0,0|2,1,0]=4 3470 B8R0.21 C[Si](Cl)(Cl)CCCCCl Amb25067985 [0,1,0,0,0,0|2,1,0]=4 3471 B8R0.21 C[Si](F)(F)CCCCN Amb24365268 [0,1,0,0,0,0|2,1,0]=4 3472 B8R0.21 ClCCCCS(=O)(=O)C Amb17138674 [0,1,0,0,0,0|2,0,0]=3 3473 B8R0.21 FCCCOS(=O)(=O)C Amb10841781 [0,1,0,0,0,0|3,0,0]=4 3474 B8R0.21 ICCCCS(=O)(=O)[O-] Amb10880692 [0,1,0,0,0,0|3,0,0]=4 3475 B8R0.21 N#CCCCS(=O)(=O)C Amb17504334 [0,1,0,0,0,0|2,0,1]=4 3476 B8R0.21 NCCCCC(O)(C)C Amb17569932 [0,1,0,0,0,0|1,0,2]=4 3477 B8R0.21 NCCCCS(=O)(=O)C Amb17138437 [0,1,0,0,0,0|2,0,0]=3 3478 B8R0.21 NCCCCS(N)(=O)=O Amb19016662 [0,1,0,0,0,0|3,0,0]=4 3479 B8R0.21 NCCCSS(=O)(=O)C Amb10069437 [0,1,0,0,0,0|3,0,0]=4 3480 B8R0.21 NCCCSS(=O)(=O)C Amb17608278 [0,1,0,0,0,0|3,0,0]=4 3481 B8R0.21 NP(N)(=O)CCCCCl Amb25362835 [0,1,0,0,0,0|3,0,0]=4 3482 B8R0.21 O=S(=O)(Cl)CCCCBr Amb24476654 [0,1,0,0,0,0|3,0,0]=4 3483 B8R0.21 O=S(=O)(Cl)CCCCF Amb25325507 [0,1,0,0,0,0|3,0,0]=4 3484 B8R0.21 O=S(=O)([S-])CCCCCl Amb25366296 [0,1,0,0,0,0|3,0,0]=4 3485 B8R0.21 OCCCCC(C)(C)C Amb10572498 [0,1,0,0,0,0|2,0,1]=4 3486 B8R0.21 OCCCCC(N)(C)C Amb17569935 [0,1,0,0,0,0|2,0,1]=4 3487 B8R0.21 OCCCCP(O)(O)=O Amb25188984 [0,1,0,0,0,0|3,0,0]=4 3488 B8R0.21 OP(O)(=O)CCCCBr Amb22832006 [0,1,0,0,0,0|3,0,0]=4 3489 B8R0.21 OP(O)(=O)CCCCCl Amb22388731 [0,1,0,0,0,0|3,0,0]=4 3490 B8R0.21 OS(=O)(=O)CCCCBr Amb24467015 [0,1,0,0,0,0|3,0,0]=4 3491 B8R0.21 [O-]S(=O)(=O)CCCCI Amb25352406 [0,1,0,0,0,0|3,0,0]=4 3492 B8R0.28 C=C(F)CCCC(O)=O Amb22641515 [0,1,0,0,0,0|1,0,2]=4 3493 B8R0.28 CC(=C)CCCC(C)=C Amb22228385 [0,1,0,0,0,0|1,0,1]=3 3494 B8R0.28 CC(=C)CCCC(C)=O Amb17739959 [0,1,0,0,0,0|0,0,1]=2 3495 B8R0.28 CC(=C)CCOC(N)=O Amb24760559 [0,1,0,0,0,0|2,0,1]=4 3496 B8R0.28 CC(=C)COCC(C)=C Amb17934025 [0,1,0,0,0,0|2,0,1]=4 3497 B8R0.28 CC(=C)CSCC(C)=C Amb21618743 [0,1,0,0,0,0|2,0,1]=4 3498 B8R0.28 CC(=C)C[Ru]CC(C)=C Amb22002190 [0,1,0,0,0,0|2,0,1]=4 3499 B8R0.28 CC(=C)OCCN(C)C Amb24101317 [0,1,0,0,0,0|3,0,0]=4 3500 B8R0.28 CC(=N)NCCC(O)=O Amb25836109 [0,1,0,0,0,0|2,0,1]=4 3501 B8R0.28 CC(=N)NCCN(C)C Amb25123604 [0,1,0,0,0,0|3,0,0]=4 3502 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,1,0,0,0,0|0,0,3]=4 3503 B8R0.28 CC(=O)CCC=C(F)F Amb24478042 [0,1,0,0,0,0|1,0,2]=4 3504 B8R0.28 CC(=O)CCCB(O)O Amb24068595 [0,1,0,0,0,0|2,0,0]=3 3505 B8R0.28 CC(=O)CCCC(=C)O Amb24422924 [0,1,0,0,0,0|0,0,2]=3 3506 B8R0.28 CC(=O)CCCC(=O)Cl Amb24752758 [0,1,0,0,0,0|1,0,1]=3 3507 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,1,0,0,0,0|1,0,1]=3 3508 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,1,0,0,0,0|0,0,1]=2 3509 B8R0.28 CC(=O)CCCC(Cl)Cl Amb24480288 [0,1,0,0,0,0|1,0,0]=2 3510 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,1,0,0,0,0|1,0,1]=3 3511 B8R0.28 CC(=O)CCC[N+]([O-])=O Amb18203187 [0,1,0,0,0,0|2,0,0]=3 3512 B8R0.28 CC(=O)CCNC(=O)C Amb17102868 [0,1,0,0,0,0|1,0,1]=3 3513 B8R0.28 CC(=O)CCOC(F)F Amb25276866 [0,1,0,0,0,0|2,0,0]=3 3514 B8R0.28 CC(=O)CCO[SiH](C)C Amb25233637 [0,1,0,0,0,0|1,1,0]=3 3515 B8R0.28 CC(=O)CC\C=C(/Cl)\C Amb17593664 [0,1,0,0,0,0|0,0,2]=3 3516 B8R0.28 CC(=O)CNCC(C)=O Amb22168687 [0,1,0,0,0,0|1,0,1]=3 3517 B8R0.28 CC(=O)CNCC(O)=O Amb24375747 [0,1,0,0,0,0|2,0,1]=4 3518 B8R0.28 CC(=O)COCC(F)F Amb24396675 [0,1,0,0,0,0|2,0,0]=3 3519 B8R0.28 CC(=O)COCC(N)=O Amb24070191 [0,1,0,0,0,0|2,0,1]=4 3520 B8R0.28 CC(=O)CSCC(=C)Br Amb24421359 [0,1,0,0,0,0|1,0,2]=4 3521 B8R0.28 CC(=O)CSCC(C)=O Amb25244895 [0,1,0,0,0,0|1,0,1]=3 3522 B8R0.28 CC(=O)CSCC([O-])=O Amb20622616 [0,1,0,0,0,0|2,0,1]=4 3523 B8R0.28 CC(=O)C\C=C/C(C)=C Amb25810284 [0,1,0,0,0,0|0,0,3]=4 3524 B8R0.28 CC(=O)C\C=C/N(C)C Amb25335355 [0,1,0,0,0,0|1,0,2]=4 3525 B8R0.28 CC(=O)C\C=C\C(C)=C Amb24744667 [0,1,0,0,0,0|0,0,3]=4 3526 B8R0.28 CC(=O)NCCC(=S)N Amb17232012 [0,1,0,0,0,0|2,0,1]=4 3527 B8R0.28 CC(=O)NCCC(F)F Amb24534489 [0,1,0,0,0,0|2,0,0]=3 3528 B8R0.28 CC(=O)OCCC(O)=O Amb18642866 [0,1,0,0,0,0|2,0,1]=4 3529 B8R0.28 CC(=O)OCCS(C)=O Amb24481662 [0,1,0,0,0,0|2,0,0]=3 3530 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,1,0,0,0,0|1,0,2]=4 3531 B8R0.28 CC(=O)SCCB(O)O Amb25854421 [0,1,0,0,0,0|3,0,0]=4 3532 B8R0.28 CC(=O)SCCC(N)=O Amb24552735 [0,1,0,0,0,0|2,0,1]=4 3533 B8R0.28 CC(=O)SCNC(C)=O Amb24662115 [0,1,0,0,0,0|2,0,1]=4 3534 B8R0.28 CC(=O)\C=C/CC(C)=O Amb25072729 [0,1,0,0,0,0|0,0,3]=4 3535 B8R0.28 CC(=O)\C=C\CC(C)=O Amb25238337 [0,1,0,0,0,0|0,0,3]=4 3536 B8R0.28 CC(=O)\C=C\CN(C)C Amb24557401 [0,1,0,0,0,0|1,0,2]=4 3537 B8R0.28 CC(=S)NCCC(C)=O Amb24682550 [0,1,0,0,0,0|1,0,1]=3 3538 B8R0.28 CC(=S)SCCC(O)=O Amb24480281 [0,1,0,0,0,0|2,0,1]=4 3539 B8R0.28 CC(Br)=CCCC(O)=O Amb25200944 [0,1,0,0,0,0|1,0,2]=4 3540 B8R0.28 CC(Br)CCCC(=O)Cl Amb25364942 [0,1,0,0,0,0|1,0,0]=2 3541 B8R0.28 CC(Br)CCCC(C)=O Amb24340312 [0,1,0,0,0,0|0,0,0]=1 3542 B8R0.28 CC(Br)CCCC(C)Br Amb24588841 [0,1,0,0,0,0|1,0,1]=3 3543 B8R0.28 CC(Br)CCCC(O)=O Amb24480052 [0,1,0,0,0,0|1,0,0]=2 3544 B8R0.28 CC(Br)CCCS(C)=O Amb24549111 [0,1,0,0,0,0|1,0,0]=2 3545 B8R0.28 CC(Br)CCNC(C)=O Amb24618949 [0,1,0,0,0,0|1,0,0]=2 3546 B8R0.28 CC(Br)CCOC(C)=O Amb24626624 [0,1,0,0,0,0|1,0,0]=2 3547 B8R0.28 CC(Br)\C=C\OC(C)=O Amb24480041 [0,1,0,0,0,0|1,0,2]=4 3548 B8R0.28 CC(C)/C=C/CC(O)=O Amb17844074 [0,1,0,0,0,0|1,0,2]=4 3549 B8R0.28 CC(C)=CCCC(N)=O Amb24655596 [0,1,0,0,0,0|1,0,2]=4 3550 B8R0.28 CC(C)=CCCN(C)C Amb25208019 [0,1,0,0,0,0|2,0,1]=4 3551 B8R0.28 CC(C)=CCOC(C)=O Amb22002433 [0,1,0,0,0,0|1,0,2]=4 3552 B8R0.28 CC(C)=COCC(C)=O Amb24389019 [0,1,0,0,0,0|1,0,2]=4 3553 B8R0.28 CC(C)C=C=CC(C)=O Amb25834315 [0,1,0,0,0,0|0,0,3]=4 3554 B8R0.28 CC(C)C=NNC(C)=O Amb24481921 [0,1,0,0,0,0|2,0,1]=4 3555 B8R0.28 CC(C)CCCB(O)O Amb24593360 [0,1,0,0,0,0|2,0,1]=4 3556 B8R0.28 CC(C)CCCC(=O)Cl Amb24477882 [0,1,0,0,0,0|1,0,0]=2 3557 B8R0.28 CC(C)CCCC(C)=C Amb22228386 [0,1,0,0,0,0|1,0,0]=2 3558 B8R0.28 CC(C)CCCC(C)Br Amb18330330 [0,1,0,0,0,0|1,0,1]=3 3559 B8R0.28 CC(C)CCCC(C)C Amb22228384 [0,1,0,0,0,0|1,0,1]=3 3560 B8R0.28 CC(C)CCCC(N)=N Amb23569433 [0,1,0,0,0,0|2,0,0]=3 3561 B8R0.28 CC(C)CCCC(N)=O Amb24579456 [0,1,0,0,0,0|1,0,0]=2 3562 B8R0.28 CC(C)CCCN(C)C Amb25046219 [0,1,0,0,0,0|2,0,0]=3 3563 B8R0.28 CC(C)CCCS(C)=O Amb24577266 [0,1,0,0,0,0|1,0,0]=2 3564 B8R0.28 CC(C)CCC[C@@H](C)N Amb22232273 [0,1,0,0,0,0|1,0,1]=3 3565 B8R0.28 CC(C)CCC[C@@H](C)O Amb22746847 [0,1,0,0,0,0|0,0,2]=3 3566 B8R0.28 CC(C)CCC[C@H](C)N Amb22225819 [0,1,0,0,0,0|1,0,1]=3 3567 B8R0.28 CC(C)CCNC(=O)Cl Amb25378849 [0,1,0,0,0,0|2,0,0]=3 3568 B8R0.28 CC(C)CCNC(C)=S Amb25298880 [0,1,0,0,0,0|1,1,0]=3 3569 B8R0.28 CC(C)CCNC(N)=N Amb20631267 [0,1,0,0,0,0|3,0,0]=4 3570 B8R0.28 CC(C)CCNC(N)=N Amb24524670 [0,1,0,0,0,0|3,0,0]=4 3571 B8R0.28 CC(C)CCNN(C)C Amb25227745 [0,1,0,0,0,0|3,0,0]=4 3572 B8R0.28 CC(C)CCOC(C)Cl Amb25724972 [0,1,0,0,0,0|2,0,1]=4 3573 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,1,0,0,0,0|2,0,0]=3 3574 B8R0.28 CC(C)CCOC(N)=S Amb25785397 [0,1,0,0,0,0|2,1,0]=4 3575 B8R0.28 CC(C)CCOC([S-])=S Amb19748289 [0,1,0,0,0,0|2,1,0]=4 3576 B8R0.28 CC(C)CCOS([O-])=O Amb24524507 [0,1,0,0,0,0|3,0,0]=4 3577 B8R0.28 CC(C)CCSC(N)=N Amb20676007 [0,1,0,0,0,0|3,0,0]=4 3578 B8R0.28 CC(C)CCSC(N)=O Amb24680835 [0,1,0,0,0,0|2,0,0]=3 3579 B8R0.28 CC(C)CNCC(=C)Br Amb19005215 [0,1,0,0,0,0|2,0,1]=4 3580 B8R0.28 CC(C)CNCC(=C)Cl Amb19004837 [0,1,0,0,0,0|2,0,1]=4 3581 B8R0.28 CC(C)CNCC(C)=O Amb25067661 [0,1,0,0,0,0|1,0,0]=2 3582 B8R0.28 CC(C)CNCC(C)Cl Amb25065676 [0,1,0,0,0,0|2,0,1]=4 3583 B8R0.28 CC(C)CNCC(C)N Amb19009717 [0,1,0,0,0,0|2,0,1]=4 3584 B8R0.28 CC(C)CNCC(O)=O Amb19373106 [0,1,0,0,0,0|2,0,0]=3 3585 B8R0.28 CC(C)CNCS(O)=O Amb24478690 [0,1,0,0,0,0|3,0,0]=4 3586 B8R0.28 CC(C)CNC[C@@H](C)O Amb25135487 [0,1,0,0,0,0|1,0,2]=4 3587 B8R0.28 CC(C)CNC[C@H](C)O Amb25079110 [0,1,0,0,0,0|1,0,2]=4 3588 B8R0.28 CC(C)CNN=C(C)C Amb24749343 [0,1,0,0,0,0|3,0,0]=4 3589 B8R0.28 CC(C)CNNC(N)=O Amb24359844 [0,1,0,0,0,0|3,0,0]=4 3590 B8R0.28 CC(C)COC[C@@H](C)O Amb24423772 [0,1,0,0,0,0|1,0,2]=4 3591 B8R0.28 CC(C)CONS(C)=O Amb24551950 [0,1,0,0,0,0|3,0,0]=4 3592 B8R0.28 CC(C)CPCC(C)C Amb22734785 [0,1,0,0,0,0|2,0,1]=4 3593 B8R0.28 CC(C)CSCC(C)=C Amb24371809 [0,1,0,0,0,0|2,0,0]=3 3594 B8R0.28 CC(C)CSCC(N)=O Amb25283648 [0,1,0,0,0,0|2,0,0]=3 3595 B8R0.28 CC(C)CSC[C@@H](C)N Amb24481868 [0,1,0,0,0,0|2,0,1]=4 3596 B8R0.28 CC(C)C[Al+]CC(C)C Amb20240962 [0,1,0,0,0,0|2,0,1]=4 3597 B8R0.28 CC(C)C[Al+]CC(C)C Amb22053726 [0,1,0,0,0,0|2,0,1]=4 3598 B8R0.28 CC(C)C\C=C\C(N)=O Amb25731688 [0,1,0,0,0,0|1,0,2]=4 3599 B8R0.28 CC(C)N=CCC(C)=O Amb25198123 [0,1,0,0,0,0|1,0,1]=3 3600 B8R0.28 CC(C)NCC=C(C)C Amb18642550 [0,1,0,0,0,0|2,0,1]=4 3601 B8R0.28 CC(C)NCCC(C)=C Amb19025196 [0,1,0,0,0,0|2,0,0]=3 3602 B8R0.28 CC(C)NCCC(C)N Amb19008024 [0,1,0,0,0,0|2,0,1]=4 3603 B8R0.28 CC(C)NCCC(C)O Amb24117028 [0,1,0,0,0,0|1,0,2]=4 3604 B8R0.28 CC(C)NCCC(N)=N Amb25162018 [0,1,0,0,0,0|3,0,0]=4 3605 B8R0.28 CC(C)NCCN(C)N Amb18642857 [0,1,0,0,0,0|3,0,0]=4 3606 B8R0.28 CC(C)NCC[C@@H](C)N Amb24561628 [0,1,0,0,0,0|2,0,1]=4 3607 B8R0.28 CC(C)NCC[C@@H](C)O Amb24351618 [0,1,0,0,0,0|1,0,2]=4 3608 B8R0.28 CC(C)NCSC(C)=O Amb25314413 [0,1,0,0,0,0|2,0,0]=3 3609 B8R0.28 CC(C)NOCC(C)=C Amb24539135 [0,1,0,0,0,0|3,0,0]=4 3610 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,1,0,0,0,0|2,0,0]=3 3611 B8R0.28 CC(C)OCCC(C)=O Amb22229804 [0,1,0,0,0,0|1,0,0]=2 3612 B8R0.28 CC(C)OCCC(C)N Amb19025758 [0,1,0,0,0,0|2,0,1]=4 3613 B8R0.28 CC(C)OCCC(N)=O Amb25783535 [0,1,0,0,0,0|2,0,0]=3 3614 B8R0.28 CC(C)OCCS(O)=O Amb24551322 [0,1,0,0,0,0|3,0,0]=4 3615 B8R0.28 CC(C)OCC[C@H](C)O Amb25090046 [0,1,0,0,0,0|1,0,2]=4 3616 B8R0.28 CC(C)ONCC(C)=C Amb25279062 [0,1,0,0,0,0|3,0,0]=4 3617 B8R0.28 CC(C)ONCC(O)=O Amb24690245 [0,1,0,0,0,0|3,0,0]=4 3618 B8R0.28 CC(C)SCCC(C)N Amb24716948 [0,1,0,0,0,0|2,0,1]=4 3619 B8R0.28 CC(C)SCCC(N)=O Amb25739954 [0,1,0,0,0,0|2,0,0]=3 3620 B8R0.28 CC(C)SCC[N+]([O-])=O Amb24407962 [0,1,0,0,0,0|3,0,0]=4 3621 B8R0.28 CC(C)SNCC(N)=O Amb25118863 [0,1,0,0,0,0|3,0,0]=4 3622 B8R0.28 CC(C)SSCC(O)=O Amb24425479 [0,1,0,0,0,0|3,0,0]=4 3623 B8R0.28 CC(C)\C=C\NC(C)=O Amb24761262 [0,1,0,0,0,0|1,0,2]=4 3624 B8R0.28 CC(C)\N=C\CC(C)=O Amb25773461 [0,1,0,0,0,0|1,0,1]=3 3625 B8R0.28 CC(CCCC(=O)O)O Amb2371277 [0,1,0,0,0,0|1,0,0]=2 3626 B8R0.28 CC(CCCC(=O)[O-])O Amb17615415 [0,1,0,0,0,0|1,0,0]=2 3627 B8R0.28 CC(CCNC(=O)N)C Amb1104833 [0,1,0,0,0,0|2,0,0]=3 3628 B8R0.28 CC(CCOC(=S)[S-])C Amb13777309 [0,1,0,0,0,0|2,1,0]=4 3629 B8R0.28 CC(CNCC(=C)C)C Amb17308640 [0,1,0,0,0,0|2,0,0]=3 3630 B8R0.28 CC(CNCC(=C)C)O Amb17308667 [0,1,0,0,0,0|2,0,0]=3 3631 B8R0.28 CC(CNCC(=O)N)C Amb1118171 [0,1,0,0,0,0|2,0,0]=3 3632 B8R0.28 CC(CNCC(Cl)C)Cl Amb17600138 [0,1,0,0,0,0|2,0,1]=4 3633 B8R0.28 CC(COCC(=O)N)C Amb2131093 [0,1,0,0,0,0|2,0,0]=3 3634 B8R0.28 CC(COCC(N)C)C Amb13952731 [0,1,0,0,0,0|2,0,1]=4 3635 B8R0.28 CC(CSCC(=O)O)C Amb1134811 [0,1,0,0,0,0|2,0,0]=3 3636 B8R0.28 CC(Cl)=CCCC(C)=O Amb25274421 [0,1,0,0,0,0|0,0,2]=3 3637 B8R0.28 CC(Cl)=CCNC(C)=O Amb25111784 [0,1,0,0,0,0|1,0,2]=4 3638 B8R0.28 CC(Cl)CCC=C(C)C Amb25032126 [0,1,0,0,0,0|1,0,1]=3 3639 B8R0.28 CC(Cl)CCCC(C)=O Amb25724389 [0,1,0,0,0,0|0,0,0]=1 3640 B8R0.28 CC(Cl)CCCC(C)Cl Amb24390900 [0,1,0,0,0,0|1,0,1]=3 3641 B8R0.28 CC(Cl)CCCC(O)=O Amb24740888 [0,1,0,0,0,0|1,0,0]=2 3642 B8R0.28 CC(Cl)CCCN(C)Cl Amb24480216 [0,1,0,0,0,0|2,0,0]=3 3643 B8R0.28 CC(Cl)CCSC(C)=O Amb25146226 [0,1,0,0,0,0|1,0,0]=2 3644 B8R0.28 CC(Cl)COCC(O)=O Amb24480258 [0,1,0,0,0,0|2,0,0]=3 3645 B8R0.28 CC(Cl)\C=C\OC(C)=O Amb24650034 [0,1,0,0,0,0|1,0,2]=4 3646 B8R0.28 CC(F)CCOC(C)=O Amb24481945 [0,1,0,0,0,0|1,0,0]=2 3647 B8R0.28 CC(F)COCC(C)=O Amb25178543 [0,1,0,0,0,0|1,0,0]=2 3648 B8R0.28 CC(I)CCSC(N)=N Amb22364948 [0,1,0,0,0,0|3,0,0]=4 3649 B8R0.28 CC(I)CCSC(N)=N Amb24542719 [0,1,0,0,0,0|3,0,0]=4 3650 B8R0.28 CC(N)CCCC(C)N Amb24594438 [0,1,0,0,0,0|1,0,1]=3 3651 B8R0.28 CC(N)CCCC(O)=O Amb22059416 [0,1,0,0,0,0|1,0,0]=2 3652 B8R0.28 CC(N)CCNC(C)=O Amb24384456 [0,1,0,0,0,0|1,0,0]=2 3653 B8R0.28 CC(N)COCC(O)=O Amb25368702 [0,1,0,0,0,0|2,0,0]=3 3654 B8R0.28 CC(N)CSCC(=C)Cl Amb24653169 [0,1,0,0,0,0|2,0,1]=4 3655 B8R0.28 CC(N)CSCC(C)=C Amb24478766 [0,1,0,0,0,0|2,0,0]=3 3656 B8R0.28 CC(NCCC(=O)O)C Amb1106349 [0,1,0,0,0,0|2,0,0]=3 3657 B8R0.28 CC(NCCC(=S)N)C Amb17232016 [0,1,0,0,0,0|2,1,0]=4 3658 B8R0.28 CC(O)CCCB(O)O Amb24389636 [0,1,0,0,0,0|2,0,1]=4 3659 B8R0.28 CC(O)CCCC(=C)Br Amb25058566 [0,1,0,0,0,0|1,0,1]=3 3660 B8R0.28 CC(O)CCCC(C)=C Amb24478673 [0,1,0,0,0,0|1,0,0]=2 3661 B8R0.28 CC(O)CCCC(C)=O Amb24340114 [0,1,0,0,0,0|0,0,0]=1 3662 B8R0.28 CC(O)CCCC(N)=O Amb24622764 [0,1,0,0,0,0|1,0,0]=2 3663 B8R0.28 CC(O)CCCN(C)C Amb24271102 [0,1,0,0,0,0|2,0,0]=3 3664 B8R0.28 CC(O)CCNC(N)=N Amb24726602 [0,1,0,0,0,0|3,0,0]=4 3665 B8R0.28 CC(O)CCNN(C)C Amb24614960 [0,1,0,0,0,0|3,0,0]=4 3666 B8R0.28 CC(O)CCNS(C)=O Amb25176978 [0,1,0,0,0,0|2,0,0]=3 3667 B8R0.28 CC(O)CCOC(N)=O Amb25293990 [0,1,0,0,0,0|2,0,0]=3 3668 B8R0.28 CC(O)CCSC(C)=O Amb25846896 [0,1,0,0,0,0|1,0,0]=2 3669 B8R0.28 CC(O)CC\C=C(\C)/Br Amb24430963 [0,1,0,0,0,0|1,0,1]=3 3670 B8R0.28 CC(O)CNCC(=C)Br Amb18303322 [0,1,0,0,0,0|2,0,1]=4 3671 B8R0.28 CC(O)CNCC(=C)Cl Amb19004839 [0,1,0,0,0,0|2,0,1]=4 3672 B8R0.28 CC(O)CNCC(C)=O Amb24589662 [0,1,0,0,0,0|1,0,0]=2 3673 B8R0.28 CC(O)CNCC(C)N Amb24117888 [0,1,0,0,0,0|1,0,2]=4 3674 B8R0.28 CC(O)CNN=C(C)C Amb24355137 [0,1,0,0,0,0|3,0,0]=4 3675 B8R0.28 CC(O)CONC(N)=O Amb24604387 [0,1,0,0,0,0|3,0,0]=4 3676 B8R0.28 CC(O)CSCC(C)O Amb25144450 [0,1,0,0,0,0|1,0,2]=4 3677 B8R0.28 CC(O)CSCC(N)=O Amb25690591 [0,1,0,0,0,0|2,0,0]=3 3678 B8R0.28 CC(O)CSCC(O)=O Amb19005278 [0,1,0,0,0,0|2,0,0]=3 3679 B8R0.28 CC(O)C\C=C\C(C)=C Amb24387741 [0,1,0,0,0,0|1,0,2]=4 3680 B8R0.28 CC(O)C\C=C\C(O)=O Amb18642771 [0,1,0,0,0,0|1,0,2]=4 3681 B8R0.28 CC(O)NCCC(N)=O Amb24446895 [0,1,0,0,0,0|2,0,0]=3 3682 B8R0.28 CC(O)\C=C\CC(C)=C Amb24431893 [0,1,0,0,0,0|1,0,2]=4 3683 B8R0.28 CC(O)\C=C\OC(C)=O Amb24686264 [0,1,0,0,0,0|1,0,2]=4 3684 B8R0.28 CC(S)CCOC(C)=O Amb25077156 [0,1,0,0,0,0|1,0,0]=2 3685 B8R0.28 CC(S)\C=C/CC(O)=O Amb18644289 [0,1,0,0,0,0|1,0,2]=4 3686 B8R0.28 CC(S)\C=C\CC(O)=O Amb24514919 [0,1,0,0,0,0|1,0,2]=4 3687 B8R0.28 CC(SCCC(=S)N)C Amb17307561 [0,1,0,0,0,0|2,1,0]=4 3688 B8R0.28 CN(C)CCCC(O)O Amb24544945 [0,1,0,0,0,0|3,0,0]=4 3689 B8R0.28 CN(C)NCCC(O)=O Amb24113891 [0,1,0,0,0,0|3,0,0]=4 3690 B8R0.28 CN(CCNC(=O)N)C Amb1129425 [0,1,0,0,0,0|3,0,0]=4 3691 B8R0.28 CN(CCNC(C)C)C Amb1111866 [0,1,0,0,0,0|3,0,0]=4 3692 B8R0.28 CP(C)CCCP(C)C Amb22731671 [0,1,0,0,0,0|3,0,0]=4 3693 B8R0.28 CS(=O)CCCC(N)=S Amb24629819 [0,1,0,0,0,0|2,0,1]=4 3694 B8R0.28 CS(=O)CCCC(O)=O Amb18306076 [0,1,0,0,0,0|2,0,0]=3 3695 B8R0.28 C[C@@H](N)CCCC(O)=O Amb24435680 [0,1,0,0,0,0|1,0,0]=2 3696 B8R0.28 C[C@@H](N)COCC(O)=O Amb24641471 [0,1,0,0,0,0|2,0,0]=3 3697 B8R0.28 C[C@@H](O)CCC=C(C)C Amb22049561 [0,1,0,0,0,0|1,0,1]=3 3698 B8R0.28 C[C@@H](O)CCCC(C)O Amb24412846 [0,1,0,0,0,0|0,0,2]=3 3699 B8R0.28 C[C@@H](O)CCOC(C)=O Amb25357488 [0,1,0,0,0,0|1,0,0]=2 3700 B8R0.28 C[C@@H](O)CNCC(C)O Amb25032285 [0,1,0,0,0,0|1,0,2]=4 3701 B8R0.28 C[C@@H](O)CNCC(N)=O Amb25260382 [0,1,0,0,0,0|2,0,0]=3 3702 B8R0.28 C[C@@H](O)COCC(C)O Amb25796323 [0,1,0,0,0,0|1,0,2]=4 3703 B8R0.28 C[C@@H](O)CSCC(N)=O Amb25799456 [0,1,0,0,0,0|2,0,0]=3 3704 B8R0.28 C[C@@H](O)C\C=C\C(O)=O Amb25250610 [0,1,0,0,0,0|1,0,2]=4 3705 B8R0.28 C[C@H](Br)CCC=C(C)C Amb25374451 [0,1,0,0,0,0|1,0,1]=3 3706 B8R0.28 C[C@H](N)COCC(O)=O Amb25305053 [0,1,0,0,0,0|2,0,0]=3 3707 B8R0.28 C[C@H](N)CSCC(N)=O Amb25054209 [0,1,0,0,0,0|2,0,0]=3 3708 B8R0.28 C[C@H](O)CC#CC(O)=O Amb24627681 [0,1,0,0,0,0|1,0,2]=4 3709 B8R0.28 C[C@H](O)CCC=C(C)C Amb22049564 [0,1,0,0,0,0|1,0,1]=3 3710 B8R0.28 C[C@H](O)CCCC(O)=O Amb25842809 [0,1,0,0,0,0|1,0,0]=2 3711 B8R0.28 C[C@H](O)CCC[C@@H](C)O Amb25803331 [0,1,0,0,0,0|0,0,2]=3 3712 B8R0.28 C[C@H](O)CCC[C@H](C)O Amb25097837 [0,1,0,0,0,0|0,0,2]=3 3713 B8R0.28 C[C@H](O)CCNC(N)=O Amb25272281 [0,1,0,0,0,0|2,0,0]=3 3714 B8R0.28 C[C@H](O)COC[C@@H](C)O Amb25801708 [0,1,0,0,0,0|1,0,2]=4 3715 B8R0.28 C[C@H](O)CSCC(N)=O Amb25202527 [0,1,0,0,0,0|2,0,0]=3 3716 B8R0.28 NC(=N)CCCC(O)=O Amb25757878 [0,1,0,0,0,0|2,0,1]=4 3717 B8R0.28 NC(=O)CCCC(N)=N Amb25173064 [0,1,0,0,0,0|2,0,1]=4 3718 B8R0.28 NC(=O)CCCC(N)=O Amb24098550 [0,1,0,0,0,0|2,0,1]=4 3719 B8R0.28 NC(=O)CCC[N+]([O-])=O Amb22432425 [0,1,0,0,0,0|3,0,0]=4 3720 B8R0.28 NC(=O)CNCC(F)F Amb25325661 [0,1,0,0,0,0|3,0,0]=4 3721 B8R0.28 NC(=O)NCCC(F)F Amb25369231 [0,1,0,0,0,0|3,0,0]=4 3722 B8R0.28 O=C(Cl)CCCC(Cl)Cl Amb24602174 [0,1,0,0,0,0|2,0,0]=3 3723 B8R0.28 OC(=O)CCC=C(C)C Amb10601609 [0,1,0,0,0,0|1,0,2]=4 3724 B8R0.28 OC(=O)CCCC(=O)Br Amb24480005 [0,1,0,0,0,0|2,0,1]=4 3725 B8R0.28 OC(=O)CCCC(Cl)Cl Amb24479944 [0,1,0,0,0,0|2,0,0]=3 3726 B8R0.28 OC(=O)CCCC(F)F Amb24117996 [0,1,0,0,0,0|2,0,0]=3 3727 B8R0.28 OC(=O)CCCC(O)=O Amb22351480 [0,1,0,0,0,0|2,0,1]=4 3728 B8R0.28 OC(=O)CCCC(O)=O Amb22351829 [0,1,0,0,0,0|2,0,1]=4 3729 B8R0.28 OC(=O)CCCP(O)=O Amb24480161 [0,1,0,0,0,0|3,0,0]=4 3730 B8R0.28 OC(=O)CCNC(=O)C Amb1104704 [0,1,0,0,0,0|2,0,1]=4 3731 B8R0.28 OC(=O)CCOC(F)F Amb25342869 [0,1,0,0,0,0|3,0,0]=4 3732 B8R0.28 OC(=O)CCSC(=O)C Amb17607685 [0,1,0,0,0,0|2,0,1]=4 3733 B8R0.28 OC(=O)CNCC(F)F Amb24433048 [0,1,0,0,0,0|3,0,0]=4 3734 B8R0.28 OC(=O)CSCC(F)F Amb18791606 [0,1,0,0,0,0|3,0,0]=4 3735 B8R0.28 OC(O)CCCC(O)=O Amb25205498 [0,1,0,0,0,0|2,0,0]=3 3736 B8R0.28 O[13C](=O)CCC[13C](=O)O Amb17614793 [0,1,0,0,0,0|2,0,1]=4 3737 B8R0.28 [O-]C(=O)CCCC([O-])=O Amb22729768 [0,1,0,0,0,0|2,0,1]=4 3738 B8R0.28 [O-][N+](=O)CCCC(O)=O Amb24711043 [0,1,0,0,0,0|3,0,0]=4 3739 B8R1.1 C#CC1CCC(=O)N1 Amb24505237 [0,0,0,1,0,0|1,0,2]=4 3740 B8R1.1 C#C[C@@H]1CCC(=O)N1 Amb25840299 [0,0,0,1,0,0|1,0,2]=4 3741 B8R1.1 C#C[C@H]1CC(=O)CC1 Amb24721679 [0,0,0,1,0,0|0,0,2]=3 3742 B8R1.1 C#C[C@H]1CCC(=O)N1 Amb25062993 [0,0,0,1,0,0|1,0,2]=4 3743 B8R1.1 C=C1CC(CC1)C#N Amb18641604 [0,0,0,1,0,0|2,0,1]=4 3744 B8R1.1 C=C1COC(CO)C1 Amb25662542 [0,0,0,1,0,0|3,0,0]=4 3745 B8R1.1 C=CC1CCC(=O)N1 Amb20622087 [0,0,0,1,0,0|1,0,2]=4 3746 B8R1.1 C=CC1CNC(=O)C1 Amb25117425 [0,0,0,1,0,0|1,0,2]=4 3747 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,0,0,1,0,0|1,0,2]=4 3748 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,0,0,1,0,0|1,0,2]=4 3749 B8R1.1 C=C[C@H]1CC(=O)CC1 Amb24524536 [0,0,0,1,0,0|0,0,2]=3 3750 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,0,0,1,0,0|1,0,2]=4 3751 B8R1.1 CC1=CCC(CO)O1 Amb24386881 [0,0,0,1,0,0|1,0,2]=4 3752 B8R1.1 CC1=NC(CBr)CO1 Amb25138721 [0,0,0,1,0,0|3,0,0]=4 3753 B8R1.1 CC1=NC(CCl)CS1 Amb22396508 [0,0,0,1,0,0|3,0,0]=4 3754 B8R1.1 CC1=NC(CO)CO1 Amb24527624 [0,0,0,1,0,0|3,0,0]=4 3755 B8R1.1 CC1=NC(CO)CS1 Amb25138240 [0,0,0,1,0,0|3,0,0]=4 3756 B8R1.1 CC1=NCC(CBr)O1 Amb25783980 [0,0,0,1,0,0|2,0,1]=4 3757 B8R1.1 CC1=NCC(CCl)O1 Amb25706232 [0,0,0,1,0,0|2,0,1]=4 3758 B8R1.1 CC1=NCC(CF)O1 Amb25322610 [0,0,0,1,0,0|2,0,1]=4 3759 B8R1.1 CC1=NCC(CI)O1 Amb24622214 [0,0,0,1,0,0|2,0,1]=4 3760 B8R1.1 CC1CC(CC1)CO Amb22886865 [0,0,0,1,0,0|2,0,1]=4 3761 B8R1.1 CC1CCC(C1)NC Amb24271088 [0,0,0,1,0,0|2,0,1]=4 3762 B8R1.1 CC1CCC(C1)SC Amb24424705 [0,0,0,1,0,0|2,0,1]=4 3763 B8R1.1 CC1CCC(CC)N1 Amb25786145 [0,0,0,1,0,0|1,0,1]=3 3764 B8R1.1 CC1CCC(CF)N1 Amb25032354 [0,0,0,1,0,0|2,0,1]=4 3765 B8R1.1 CC1CCC(CO)S1 Amb24687787 [0,0,0,1,0,0|1,1,1]=4 3766 B8R1.1 CC1CCC(CS)O1 Amb24524291 [0,0,0,1,0,0|1,0,2]=4 3767 B8R1.1 CC1CC[C@@H](CO)N1 Amb25068509 [0,0,0,1,0,0|2,0,1]=4 3768 B8R1.1 CC1CNC(C1)CC Amb19375396 [0,0,0,1,0,0|2,0,1]=4 3769 B8R1.1 CC1CNC(CC)S1 Amb25733268 [0,0,0,1,0,0|1,1,1]=4 3770 B8R1.1 CC1COC(CC)O1 Amb19892405 [0,0,0,1,0,0|1,0,2]=4 3771 B8R1.1 CC1CSC(CC)N1 Amb25756710 [0,0,0,1,0,0|2,0,1]=4 3772 B8R1.1 CC1NC(CO1)CC Amb25126945 [0,0,0,1,0,0|2,0,1]=4 3773 B8R1.1 CC1NC(CS1)CC Amb24641216 [0,0,0,1,0,0|2,0,1]=4 3774 B8R1.1 CC=1CC(CO)CN1 Amb25204416 [0,0,0,1,0,0|3,0,0]=4 3775 B8R1.1 CC=1CC=C(CC)C1 Amb22229283 [0,0,0,1,0,0|1,0,2]=4 3776 B8R1.1 CC=1CCC(CO)N1 Amb24734855 [0,0,0,1,0,0|2,0,0]=3 3777 B8R1.1 CC=1C[C@H](CO)CC1 Amb24481425 [0,0,0,1,0,0|2,0,1]=4 3778 B8R1.1 CCC1=NCC(=O)O1 Amb25238829 [0,0,0,1,0,0|2,0,1]=4 3779 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,0,0,1,0,0|1,0,2]=4 3780 B8R1.1 CCC1C=CC(=O)S1 Amb24638103 [0,0,0,1,0,0|1,0,2]=4 3781 B8R1.1 CCC1CC(=O)C=C1 Amb25713811 [0,0,0,1,0,0|0,0,2]=3 3782 B8R1.1 CCC1CC(=O)CC1 Amb19267107 [0,0,0,1,0,0|0,0,0]=1 3783 B8R1.1 CCC1CC(=O)CS1 Amb25273070 [0,0,0,1,0,0|1,0,0]=2 3784 B8R1.1 CCC1CC(O)CO1 Amb24340231 [0,0,0,1,0,0|1,0,2]=4 3785 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,0,0,1,0,0|1,0,0]=2 3786 B8R1.1 CCC1CCC(N)C1 Amb25850555 [0,0,0,1,0,0|1,0,1]=3 3787 B8R1.1 CCC1CCC(O)C1 Amb24471617 [0,0,0,1,0,0|0,0,2]=3 3788 B8R1.1 CCC1CCC(S)C1 Amb25082172 [0,0,0,1,0,0|0,1,1]=3 3789 B8R1.1 CCC1CN=C(C)N1 Amb25732193 [0,0,0,1,0,0|2,0,0]=3 3790 B8R1.1 CCC1CN=C(C)S1 Amb25197984 [0,0,0,1,0,0|1,1,0]=3 3791 B8R1.1 CCC1CN=C(Cl)O1 Amb24519084 [0,0,0,1,0,0|2,0,1]=4 3792 B8R1.1 CCC1CN=C(N)N1 Amb24483143 [0,0,0,1,0,0|3,0,0]=4 3793 B8R1.1 CCC1CN=C(N)O1 Amb25728217 [0,0,0,1,0,0|2,0,1]=4 3794 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,0,0,1,0,0|1,0,0]=2 3795 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,0,0,1,0,0|2,0,0]=3 3796 B8R1.1 CCC1CNC(S)=N1 Amb25072509 [0,0,0,1,0,0|2,1,0]=4 3797 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,0,0,1,0,0|2,0,0]=3 3798 B8R1.1 CCC1COC(N)=N1 Amb24436270 [0,0,0,1,0,0|3,0,0]=4 3799 B8R1.1 CCC1CSC(=S)N1 Amb25078191 [0,0,0,1,0,0|2,1,0]=4 3800 B8R1.1 CCC1CSC(Br)=N1 Amb25749236 [0,0,0,1,0,0|3,0,0]=4 3801 B8R1.1 CCC1CSC(C)=N1 Amb24325349 [0,0,0,1,0,0|2,0,0]=3 3802 B8R1.1 CCC1N=C(C)CS1 Amb24664975 [0,0,0,1,0,0|2,0,0]=3 3803 B8R1.1 CCC1NC(C)=NO1 Amb25757916 [0,0,0,1,0,0|3,0,0]=4 3804 B8R1.1 CCC1NCC(O1)C Amb17506185 [0,0,0,1,0,0|1,0,2]=4 3805 B8R1.1 CCC1OCC(N1)C Amb17506184 [0,0,0,1,0,0|2,0,1]=4 3806 B8R1.1 CCC=1CC(=O)OC1 Amb24759211 [0,0,0,1,0,0|1,0,2]=4 3807 B8R1.1 CCC=1CCC(C)C1 Amb25810526 [0,0,0,1,0,0|1,0,2]=4 3808 B8R1.1 CCC=1COC(=O)C1 Amb24686984 [0,0,0,1,0,0|1,0,2]=4 3809 B8R1.1 CCC=1NC(=O)CN1 Amb25162785 [0,0,0,1,0,0|2,0,1]=4 3810 B8R1.1 CCN1CC(Br)CC1 Amb25075046 [0,0,0,1,0,0|2,0,1]=4 3811 B8R1.1 CCN1CC(Cl)CC1 Amb24099896 [0,0,0,1,0,0|2,0,1]=4 3812 B8R1.1 CCN1CCC(=O)N1 Amb24716029 [0,0,0,1,0,0|2,0,0]=3 3813 B8R1.1 CCN1C[C@@H](N)CC1 Amb19892530 [0,0,0,1,0,0|2,0,1]=4 3814 B8R1.1 CCN1C[C@@H](N)CC1 Amb25084601 [0,0,0,1,0,0|2,0,1]=4 3815 B8R1.1 CCN1C[C@H](N)CC1 Amb19892061 [0,0,0,1,0,0|2,0,1]=4 3816 B8R1.1 CCN1C[C@H](O)CC1 Amb24735301 [0,0,0,1,0,0|1,0,2]=4 3817 B8R1.1 CC[C@@H]1CC(=O)CC1 Amb25142670 [0,0,0,1,0,0|0,0,0]=1 3818 B8R1.1 CC[C@@H]1CCC(=S)N1 Amb25712485 [0,0,0,1,0,0|1,1,0]=3 3819 B8R1.1 CC[C@@H]1CC[C@@H](O)C1 Amb24587422 [0,0,0,1,0,0|0,0,2]=3 3820 B8R1.1 CC[C@@H]1CNC(=O)C1 Amb25367322 [0,0,0,1,0,0|1,0,0]=2 3821 B8R1.1 CC[C@@H]1CNC(=O)O1 Amb24507830 [0,0,0,1,0,0|2,0,0]=3 3822 B8R1.1 CC[C@@H]1CSC(=S)N1 Amb24409541 [0,0,0,1,0,0|2,1,0]=4 3823 B8R1.1 CC[C@H]1CC(=O)CC1 Amb24614252 [0,0,0,1,0,0|0,0,0]=1 3824 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,0,0,1,0,0|1,0,0]=2 3825 B8R1.1 CC[C@H]1CNC(=O)C1 Amb24632784 [0,0,0,1,0,0|1,0,0]=2 3826 B8R1.1 CN1CC(CBr)CC1 Amb19516954 [0,0,0,1,0,0|3,0,0]=4 3827 B8R1.1 CN1CC(CBr)CC1 Amb20668372 [0,0,0,1,0,0|3,0,0]=4 3828 B8R1.1 CN1CC(CCl)CC1 Amb21961466 [0,0,0,1,0,0|3,0,0]=4 3829 B8R1.1 CN1CC(CI)CC1 Amb21861158 [0,0,0,1,0,0|3,0,0]=4 3830 B8R1.1 CN1CC(CN)CC1 Amb21857704 [0,0,0,1,0,0|3,0,0]=4 3831 B8R1.1 CN1CCC(CO)N1 Amb25197051 [0,0,0,1,0,0|3,0,0]=4 3832 B8R1.1 CN1C[C@@H](CN)CC1 Amb23439250 [0,0,0,1,0,0|3,0,0]=4 3833 B8R1.1 CN1C[C@@H](CO)CC1 Amb22744754 [0,0,0,1,0,0|3,0,0]=4 3834 B8R1.1 CN1C[C@H](CO)CC1 Amb25831158 [0,0,0,1,0,0|3,0,0]=4 3835 B8R1.1 CNC1CCC(F)C1 Amb25267201 [0,0,0,1,0,0|2,0,1]=4 3836 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,0,0,1,0,0|2,0,0]=3 3837 B8R1.1 CNC=1CCC(=O)C1 Amb24377588 [0,0,0,1,0,0|1,0,2]=4 3838 B8R1.1 CN[C@@H]1CN(C)CC1 Amb22230931 [0,0,0,1,0,0|3,0,0]=4 3839 B8R1.1 CN[C@@H]1CN(C)CC1 Amb22504092 [0,0,0,1,0,0|3,0,0]=4 3840 B8R1.1 CN[C@H]1CN(C)CC1 Amb22230913 [0,0,0,1,0,0|3,0,0]=4 3841 B8R1.1 COC1CC(=O)C=C1 Amb24425404 [0,0,0,1,0,0|1,0,2]=4 3842 B8R1.1 COC1CC(=O)CC1 Amb24483163 [0,0,0,1,0,0|1,0,0]=2 3843 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,0,0,1,0,0|2,0,0]=3 3844 B8R1.1 COC1CCC(N)C1 Amb24183578 [0,0,0,1,0,0|2,0,1]=4 3845 B8R1.1 COC1CCC(N)C1 Amb24483122 [0,0,0,1,0,0|2,0,1]=4 3846 B8R1.1 COC1CNC(=O)C1 Amb24683870 [0,0,0,1,0,0|2,0,0]=3 3847 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,0,0,1,0,0|3,0,0]=4 3848 B8R1.1 COC=1CCC(=O)C1 Amb21864758 [0,0,0,1,0,0|1,0,2]=4 3849 B8R1.1 CO[C@@H]1CC[C@@H](O)C1 Amb25283262 [0,0,0,1,0,0|1,0,2]=4 3850 B8R1.1 CO[C@H]1CC(=O)C=C1 Amb25689601 [0,0,0,1,0,0|1,0,2]=4 3851 B8R1.1 CSC1CCC(N)C1 Amb19337233 [0,0,0,1,0,0|2,0,1]=4 3852 B8R1.1 CSC=1CCC(=O)C1 Amb24626948 [0,0,0,1,0,0|1,0,2]=4 3853 B8R1.1 C[C@@H]1CCC(CO)O1 Amb24524279 [0,0,0,1,0,0|1,0,2]=4 3854 B8R1.1 C[C@@H]1CC[C@@H](CC)N1 Amb25232234 [0,0,0,1,0,0|1,0,1]=3 3855 B8R1.1 C[C@@H]1CC[C@@H](CCl)O1 Amb24579524 [0,0,0,1,0,0|1,0,2]=4 3856 B8R1.1 C[C@@H]1CC[C@@H](CO)N1 Amb24516993 [0,0,0,1,0,0|2,0,1]=4 3857 B8R1.1 C[C@@H]1CC[C@@H](CO)O1 Amb24712524 [0,0,0,1,0,0|1,0,2]=4 3858 B8R1.1 C[C@@H]1CC[C@H](CO)N1 Amb24679369 [0,0,0,1,0,0|2,0,1]=4 3859 B8R1.1 C[C@@H]1CC[C@H](CO)O1 Amb22886849 [0,0,0,1,0,0|1,0,2]=4 3860 B8R1.1 C[C@@H]1CN[C@@H](C1)CC Amb18833051 [0,0,0,1,0,0|2,0,1]=4 3861 B8R1.1 C[C@H]1CC(CC1)CO Amb25676567 [0,0,0,1,0,0|2,0,1]=4 3862 B8R1.1 C[C@H]1CCC(CO)O1 Amb25119985 [0,0,0,1,0,0|1,0,2]=4 3863 B8R1.1 C[C@H]1CC[C@@H](C1)CC Amb25250483 [0,0,0,1,0,0|1,0,1]=3 3864 B8R1.1 C[C@H]1CC[C@@H](CO)N1 Amb22886262 [0,0,0,1,0,0|2,0,1]=4 3865 B8R1.1 C[C@H]1CC[C@@H](CO)N1 Amb24745399 [0,0,0,1,0,0|2,0,1]=4 3866 B8R1.1 C[C@H]1CC[C@H](C1)CC Amb25061642 [0,0,0,1,0,0|1,0,1]=3 3867 B8R1.1 C[C@H]1CN[C@@H](C1)CC Amb25026435 [0,0,0,1,0,0|2,0,1]=4 3868 B8R1.1 C\C=C\1/CCC(=O)O1 Amb24751500 [0,0,0,1,0,0|1,0,2]=4 3869 B8R1.1 ClCC1CCC(=O)O1 Amb10608418 [0,0,0,1,0,0|2,0,0]=3 3870 B8R1.1 ClCC1CCN(C1)C Amb1090894 [0,0,0,1,0,0|3,0,0]=4 3871 B8R1.1 ClCC1CNC(=O)O1 Amb1152954 [0,0,0,1,0,0|3,0,0]=4 3872 B8R1.1 N#CC1CC(=O)CC1 Amb22886979 [0,0,0,1,0,0|1,0,1]=3 3873 B8R1.1 N#C[C@@H]1CCC(=O)N1 Amb25662472 [0,0,0,1,0,0|2,0,1]=4 3874 B8R1.1 N=C1CCC(CO)N1 Amb24630540 [0,0,0,1,0,0|3,0,0]=4 3875 B8R1.1 N=C1CC[C@@H](CO)N1 Amb24580264 [0,0,0,1,0,0|3,0,0]=4 3876 B8R1.1 NC1CC(CC1)CO Amb18641837 [0,0,0,1,0,0|2,0,1]=4 3877 B8R1.1 NC1CCC(C1)CN Amb24061862 [0,0,0,1,0,0|2,0,1]=4 3878 B8R1.1 NCC1CC(=O)CC1 Amb24644946 [0,0,0,1,0,0|1,0,0]=2 3879 B8R1.1 NCC1CC=C(Cl)C1 Amb23594525 [0,0,0,1,0,0|2,0,1]=4 3880 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,0,0,1,0,0|2,0,0]=3 3881 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,0,0,1,0,0|2,0,0]=3 3882 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,0,0,1,0,0|2,0,0]=3 3883 B8R1.1 NCC1CCC(Br)C1 Amb25284444 [0,0,0,1,0,0|2,0,1]=4 3884 B8R1.1 NCC1CCC(Cl)C1 Amb25043012 [0,0,0,1,0,0|2,0,1]=4 3885 B8R1.1 NCC1CCC(F)C1 Amb22886212 [0,0,0,1,0,0|2,0,1]=4 3886 B8R1.1 NCC1CCC(F)C1 Amb23456103 [0,0,0,1,0,0|2,0,1]=4 3887 B8R1.1 NCC1CCC(O)C1 Amb18641846 [0,0,0,1,0,0|1,0,2]=4 3888 B8R1.1 NCC1CCC(O)C1 Amb22886211 [0,0,0,1,0,0|1,0,2]=4 3889 B8R1.1 NCC1CCN(C1)C Amb2236418 [0,0,0,1,0,0|3,0,0]=4 3890 B8R1.1 NCC1CCN(C1)C Amb2237146 [0,0,0,1,0,0|3,0,0]=4 3891 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,0,0,1,0,0|2,0,0]=3 3892 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,0,0,1,0,0|3,0,0]=4 3893 B8R1.1 NCC1CNC(=O)O1 Amb23439310 [0,0,0,1,0,0|3,0,0]=4 3894 B8R1.1 NCC1COC(=O)C1 Amb22642236 [0,0,0,1,0,0|2,0,0]=3 3895 B8R1.1 NCC1CSC(=O)O1 Amb25843341 [0,0,0,1,0,0|3,0,0]=4 3896 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,0,0,1,0,0|2,0,0]=3 3897 B8R1.1 NC[C@@H]1CCC(=O)O1 Amb24656037 [0,0,0,1,0,0|2,0,0]=3 3898 B8R1.1 NC[C@@H]1CC[C@@H](C1)O Amb10066982 [0,0,0,1,0,0|1,0,2]=4 3899 B8R1.1 NC[C@@H]1CC[C@@H](F)C1 Amb22886221 [0,0,0,1,0,0|2,0,1]=4 3900 B8R1.1 NC[C@@H]1CC[C@@H](F)C1 Amb24641345 [0,0,0,1,0,0|2,0,1]=4 3901 B8R1.1 NC[C@@H]1CC[C@H](C1)O Amb10066974 [0,0,0,1,0,0|1,0,2]=4 3902 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,0,0,1,0,0|2,0,0]=3 3903 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,0,0,1,0,0|2,0,0]=3 3904 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,0,0,1,0,0|3,0,0]=4 3905 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,0,0,1,0,0|3,0,0]=4 3906 B8R1.1 NC[C@H]1CCC(=O)O1 Amb24376645 [0,0,0,1,0,0|2,0,0]=3 3907 B8R1.1 NC[C@H]1CC[C@@H](C1)O Amb10066981 [0,0,0,1,0,0|1,0,2]=4 3908 B8R1.1 NC[C@H]1CC[C@H](C1)O Amb10066975 [0,0,0,1,0,0|1,0,2]=4 3909 B8R1.1 NN1CC(CO)CC1 Amb25724495 [0,0,0,1,0,0|3,0,0]=4 3910 B8R1.1 N[C@@H]1C[C@@H](CC1)CF Amb23598383 [0,0,0,1,0,0|2,0,1]=4 3911 B8R1.1 N[C@H]1C[C@@H](CC1)CO Amb24603976 [0,0,0,1,0,0|2,0,1]=4 3912 B8R1.1 N[C@H]1C[C@H](CC1)CO Amb24526904 [0,0,0,1,0,0|2,0,1]=4 3913 B8R1.1 O=C1CC(CBr)CC1 Amb24483273 [0,0,0,1,0,0|1,0,0]=2 3914 B8R1.1 O=C1CC(CBr)CN1 Amb23597459 [0,0,0,1,0,0|2,0,0]=3 3915 B8R1.1 O=C1CC(CCl)CO1 Amb25367200 [0,0,0,1,0,0|2,0,0]=3 3916 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,0,0,1,0,0|2,0,0]=3 3917 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,0,0,1,0,0|2,0,0]=3 3918 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,0,0,1,0,0|2,0,0]=3 3919 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,0,0,1,0,0|2,0,0]=3 3920 B8R1.1 O=C1CCC(CCl)=C1 Amb24645790 [0,0,0,1,0,0|1,0,2]=4 3921 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,0,0,1,0,0|2,0,0]=3 3922 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,0,0,1,0,0|2,0,0]=3 3923 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,0,0,1,0,0|2,0,0]=3 3924 B8R1.1 O=C1CC[C@@H](CF)N1 Amb19148412 [0,0,0,1,0,0|2,0,0]=3 3925 B8R1.1 O=C1C[C@@H](CF)CO1 Amb22746494 [0,0,0,1,0,0|2,0,0]=3 3926 B8R1.1 O=C1C[C@H](CBr)CO1 Amb24429041 [0,0,0,1,0,0|2,0,0]=3 3927 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,0,0,1,0,0|2,0,0]=3 3928 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,0,0,1,0,0|3,0,0]=4 3929 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,0,0,1,0,0|3,0,0]=4 3930 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,0,0,1,0,0|3,0,0]=4 3931 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,0,0,1,0,0|3,0,0]=4 3932 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,0,0,1,0,0|3,0,0]=4 3933 B8R1.1 O=C1OC[C@H](CCl)O1 Amb25234049 [0,0,0,1,0,0|3,0,0]=4 3934 B8R1.1 O=C1SCC(CBr)S1 Amb24376514 [0,0,0,1,0,0|3,0,0]=4 3935 B8R1.1 O=CC1CC(=O)CC1 Amb18124240 [0,0,0,1,0,0|1,0,1]=3 3936 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [0,0,0,1,0,0|2,0,1]=4 3937 B8R1.1 O=CC1CCC(=O)O1 Amb18641761 [0,0,0,1,0,0|2,0,1]=4 3938 B8R1.1 O=CC1CCC(=O)S1 Amb25094339 [0,0,0,1,0,0|2,0,1]=4 3939 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [0,0,0,1,0,0|2,0,1]=4 3940 B8R1.1 O=CN1CC(=O)CC1 Amb25787488 [0,0,0,1,0,0|2,0,1]=4 3941 B8R1.1 O=C[C@@H]1CC(=O)CC1 Amb24481518 [0,0,0,1,0,0|1,0,1]=3 3942 B8R1.1 O=C[C@@H]1CCC(=O)O1 Amb24527426 [0,0,0,1,0,0|2,0,1]=4 3943 B8R1.1 O=C[C@@H]1CCC(=O)S1 Amb24483031 [0,0,0,1,0,0|2,0,1]=4 3944 B8R1.1 O=C[C@@H]1CNC(=O)C1 Amb24377645 [0,0,0,1,0,0|2,0,1]=4 3945 B8R1.1 O=C[C@H]1CC(=O)CC1 Amb25759704 [0,0,0,1,0,0|1,0,1]=3 3946 B8R1.1 O=C[C@H]1CCC(=O)N1 Amb24482383 [0,0,0,1,0,0|2,0,1]=4 3947 B8R1.1 O=S1CO[C@@H](CCl)C1 Amb24393149 [0,0,0,1,0,0|3,0,0]=4 3948 B8R1.1 OC1CC(CC1)CS Amb25853014 [0,0,0,1,0,0|1,0,2]=4 3949 B8R1.1 OC1CCC(C1)CO Amb22168730 [0,0,0,1,0,0|1,0,2]=4 3950 B8R1.1 OCC1CC(=O)CC1 Amb22168734 [0,0,0,1,0,0|1,0,0]=2 3951 B8R1.1 OCC1CC(=O)CO1 Amb24117838 [0,0,0,1,0,0|2,0,0]=3 3952 B8R1.1 OCC1CC=C(Cl)C1 Amb23594524 [0,0,0,1,0,0|2,0,1]=4 3953 B8R1.1 OCC1CCC(=O)N1 Amb1162732 [0,0,0,1,0,0|2,0,0]=3 3954 B8R1.1 OCC1CCC(=O)O1 Amb20240701 [0,0,0,1,0,0|2,0,0]=3 3955 B8R1.1 OCC1CCC(F)C1 Amb23455679 [0,0,0,1,0,0|2,0,1]=4 3956 B8R1.1 OCC1CNC(=O)S1 Amb25349662 [0,0,0,1,0,0|3,0,0]=4 3957 B8R1.1 OCC1COC(=O)C1 Amb22886806 [0,0,0,1,0,0|2,0,0]=3 3958 B8R1.1 OCC1COC(=O)N1 Amb22410779 [0,0,0,1,0,0|3,0,0]=4 3959 B8R1.1 OCC1OCC(=O)O1 Amb24643063 [0,0,0,1,0,0|3,0,0]=4 3960 B8R1.1 OC[C@@H]1CC(=O)C=C1 Amb25373368 [0,0,0,1,0,0|1,0,2]=4 3961 B8R1.1 OC[C@@H]1CC(=O)CC1 Amb22748084 [0,0,0,1,0,0|1,0,0]=2 3962 B8R1.1 OC[C@@H]1CCC(=O)N1 Amb2371840 [0,0,0,1,0,0|2,0,0]=3 3963 B8R1.1 OC[C@@H]1CCC(=O)S1 Amb24372061 [0,0,0,1,0,0|2,0,0]=3 3964 B8R1.1 OC[C@@H]1CNC(=O)C1 Amb25745471 [0,0,0,1,0,0|2,0,0]=3 3965 B8R1.1 OC[C@@H]1CNC(=O)O1 Amb24183552 [0,0,0,1,0,0|3,0,0]=4 3966 B8R1.1 OC[C@@H]1COC(=O)C1 Amb24414055 [0,0,0,1,0,0|2,0,0]=3 3967 B8R1.1 OC[C@H]1CC(=O)C=C1 Amb25093663 [0,0,0,1,0,0|1,0,2]=4 3968 B8R1.1 OC[C@H]1CC(=O)CC1 Amb24532129 [0,0,0,1,0,0|1,0,0]=2 3969 B8R1.1 OC[C@H]1CCC(=O)S1 Amb25823343 [0,0,0,1,0,0|2,0,0]=3 3970 B8R1.1 OC[C@H]1CNC(=O)C1 Amb24515579 [0,0,0,1,0,0|2,0,0]=3 3971 B8R1.1 OC[C@H]1CNC(=O)O1 Amb22737250 [0,0,0,1,0,0|3,0,0]=4 3972 B8R1.1 OC[C@H]1CSC(=O)N1 Amb24697600 [0,0,0,1,0,0|3,0,0]=4 3973 B8R1.1 O[C@@H]1CC[C@H](C1)CO Amb22748539 [0,0,0,1,0,0|1,0,2]=4 3974 B8R1.1 O[C@H]1CC[C@@H](C1)CO Amb24544575 [0,0,0,1,0,0|1,0,2]=4 3975 B8R1.1 O[C@H]1CC[C@H](C1)CO Amb24619136 [0,0,0,1,0,0|1,0,2]=4 3976 B8R1.4 C=C1CC(O)CCC1 Amb25296194 [0,0,0,1,0,0|2,0,0]=3 3977 B8R1.4 C=C1CCCC(=C)C1 Amb17940138 [0,0,0,1,0,0|1,0,2]=4 3978 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,0,0,1,0,0|0,0,2]=3 3979 B8R1.4 CC1=CC(=O)CCO1 Amb25053054 [0,0,0,1,0,0|1,0,2]=4 3980 B8R1.4 CC1=CC(=O)CCS1 Amb25092957 [0,0,0,1,0,0|1,0,2]=4 3981 B8R1.4 CC1=CC(CCC1)O Amb10844732 [0,0,0,1,0,0|2,0,0]=3 3982 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,0,0,1,0,0|1,0,2]=4 3983 B8R1.4 CC1C=C(C)CCN1 Amb24694144 [0,0,0,1,0,0|2,0,0]=3 3984 B8R1.4 CC1C=CCC(=O)N1 Amb24392943 [0,0,0,1,0,0|1,0,2]=4 3985 B8R1.4 CC1CC(=C)CCC1 Amb25237522 [0,0,0,1,0,0|1,0,0]=2 3986 B8R1.4 CC1CC(=C)CCO1 Amb25235098 [0,0,0,1,0,0|2,0,0]=3 3987 B8R1.4 CC1CC(=N)NCC1 Amb19930463 [0,0,0,1,0,0|2,0,0]=3 3988 B8R1.4 CC1CC(=O)C=CO1 Amb25173826 [0,0,0,1,0,0|1,0,2]=4 3989 B8R1.4 CC1CC(=O)C=CS1 Amb25053096 [0,0,0,1,0,0|1,0,2]=4 3990 B8R1.4 CC1CC(=O)CC=C1 Amb25713549 [0,0,0,1,0,0|0,0,2]=3 3991 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,0,0,1,0,0|1,0,0]=2 3992 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,0,0,1,0,0|1,0,0]=2 3993 B8R1.4 CC1CC(=O)NC=C1 Amb24745438 [0,0,0,1,0,0|1,0,2]=4 3994 B8R1.4 CC1CC(=O)NCC1 Amb20668125 [0,0,0,1,0,0|1,0,0]=2 3995 B8R1.4 CC1CC(Br)CCN1 Amb25704461 [0,0,0,1,0,0|2,0,1]=4 3996 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [0,0,0,1,0,0|2,0,1]=4 3997 B8R1.4 CC1CC(Br)CNC1 Amb25197630 [0,0,0,1,0,0|2,0,1]=4 3998 B8R1.4 CC1CC(Br)CSC1 Amb23568744 [0,0,0,1,0,0|2,0,1]=4 3999 B8R1.4 CC1CC(Br)OCC1 Amb24433110 [0,0,0,1,0,0|2,0,1]=4 4000 B8R1.4 CC1CC(C)=CCN1 Amb25352197 [0,0,0,1,0,0|2,0,1]=4 4001 B8R1.4 CC1CC(C)CCC1 Amb22228339 [0,0,0,1,0,0|1,0,1]=3 4002 B8R1.4 CC1CC(C)NCC1 Amb19957920 [0,0,0,1,0,0|2,0,1]=4 4003 B8R1.4 CC1CC(Cl)OCC1 Amb24693934 [0,0,0,1,0,0|2,0,1]=4 4004 B8R1.4 CC1CC(N)=NCC1 Amb22496716 [0,0,0,1,0,0|2,0,0]=3 4005 B8R1.4 CC1CC(N)CCN1 Amb23440606 [0,0,0,1,0,0|2,0,1]=4 4006 B8R1.4 CC1CC(N)CCO1 Amb22059408 [0,0,0,1,0,0|2,0,1]=4 4007 B8R1.4 CC1CC(N)CCS1 Amb18642861 [0,0,0,1,0,0|2,0,1]=4 4008 B8R1.4 CC1CC(N)CSC1 Amb23568739 [0,0,0,1,0,0|2,0,1]=4 4009 B8R1.4 CC1CC(O)CCO1 Amb22757197 [0,0,0,1,0,0|1,0,2]=4 4010 B8R1.4 CC1CC(O)CNC1 Amb24507417 [0,0,0,1,0,0|1,0,2]=4 4011 B8R1.4 CC1CC(O)CSC1 Amb23568717 [0,0,0,1,0,0|1,0,2]=4 4012 B8R1.4 CC1CC(S)NCC1 Amb24531328 [0,0,0,1,0,0|1,1,1]=4 4013 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,0,0,1,0,0|1,0,2]=4 4014 B8R1.4 CC1CC=NC(=O)N1 Amb24580624 [0,0,0,1,0,0|2,0,1]=4 4015 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,0,0,1,0,0|0,0,0]=1 4016 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,0,0,1,0,0|1,0,0]=2 4017 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,0,0,1,0,0|1,0,0]=2 4018 B8R1.4 CC1CCCC(C1)N Amb1120465 [0,0,0,1,0,0|1,0,1]=3 4019 B8R1.4 CC1CCCC(Cl)O1 Amb25258362 [0,0,0,1,0,0|1,0,2]=4 4020 B8R1.4 CC1CCCC(N)=N1 Amb24674080 [0,0,0,1,0,0|2,0,0]=3 4021 B8R1.4 CC1CCCN(C1)C Amb10573560 [0,0,0,1,0,0|2,0,0]=3 4022 B8R1.4 CC1CCCN(C1)N Amb17231819 [0,0,0,1,0,0|2,0,0]=3 4023 B8R1.4 CC1CCN=C(N)S1 Amb22228568 [0,0,0,1,0,0|2,1,0]=4 4024 B8R1.4 CC1CCNC(=N)C1 Amb17616048 [0,0,0,1,0,0|2,0,0]=3 4025 B8R1.4 CC1CCNC(=S)O1 Amb25836339 [0,0,0,1,0,0|2,0,1]=4 4026 B8R1.4 CC1CCNC(C)=N1 Amb25837033 [0,0,0,1,0,0|2,0,0]=3 4027 B8R1.4 CC1CCNC(C)S1 Amb24452780 [0,0,0,1,0,0|1,1,1]=4 4028 B8R1.4 CC1CCOC(=O)C1 Amb15693478 [0,0,0,1,0,0|1,0,0]=2 4029 B8R1.4 CC1CCOC(=S)N1 Amb24548582 [0,0,0,1,0,0|2,1,0]=4 4030 B8R1.4 CC1CCSC(=S)N1 Amb25368051 [0,0,0,1,0,0|2,1,0]=4 4031 B8R1.4 CC1CN(C)CCN1 Amb18062087 [0,0,0,1,0,0|3,0,0]=4 4032 B8R1.4 CC1CN(C)CCN1 Amb22728011 [0,0,0,1,0,0|3,0,0]=4 4033 B8R1.4 CC1CN(C)CCO1 Amb22754927 [0,0,0,1,0,0|3,0,0]=4 4034 B8R1.4 CC1CN(N)CCC1 Amb22491393 [0,0,0,1,0,0|2,0,0]=3 4035 B8R1.4 CC1CN(N)CCO1 Amb18559327 [0,0,0,1,0,0|3,0,0]=4 4036 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,0,0,1,0,0|2,0,0]=3 4037 B8R1.4 CC1CNCC(C)=C1 Amb25757457 [0,0,0,1,0,0|2,0,0]=3 4038 B8R1.4 CC1CNCC(C)N1 Amb23412204 [0,0,0,1,0,0|2,0,1]=4 4039 B8R1.4 CC1CNCC(C)O1 Amb22754920 [0,0,0,1,0,0|1,0,2]=4 4040 B8R1.4 CC1CNCC(C)S1 Amb18642865 [0,0,0,1,0,0|1,1,1]=4 4041 B8R1.4 CC1CNCC(C)S1 Amb19373865 [0,0,0,1,0,0|1,1,1]=4 4042 B8R1.4 CC1CNCC(N1)C Amb10067760 [0,0,0,1,0,0|2,0,1]=4 4043 B8R1.4 CC1COCC(=O)C1 Amb24431094 [0,0,0,1,0,0|1,0,0]=2 4044 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,0,0,1,0,0|2,0,0]=3 4045 B8R1.4 CC1COCC(C)N1 Amb19515707 [0,0,0,1,0,0|2,0,1]=4 4046 B8R1.4 CC1CS(=O)CCN1 Amb18124392 [0,0,0,1,0,0|2,0,0]=3 4047 B8R1.4 CC1CSCC(=O)C1 Amb23568711 [0,0,0,1,0,0|1,0,0]=2 4048 B8R1.4 CC1CSCC(=O)N1 Amb25131602 [0,0,0,1,0,0|2,0,0]=3 4049 B8R1.4 CC1CSCC(C)N1 Amb18642862 [0,0,0,1,0,0|2,0,1]=4 4050 B8R1.4 CC1CSCC(C)N1 Amb20622324 [0,0,0,1,0,0|2,0,1]=4 4051 B8R1.4 CC1NCCC(=O)C1 Amb1087926 [0,0,0,1,0,0|1,0,0]=2 4052 B8R1.4 CC1OCCC(C)=C1 Amb17689157 [0,0,0,1,0,0|2,0,0]=3 4053 B8R1.4 CC=1CC(=O)NCC1 Amb25259208 [0,0,0,1,0,0|1,0,2]=4 4054 B8R1.4 CC=1CC(=O)OCC1 Amb24751502 [0,0,0,1,0,0|1,0,2]=4 4055 B8R1.4 CC=1CC(O)CCC1 Amb25245575 [0,0,0,1,0,0|2,0,1]=4 4056 B8R1.4 CC=1CCCC(Br)C1 Amb25108623 [0,0,0,1,0,0|2,0,0]=3 4057 B8R1.4 CC=1CCCC(N)C1 Amb18641662 [0,0,0,1,0,0|2,0,0]=3 4058 B8R1.4 CC=1CCC[C@@H](O)C1 Amb25734264 [0,0,0,1,0,0|2,0,0]=3 4059 B8R1.4 CC=1COCC(=O)C1 Amb25065804 [0,0,0,1,0,0|1,0,2]=4 4060 B8R1.4 CC=1C[C@@H](O)CCC1 Amb24619172 [0,0,0,1,0,0|2,0,1]=4 4061 B8R1.4 CC=1NC(O)CCN1 Amb25326382 [0,0,0,1,0,0|3,0,0]=4 4062 B8R1.4 CC=1NCCC(=O)N1 Amb24382048 [0,0,0,1,0,0|2,0,1]=4 4063 B8R1.4 CN1CC(=O)CCC1 Amb22304741 [0,0,0,1,0,0|1,0,0]=2 4064 B8R1.4 CN1CC(=O)CCC1 Amb22490632 [0,0,0,1,0,0|1,0,0]=2 4065 B8R1.4 CN1CC(=O)NCC1 Amb19958159 [0,0,0,1,0,0|2,0,0]=3 4066 B8R1.4 CN1CC(=O)OCC1 Amb21963307 [0,0,0,1,0,0|2,0,0]=3 4067 B8R1.4 CN1CC(=O)OCC1 Amb22491652 [0,0,0,1,0,0|2,0,0]=3 4068 B8R1.4 CN1CC(Br)CCC1 Amb21860296 [0,0,0,1,0,0|2,0,1]=4 4069 B8R1.4 CN1CC(Br)CCC1 Amb22496801 [0,0,0,1,0,0|2,0,1]=4 4070 B8R1.4 CN1CC(I)CCC1 Amb21860298 [0,0,0,1,0,0|2,0,1]=4 4071 B8R1.4 CN1CC(O)CCC1 Amb24064756 [0,0,0,1,0,0|1,0,2]=4 4072 B8R1.4 CN1CC(S)CCC1 Amb24608915 [0,0,0,1,0,0|1,1,1]=4 4073 B8R1.4 CN1CCC=C(C1)Br Amb10975875 [0,0,0,1,0,0|2,0,1]=4 4074 B8R1.4 CN1CCC=C(C1)Br Amb13888761 [0,0,0,1,0,0|2,0,1]=4 4075 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,0,0,1,0,0|1,0,0]=2 4076 B8R1.4 CN1CCCC(Cl)C1 Amb17939887 [0,0,0,1,0,0|2,0,1]=4 4077 B8R1.4 CN1CCCN(C1)C Amb10574478 [0,0,0,1,0,0|3,0,0]=4 4078 B8R1.4 CN1CCC[C@@H](C1)N Amb17134810 [0,0,0,1,0,0|2,0,1]=4 4079 B8R1.4 CN1CCNC(=O)N1 Amb24426756 [0,0,0,1,0,0|3,0,0]=4 4080 B8R1.4 CN1CCN[C@H](C1)C Amb15701224 [0,0,0,1,0,0|3,0,0]=4 4081 B8R1.4 CN1C[C@@H](Br)CCC1 Amb22226654 [0,0,0,1,0,0|2,0,1]=4 4082 B8R1.4 CN1C[C@@H](C)NCC1 Amb23439872 [0,0,0,1,0,0|3,0,0]=4 4083 B8R1.4 CN1C[C@@H](C)NCC1 Amb24054699 [0,0,0,1,0,0|3,0,0]=4 4084 B8R1.4 CN1C[C@@H](Cl)CCC1 Amb22226656 [0,0,0,1,0,0|2,0,1]=4 4085 B8R1.4 CN1C[C@@H](I)CCC1 Amb22226477 [0,0,0,1,0,0|2,0,1]=4 4086 B8R1.4 CN1C[C@@H](N)CCC1 Amb22405886 [0,0,0,1,0,0|2,0,1]=4 4087 B8R1.4 CN1C[C@@H](N)CCC1 Amb24053175 [0,0,0,1,0,0|2,0,1]=4 4088 B8R1.4 CN1C[C@@H](O)CCC1 Amb22225471 [0,0,0,1,0,0|1,0,2]=4 4089 B8R1.4 CN1C[C@H](Br)CCC1 Amb22225308 [0,0,0,1,0,0|2,0,1]=4 4090 B8R1.4 CN1C[C@H](Cl)CCC1 Amb22225319 [0,0,0,1,0,0|2,0,1]=4 4091 B8R1.4 CN1C[C@H](I)CCC1 Amb22225056 [0,0,0,1,0,0|2,0,1]=4 4092 B8R1.4 CN1C[C@H](N)CCC1 Amb22225152 [0,0,0,1,0,0|2,0,1]=4 4093 B8R1.4 CN1C[C@H](N)CCC1 Amb24053176 [0,0,0,1,0,0|2,0,1]=4 4094 B8R1.4 CN1C[C@H](O)CCC1 Amb22225150 [0,0,0,1,0,0|1,0,2]=4 4095 B8R1.4 CS=1CCCC(=O)C1 Amb25318868 [0,0,0,1,0,0|1,0,1]=3 4096 B8R1.4 C[C@@H]1CC(=O)C=CO1 Amb22748948 [0,0,0,1,0,0|1,0,2]=4 4097 B8R1.4 C[C@@H]1CC(=O)CCC1 Amb22799724 [0,0,0,1,0,0|0,0,0]=1 4098 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,0,0,1,0,0|1,0,0]=2 4099 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,0,0,1,0,0|1,0,0]=2 4100 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,0,0,1,0,0|1,0,0]=2 4101 B8R1.4 C[C@@H]1CC(=O)NCC1 Amb25739591 [0,0,0,1,0,0|1,0,0]=2 4102 B8R1.4 C[C@@H]1CC(N)CCC1 Amb24674089 [0,0,0,1,0,0|1,0,1]=3 4103 B8R1.4 C[C@@H]1CC=CC(=O)N1 Amb25062539 [0,0,0,1,0,0|1,0,2]=4 4104 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,0,0,1,0,0|1,0,0]=2 4105 B8R1.4 C[C@@H]1CCCC(C)N1 Amb25779036 [0,0,0,1,0,0|1,0,1]=3 4106 B8R1.4 C[C@@H]1CCCC(O)O1 Amb25680618 [0,0,0,1,0,0|1,0,2]=4 4107 B8R1.4 C[C@@H]1CCC[C@@H](O)O1 Amb25345132 [0,0,0,1,0,0|1,0,2]=4 4108 B8R1.4 C[C@@H]1CN(C)CCN1 Amb18833028 [0,0,0,1,0,0|3,0,0]=4 4109 B8R1.4 C[C@@H]1CN(C)CCN1 Amb22756297 [0,0,0,1,0,0|3,0,0]=4 4110 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,0,0,1,0,0|2,0,0]=3 4111 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,0,0,1,0,0|2,0,0]=3 4112 B8R1.4 C[C@@H]1CNC[C@@H](C)C1 Amb25231776 [0,0,0,1,0,0|2,0,1]=4 4113 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 Amb22745664 [0,0,0,1,0,0|2,0,1]=4 4114 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 Amb22746818 [0,0,0,1,0,0|2,0,1]=4 4115 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 Amb23439675 [0,0,0,1,0,0|2,0,1]=4 4116 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22745550 [0,0,0,1,0,0|1,0,2]=4 4117 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22748718 [0,0,0,1,0,0|1,0,2]=4 4118 B8R1.4 C[C@@H]1CNC[C@H](C)N1 Amb23399869 [0,0,0,1,0,0|2,0,1]=4 4119 B8R1.4 C[C@@H]1CNC[C@H](C)S1 Amb24394593 [0,0,0,1,0,0|1,1,1]=4 4120 B8R1.4 C[C@@H]1COCC(=O)C1 Amb25746655 [0,0,0,1,0,0|1,0,0]=2 4121 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,0,0,1,0,0|2,0,0]=3 4122 B8R1.4 C[C@@H]1COCC(C)N1 Amb24561848 [0,0,0,1,0,0|2,0,1]=4 4123 B8R1.4 C[C@@H]1COC[C@@H](C)N1 Amb22744738 [0,0,0,1,0,0|2,0,1]=4 4124 B8R1.4 C[C@@H]1COC[C@@H](C)N1 Amb22744959 [0,0,0,1,0,0|2,0,1]=4 4125 B8R1.4 C[C@@H]1COC[C@H](C)N1 Amb22745382 [0,0,0,1,0,0|2,0,1]=4 4126 B8R1.4 C[C@@H]1COC[C@H](C)N1 Amb22749660 [0,0,0,1,0,0|2,0,1]=4 4127 B8R1.4 C[C@@H]1CS(=O)CCN1 Amb24695988 [0,0,0,1,0,0|2,0,0]=3 4128 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [0,0,0,1,0,0|2,0,1]=4 4129 B8R1.4 C[C@@H]1C[C@@H](C)CCC1 Amb22800215 [0,0,0,1,0,0|1,0,1]=3 4130 B8R1.4 C[C@@H]1C[C@@H](Cl)CCC1 Amb24589765 [0,0,0,1,0,0|1,0,1]=3 4131 B8R1.4 C[C@@H]1C[C@@H](N)CCC1 Amb22746977 [0,0,0,1,0,0|1,0,1]=3 4132 B8R1.4 C[C@@H]1C[C@@H](O)CCO1 Amb22753040 [0,0,0,1,0,0|1,0,2]=4 4133 B8R1.4 C[C@@H]1C[C@@H](O)CCS1 Amb24515322 [0,0,0,1,0,0|1,0,2]=4 4134 B8R1.4 C[C@@H]1C[C@H](C)NCC1 Amb22748742 [0,0,0,1,0,0|2,0,1]=4 4135 B8R1.4 C[C@@H]1C[C@H](Cl)OCC1 Amb24513485 [0,0,0,1,0,0|2,0,1]=4 4136 B8R1.4 C[C@@H]1C[C@H](N)CCC1 Amb25230368 [0,0,0,1,0,0|1,0,1]=3 4137 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [0,0,0,1,0,0|2,0,1]=4 4138 B8R1.4 C[C@@H]1C[C@H](O)CCC1 Amb22800307 [0,0,0,1,0,0|0,0,2]=3 4139 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb22406182 [0,0,0,1,0,0|1,0,2]=4 4140 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb23440188 [0,0,0,1,0,0|1,0,2]=4 4141 B8R1.4 C[C@@H]1C[C@H](O)CCO1 Amb22746391 [0,0,0,1,0,0|1,0,2]=4 4142 B8R1.4 C[C@H]1CC(=O)C=CN1 Amb25800362 [0,0,0,1,0,0|1,0,2]=4 4143 B8R1.4 C[C@H]1CC(=O)C=CO1 Amb24483279 [0,0,0,1,0,0|1,0,2]=4 4144 B8R1.4 C[C@H]1CC(=O)CCC1 Amb21618704 [0,0,0,1,0,0|0,0,0]=1 4145 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,0,0,1,0,0|1,0,0]=2 4146 B8R1.4 C[C@H]1CC(N)CCC1 Amb24529186 [0,0,0,1,0,0|1,0,1]=3 4147 B8R1.4 C[C@H]1CC(O)OCC1 Amb25810643 [0,0,0,1,0,0|1,0,2]=4 4148 B8R1.4 C[C@H]1CC=CC(=O)C1 Amb25723295 [0,0,0,1,0,0|0,0,2]=3 4149 B8R1.4 C[C@H]1CC=CC(=O)N1 Amb25326479 [0,0,0,1,0,0|1,0,2]=4 4150 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,0,0,1,0,0|1,0,2]=4 4151 B8R1.4 C[C@H]1CCCC(=O)N1 Amb25327957 [0,0,0,1,0,0|1,0,0]=2 4152 B8R1.4 C[C@H]1CCC[C@@H](O)O1 Amb25175369 [0,0,0,1,0,0|1,0,2]=4 4153 B8R1.4 C[C@H]1CN(C)CCN1 Amb22736681 [0,0,0,1,0,0|3,0,0]=4 4154 B8R1.4 C[C@H]1CN(C)CCO1 Amb25162545 [0,0,0,1,0,0|3,0,0]=4 4155 B8R1.4 C[C@H]1CN(N)CCC1 Amb25807281 [0,0,0,1,0,0|2,0,0]=3 4156 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,0,0,1,0,0|2,0,0]=3 4157 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,0,0,1,0,0|2,0,0]=3 4158 B8R1.4 C[C@H]1CNC[C@H](C)C1 Amb25214406 [0,0,0,1,0,0|2,0,1]=4 4159 B8R1.4 C[C@H]1CNC[C@H](C)N1 Amb24697595 [0,0,0,1,0,0|2,0,1]=4 4160 B8R1.4 C[C@H]1CNC[C@H](C)O1 Amb22406103 [0,0,0,1,0,0|1,0,2]=4 4161 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,0,0,1,0,0|2,0,0]=3 4162 B8R1.4 C[C@H]1COC[C@H](C)N1 Amb24514970 [0,0,0,1,0,0|2,0,1]=4 4163 B8R1.4 C[C@H]1C[C@@H](C)NCC1 Amb24603758 [0,0,0,1,0,0|2,0,1]=4 4164 B8R1.4 C[C@H]1C[C@@H](Cl)CCC1 Amb24512116 [0,0,0,1,0,0|1,0,1]=3 4165 B8R1.4 C[C@H]1C[C@@H](O)CCC1 Amb24713971 [0,0,0,1,0,0|0,0,2]=3 4166 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Amb22406181 [0,0,0,1,0,0|1,0,2]=4 4167 B8R1.4 C[C@H]1C[C@@H](O)CCS1 Amb24515349 [0,0,0,1,0,0|1,0,2]=4 4168 B8R1.4 C[C@H]1C[C@H](Br)CCC1 Amb24519716 [0,0,0,1,0,0|1,0,1]=3 4169 B8R1.4 C[C@H]1C[C@H](C)CCC1 Amb25101983 [0,0,0,1,0,0|1,0,1]=3 4170 B8R1.4 C[C@H]1C[C@H](N)CCC1 Amb24629158 [0,0,0,1,0,0|1,0,1]=3 4171 B8R1.4 C[C@H]1C[C@H](O)CCC1 Amb24383351 [0,0,0,1,0,0|0,0,2]=3 4172 B8R1.4 C[C@H]1C[C@H](O)CCS1 Amb24515394 [0,0,0,1,0,0|1,0,2]=4 4173 B8R1.4 C[C@H]1C[C@H](O)CNC1 Amb25206204 [0,0,0,1,0,0|1,0,2]=4 4174 B8R1.4 ClC1CC(Cl)CCC1 Amb24467486 [0,0,0,1,0,0|2,0,1]=4 4175 B8R1.4 ClC=1CCCC(Br)C1 Amb25189957 [0,0,0,1,0,0|2,0,1]=4 4176 B8R1.4 Cl[C@@H]1C[C@H](Br)CCC1 Amb24557453 [0,0,0,1,0,0|2,0,1]=4 4177 B8R1.4 FC1CC(Cl)CCC1 Amb25839740 [0,0,0,1,0,0|2,0,1]=4 4178 B8R1.4 F[C@@H]1C[C@H](Cl)CCC1 Amb24557823 [0,0,0,1,0,0|2,0,1]=4 4179 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,0,0,1,0,0|1,0,2]=4 4180 B8R1.4 NC1CC(=O)CCC1 Amb23440459 [0,0,0,1,0,0|1,0,0]=2 4181 B8R1.4 NC1CC(=O)NCC1 Amb19957631 [0,0,0,1,0,0|2,0,0]=3 4182 B8R1.4 NC1CC(=O)NCC1 Amb21960626 [0,0,0,1,0,0|2,0,0]=3 4183 B8R1.4 NC1CC(=O)OCC1 Amb18641823 [0,0,0,1,0,0|2,0,0]=3 4184 B8R1.4 NC1CC(F)CCC1 Amb22233777 [0,0,0,1,0,0|2,0,1]=4 4185 B8R1.4 NC1CC(N)=NCC1 Amb25225367 [0,0,0,1,0,0|3,0,0]=4 4186 B8R1.4 NC1CC(N)CCC1 Amb22230141 [0,0,0,1,0,0|2,0,1]=4 4187 B8R1.4 NC1CC(O)CCC1 Amb22491291 [0,0,0,1,0,0|1,0,2]=4 4188 B8R1.4 NC1CCCC(C1)Br Amb16233891 [0,0,0,1,0,0|2,0,1]=4 4189 B8R1.4 NC1CCCC(C1)Cl Amb16233743 [0,0,0,1,0,0|2,0,1]=4 4190 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,0,0,1,0,0|2,0,0]=3 4191 B8R1.4 NC1CS(=O)CCC1 Amb18124391 [0,0,0,1,0,0|2,0,0]=3 4192 B8R1.4 NC=1CCCC(=O)N1 Amb24525241 [0,0,0,1,0,0|2,0,1]=4 4193 B8R1.4 NN1CC(O)CCC1 Amb25359108 [0,0,0,1,0,0|3,0,0]=4 4194 B8R1.4 NN1CCCC(C1)F Amb13888980 [0,0,0,1,0,0|3,0,0]=4 4195 B8R1.4 N[C@@H]1CC(=O)NCC1 Amb25168718 [0,0,0,1,0,0|2,0,0]=3 4196 B8R1.4 N[C@@H]1C[C@@H](F)CCC1 Amb22886235 [0,0,0,1,0,0|2,0,1]=4 4197 B8R1.4 N[C@@H]1C[C@@H](N)CCC1 Amb24323765 [0,0,0,1,0,0|2,0,1]=4 4198 B8R1.4 N[C@@H]1C[C@@H](O)CCC1 Amb22828171 [0,0,0,1,0,0|1,0,2]=4 4199 B8R1.4 N[C@@H]1C[C@@H](O)CCC1 Amb22886176 [0,0,0,1,0,0|1,0,2]=4 4200 B8R1.4 N[C@@H]1C[C@H](N)CCC1 Amb22746528 [0,0,0,1,0,0|2,0,1]=4 4201 B8R1.4 N[C@@H]1C[C@H](N)CCC1 Amb24323764 [0,0,0,1,0,0|2,0,1]=4 4202 B8R1.4 N[C@@H]1C[C@H](O)CCC1 Amb22746547 [0,0,0,1,0,0|1,0,2]=4 4203 B8R1.4 N[C@@H]1C[C@H](O)CCC1 Amb22752827 [0,0,0,1,0,0|1,0,2]=4 4204 B8R1.4 N[C@H]1CC(=O)OCC1 Amb24550653 [0,0,0,1,0,0|2,0,0]=3 4205 B8R1.4 N[C@H]1CS(=O)CCC1 Amb25168909 [0,0,0,1,0,0|2,0,0]=3 4206 B8R1.4 N[C@H]1C[C@@H](O)CCC1 Amb22270007 [0,0,0,1,0,0|1,0,2]=4 4207 B8R1.4 N[C@H]1C[C@H](N)CCC1 Amb24390427 [0,0,0,1,0,0|2,0,1]=4 4208 B8R1.4 N[C@H]1C[C@H](O)CCC1 Amb24074365 [0,0,0,1,0,0|1,0,2]=4 4209 B8R1.4 N[C@H]1C[C@H](O)CCC1 Amb24671187 [0,0,0,1,0,0|1,0,2]=4 4210 B8R1.4 O=C1CC(Cl)CNN1 Amb22728306 [0,0,0,1,0,0|3,0,0]=4 4211 B8R1.4 O=C1CC(F)CCC1 Amb24578309 [0,0,0,1,0,0|1,0,0]=2 4212 B8R1.4 O=C1CC(F)OCC1 Amb21927920 [0,0,0,1,0,0|2,0,0]=3 4213 B8R1.4 O=C1CC(I)CCC1 Amb24436778 [0,0,0,1,0,0|1,0,0]=2 4214 B8R1.4 O=C1CC(I)CCN1 Amb24387789 [0,0,0,1,0,0|2,0,0]=3 4215 B8R1.4 O=C1CC(I)CNN1 Amb25250615 [0,0,0,1,0,0|3,0,0]=4 4216 B8R1.4 O=C1CC(S)CCC1 Amb25205406 [0,0,0,1,0,0|1,0,0]=2 4217 B8R1.4 O=C1CCCC(=S)N1 Amb25807347 [0,0,0,1,0,0|2,0,1]=4 4218 B8R1.4 O=C1CCCC(I)=C1 Amb25706767 [0,0,0,1,0,0|1,0,2]=4 4219 B8R1.4 O=C1CCCC(S)=C1 Amb25128260 [0,0,0,1,0,0|1,0,2]=4 4220 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,0,0,1,0,0|2,0,1]=4 4221 B8R1.4 O=C1CNCC(=O)C1 Amb22755578 [0,0,0,1,0,0|2,0,1]=4 4222 B8R1.4 O=C1COCC(=O)C1 Amb22292040 [0,0,0,1,0,0|2,0,1]=4 4223 B8R1.4 O=C1COCC(=O)C1 Amb22406411 [0,0,0,1,0,0|2,0,1]=4 4224 B8R1.4 O=C1CSCC(=O)C1 Amb2499999 [0,0,0,1,0,0|2,0,1]=4 4225 B8R1.4 O=S1CS(=O)CCC1 Amb22363746 [0,0,0,1,0,0|3,0,0]=4 4226 B8R1.4 O=S1C[C@@H](Cl)CCC1 Amb24533964 [0,0,0,1,0,0|2,0,0]=3 4227 B8R1.4 O=S1C[C@H](Cl)CCC1 Amb25779923 [0,0,0,1,0,0|2,0,0]=3 4228 B8R1.4 O=[13C]1CCC[13C](=O)O1 Amb17614796 [0,0,0,1,0,0|2,0,1]=4 4229 B8R1.4 O=[13C]1CCC[13C](=O)[13CH2]1 Amb17611454 [0,0,0,1,0,0|1,0,1]=3 4230 B8R1.4 O=[13C]1[13CH2][13CH2][13CH2][13C](=O)[13CH2]1 Amb17611455 [0,0,0,1,0,0|1,0,1]=3 4231 B8R1.4 OC1=CC(=O)CCC1 Amb17844413 [0,0,0,1,0,0|1,0,2]=4 4232 B8R1.4 OC1CC(=O)CCC1 Amb22754759 [0,0,0,1,0,0|1,0,0]=2 4233 B8R1.4 OC1CC(=O)CCN1 Amb24746013 [0,0,0,1,0,0|2,0,0]=3 4234 B8R1.4 OC1CC(=O)OCC1 Amb24475154 [0,0,0,1,0,0|2,0,0]=3 4235 B8R1.4 OC1CC(Br)CCC1 Amb24483115 [0,0,0,1,0,0|1,0,2]=4 4236 B8R1.4 OC1CCCC(Br)=C1 Amb24606865 [0,0,0,1,0,0|2,0,1]=4 4237 B8R1.4 OC1CCNC(=O)C1 Amb10602744 [0,0,0,1,0,0|2,0,0]=3 4238 B8R1.4 OC1CCNC(C1)C Amb1051141 [0,0,0,1,0,0|1,0,2]=4 4239 B8R1.4 OC1CNCC(=O)N1 Amb24446977 [0,0,0,1,0,0|3,0,0]=4 4240 B8R1.4 O[C@@H]1CC(=O)NCC1 Amb22744924 [0,0,0,1,0,0|2,0,0]=3 4241 B8R1.4 O[C@@H]1CCNC(=O)C1 Amb17845212 [0,0,0,1,0,0|2,0,0]=3 4242 B8R1.4 O[C@@H]1C[C@@H](O)CCC1 Amb22801014 [0,0,0,1,0,0|1,0,2]=4 4243 B8R1.4 O[C@@H]1C[C@H](Br)CCC1 Amb24739845 [0,0,0,1,0,0|1,0,2]=4 4244 B8R1.4 O[C@@H]1C[C@H](Cl)CCC1 Amb24512124 [0,0,0,1,0,0|1,0,2]=4 4245 B8R1.4 O[C@@H]1C[C@H](O)CCC1 Amb22801622 [0,0,0,1,0,0|1,0,2]=4 4246 B8R1.4 O[C@H]1CC(=O)CCC1 Amb25320136 [0,0,0,1,0,0|1,0,0]=2 4247 B8R1.4 O[C@H]1CC(=O)OCC1 Amb25320391 [0,0,0,1,0,0|2,0,0]=3 4248 B8R1.4 O[C@H]1CCCC(Br)=C1 Amb25296540 [0,0,0,1,0,0|2,0,1]=4 4249 B8R1.4 O[C@H]1C[C@H](Br)CCC1 Amb24558410 [0,0,0,1,0,0|1,0,2]=4 4250 B8R1.4 O[C@H]1C[C@H](Cl)CCC1 Amb24739695 [0,0,0,1,0,0|1,0,2]=4 4251 B8R1.4 [O-]C1COCC(=O)C1 Amb22739834 [0,0,0,1,0,0|2,0,0]=3 4252 B8R1.6 C#CCC1CC(=O)N1 Amb24642215 [0,0,0,1,0,0|1,0,2]=4 4253 B8R1.6 C=CCC1CC(=O)N1 Amb24453069 [0,0,0,1,0,0|1,0,2]=4 4254 B8R1.6 C=CC[C@@H]1CC(=O)N1 Amb25107896 [0,0,0,1,0,0|1,0,2]=4 4255 B8R1.6 CC1CC(C1)CNC Amb23580217 [0,0,0,1,0,0|2,0,1]=4 4256 B8R1.6 CC1CC(C1)NCC Amb24483219 [0,0,0,1,0,0|2,0,1]=4 4257 B8R1.6 CC1CC(CCN)C1 Amb23590279 [0,0,0,1,0,0|2,0,1]=4 4258 B8R1.6 CCCC1CC(=C)C1 Amb25237339 [0,0,0,1,0,0|1,0,0]=2 4259 B8R1.6 CCCN1CC(N)C1 Amb18833026 [0,0,0,1,0,0|2,0,1]=4 4260 B8R1.6 CCCN1CC(O)C1 Amb25747214 [0,0,0,1,0,0|1,0,2]=4 4261 B8R1.6 CCC[C@@H]1CC(=O)N1 Amb25842837 [0,0,0,1,0,0|1,0,0]=2 4262 B8R1.6 CCNC1CC(Cl)C1 Amb24483290 [0,0,0,1,0,0|2,0,1]=4 4263 B8R1.6 CCNC1CC(O)C1 Amb24391346 [0,0,0,1,0,0|1,0,2]=4 4264 B8R1.6 CCNC1CN(C)C1 Amb23439678 [0,0,0,1,0,0|3,0,0]=4 4265 B8R1.6 CCOC1CC(=C)C1 Amb24654384 [0,0,0,1,0,0|2,0,0]=3 4266 B8R1.6 CCOC1CC(=O)C1 Amb22059813 [0,0,0,1,0,0|1,0,0]=2 4267 B8R1.6 CCOC1CC(=O)N1 Amb24393354 [0,0,0,1,0,0|2,0,0]=3 4268 B8R1.6 CCOC1CC(Br)C1 Amb23455006 [0,0,0,1,0,0|2,0,1]=4 4269 B8R1.6 CCOC1CC(Cl)C1 Amb24661818 [0,0,0,1,0,0|2,0,1]=4 4270 B8R1.6 CCOC1CC(N)C1 Amb25210766 [0,0,0,1,0,0|2,0,1]=4 4271 B8R1.6 CCOC1CC(O)C1 Amb25079645 [0,0,0,1,0,0|1,0,2]=4 4272 B8R1.6 CCOC=1CC(=O)C1 Amb24689572 [0,0,0,1,0,0|1,0,2]=4 4273 B8R1.6 CCO[C@@H]1C[C@@H](O)C1 Amb24482985 [0,0,0,1,0,0|1,0,2]=4 4274 B8R1.6 CCO[C@H]1C[C@@H](Br)C1 Amb25348447 [0,0,0,1,0,0|2,0,1]=4 4275 B8R1.6 CCO[C@H]1C[C@@H](N)C1 Amb25367725 [0,0,0,1,0,0|2,0,1]=4 4276 B8R1.6 CCSC1CC(=O)N1 Amb24604270 [0,0,0,1,0,0|2,0,0]=3 4277 B8R1.6 CN1CC(CCO)C1 Amb21962977 [0,0,0,1,0,0|3,0,0]=4 4278 B8R1.6 CNCC1CC(Br)C1 Amb24534045 [0,0,0,1,0,0|2,0,1]=4 4279 B8R1.6 CNCC1CC(O)C1 Amb25732572 [0,0,0,1,0,0|1,0,2]=4 4280 B8R1.6 CNCC1CN(C)C1 Amb24079724 [0,0,0,1,0,0|3,0,0]=4 4281 B8R1.6 CNC[C@@H]1C[C@H](O)C1 Amb22831752 [0,0,0,1,0,0|1,0,2]=4 4282 B8R1.6 COCC1CC(=O)C1 Amb25771052 [0,0,0,1,0,0|1,0,0]=2 4283 B8R1.6 COCC1CC(C1)N Amb10603646 [0,0,0,1,0,0|2,0,1]=4 4284 B8R1.6 COCC1CC(N)C1 Amb25698388 [0,0,0,1,0,0|2,0,1]=4 4285 B8R1.6 C\C=C\C1CC(=O)N1 Amb24573008 [0,0,0,1,0,0|1,0,2]=4 4286 B8R1.6 N#CCN1CC(=O)C1 Amb25793590 [0,0,0,1,0,0|2,0,1]=4 4287 B8R1.6 NCCC1CC(=O)N1 Amb25127066 [0,0,0,1,0,0|2,0,0]=3 4288 B8R1.6 NCCC1CC(O)C1 Amb24715768 [0,0,0,1,0,0|1,0,2]=4 4289 B8R1.6 NCCN1CC(=O)C1 Amb25268925 [0,0,0,1,0,0|2,0,0]=3 4290 B8R1.6 NCC[C@H]1C[C@@H](O)C1 Amb25062403 [0,0,0,1,0,0|1,0,2]=4 4291 B8R1.6 O=CCC1CC(=O)N1 Amb24376079 [0,0,0,1,0,0|2,0,1]=4 4292 B8R1.6 OCCC1CC(F)C1 Amb24663610 [0,0,0,1,0,0|2,0,1]=4 4293 B8R1.7 C=C(F)C1CCCN1 Amb24526874 [0,0,0,1,0,0|2,0,1]=4 4294 B8R1.7 C=C(F)[C@@H]1CCCN1 Amb25232471 [0,0,0,1,0,0|2,0,1]=4 4295 B8R1.7 CC(=C)C1CCCN1 Amb23536664 [0,0,0,1,0,0|2,0,0]=3 4296 B8R1.7 CC(=C)C1COCC1 Amb25305384 [0,0,0,1,0,0|2,0,0]=3 4297 B8R1.7 CC(=C)C1OCCO1 Amb17334060 [0,0,0,1,0,0|3,0,0]=4 4298 B8R1.7 CC(=C)N1CCCC1 Amb25245391 [0,0,0,1,0,0|2,0,0]=3 4299 B8R1.7 CC(=O)C1=CCCO1 Amb25759909 [0,0,0,1,0,0|1,0,2]=4 4300 B8R1.7 CC(=O)C1=NCCO1 Amb24481446 [0,0,0,1,0,0|2,0,1]=4 4301 B8R1.7 CC(=O)C1CCC=C1 Amb25373909 [0,0,0,1,0,0|0,0,2]=3 4302 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [0,0,0,1,0,0|1,0,1]=3 4303 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,0,0,1,0,0|1,0,0]=2 4304 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [0,0,0,1,0,0|1,0,0]=2 4305 B8R1.7 CC(=O)C1CCN=N1 Amb24086404 [0,0,0,1,0,0|2,0,0]=3 4306 B8R1.7 CC(=O)C1CCSS1 Amb24584425 [0,0,0,1,0,0|2,0,0]=3 4307 B8R1.7 CC(=O)C1CNCC1 Amb18833067 [0,0,0,1,0,0|1,0,0]=2 4308 B8R1.7 CC(=O)C1CNCC1 Amb22899078 [0,0,0,1,0,0|1,0,0]=2 4309 B8R1.7 CC(=O)C1COCC1 Amb18833038 [0,0,0,1,0,0|1,0,0]=2 4310 B8R1.7 CC(=O)C1N=CCS1 Amb25066996 [0,0,0,1,0,0|2,0,1]=4 4311 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [0,0,0,1,0,0|2,0,0]=3 4312 B8R1.7 CC(=O)C1NCCS1 Amb25127993 [0,0,0,1,0,0|2,0,0]=3 4313 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [0,0,0,1,0,0|2,0,0]=3 4314 B8R1.7 CC(=O)C1SCCS1 Amb25173435 [0,0,0,1,0,0|2,0,0]=3 4315 B8R1.7 CC(=O)C=1CCCC1 Amb22338190 [0,0,0,1,0,0|0,0,2]=3 4316 B8R1.7 CC(=O)C=1CCCN1 Amb21962890 [0,0,0,1,0,0|1,0,1]=3 4317 B8R1.7 CC(=O)C=1CSCC1 Amb25830074 [0,0,0,1,0,0|1,0,2]=4 4318 B8R1.7 CC(=O)N1CC=CC1 Amb24502401 [0,0,0,1,0,0|1,0,2]=4 4319 B8R1.7 CC(=O)N1CCCN1 Amb25213247 [0,0,0,1,0,0|2,0,0]=3 4320 B8R1.7 CC(=O)N1CCCO1 Amb24354493 [0,0,0,1,0,0|2,0,0]=3 4321 B8R1.7 CC(=O)N1CSCC1 Amb24354533 [0,0,0,1,0,0|2,0,0]=3 4322 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [0,0,0,1,0,0|1,0,0]=2 4323 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [0,0,0,1,0,0|1,0,0]=2 4324 B8R1.7 CC(Br)C1CCCC1 Amb18183992 [0,0,0,1,0,0|1,0,1]=3 4325 B8R1.7 CC(C)C1CCCN1 Amb17659149 [0,0,0,1,0,0|2,0,1]=4 4326 B8R1.7 CC(C)C1CNCC1 Amb18946972 [0,0,0,1,0,0|2,0,1]=4 4327 B8R1.7 CC(C)C1CNCC1 Amb20630556 [0,0,0,1,0,0|2,0,1]=4 4328 B8R1.7 CC(C)[C@@H]1CCCN1 Amb24183507 [0,0,0,1,0,0|2,0,1]=4 4329 B8R1.7 CC(C1CCCC1)N Amb15701536 [0,0,0,1,0,0|1,0,1]=3 4330 B8R1.7 CC(C1CCCN1)C Amb2234804 [0,0,0,1,0,0|2,0,1]=4 4331 B8R1.7 CC(C1CCCN1)C Amb2237165 [0,0,0,1,0,0|2,0,1]=4 4332 B8R1.7 CC(C1CCCN1)N Amb10609840 [0,0,0,1,0,0|2,0,1]=4 4333 B8R1.7 CC(C1CCCN1)N Amb10610386 [0,0,0,1,0,0|2,0,1]=4 4334 B8R1.7 CC(C1CCCN1)O Amb17231822 [0,0,0,1,0,0|1,0,2]=4 4335 B8R1.7 CC(F)C1CCCN1 Amb23454743 [0,0,0,1,0,0|2,0,1]=4 4336 B8R1.7 CC(N)C1CCCC1 Amb22587363 [0,0,0,1,0,0|1,0,1]=3 4337 B8R1.7 CC(N)C1CCCO1 Amb21955382 [0,0,0,1,0,0|2,0,1]=4 4338 B8R1.7 CC(N)C1CCCS1 Amb25173848 [0,0,0,1,0,0|2,0,1]=4 4339 B8R1.7 CC(N)C1CCNC1 Amb23448554 [0,0,0,1,0,0|2,0,1]=4 4340 B8R1.7 CC(N)C1CCOC1 Amb18203285 [0,0,0,1,0,0|2,0,1]=4 4341 B8R1.7 CC(N)C1CCSC1 Amb18831918 [0,0,0,1,0,0|2,0,1]=4 4342 B8R1.7 CC(N)N1CCCC1 Amb25367250 [0,0,0,1,0,0|2,0,1]=4 4343 B8R1.7 CC(N1CCCC1)C Amb16186699 [0,0,0,1,0,0|2,0,1]=4 4344 B8R1.7 CC(O)C1CCCS1 Amb25694920 [0,0,0,1,0,0|1,0,2]=4 4345 B8R1.7 CC(O)C1CCNC1 Amb22886901 [0,0,0,1,0,0|1,0,2]=4 4346 B8R1.7 CC(O)C1CCOC1 Amb20623722 [0,0,0,1,0,0|1,0,2]=4 4347 B8R1.7 CC(O)C1CCSC1 Amb24411877 [0,0,0,1,0,0|1,0,2]=4 4348 B8R1.7 CC(O)[C@@H]1CCCN1 Amb24685154 [0,0,0,1,0,0|1,0,2]=4 4349 B8R1.7 CC(S)C1CCCC1 Amb25348009 [0,0,0,1,0,0|0,1,1]=3 4350 B8R1.7 CC(S)C1CCOC1 Amb25337944 [0,0,0,1,0,0|1,1,1]=4 4351 B8R1.7 CN(C)C1CCCN1 Amb25202091 [0,0,0,1,0,0|3,0,0]=4 4352 B8R1.7 CN(C)C1CNCC1 Amb20240914 [0,0,0,1,0,0|3,0,0]=4 4353 B8R1.7 CN(C)C1CNCC1 Amb22000872 [0,0,0,1,0,0|3,0,0]=4 4354 B8R1.7 CN(C)[C@@H]1CCNC1 Amb17935654 [0,0,0,1,0,0|3,0,0]=4 4355 B8R1.7 CN(C)[C@@H]1CNCC1 Amb22226436 [0,0,0,1,0,0|3,0,0]=4 4356 B8R1.7 CN(C)[C@@H]1CNCC1 Amb22388660 [0,0,0,1,0,0|3,0,0]=4 4357 B8R1.7 CN(C)[C@H]1CCCN1 Amb24629712 [0,0,0,1,0,0|3,0,0]=4 4358 B8R1.7 CS(=O)C1CNCC1 Amb25185409 [0,0,0,1,0,0|2,0,0]=3 4359 B8R1.7 CS(=O)N1CCCO1 Amb25177398 [0,0,0,1,0,0|3,0,0]=4 4360 B8R1.7 C[C@@H](N)C1CCCC1 Amb19515477 [0,0,0,1,0,0|1,0,1]=3 4361 B8R1.7 C[C@@H](N)C1CCCC1 Amb22748795 [0,0,0,1,0,0|1,0,1]=3 4362 B8R1.7 C[C@@H](N)C1CCCO1 Amb19514591 [0,0,0,1,0,0|2,0,1]=4 4363 B8R1.7 C[C@@H](N)C1CCCS1 Amb25115255 [0,0,0,1,0,0|2,0,1]=4 4364 B8R1.7 C[C@@H](O)C1CCCC1 Amb19515558 [0,0,0,1,0,0|0,0,2]=3 4365 B8R1.7 C[C@@H](O)C1CCOC1 Amb25724373 [0,0,0,1,0,0|1,0,2]=4 4366 B8R1.7 C[C@@H](O)[C@@H]1CCNC1 Amb25174882 [0,0,0,1,0,0|1,0,2]=4 4367 B8R1.7 C[C@@H](O)[C@H]1CCCO1 Amb24592408 [0,0,0,1,0,0|1,0,2]=4 4368 B8R1.7 C[C@H](N)C1CCCS1 Amb24719948 [0,0,0,1,0,0|2,0,1]=4 4369 B8R1.7 C[C@H](N)[C@H]1CCNC1 Amb25239816 [0,0,0,1,0,0|2,0,1]=4 4370 B8R1.7 C[C@H](O)C1CCCC1 Amb25842291 [0,0,0,1,0,0|0,0,2]=3 4371 B8R1.7 C[C@H](O)C1CCOC1 Amb24365203 [0,0,0,1,0,0|1,0,2]=4 4372 B8R1.7 ClC(=O)C1CSCN1 Amb17142875 [0,0,0,1,0,0|3,0,0]=4 4373 B8R1.7 ClC(Cl)C1CCCC1 Amb25798892 [0,0,0,1,0,0|2,0,1]=4 4374 B8R1.7 Cl[SiH](Cl)C1CCCC1 Amb25107704 [0,0,0,1,0,0|2,1,0]=4 4375 B8R1.7 NC(=N)C1CCCN1 Amb24549144 [0,0,0,1,0,0|3,0,0]=4 4376 B8R1.7 NC(=N)C1CCCO1 Amb22059430 [0,0,0,1,0,0|3,0,0]=4 4377 B8R1.7 NC(=N)C1CCCS1 Amb24470321 [0,0,0,1,0,0|3,0,0]=4 4378 B8R1.7 NC(=N)C1CNCC1 Amb17934233 [0,0,0,1,0,0|3,0,0]=4 4379 B8R1.7 NC(=N)C1CNCC1 Amb24502578 [0,0,0,1,0,0|3,0,0]=4 4380 B8R1.7 NC(=N)N1CCCC1 Amb10070761 [0,0,0,1,0,0|3,0,0]=4 4381 B8R1.7 NC(=N)N1CCCC1 Amb2079636 [0,0,0,1,0,0|3,0,0]=4 4382 B8R1.7 NC(=N)N1CCCC1 Amb22736590 [0,0,0,1,0,0|3,0,0]=4 4383 B8R1.7 NC(=O)C1CC=CC1 Amb10068010 [0,0,0,1,0,0|1,0,2]=4 4384 B8R1.7 NC(=O)C1CCC=C1 Amb25063981 [0,0,0,1,0,0|1,0,2]=4 4385 B8R1.7 NC(=O)C1CCCN1 Amb1152272 [0,0,0,1,0,0|2,0,0]=3 4386 B8R1.7 NC(=O)C1CCCS1 Amb24461593 [0,0,0,1,0,0|2,0,0]=3 4387 B8R1.7 NC(=O)C1CCSS1 Amb24060539 [0,0,0,1,0,0|3,0,0]=4 4388 B8R1.7 NC(=O)C1CNCC1 Amb19373271 [0,0,0,1,0,0|2,0,0]=3 4389 B8R1.7 NC(=O)C1CNCO1 Amb25276465 [0,0,0,1,0,0|3,0,0]=4 4390 B8R1.7 NC(=O)C1CNCS1 Amb24481531 [0,0,0,1,0,0|3,0,0]=4 4391 B8R1.7 NC(=O)C1COCN1 Amb24740220 [0,0,0,1,0,0|3,0,0]=4 4392 B8R1.7 NC(=O)C1SCCS1 Amb25097480 [0,0,0,1,0,0|3,0,0]=4 4393 B8R1.7 NC(=O)C=1CCCC1 Amb20622488 [0,0,0,1,0,0|1,0,2]=4 4394 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [0,0,0,1,0,0|2,0,0]=3 4395 B8R1.7 NC(=O)N1CCCN1 Amb24563074 [0,0,0,1,0,0|3,0,0]=4 4396 B8R1.7 NC(=O)N1CCCO1 Amb24465577 [0,0,0,1,0,0|3,0,0]=4 4397 B8R1.7 NC(=O)N1COCC1 Amb24603319 [0,0,0,1,0,0|3,0,0]=4 4398 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,0,0,1,0,0|2,0,0]=3 4399 B8R1.7 NC(=O)[C@@H]1CCON1 Amb24542870 [0,0,0,1,0,0|3,0,0]=4 4400 B8R1.7 NC(=O)[C@@H]1CNCC1 Amb20671395 [0,0,0,1,0,0|2,0,0]=3 4401 B8R1.7 NC(=O)[C@@H]1CNCC1 Amb22405893 [0,0,0,1,0,0|2,0,0]=3 4402 B8R1.7 NC(=O)[C@@H]1CSCN1 Amb25111427 [0,0,0,1,0,0|3,0,0]=4 4403 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,0,0,1,0,0|2,0,0]=3 4404 B8R1.7 NC(=O)[C@H]1CNCC1 Amb20671394 [0,0,0,1,0,0|2,0,0]=3 4405 B8R1.7 NC(=O)[C@H]1CNCC1 Amb22405894 [0,0,0,1,0,0|2,0,0]=3 4406 B8R1.7 NC(=S)C1CCCN1 Amb19148043 [0,0,0,1,0,0|2,1,0]=4 4407 B8R1.7 NC(=S)C1CCCO1 Amb18108094 [0,0,0,1,0,0|2,1,0]=4 4408 B8R1.7 NC(=S)C1COCC1 Amb1114015 [0,0,0,1,0,0|2,1,0]=4 4409 B8R1.7 NC(=S)[C@@H]1CCCN1 Amb24588473 [0,0,0,1,0,0|2,1,0]=4 4410 B8R1.7 NC(=S)[C@H]1CCCN1 Amb24469314 [0,0,0,1,0,0|2,1,0]=4 4411 B8R1.7 NC(=[NH2+])N1CCCC1 Amb22269903 [0,0,0,1,0,0|3,0,0]=4 4412 B8R1.7 NC(O)C1CCCC1 Amb24351467 [0,0,0,1,0,0|1,0,2]=4 4413 B8R1.7 O=C(Cl)C1CC=CC1 Amb24371090 [0,0,0,1,0,0|1,0,2]=4 4414 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [0,0,0,1,0,0|2,0,0]=3 4415 B8R1.7 O=C(Cl)[C@H]1CCCN1 Amb24655823 [0,0,0,1,0,0|2,0,0]=3 4416 B8R1.7 O=C(S)N1CCCC1 Amb25827611 [0,0,0,1,0,0|2,0,0]=3 4417 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [0,0,0,1,0,0|2,0,0]=3 4418 B8R1.7 OB(C1CCCC1)O Amb2447144 [0,0,0,1,0,0|2,0,1]=4 4419 B8R1.7 OC(=O)C1CCC=C1 Amb18641680 [0,0,0,1,0,0|1,0,2]=4 4420 B8R1.7 OC(=O)C1CCCN1 Amb22040086 [0,0,0,1,0,0|2,0,0]=3 4421 B8R1.7 OC(=O)C1CCCN1 Amb2542766 [0,0,0,1,0,0|2,0,0]=3 4422 B8R1.7 OC(=O)C1CCCS1 Amb18124363 [0,0,0,1,0,0|2,0,0]=3 4423 B8R1.7 OC(=O)C1CCNN1 Amb18641878 [0,0,0,1,0,0|3,0,0]=4 4424 B8R1.7 OC(=O)C1CCON1 Amb24351403 [0,0,0,1,0,0|3,0,0]=4 4425 B8R1.7 OC(=O)C1CNCC1 Amb16230724 [0,0,0,1,0,0|2,0,0]=3 4426 B8R1.7 OC(=O)C1CNCC1 Amb16233446 [0,0,0,1,0,0|2,0,0]=3 4427 B8R1.7 OC(=O)C1CNCO1 Amb24359881 [0,0,0,1,0,0|3,0,0]=4 4428 B8R1.7 OC(=O)C1CNOC1 Amb24560626 [0,0,0,1,0,0|3,0,0]=4 4429 B8R1.7 OC(=O)C1CSCC1 Amb18124360 [0,0,0,1,0,0|2,0,0]=3 4430 B8R1.7 OC(=O)C1CSCN1 Amb2549799 [0,0,0,1,0,0|3,0,0]=4 4431 B8R1.7 OC(=O)C1CSSC1 Amb17593735 [0,0,0,1,0,0|3,0,0]=4 4432 B8R1.7 OC(=O)C1C[13CH2]CN1 Amb22367338 [0,0,0,1,0,0|2,0,0]=3 4433 B8R1.7 OC(=O)C1NCCO1 Amb24760849 [0,0,0,1,0,0|3,0,0]=4 4434 B8R1.7 OC(=O)C1NCCS1 Amb2444644 [0,0,0,1,0,0|3,0,0]=4 4435 B8R1.7 OC(=O)C1OCCO1 Amb24349582 [0,0,0,1,0,0|3,0,0]=4 4436 B8R1.7 OC(=O)C1SCCS1 Amb20669087 [0,0,0,1,0,0|3,0,0]=4 4437 B8R1.7 OC(=O)C=1CCCN1 Amb18641721 [0,0,0,1,0,0|2,0,1]=4 4438 B8R1.7 OC(=O)[C@@H]1CCC=N1 Amb25075457 [0,0,0,1,0,0|2,0,1]=4 4439 B8R1.7 OC(=O)[C@@H]1COCC1 Amb22226787 [0,0,0,1,0,0|2,0,0]=3 4440 B8R1.7 OC(=O)[C@@H]1COCN1 Amb19515958 [0,0,0,1,0,0|3,0,0]=4 4441 B8R1.7 OC(=O)[C@@H]1NCCS1 Amb24383041 [0,0,0,1,0,0|3,0,0]=4 4442 B8R1.7 OC(=O)[C@H]1CCC=C1 Amb25304679 [0,0,0,1,0,0|1,0,2]=4 4443 B8R1.7 OC(=O)[C@H]1CCCS1 Amb24481353 [0,0,0,1,0,0|2,0,0]=3 4444 B8R1.7 OC(=O)[C@H]1CCSS1 Amb24738509 [0,0,0,1,0,0|3,0,0]=4 4445 B8R1.7 OC(=O)[C@H]1COCC1 Amb10603235 [0,0,0,1,0,0|2,0,0]=3 4446 B8R1.7 OC(=O)[C@H]1COCN1 Amb25733088 [0,0,0,1,0,0|3,0,0]=4 4447 B8R1.7 OS(=O)C1COCC1 Amb25713371 [0,0,0,1,0,0|3,0,0]=4 4448 B8R1.7 O[13C](=O)C1CCCN1 Amb22367492 [0,0,0,1,0,0|2,0,0]=3 4449 B8R1.7 O[13C](=O)[13C@@H]1[13CH2][13CH2][13CH2][15NH]1 Amb19133705 [0,0,0,1,0,0|2,0,0]=3 4450 B8R1.7 O[13C](=O)[C@@H]1CCCN1 Amb22336891 [0,0,0,1,0,0|2,0,0]=3 4451 B8R1.7 SC(=S)C1CNCC1 Amb24435436 [0,0,0,1,0,0|2,1,0]=4 4452 B8R1.7 [13CH3][13C](=O)C1=NCCC1 Amb17607638 [0,0,0,1,0,0|1,0,1]=3 4453 B8R1.7 [O-]C(=O)C1CSCN1 Amb10072986 [0,0,0,1,0,0|3,0,0]=4 4454 B8R1.7 [S-]C(=S)N1CCCC1 Amb15741178 [0,0,0,1,0,0|2,1,0]=4 4455 B8R1.7 [S-]C(=S)N1CCCC1 Amb22757636 [0,0,0,1,0,0|2,1,0]=4 4456 B8R1.9 C=C1CC1CCCBr Amb24552849 [0,0,0,1,0,0|2,0,0]=3 4457 B8R1.9 C=C1CC1CCCCl Amb24460116 [0,0,0,1,0,0|2,0,0]=3 4458 B8R1.9 CC1CC1NCCC Amb18990709 [0,0,0,1,0,0|2,0,1]=4 4459 B8R1.9 CC1OC1CCCCl Amb24524265 [0,0,0,1,0,0|1,0,2]=4 4460 B8R1.9 CCCCC1=CC1=O Amb24332715 [0,0,0,1,0,0|0,0,2]=3 4461 B8R1.9 CCCCC1CC1Br Amb25296467 [0,0,0,1,0,0|1,0,1]=3 4462 B8R1.9 CCCCC1CC1Cl Amb25778308 [0,0,0,1,0,0|1,0,1]=3 4463 B8R1.9 CCCCC1OC1Cl Amb25266992 [0,0,0,1,0,0|1,0,2]=4 4464 B8R1.9 CCCC[C@@H]1C[C@H]1F Amb24549096 [0,0,0,1,0,0|1,0,1]=3 4465 B8R1.9 CCCC[C@@H]1C[C@H]1O Amb24598213 [0,0,0,1,0,0|0,0,2]=3 4466 B8R1.9 CCCC[C@@H]1O[C@@H]1Cl Amb25339622 [0,0,0,1,0,0|1,0,2]=4 4467 B8R1.9 C[C@@H]1O[C@@H]1CCCBr Amb25173062 [0,0,0,1,0,0|1,0,2]=4 4468 B8R1.9 C[C@@H]1O[C@@H]1CCCCl Amb24515089 [0,0,0,1,0,0|1,0,2]=4 4469 B8R1.9 C[C@@H]1O[C@@H]1CCCO Amb25176894 [0,0,0,1,0,0|1,0,2]=4 4470 B8R1.9 C[C@H]1O[C@H]1CCCO Amb25332332 [0,0,0,1,0,0|1,0,2]=4 4471 B8R1.9 OCCCC1=CC1=O Amb25142657 [0,0,0,1,0,0|1,0,2]=4 4472 B8R1.9 O[C@H]1CC1CCCCl Amb25283482 [0,0,0,1,0,0|1,0,2]=4 4473 B8R1.19 CC1(Br)CCCC1O Amb25226362 [0,0,0,1,0,0|2,0,1]=4 4474 B8R1.19 CC1(C)CCCC1Br Amb24710278 [0,0,0,1,0,0|2,0,1]=4 4475 B8R1.19 CC1(C)CCCC1Cl Amb24443109 [0,0,0,1,0,0|2,0,1]=4 4476 B8R1.19 CC1(C)CCCC1N Amb20622593 [0,0,0,1,0,0|2,0,1]=4 4477 B8R1.19 CC1(C)CCCC1S Amb24409187 [0,0,0,1,0,0|2,0,1]=4 4478 B8R1.19 CC1(C)CCC[C@@H]1O Amb25802028 [0,0,0,1,0,0|2,0,1]=4 4479 B8R1.19 CC1(C)CCC[C@H]1N Amb24698776 [0,0,0,1,0,0|2,0,1]=4 4480 B8R1.19 CC1(C)CCC[C@H]1O Amb24689522 [0,0,0,1,0,0|2,0,1]=4 4481 B8R1.19 CC1(Cl)CCCC1Cl Amb24400392 [0,0,0,1,0,0|2,0,1]=4 4482 B8R1.19 CC1(F)CCCC1N Amb23455500 [0,0,0,1,0,0|2,0,1]=4 4483 B8R1.19 CC1(N)CCCC1N Amb18641817 [0,0,0,1,0,0|2,0,1]=4 4484 B8R1.19 CC1(N)CCCC1O Amb25169116 [0,0,0,1,0,0|2,0,1]=4 4485 B8R1.19 CC1(O)CCCC1Br Amb24652228 [0,0,0,1,0,0|1,0,2]=4 4486 B8R1.19 CC1(O)CCCC1Cl Amb24481532 [0,0,0,1,0,0|1,0,2]=4 4487 B8R1.19 CC1(O)CCCC1I Amb24664976 [0,0,0,1,0,0|1,0,2]=4 4488 B8R1.19 CC1(O)CCCC1N Amb22295747 [0,0,0,1,0,0|1,0,2]=4 4489 B8R1.19 CC1(O)CCCC1O Amb24407803 [0,0,0,1,0,0|1,0,2]=4 4490 B8R1.19 CC1CCCC1(C)C Amb25368248 [0,0,0,1,0,0|1,0,1]=3 4491 B8R1.19 CC1CCCC1(F)F Amb20669929 [0,0,0,1,0,0|2,0,1]=4 4492 B8R1.19 CC1CCNC1(C)C Amb18277514 [0,0,0,1,0,0|2,0,1]=4 4493 B8R1.19 CC1CCOS1(=O)=O Amb15692754 [0,0,0,1,0,0|3,0,0]=4 4494 B8R1.19 CC1CNCC1(C)N Amb24482561 [0,0,0,1,0,0|2,0,1]=4 4495 B8R1.19 CC1COCC1(C)O Amb25837241 [0,0,0,1,0,0|1,0,2]=4 4496 B8R1.19 CC1NCCC1(C)C Amb18943920 [0,0,0,1,0,0|2,0,1]=4 4497 B8R1.19 CC1NCCC1(C)Cl Amb24400714 [0,0,0,1,0,0|2,0,1]=4 4498 B8R1.19 CC1NCCC1(C)O Amb24518636 [0,0,0,1,0,0|1,0,2]=4 4499 B8R1.19 CC1OCCC1(C)N Amb24742098 [0,0,0,1,0,0|2,0,1]=4 4500 B8R1.19 CC1OCCC1(C)O Amb24726892 [0,0,0,1,0,0|1,0,2]=4 4501 B8R1.19 CN1CCCS1(=O)=O Amb19959571 [0,0,0,1,0,0|3,0,0]=4 4502 B8R1.19 C[C@@H]1COC[C@]1(C)O Amb22886885 [0,0,0,1,0,0|1,0,2]=4 4503 B8R1.19 C[C@@]1(O)CCC[C@@H]1Cl Amb25300344 [0,0,0,1,0,0|1,0,2]=4 4504 B8R1.19 C[C@@]1(O)CCC[C@H]1Br Amb24540069 [0,0,0,1,0,0|1,0,2]=4 4505 B8R1.19 C[C@H]1COC[C@@]1(C)O Amb24588378 [0,0,0,1,0,0|1,0,2]=4 4506 B8R1.19 C[C@H]1NCC[C@@]1(C)Cl Amb25291896 [0,0,0,1,0,0|2,0,1]=4 4507 B8R1.19 C[C@]1(N)CCCC1O Amb25844764 [0,0,0,1,0,0|2,0,1]=4 4508 B8R1.19 C[Si]1(C)CCCC1Cl Amb25809918 [0,0,0,1,0,0|2,1,0]=4 4509 B8R1.19 C[Si]1(C)CCCC1O Amb24457786 [0,0,0,1,0,0|2,1,0]=4 4510 B8R1.19 O=S1(=O)CCCC1Cl Amb25856670 [0,0,0,1,0,0|3,0,0]=4 4511 B8R1.19 OC1CCCS1(=O)=O Amb25201898 [0,0,0,1,0,0|3,0,0]=4 4512 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,0,0,1,0,0|1,0,2]=4 4513 B8R1.20 C=C1C[C@@H]1CC(O)=O Amb25331268 [0,0,0,1,0,0|1,0,2]=4 4514 B8R1.20 C=C1C[C@H]1CC(O)=O Amb24686141 [0,0,0,1,0,0|1,0,2]=4 4515 B8R1.20 CC(C)CC1CC1N Amb18285795 [0,0,0,1,0,0|2,0,1]=4 4516 B8R1.20 CC(C)NC1CC1C Amb18961499 [0,0,0,1,0,0|2,0,1]=4 4517 B8R1.20 CC(C)N[C@@H]1C[C@H]1C Amb24526308 [0,0,0,1,0,0|2,0,1]=4 4518 B8R1.20 CC1CC1=CC(O)=O Amb25256441 [0,0,0,1,0,0|1,0,2]=4 4519 B8R1.20 CC1CC1CB(O)O Amb24641424 [0,0,0,1,0,0|2,0,1]=4 4520 B8R1.20 CC1CC1CC(N)=O Amb25772500 [0,0,0,1,0,0|1,0,0]=2 4521 B8R1.20 CC1CC1CC(O)=O Amb25316515 [0,0,0,1,0,0|1,0,0]=2 4522 B8R1.20 CC1CC1NC(N)=O Amb25074259 [0,0,0,1,0,0|2,0,0]=3 4523 B8R1.20 CC1CC1NC(N)=S Amb25361754 [0,0,0,1,0,0|2,1,0]=4 4524 B8R1.20 CC1OC1CC(O)=O Amb24710388 [0,0,0,1,0,0|2,0,0]=3 4525 B8R1.20 CC1OC1C[N+]([O-])=O Amb25205724 [0,0,0,1,0,0|3,0,0]=4 4526 B8R1.20 CS(=O)NC1CC1N Amb24583477 [0,0,0,1,0,0|3,0,0]=4 4527 B8R1.20 C[C@@H]1C[C@H]1CC(C)=O Amb24373459 [0,0,0,1,0,0|0,0,0]=1 4528 B8R1.20 C[C@@H]1C[C@H]1NC(C)=O Amb24619123 [0,0,0,1,0,0|1,0,0]=2 4529 B8R1.20 C[C@@H]1O[C@H]1CC(N)=O Amb24629162 [0,0,0,1,0,0|2,0,0]=3 4530 B8R1.20 C[C@H]1C[C@H]1CC(C)=O Amb25257655 [0,0,0,1,0,0|0,0,0]=1 4531 B8R1.20 C[C@H]1C[C@H]1CC(O)=O Amb25174744 [0,0,0,1,0,0|1,0,0]=2 4532 B8R1.20 C[C@H]1C[C@H]1NC(N)=O Amb24532410 [0,0,0,1,0,0|2,0,0]=3 4533 B8R1.20 C[C@H]1O[C@@H]1CC(C)O Amb25176687 [0,0,0,1,0,0|1,0,2]=4 4534 B8R1.20 C[C@H]1O[C@H]1CC(O)=O Amb25747306 [0,0,0,1,0,0|2,0,0]=3 4535 B8R1.20 N[C@H]1C[C@H]1CC(O)=O Amb24585123 [0,0,0,1,0,0|2,0,0]=3 4536 B8R1.22 BrC1=CCCCCC1 Amb10071167 [0,0,0,1,0,0|1,0,1]=3 4537 B8R1.22 BrC1CCCNCC1 Amb24466862 [0,0,0,1,0,0|2,0,1]=4 4538 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,1,0,0|2,0,1]=4 4539 B8R1.22 C=C1CCCCCC1 Amb25325282 [0,0,0,1,0,0|1,0,0]=2 4540 B8R1.22 C=C1CNCCCC1 Amb24624045 [0,0,0,1,0,0|2,0,0]=3 4541 B8R1.22 C=C1CSCCSC1 Amb24694547 [0,0,0,1,0,0|3,0,0]=4 4542 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,0,0,1,0,0|1,0,2]=4 4543 B8R1.22 CC1=CCCCCN1 Amb24443923 [0,0,0,1,0,0|1,0,1]=3 4544 B8R1.22 CC1CCCCCC1 Amb22230865 [0,0,0,1,0,0|1,0,1]=3 4545 B8R1.22 CC1CCCCCN1 Amb18943961 [0,0,0,1,0,0|1,0,1]=3 4546 B8R1.22 CC1CCCCCN1 Amb22055352 [0,0,0,1,0,0|1,0,1]=3 4547 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,1,0,0|0,0,2]=3 4548 B8R1.22 CC1CCCNCC1 Amb22546367 [0,0,0,1,0,0|2,0,1]=4 4549 B8R1.22 CC1CCNCCN1 Amb24053173 [0,0,0,1,0,0|2,0,1]=4 4550 B8R1.22 CC1CCNCCS1 Amb22642273 [0,0,0,1,0,0|1,1,1]=4 4551 B8R1.22 CC1CCOCCN1 Amb25108477 [0,0,0,1,0,0|2,0,1]=4 4552 B8R1.22 CC1CCSCCN1 Amb24681013 [0,0,0,1,0,0|2,0,1]=4 4553 B8R1.22 CC1CNCCCC1 Amb22886304 [0,0,0,1,0,0|2,0,1]=4 4554 B8R1.22 CC1CNCCCN1 Amb17578102 [0,0,0,1,0,0|2,0,1]=4 4555 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,1,0,0|1,0,2]=4 4556 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,1,0,0|2,0,1]=4 4557 B8R1.22 CC1OCCCCO1 Amb22731719 [0,0,0,1,0,0|1,0,2]=4 4558 B8R1.22 CC=1CCCCCC1 Amb22227978 [0,0,0,1,0,0|1,0,0]=2 4559 B8R1.22 CC=1CCNCCN1 Amb25784814 [0,0,0,1,0,0|2,0,0]=3 4560 B8R1.22 CC=1NCCCCN1 Amb22345658 [0,0,0,1,0,0|2,0,0]=3 4561 B8R1.22 CN1CCCCCC1 Amb22729377 [0,0,0,1,0,0|2,0,0]=3 4562 B8R1.22 CN1CCCNCC1 Amb22167533 [0,0,0,1,0,0|3,0,0]=4 4563 B8R1.22 CN1CCCNCN1 Amb25293927 [0,0,0,1,0,0|3,0,0]=4 4564 B8R1.22 ClC1CCCCCS1 Amb24652277 [0,0,0,1,0,0|1,1,1]=4 4565 B8R1.22 ClN1CCCCCC1 Amb22497474 [0,0,0,1,0,0|2,0,0]=3 4566 B8R1.22 FC1CCCCNC1 Amb13953139 [0,0,0,1,0,0|2,0,1]=4 4567 B8R1.22 FC1CCCNCC1 Amb22886243 [0,0,0,1,0,0|2,0,1]=4 4568 B8R1.22 FC1CNCCCC1 Amb22886275 [0,0,0,1,0,0|2,0,1]=4 4569 B8R1.22 N=C1CCCCCN1 Amb22488763 [0,0,0,1,0,0|2,0,0]=3 4570 B8R1.22 N=C1CCNCCN1 Amb24481332 [0,0,0,1,0,0|3,0,0]=4 4571 B8R1.22 N=C1COCCCN1 Amb25223773 [0,0,0,1,0,0|3,0,0]=4 4572 B8R1.22 NC1CCCOCC1 Amb18832507 [0,0,0,1,0,0|2,0,1]=4 4573 B8R1.22 NC1CCCSCC1 Amb18199477 [0,0,0,1,0,0|2,0,1]=4 4574 B8R1.22 NC1CNCCCC1 Amb22388535 [0,0,0,1,0,0|2,0,1]=4 4575 B8R1.22 NC=1CCCCCC1 Amb24739386 [0,0,0,1,0,0|1,0,1]=3 4576 B8R1.22 NC=1CCCCCN1 Amb19514661 [0,0,0,1,0,0|2,0,0]=3 4577 B8R1.22 NC=1CSCCCN1 Amb25688170 [0,0,0,1,0,0|3,0,0]=4 4578 B8R1.22 NN1CCCNCC1 Amb24381805 [0,0,0,1,0,0|3,0,0]=4 4579 B8R1.22 NN1CCCOCC1 Amb25681314 [0,0,0,1,0,0|3,0,0]=4 4580 B8R1.22 N[C@@H]1CCCCNC1 Amb16185497 [0,0,0,1,0,0|2,0,1]=4 4581 B8R1.22 N[C@@H]1CCCOCC1 Amb24476582 [0,0,0,1,0,0|2,0,1]=4 4582 B8R1.22 N[C@@H]1CNCCCC1 Amb22744950 [0,0,0,1,0,0|2,0,1]=4 4583 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,0,0,1,0,0|1,0,2]=4 4584 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,0,0,1,0,0|0,0,2]=3 4585 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,0,0,1,0,0|0,0,2]=3 4586 B8R1.22 O=C1CCCCC=C1 Amb10601704 [0,0,0,1,0,0|0,0,2]=3 4587 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,0,0,1,0,0|1,0,0]=2 4588 B8R1.22 O=C1CCCCC[N-]1 Amb22053646 [0,0,0,1,0,0|1,0,0]=2 4589 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,0,0,1,0,0|1,0,0]=2 4590 B8R1.22 O=C1CCCCSC1 Amb10071767 [0,0,0,1,0,0|1,0,0]=2 4591 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,0,0,1,0,0|1,0,0]=2 4592 B8R1.22 O=C1CCOCCO1 Amb24060726 [0,0,0,1,0,0|2,0,0]=3 4593 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,0,0,1,0,0|2,0,0]=3 4594 B8R1.22 O=C1CNCCCC1 Amb22000936 [0,0,0,1,0,0|1,0,0]=2 4595 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,0,0,1,0,0|2,0,0]=3 4596 B8R1.22 O=C1CNCCNC1 Amb25259581 [0,0,0,1,0,0|2,0,0]=3 4597 B8R1.22 O=C1COCCC=C1 Amb25295282 [0,0,0,1,0,0|1,0,2]=4 4598 B8R1.22 O=C1COCCCC1 Amb25143067 [0,0,0,1,0,0|1,0,0]=2 4599 B8R1.22 O=C1COCCCN1 Amb22371065 [0,0,0,1,0,0|2,0,0]=3 4600 B8R1.22 O=C1COCCCO1 Amb24558825 [0,0,0,1,0,0|2,0,0]=3 4601 B8R1.22 O=C1COCCOC1 Amb22284314 [0,0,0,1,0,0|2,0,0]=3 4602 B8R1.22 O=C1CSCCCN1 Amb25378108 [0,0,0,1,0,0|2,0,0]=3 4603 B8R1.22 O=C1NCCNCC1 Amb10069937 [0,0,0,1,0,0|2,0,0]=3 4604 B8R1.22 O=C1NCCNCC1 Amb1107713 [0,0,0,1,0,0|2,0,0]=3 4605 B8R1.22 O=C1NCCOCC1 Amb13951193 [0,0,0,1,0,0|2,0,0]=3 4606 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,0,0,1,0,0|2,0,0]=3 4607 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,0,0,1,0,0|2,0,0]=3 4608 B8R1.22 OC1CCCCCS1 Amb17615898 [0,0,0,1,0,0|1,0,2]=4 4609 B8R1.22 OC1CCCNCC1 Amb19958701 [0,0,0,1,0,0|1,0,2]=4 4610 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,1,0,0|1,0,2]=4 4611 B8R1.22 OC1CCCSCC1 Amb18202861 [0,0,0,1,0,0|1,0,2]=4 4612 B8R1.22 OC1CNCCCC1 Amb22371121 [0,0,0,1,0,0|1,0,2]=4 4613 B8R1.22 OC1CNCCCC1 Amb22886250 [0,0,0,1,0,0|1,0,2]=4 4614 B8R1.22 O[C@H]1CNCCCC1 Amb24630787 [0,0,0,1,0,0|1,0,2]=4 4615 B8R1.22 S=C1CCCCCN1 Amb1935077 [0,0,0,1,0,0|1,1,0]=3 4616 B8R1.22 S=C1CCOCCN1 Amb25836331 [0,0,0,1,0,0|2,1,0]=4 4617 B8R1.22 S=C1COCCCN1 Amb25808992 [0,0,0,1,0,0|2,1,0]=4 4618 B8R1.22 S=C1CSCCCN1 Amb25367071 [0,0,0,1,0,0|2,1,0]=4 4619 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,1,0,0|1,1,1]=4 4620 B8R1.27 CC1(C)CC1CCO Amb25051441 [0,0,0,1,0,0|2,0,1]=4 4621 B8R1.27 CCCC1CC1(C)O Amb25132122 [0,0,0,1,0,0|0,0,2]=3 4622 B8R1.27 CCNC1CC1(C)C Amb18523744 [0,0,0,1,0,0|2,0,1]=4 4623 B8R1.27 CNCC1CC1(C)C Amb10608234 [0,0,0,1,0,0|2,0,1]=4 4624 B8R1.27 CNCC1CC1(C)C Amb22587192 [0,0,0,1,0,0|2,0,1]=4 4625 B8R1.31 CC(=C)[C@@H]1CC[C@H]1O Amb24625276 [0,0,0,1,0,0|2,0,0]=3 4626 B8R1.31 CC(=O)C1CCN1C Amb25196048 [0,0,0,1,0,0|1,0,0]=2 4627 B8R1.31 CC(=O)C1CNC1=O Amb24526367 [0,0,0,1,0,0|2,0,1]=4 4628 B8R1.31 CC(=O)C1COC1=O Amb24601316 [0,0,0,1,0,0|2,0,1]=4 4629 B8R1.31 CC1CCC1C(=O)Cl Amb25123268 [0,0,0,1,0,0|1,0,0]=2 4630 B8R1.31 CC1CCC1C(C)=O Amb25101506 [0,0,0,1,0,0|0,0,0]=1 4631 B8R1.31 CC1CCC1C(C)Br Amb25823473 [0,0,0,1,0,0|1,0,1]=3 4632 B8R1.31 CC1CCC1C(C)N Amb24476174 [0,0,0,1,0,0|1,0,1]=3 4633 B8R1.31 CC1CCC1C(C)O Amb25270791 [0,0,0,1,0,0|0,0,2]=3 4634 B8R1.31 CC1CCC1C(N)=O Amb24481452 [0,0,0,1,0,0|1,0,0]=2 4635 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,0,0,1,0,0|1,0,0]=2 4636 B8R1.31 CC1CCN1C(N)=O Amb24748909 [0,0,0,1,0,0|2,0,0]=3 4637 B8R1.31 CC1NCC1N(C)C Amb25695387 [0,0,0,1,0,0|3,0,0]=4 4638 B8R1.31 CN(C)C1CCC1N Amb25124860 [0,0,0,1,0,0|3,0,0]=4 4639 B8R1.31 CN(C)C1CCC1O Amb24483060 [0,0,0,1,0,0|3,0,0]=4 4640 B8R1.31 CN(C)[C@@H]1CC[C@@H]1N Amb25328525 [0,0,0,1,0,0|3,0,0]=4 4641 B8R1.31 CN(C)[C@H]1CC[C@@H]1N Amb25174970 [0,0,0,1,0,0|3,0,0]=4 4642 B8R1.31 CN(C)[C@H]1CC[C@@H]1O Amb24655741 [0,0,0,1,0,0|3,0,0]=4 4643 B8R1.31 CN1CCC1C(N)=O Amb22227962 [0,0,0,1,0,0|2,0,0]=3 4644 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,0,0,1,0,0|2,0,0]=3 4645 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,0,0,1,0,0|2,0,0]=3 4646 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,0,0,1,0,0|2,0,0]=3 4647 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,0,0,1,0,0|1,0,0]=2 4648 B8R1.31 C[C@@H]1CN[C@@H]1C(O)=O Amb24597629 [0,0,0,1,0,0|2,0,0]=3 4649 B8R1.31 C[C@@H]1NC[C@H]1N(C)C Amb24713110 [0,0,0,1,0,0|3,0,0]=4 4650 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,0,0,1,0,0|1,0,0]=2 4651 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,0,0,1,0,0|1,0,0]=2 4652 B8R1.31 C[C@H]1CN[C@@H]1C(O)=O Amb24629618 [0,0,0,1,0,0|2,0,0]=3 4653 B8R1.31 NC(=O)C1CCC1Cl Amb24482516 [0,0,0,1,0,0|2,0,0]=3 4654 B8R1.31 NC(=O)[C@@H]1CC[C@@H]1Cl Amb25174435 [0,0,0,1,0,0|2,0,0]=3 4655 B8R1.31 NC(=O)[C@@H]1CC[C@H]1Cl Amb25024326 [0,0,0,1,0,0|2,0,0]=3 4656 B8R1.31 NC1CCC1C(N)=O Amb20248288 [0,0,0,1,0,0|2,0,0]=3 4657 B8R1.31 NC1COC1C(N)=O Amb25309396 [0,0,0,1,0,0|3,0,0]=4 4658 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,0,0,1,0,0|3,0,0]=4 4659 B8R1.31 N[C@@H]1CC[C@@H]1C(N)=O Amb24670123 [0,0,0,1,0,0|2,0,0]=3 4660 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,0,0,1,0,0|2,0,0]=3 4661 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,0,0,1,0,0|2,0,0]=3 4662 B8R1.31 N[C@@H]1CO[C@@H]1C(O)=O Amb24568133 [0,0,0,1,0,0|3,0,0]=4 4663 B8R1.31 N[C@@H]1CO[C@H]1C(O)=O Amb24681491 [0,0,0,1,0,0|3,0,0]=4 4664 B8R1.31 N[C@H]1CC[C@H]1C(N)=O Amb25326921 [0,0,0,1,0,0|2,0,0]=3 4665 B8R1.31 N[C@H]1CO[C@@H]1C(O)=O Amb25324265 [0,0,0,1,0,0|3,0,0]=4 4666 B8R1.31 O=C(Cl)C1CCC1Cl Amb25718688 [0,0,0,1,0,0|2,0,0]=3 4667 B8R1.31 O=C(Cl)[C@@H]1CC[C@@H]1Cl Amb25361006 [0,0,0,1,0,0|2,0,0]=3 4668 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,0,0,1,0,0|2,0,0]=3 4669 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,0,0,1,0,0|2,0,0]=3 4670 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,0,0,1,0,0|2,0,0]=3 4671 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,0,0,1,0,0|2,0,0]=3 4672 B8R1.34 C=C(Br)CN1CCC1 Amb22896555 [0,0,0,1,0,0|2,0,1]=4 4673 B8R1.34 C=C(Br)CN1CCC1 Amb25136715 [0,0,0,1,0,0|2,0,1]=4 4674 B8R1.34 CC(=C)CC1CCC1 Amb25141378 [0,0,0,1,0,0|1,0,0]=2 4675 B8R1.34 CC(=C)CC1CNC1 Amb24576858 [0,0,0,1,0,0|2,0,0]=3 4676 B8R1.34 CC(=O)C=C1CCC1 Amb21858878 [0,0,0,1,0,0|0,0,2]=3 4677 B8R1.34 CC(=O)C=C1COC1 Amb20671341 [0,0,0,1,0,0|1,0,2]=4 4678 B8R1.34 CC(=O)CC1CCC1 Amb20668826 [0,0,0,1,0,0|0,0,0]=1 4679 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,0,0,1,0,0|1,0,0]=2 4680 B8R1.34 CC(=O)CN1CCC1 Amb25266769 [0,0,0,1,0,0|1,0,0]=2 4681 B8R1.34 CC(=O)NC1CNC1 Amb21960869 [0,0,0,1,0,0|2,0,0]=3 4682 B8R1.34 CC(=O)OC1CCC1 Amb25215621 [0,0,0,1,0,0|1,0,0]=2 4683 B8R1.34 CC(=O)OC1CNC1 Amb21956164 [0,0,0,1,0,0|2,0,0]=3 4684 B8R1.34 CC(=O)OC1CNC1 Amb21959342 [0,0,0,1,0,0|2,0,0]=3 4685 B8R1.34 CC(=O)OC1COC1 Amb25257353 [0,0,0,1,0,0|2,0,0]=3 4686 B8R1.34 CC(Br)CC1CCC1 Amb25335129 [0,0,0,1,0,0|1,0,1]=3 4687 B8R1.34 CC(C)=C=C1CCC1 Amb25700003 [0,0,0,1,0,0|1,0,2]=4 4688 B8R1.34 CC(C)CC1CNC1 Amb18960085 [0,0,0,1,0,0|2,0,1]=4 4689 B8R1.34 CC(C)NC1CCC1 Amb18960945 [0,0,0,1,0,0|2,0,1]=4 4690 B8R1.34 CC(C)NC1CCC1 Amb19374818 [0,0,0,1,0,0|2,0,1]=4 4691 B8R1.34 CC(N)CC1CCC1 Amb25368240 [0,0,0,1,0,0|1,0,1]=3 4692 B8R1.34 CC(N)CC1CCO1 Amb25351976 [0,0,0,1,0,0|2,0,1]=4 4693 B8R1.34 CC(N)CC1COC1 Amb25312424 [0,0,0,1,0,0|2,0,1]=4 4694 B8R1.34 CC(N)CN1CCC1 Amb25126473 [0,0,0,1,0,0|2,0,1]=4 4695 B8R1.34 CC(O)CC1CCC1 Amb24590967 [0,0,0,1,0,0|0,0,2]=3 4696 B8R1.34 CC(O)CC1CSC1 Amb25746467 [0,0,0,1,0,0|1,0,2]=4 4697 B8R1.34 CC(S)CC1CCC1 Amb24421800 [0,0,0,1,0,0|0,1,1]=3 4698 B8R1.34 CN(C)CC1CNC1 Amb21960867 [0,0,0,1,0,0|3,0,0]=4 4699 B8R1.34 CN(C)CC1CNC1 Amb22227647 [0,0,0,1,0,0|3,0,0]=4 4700 B8R1.34 CN(C)C[C@@H]1CCN1 Amb24459816 [0,0,0,1,0,0|3,0,0]=4 4701 B8R1.34 CN(C)C[C@H]1CCN1 Amb24482986 [0,0,0,1,0,0|3,0,0]=4 4702 B8R1.34 CN(CC1CCC1)C Amb1779269 [0,0,0,1,0,0|2,0,0]=3 4703 B8R1.34 C[C@@H](O)CC1CCC1 Amb24673338 [0,0,0,1,0,0|0,0,2]=3 4704 B8R1.34 C[C@@H](O)CN1CCC1 Amb25787395 [0,0,0,1,0,0|1,0,2]=4 4705 B8R1.34 C[C@H](N)CC1CCC1 Amb24483051 [0,0,0,1,0,0|1,0,1]=3 4706 B8R1.34 C[C@H](O)CC1CCC1 Amb24719399 [0,0,0,1,0,0|0,0,2]=3 4707 B8R1.34 C[C@H](O)CN1CCC1 Amb24735102 [0,0,0,1,0,0|1,0,2]=4 4708 B8R1.34 NC(=N)CC1CCC1 Amb25693457 [0,0,0,1,0,0|2,0,0]=3 4709 B8R1.34 NC(=N)NC1CCC1 Amb24433597 [0,0,0,1,0,0|3,0,0]=4 4710 B8R1.34 NC(=O)CC1CCN1 Amb24561003 [0,0,0,1,0,0|2,0,0]=3 4711 B8R1.34 NC(=O)CC1COC1 Amb25080580 [0,0,0,1,0,0|2,0,0]=3 4712 B8R1.34 NC(=O)CN1CCC1 Amb25167404 [0,0,0,1,0,0|2,0,0]=3 4713 B8R1.34 NC(=O)NC1CCC1 Amb24692278 [0,0,0,1,0,0|2,0,0]=3 4714 B8R1.34 NC(=O)OC1CNC1 Amb23598269 [0,0,0,1,0,0|3,0,0]=4 4715 B8R1.34 NC(=O)OC1CSC1 Amb22364584 [0,0,0,1,0,0|3,0,0]=4 4716 B8R1.34 NC(=S)NC1CCC1 Amb24619949 [0,0,0,1,0,0|2,1,0]=4 4717 B8R1.34 O=C(Cl)CC1CCC1 Amb22491179 [0,0,0,1,0,0|1,0,0]=2 4718 B8R1.34 OC(=O)C=C1CCC1 Amb20667794 [0,0,0,1,0,0|1,0,2]=4 4719 B8R1.34 OC(=O)CC1CCN1 Amb25068427 [0,0,0,1,0,0|2,0,0]=3 4720 B8R1.34 OC(=O)CC1CNC1 Amb21856240 [0,0,0,1,0,0|2,0,0]=3 4721 B8R1.34 OC(=O)CC1CNC1 Amb22057370 [0,0,0,1,0,0|2,0,0]=3 4722 B8R1.34 OC(=O)CC1CNC1 Amb22739043 [0,0,0,1,0,0|2,0,0]=3 4723 B8R1.34 OC(=O)CC1COC1 Amb18199145 [0,0,0,1,0,0|2,0,0]=3 4724 B8R1.34 OC(=O)CC=1CCC1 Amb24397299 [0,0,0,1,0,0|1,0,2]=4 4725 B8R1.34 OC(=O)CN1CCC1 Amb22059611 [0,0,0,1,0,0|2,0,0]=3 4726 B8R1.34 [O-][N+](=O)CC1COC1 Amb21961002 [0,0,0,1,0,0|3,0,0]=4 4727 B8R1.35 C=C(Br)CNC1CC1 Amb18969560 [0,0,0,1,0,0|2,0,1]=4 4728 B8R1.35 C=C(Cl)CNC1CC1 Amb18969181 [0,0,0,1,0,0|2,0,1]=4 4729 B8R1.35 CC(=C)CNC1CC1 Amb17317871 [0,0,0,1,0,0|2,0,0]=3 4730 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,0,0,1,0,0|0,0,0]=1 4731 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,0,0,1,0,0|2,0,0]=3 4732 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,0,0,1,0,0|2,0,0]=3 4733 B8R1.35 CC(=O)OCC1CC1 Amb24502182 [0,0,0,1,0,0|1,0,0]=2 4734 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,0,0,1,0,0|2,0,0]=3 4735 B8R1.35 CC(=O)SCC1CC1 Amb24623413 [0,0,0,1,0,0|1,0,0]=2 4736 B8R1.35 CC(=O)\C=C/[C@H]1CO1 Amb24662437 [0,0,0,1,0,0|1,0,2]=4 4737 B8R1.35 CC(=O)\C=C\C1CC1 Amb25830492 [0,0,0,1,0,0|0,0,2]=3 4738 B8R1.35 CC(=O)\C=C\C1CO1 Amb24449027 [0,0,0,1,0,0|1,0,2]=4 4739 B8R1.35 CC(=O)\C=C\[C@H]1CO1 Amb25263639 [0,0,0,1,0,0|1,0,2]=4 4740 B8R1.35 CC(Br)CCC1CC1 Amb25067290 [0,0,0,1,0,0|1,0,1]=3 4741 B8R1.35 CC(CNC1CC1)C Amb1117785 [0,0,0,1,0,0|2,0,1]=4 4742 B8R1.35 CC(CNC1CC1)O Amb17138364 [0,0,0,1,0,0|1,0,2]=4 4743 B8R1.35 CC(Cl)CCC1CC1 Amb24611649 [0,0,0,1,0,0|1,0,1]=3 4744 B8R1.35 CC(N)CCC1CC1 Amb18203368 [0,0,0,1,0,0|1,0,1]=3 4745 B8R1.35 CC(N)CNC1CC1 Amb18301876 [0,0,0,1,0,0|2,0,1]=4 4746 B8R1.35 CC(N)COC1CC1 Amb24695820 [0,0,0,1,0,0|2,0,1]=4 4747 B8R1.35 CC(O)CCC1CC1 Amb25733792 [0,0,0,1,0,0|0,0,2]=3 4748 B8R1.35 CN(C)CCC1CO1 Amb24482563 [0,0,0,1,0,0|3,0,0]=4 4749 B8R1.35 CN(C)NCC1CC1 Amb25275484 [0,0,0,1,0,0|3,0,0]=4 4750 B8R1.35 CN(N)CCC1CC1 Amb25072134 [0,0,0,1,0,0|2,0,0]=3 4751 B8R1.35 C[C@@H](N)CCC1CC1 Amb25745640 [0,0,0,1,0,0|1,0,1]=3 4752 B8R1.35 C[C@@H](O)CCC1CC1 Amb24693085 [0,0,0,1,0,0|0,0,2]=3 4753 B8R1.35 C[C@@H](O)CNC1CC1 Amb25083354 [0,0,0,1,0,0|1,0,2]=4 4754 B8R1.35 C[C@H](N)CNC1CC1 Amb24673357 [0,0,0,1,0,0|2,0,1]=4 4755 B8R1.35 C[C@H](O)CCC1CC1 Amb25025020 [0,0,0,1,0,0|0,0,2]=3 4756 B8R1.35 C[C@H](O)CC[C@@H]1CO1 Amb25284230 [0,0,0,1,0,0|1,0,2]=4 4757 B8R1.35 C[C@H](O)CNC1CC1 Amb25694355 [0,0,0,1,0,0|1,0,2]=4 4758 B8R1.35 NC(=N)CNC1CC1 Amb24495903 [0,0,0,1,0,0|3,0,0]=4 4759 B8R1.35 NC(=N)NCC1CC1 Amb19748557 [0,0,0,1,0,0|3,0,0]=4 4760 B8R1.35 NC(=N)SCC1CC1 Amb24364813 [0,0,0,1,0,0|3,0,0]=4 4761 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,0,0,1,0,0|2,0,0]=3 4762 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,0,0,1,0,0|2,0,0]=3 4763 B8R1.35 NC(=O)\C=C\C1CC1 Amb25226133 [0,0,0,1,0,0|1,0,2]=4 4764 B8R1.35 NC(=S)CCC1CC1 Amb24483097 [0,0,0,1,0,0|1,1,0]=3 4765 B8R1.35 NC(=S)CNC1CC1 Amb17231870 [0,0,0,1,0,0|2,1,0]=4 4766 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,0,0,1,0,0|1,0,0]=2 4767 B8R1.35 O=C(Cl)OCC1CC1 Amb24370017 [0,0,0,1,0,0|2,0,0]=3 4768 B8R1.35 O=C(Cl)OCC1CO1 Amb25258534 [0,0,0,1,0,0|3,0,0]=4 4769 B8R1.35 OC(=O)C#CC1CC1 Amb1036650 [0,0,0,1,0,0|1,0,2]=4 4770 B8R1.35 OC(=O)CC=C1CC1 Amb25119812 [0,0,0,1,0,0|1,0,2]=4 4771 B8R1.35 OC(=O)\C=C\C1CC1 Amb18285135 [0,0,0,1,0,0|1,0,2]=4 4772 B8R1.35 [O-]S(=O)CCC1CC1 Amb25212503 [0,0,0,1,0,0|2,0,0]=3 4773 B8R1.36 BrCCCCC1CO1 Amb16234127 [0,0,0,1,0,0|1,0,2]=4 4774 B8R1.36 CCCCCC1CO1 Amb19892425 [0,0,0,1,0,0|0,0,2]=3 4775 B8R1.36 CCCCC[C@H]1CO1 Amb10982594 [0,0,0,1,0,0|0,0,2]=3 4776 B8R1.36 CCCCNC1CC1 Amb1128506 [0,0,0,1,0,0|2,0,1]=4 4777 B8R1.36 CCCSCC1CC1 Amb25285284 [0,0,0,1,0,0|2,0,1]=4 4778 B8R1.36 CCCSC[C@@H]1CO1 Amb24733152 [0,0,0,1,0,0|1,0,2]=4 4779 B8R1.36 CCCSC[C@H]1CO1 Amb24385827 [0,0,0,1,0,0|1,0,2]=4 4780 B8R1.36 CCNCCC1CC1 Amb19018993 [0,0,0,1,0,0|2,0,1]=4 4781 B8R1.36 CCOCCC1CO1 Amb25679046 [0,0,0,1,0,0|1,0,2]=4 4782 B8R1.36 COCCCC1CO1 Amb24676522 [0,0,0,1,0,0|1,0,2]=4 4783 B8R1.36 CSCCCC1CO1 Amb24687956 [0,0,0,1,0,0|1,0,2]=4 4784 B8R1.36 ClCCCCC1CO1 Amb25727648 [0,0,0,1,0,0|1,0,2]=4 4785 B8R1.36 NCCCCC1CC1 Amb18833054 [0,0,0,1,0,0|2,0,1]=4 4786 B8R1.36 NCCCCC1CO1 Amb25843740 [0,0,0,1,0,0|1,0,2]=4 4787 B8R1.36 OCCCCC1CN1 Amb24056761 [0,0,0,1,0,0|2,0,1]=4 4788 B8R1.36 OCCCCC=1CC1 Amb25344996 [0,0,0,1,0,0|2,0,0]=3 4789 B8R1.36 OCCCC[C@@H]1CO1 Amb25832754 [0,0,0,1,0,0|1,0,2]=4 4790 B8R1.43 C#C[C@@H]1C[C@H]1C(O)=O Amb25294666 [0,0,0,1,0,0|1,0,2]=4 4791 B8R1.43 C#C[C@H]1C[C@@H]1C(O)=O Amb24076488 [0,0,0,1,0,0|1,0,2]=4 4792 B8R1.43 C=CC1CC1C(N)=O Amb24530246 [0,0,0,1,0,0|1,0,2]=4 4793 B8R1.43 C=C[C@H]1C[C@@H]1C(O)=O Amb24562586 [0,0,0,1,0,0|1,0,2]=4 4794 B8R1.43 C=C[C@H]1C[C@H]1C(O)=O Amb25173924 [0,0,0,1,0,0|1,0,2]=4 4795 B8R1.43 CC(=C)C1CC1C=O Amb25834385 [0,0,0,1,0,0|2,0,1]=4 4796 B8R1.43 CC(=C)C1OC1CO Amb25025825 [0,0,0,1,0,0|3,0,0]=4 4797 B8R1.43 CC(=C)[C@@H]1O[C@H]1CO Amb24538968 [0,0,0,1,0,0|3,0,0]=4 4798 B8R1.43 CC(=O)C1CC1CO Amb25762004 [0,0,0,1,0,0|1,0,0]=2 4799 B8R1.43 CC(=O)[C@@H]1C[C@@H]1C=C Amb25784181 [0,0,0,1,0,0|0,0,2]=3 4800 B8R1.43 CC(=O)[C@H]1C[C@@H]1C=C Amb24570441 [0,0,0,1,0,0|0,0,2]=3 4801 B8R1.43 CC(C)=C1CC1CO Amb24577410 [0,0,0,1,0,0|2,0,1]=4 4802 B8R1.43 CC(C)C1CC1CCl Amb25796614 [0,0,0,1,0,0|2,0,1]=4 4803 B8R1.43 CC(C)C1CC1CN Amb18963621 [0,0,0,1,0,0|2,0,1]=4 4804 B8R1.43 CC(C)[C@@H]1C[C@H]1CN Amb25233598 [0,0,0,1,0,0|2,0,1]=4 4805 B8R1.43 CC(Cl)C1OC1CC Amb25274021 [0,0,0,1,0,0|2,0,1]=4 4806 B8R1.43 CC(O)[C@@H]1C[C@H]1CC Amb24733487 [0,0,0,1,0,0|0,0,2]=3 4807 B8R1.43 CC(O)[C@H]1C[C@H]1CO Amb25260054 [0,0,0,1,0,0|1,0,2]=4 4808 B8R1.43 CCC1CC1C(N)=O Amb24482378 [0,0,0,1,0,0|1,0,0]=2 4809 B8R1.43 CCC1CC1C(O)=O Amb18961272 [0,0,0,1,0,0|1,0,0]=2 4810 B8R1.43 CCC1OC1C(O)=O Amb24640795 [0,0,0,1,0,0|2,0,0]=3 4811 B8R1.43 CC[C@@H]1C[C@@H]1C(C)=O Amb25779618 [0,0,0,1,0,0|0,0,0]=1 4812 B8R1.43 CC[C@@H]1C[C@H]1C(=O)Cl Amb24606720 [0,0,0,1,0,0|1,0,0]=2 4813 B8R1.43 CC[C@@H]1C[C@H]1C(C)=O Amb25809901 [0,0,0,1,0,0|0,0,0]=1 4814 B8R1.43 CC[C@@H]1C[C@H]1C(N)=O Amb24532446 [0,0,0,1,0,0|1,0,0]=2 4815 B8R1.43 CC[C@@H]1C[C@H]1C(O)=O Amb24112910 [0,0,0,1,0,0|1,0,0]=2 4816 B8R1.43 CC[C@@H]1O[C@H]1C(O)=O Amb24587605 [0,0,0,1,0,0|2,0,0]=3 4817 B8R1.43 CC[C@H]1C[C@H]1C(C)=O Amb24635581 [0,0,0,1,0,0|0,0,0]=1 4818 B8R1.43 CN(C)[C@H]1C[C@@H]1CO Amb24520130 [0,0,0,1,0,0|3,0,0]=4 4819 B8R1.43 COC1CC1C(C)=O Amb25252874 [0,0,0,1,0,0|1,0,0]=2 4820 B8R1.43 COC1CC1C(O)=O Amb25081919 [0,0,0,1,0,0|2,0,0]=3 4821 B8R1.43 CO[C@@H]1C[C@H]1C(O)=O Amb24514838 [0,0,0,1,0,0|2,0,0]=3 4822 B8R1.43 C[C@@H](O)[C@@H]1C[C@@H]1CC Amb25358065 [0,0,0,1,0,0|0,0,2]=3 4823 B8R1.43 C[C@@H](O)[C@@H]1C[C@@H]1CO Amb25206739 [0,0,0,1,0,0|1,0,2]=4 4824 B8R1.43 C[C@H](O)[C@@H]1C[C@@H]1CO Amb25175328 [0,0,0,1,0,0|1,0,2]=4 4825 B8R1.43 C[C@H](O)[C@@H]1C[C@H]1CO Amb24588289 [0,0,0,1,0,0|1,0,2]=4 4826 B8R1.43 C[C@H](O)[C@H]1C[C@H]1CO Amb24732834 [0,0,0,1,0,0|1,0,2]=4 4827 B8R1.43 C\C=C/1\CC1C(O)=O Amb24386730 [0,0,0,1,0,0|1,0,2]=4 4828 B8R1.43 C\C=C/1\C[C@H]1C(O)=O Amb25359125 [0,0,0,1,0,0|1,0,2]=4 4829 B8R1.43 N#CC1CC1C(O)=O Amb24183452 [0,0,0,1,0,0|2,0,1]=4 4830 B8R1.43 N#C[C@@H]1C[C@@H]1C(O)=O Amb24183522 [0,0,0,1,0,0|2,0,1]=4 4831 B8R1.43 N#C[C@@H]1C[C@H]1C(O)=O Amb24183456 [0,0,0,1,0,0|2,0,1]=4 4832 B8R1.43 N#C[C@H]1C[C@H]1C(O)=O Amb25168974 [0,0,0,1,0,0|2,0,1]=4 4833 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,0,0,1,0,0|2,0,0]=3 4834 B8R1.43 NC(=O)C1OC1CBr Amb25702387 [0,0,0,1,0,0|3,0,0]=4 4835 B8R1.43 NC(=O)C1OC1CO Amb25351466 [0,0,0,1,0,0|3,0,0]=4 4836 B8R1.43 NC(=O)[C@@H]1O[C@H]1CO Amb25229010 [0,0,0,1,0,0|3,0,0]=4 4837 B8R1.43 NCC1CC1C(N)=O Amb24604918 [0,0,0,1,0,0|2,0,0]=3 4838 B8R1.43 NC[C@@H]1C[C@@H]1C(O)=O Amb24680970 [0,0,0,1,0,0|2,0,0]=3 4839 B8R1.43 NNC1CC1C(=O)O Amb10576221 [0,0,0,1,0,0|3,0,0]=4 4840 B8R1.43 OC(=O)[C@@H]1C[C@H]1C=O Amb25174216 [0,0,0,1,0,0|2,0,1]=4 4841 B8R1.43 OC(=O)[C@@H]1C[C@H]1CCl Amb24698643 [0,0,0,1,0,0|2,0,0]=3 4842 B8R1.43 OC(=O)[C@H]1C[C@@H]1C=O Amb25188101 [0,0,0,1,0,0|2,0,1]=4 4843 B8R1.43 OC(=O)[C@H]1C[C@@H]1CBr Amb24515045 [0,0,0,1,0,0|2,0,0]=3 4844 B8R1.43 OC(=O)[C@H]1O[C@@H]1CBr Amb24603042 [0,0,0,1,0,0|3,0,0]=4 4845 B8R1.43 OCC1CC1C(O)=O Amb25173469 [0,0,0,1,0,0|2,0,0]=3 4846 B8R1.43 OC[C@@H]1C[C@H]1C(O)=O Amb25231147 [0,0,0,1,0,0|2,0,0]=3 4847 B8R1.43 OC[C@H]1C[C@@H]1C(O)=O Amb25319844 [0,0,0,1,0,0|2,0,0]=3 4848 B8R1.43 [O-]C(=O)C1OC1CO Amb24557010 [0,0,0,1,0,0|3,0,0]=4 4849 B8R1.43 [O-]C(=O)[C@@H]1O[C@H]1CO Amb25215740 [0,0,0,1,0,0|3,0,0]=4 4850 B8R1.43 [O-]C(=O)[C@H]1O[C@@H]1CO Amb24541614 [0,0,0,1,0,0|3,0,0]=4 4851 B8R1.43 [O-][N+](=O)C1CC1CO Amb23571861 [0,0,0,1,0,0|3,0,0]=4 4852 B8R1.48 CC1(C)CCC1CBr Amb24571711 [0,0,0,1,0,0|2,0,1]=4 4853 B8R1.48 CC1(C)CCC1CO Amb24534050 [0,0,0,1,0,0|2,0,1]=4 4854 B8R1.48 CC1(N)CCC1CO Amb24333702 [0,0,0,1,0,0|2,0,1]=4 4855 B8R1.48 CCC1NCC1(C)C Amb25300516 [0,0,0,1,0,0|2,0,1]=4 4856 B8R1.48 C[C@@]1(N)CC[C@@H]1CO Amb25174977 [0,0,0,1,0,0|2,0,1]=4 4857 B8R1.48 OCC1CCS1(=O)=O Amb25178802 [0,0,0,1,0,0|3,0,0]=4 4858 B8R1.72 BrC1(Br)CCCCC1 Amb24667698 [0,0,0,1,0,0|2,0,1]=4 4859 B8R1.72 CC1(Br)CCCCC1 Amb24481540 [0,0,0,1,0,0|1,0,1]=3 4860 B8R1.72 CC1(C)CCCCN1 Amb16231536 [0,0,0,1,0,0|2,0,1]=4 4861 B8R1.72 CC1(C)CCCCN1 Amb22754140 [0,0,0,1,0,0|2,0,1]=4 4862 B8R1.72 CC1(C)CCCNC1 Amb10982554 [0,0,0,1,0,0|2,0,1]=4 4863 B8R1.72 CC1(C)CCNCC1 Amb13952767 [0,0,0,1,0,0|2,0,1]=4 4864 B8R1.72 CC1(F)CCNCC1 Amb22735452 [0,0,0,1,0,0|2,0,1]=4 4865 B8R1.72 CC1(F)CCNCC1 Amb23597817 [0,0,0,1,0,0|2,0,1]=4 4866 B8R1.72 CC1(F)CNCCC1 Amb22886322 [0,0,0,1,0,0|2,0,1]=4 4867 B8R1.72 CC1(F)CNCCC1 Amb23597499 [0,0,0,1,0,0|2,0,1]=4 4868 B8R1.72 CC1(N)CCCCC1 Amb10609050 [0,0,0,1,0,0|1,0,1]=3 4869 B8R1.72 CC1(N)CCNCC1 Amb21856985 [0,0,0,1,0,0|2,0,1]=4 4870 B8R1.72 CC1(N)CCNCC1 Amb21857713 [0,0,0,1,0,0|2,0,1]=4 4871 B8R1.72 CC1(N)CCOCC1 Amb18833018 [0,0,0,1,0,0|2,0,1]=4 4872 B8R1.72 CC1(N)CCOCC1 Amb19958199 [0,0,0,1,0,0|2,0,1]=4 4873 B8R1.72 CC1(N)CCSCC1 Amb18199761 [0,0,0,1,0,0|2,0,1]=4 4874 B8R1.72 CC1(N)CNCCC1 Amb25286641 [0,0,0,1,0,0|2,0,1]=4 4875 B8R1.72 CC1(N)COCCC1 Amb18833019 [0,0,0,1,0,0|2,0,1]=4 4876 B8R1.72 CC1(O)CCCNC1 Amb10607739 [0,0,0,1,0,0|1,0,2]=4 4877 B8R1.72 CC1(O)CCNCC1 Amb18943983 [0,0,0,1,0,0|1,0,2]=4 4878 B8R1.72 CC1(O)CCNCC1 Amb19515938 [0,0,0,1,0,0|1,0,2]=4 4879 B8R1.72 CC1(O)CCOCC1 Amb19957780 [0,0,0,1,0,0|1,0,2]=4 4880 B8R1.72 CC1(O)CCSCC1 Amb24672466 [0,0,0,1,0,0|1,0,2]=4 4881 B8R1.72 CC1(O)CNCCC1 Amb22491963 [0,0,0,1,0,0|1,0,2]=4 4882 B8R1.72 CC1(O)COCCC1 Amb20668932 [0,0,0,1,0,0|1,0,2]=4 4883 B8R1.72 CP1(=O)CCNCC1 Amb24715796 [0,0,0,1,0,0|2,0,0]=3 4884 B8R1.72 C[N+]1(C)CCCCC1 Amb10552900 [0,0,0,1,0,0|2,0,0]=3 4885 B8R1.72 C[N+]1(C)CCCCC1 Amb10844761 [0,0,0,1,0,0|2,0,0]=3 4886 B8R1.72 C[N+]1(C)CCCCC1 Amb15692276 [0,0,0,1,0,0|2,0,0]=3 4887 B8R1.72 C[N+]1(C)CCNCC1 Amb1625919 [0,0,0,1,0,0|3,0,0]=4 4888 B8R1.72 C[N+]1(C)CCNCC1 Amb21936106 [0,0,0,1,0,0|3,0,0]=4 4889 B8R1.72 C[N+]1(C)CCOCC1 Amb24117820 [0,0,0,1,0,0|3,0,0]=4 4890 B8R1.72 C[N+]1(N)CCCCC1 Amb10552677 [0,0,0,1,0,0|2,0,0]=3 4891 B8R1.72 C[Si]1(C)CCCCC1 Amb19893758 [0,0,0,1,0,0|1,1,0]=3 4892 B8R1.72 C[Si]1(C)CCCCO1 Amb19893844 [0,0,0,1,0,0|2,1,0]=4 4893 B8R1.72 C[Si]1(C)CCNCC1 Amb24117322 [0,0,0,1,0,0|2,1,0]=4 4894 B8R1.72 C[Si]1(C)CCNCC1 Amb24183363 [0,0,0,1,0,0|2,1,0]=4 4895 B8R1.72 C[Si]1(C)COCCC1 Amb25745221 [0,0,0,1,0,0|2,1,0]=4 4896 B8R1.72 Cl[Si]1(Cl)CCCCC1 Amb22730764 [0,0,0,1,0,0|2,1,0]=4 4897 B8R1.72 FC1(F)CCCCC1 Amb10838339 [0,0,0,1,0,0|2,0,1]=4 4898 B8R1.72 N=S1(=O)CCCCC1 Amb25258608 [0,0,0,1,0,0|2,0,0]=3 4899 B8R1.72 N=S1(=O)CCOCC1 Amb22169429 [0,0,0,1,0,0|3,0,0]=4 4900 B8R1.72 NC1(O)CCCCC1 Amb24481433 [0,0,0,1,0,0|1,0,2]=4 4901 B8R1.72 O=S1(=O)CCCCN1 Amb10068561 [0,0,0,1,0,0|3,0,0]=4 4902 B8R1.72 O=S1(=O)CCNCC1 Amb1102302 [0,0,0,1,0,0|3,0,0]=4 4903 B8R1.72 SC1(S)CCCCC1 Amb22492648 [0,0,0,1,0,0|1,1,1]=4 4904 B8R1.72 [BH3-][N+]1(C)CCOCC1 Amb22351576 [0,0,0,1,0,0|3,0,0]=4 4905 B5R0.1 BC(=O)NCC Amb22343194 [2,0,0,0,0,0|2,0,0]=4 4906 B5R0.1 C/C=C/C(C)=O Amb17940030 [2,0,0,0,0,0|0,0,2]=4 4907 B5R0.1 CC#CC(=O)C Amb17593016 [2,0,0,0,0,0|0,0,2]=4 4908 B5R0.1 CC(=C)CCBr Amb21857866 [2,0,0,0,0,0|2,0,0]=4 4909 B5R0.1 CC(=C)CCN Amb17673481 [2,0,0,0,0,0|2,0,0]=4 4910 B5R0.1 CC(=O)CC#C Amb17673302 [2,0,0,0,0,0|0,0,2]=4 4911 B5R0.1 CC(=O)CC#N Amb1102132 [2,0,0,0,0,0|1,0,1]=4 4912 B5R0.1 CC(=O)CC#N Amb22274239 [2,0,0,0,0,0|1,0,1]=4 4913 B5R0.1 CC(=O)CC=O Amb17666764 [2,0,0,0,0,0|1,0,1]=4 4914 B5R0.1 CC(=O)CCBr Amb24078246 [2,0,0,0,0,0|1,0,0]=3 4915 B5R0.1 CC(=O)CCN Amb10067110 [2,0,0,0,0,0|1,0,0]=3 4916 B5R0.1 CC(=O)CCN Amb18632933 [2,0,0,0,0,0|1,0,0]=3 4917 B5R0.1 CC(=O)CN=O Amb24645582 [2,0,0,0,0,0|2,0,0]=4 4918 B5R0.1 CC(=O)CON Amb25128844 [2,0,0,0,0,0|2,0,0]=4 4919 B5R0.1 CC(=O)CSCl Amb24631131 [2,0,0,0,0,0|2,0,0]=4 4920 B5R0.1 CC(=O)NCCl Amb25790034 [2,0,0,0,0,0|2,0,0]=4 4921 B5R0.1 CC(=O)NCS Amb25124326 [2,0,0,0,0,0|2,0,0]=4 4922 B5R0.1 CC(=O)OCCl Amb17673336 [2,0,0,0,0,0|2,0,0]=4 4923 B5R0.1 CC(=O)OCI Amb25226851 [2,0,0,0,0,0|2,0,0]=4 4924 B5R0.1 CC(=O)OCN Amb24359000 [2,0,0,0,0,0|2,0,0]=4 4925 B5R0.1 CC(=O)SCBr Amb25349900 [2,0,0,0,0,0|2,0,0]=4 4926 B5R0.1 CC=CC(C)=O Amb24061083 [2,0,0,0,0,0|0,0,2]=4 4927 B5R0.1 CCC=C(C)C Amb22336412 [2,0,0,0,0,0|1,0,1]=4 4928 B5R0.1 CCCC(=C)Br Amb22583743 [2,0,0,0,0,0|1,0,1]=4 4929 B5R0.1 CCCC(=N)N Amb10610381 [2,0,0,0,0,0|2,0,0]=4 4930 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,0]=3 4931 B5R0.1 CCCC(=S)Cl Amb24626931 [2,0,0,0,0,0|1,1,0]=4 4932 B5R0.1 CCCC(C)F Amb22008011 [2,0,0,0,0,0|1,0,1]=4 4933 B5R0.1 CCCC(C)I Amb17939400 [2,0,0,0,0,0|1,0,1]=4 4934 B5R0.1 CCCC(N)C Amb10609075 [2,0,0,0,0,0|1,0,1]=4 4935 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|1,0,1]=4 4936 B5R0.1 CCCC([O-])=O Amb17772223 [2,0,0,0,0,0|1,0,0]=3 4937 B5R0.1 CCCC([O-])=O Amb22732283 [2,0,0,0,0,0|1,0,0]=3 4938 B5R0.1 CCCC([O-])=O Amb22732651 [2,0,0,0,0,0|1,0,0]=3 4939 B5R0.1 CCCN(C)C Amb22336514 [2,0,0,0,0,0|2,0,0]=4 4940 B5R0.1 CCCN(C)C Amb22733186 [2,0,0,0,0,0|2,0,0]=4 4941 B5R0.1 CCCN(C)N Amb24587192 [2,0,0,0,0,0|2,0,0]=4 4942 B5R0.1 CCCN(C)O Amb25024622 [2,0,0,0,0,0|1,0,1]=4 4943 B5R0.1 CCCS(=O)Cl Amb25025566 [2,0,0,0,0,0|2,0,0]=4 4944 B5R0.1 CCCS(N)=O Amb24733579 [2,0,0,0,0,0|2,0,0]=4 4945 B5R0.1 CCCS(O)=O Amb24615072 [2,0,0,0,0,0|2,0,0]=4 4946 B5R0.1 CCCS([O-])=O Amb19929119 [2,0,0,0,0,0|2,0,0]=4 4947 B5R0.1 CCC[13C](O)=O Amb22337992 [2,0,0,0,0,0|1,0,0]=3 4948 B5R0.1 CCC[13C](O)=O Amb22338339 [2,0,0,0,0,0|1,0,0]=3 4949 B5R0.1 CCC[C@@H](C)Br Amb24373894 [2,0,0,0,0,0|1,0,1]=4 4950 B5R0.1 CCC[C@@H](C)Cl Amb24711432 [2,0,0,0,0,0|1,0,1]=4 4951 B5R0.1 CCC[C@@H](C)I Amb24432363 [2,0,0,0,0,0|1,0,1]=4 4952 B5R0.1 CCC[C@@H](C)N Amb22898992 [2,0,0,0,0,0|1,0,1]=4 4953 B5R0.1 CCC[C@@H](C)N Amb23439500 [2,0,0,0,0,0|1,0,1]=4 4954 B5R0.1 CCC[C@H](C)I Amb25237438 [2,0,0,0,0,0|1,0,1]=4 4955 B5R0.1 CCC[C@H](C)N Amb21618754 [2,0,0,0,0,0|1,0,1]=4 4956 B5R0.1 CCNC(=O)Br Amb24563760 [2,0,0,0,0,0|2,0,0]=4 4957 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 4958 B5R0.1 CCNC(C)=N Amb25246070 [2,0,0,0,0,0|2,0,0]=4 4959 B5R0.1 CCNC(C)=S Amb24580999 [2,0,0,0,0,0|1,1,0]=4 4960 B5R0.1 CCOC(C)=S Amb22047276 [2,0,0,0,0,0|1,1,0]=4 4961 B5R0.1 CCOC([13CH3])=O Amb22363103 [2,0,0,0,0,0|1,0,0]=3 4962 B5R0.1 CCOP(C)=O Amb17673512 [2,0,0,0,0,0|2,0,0]=4 4963 B5R0.1 CCO[13C](C)=O Amb22363160 [2,0,0,0,0,0|1,0,0]=3 4964 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [2,0,0,0,0,0|1,0,0]=3 4965 B5R0.1 CCO[14C](N)=O Amb22732757 [2,0,0,0,0,0|2,0,0]=4 4966 B5R0.1 CCSC(N)=O Amb24394612 [2,0,0,0,0,0|2,0,0]=4 4967 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [2,0,0,0,0,0|1,0,0]=3 4968 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [2,0,0,0,0,0|1,0,0]=3 4969 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [2,0,0,0,0,0|1,0,0]=3 4970 B5R0.1 CN=CC(C)=O Amb25746654 [2,0,0,0,0,0|1,0,1]=4 4971 B5R0.1 CNCC(=O)C Amb17621974 [2,0,0,0,0,0|1,0,0]=3 4972 B5R0.1 CNCC(=O)N Amb10610205 [2,0,0,0,0,0|2,0,0]=4 4973 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|1,0,0]=3 4974 B5R0.1 CNCC([O-])=O Amb20246714 [2,0,0,0,0,0|2,0,0]=4 4975 B5R0.1 CNOC(C)=O Amb24323679 [2,0,0,0,0,0|2,0,0]=4 4976 B5R0.1 CNOC(C)=O Amb24629247 [2,0,0,0,0,0|2,0,0]=4 4977 B5R0.1 COCC(=O)Br Amb25282928 [2,0,0,0,0,0|2,0,0]=4 4978 B5R0.1 COCC(=O)N Amb1153776 [2,0,0,0,0,0|2,0,0]=4 4979 B5R0.1 COCC(C)=S Amb25108516 [2,0,0,0,0,0|1,1,0]=4 4980 B5R0.1 CONC(C)=O Amb25046114 [2,0,0,0,0,0|2,0,0]=4 4981 B5R0.1 CS(=O)CCCl Amb24116979 [2,0,0,0,0,0|2,0,0]=4 4982 B5R0.1 CS(=O)CCN Amb19889121 [2,0,0,0,0,0|2,0,0]=4 4983 B5R0.1 CS(=O)CCN Amb20248083 [2,0,0,0,0,0|2,0,0]=4 4984 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 4985 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|2,0,0]=4 4986 B5R0.1 CSCC(C)=C Amb20671946 [2,0,0,0,0,0|2,0,0]=4 4987 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|1,0,0]=3 4988 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 4989 B5R0.1 CSCS(C)=O Amb22045140 [2,0,0,0,0,0|2,0,0]=4 4990 B5R0.1 CSNC(C)=O Amb22500292 [2,0,0,0,0,0|2,0,0]=4 4991 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [2,0,0,0,0,0|1,0,0]=3 4992 B5R0.1 NC(=O)CCBr Amb21618712 [2,0,0,0,0,0|2,0,0]=4 4993 B5R0.1 NC(=O)CCCl Amb1127569 [2,0,0,0,0,0|2,0,0]=4 4994 B5R0.1 NCCC(=O)Cl Amb24117140 [2,0,0,0,0,0|2,0,0]=4 4995 B5R0.1 NCCC(=O)N Amb1137251 [2,0,0,0,0,0|2,0,0]=4 4996 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|2,0,0]=4 4997 B5R0.1 O=C(Br)CCBr Amb24624022 [2,0,0,0,0,0|2,0,0]=4 4998 B5R0.1 O=C(Br)CCCl Amb24474527 [2,0,0,0,0,0|2,0,0]=4 4999 B5R0.1 O=C(I)CCCl Amb25146462 [2,0,0,0,0,0|2,0,0]=4 5000 B5R0.1 OC(=O)CCF Amb10603694 [2,0,0,0,0,0|2,0,0]=4 5001 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [2,0,0,0,0,0|1,0,0]=3 5002 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [2,0,0,0,0,0|1,0,0]=3 5003 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [2,0,0,0,0,0|1,0,0]=3 5004 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [2,0,0,0,0,0|2,0,0]=4 5005 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [2,0,0,0,0,0|2,0,0]=4 5006 B5R0.1 [2H]C(=O)OCC Amb22336312 [2,0,0,0,0,0|2,0,0]=4 5007 B5R0.1 [O-]C(=O)CCBr Amb22229633 [2,0,0,0,0,0|2,0,0]=4 5008 B5R0.1 [O-]C(=O)CCCl Amb10604124 [2,0,0,0,0,0|2,0,0]=4 5009 B5R0.1 [O-]C(=O)CCCl Amb22051669 [2,0,0,0,0,0|2,0,0]=4 5010 B5R0.1 [O-]C(=O)CCO Amb22055495 [2,0,0,0,0,0|2,0,0]=4 5011 B5R0.2 BCCCCN Amb24745748 [2,0,0,0,0,0|2,0,0]=4 5012 B5R0.2 BSCCCC Amb25339480 [2,0,0,0,0,0|2,0,0]=4 5013 B5R0.2 BrCCOCC Amb1158671 [2,0,0,0,0,0|2,0,0]=4 5014 B5R0.2 C=CCCCCl Amb22229585 [2,0,0,0,0,0|1,0,1]=4 5015 B5R0.2 C=CCCCF Amb25689705 [2,0,0,0,0,0|1,0,1]=4 5016 B5R0.2 C=CCCCI Amb25278794 [2,0,0,0,0,0|1,0,1]=4 5017 B5R0.2 C=CCCCN Amb18299670 [2,0,0,0,0,0|1,0,1]=4 5018 B5R0.2 C=CCCCN Amb22001451 [2,0,0,0,0,0|1,0,1]=4 5019 B5R0.2 CC/N=N/CC Amb17940073 [2,0,0,0,0,0|2,0,0]=4 5020 B5R0.2 CC=CCCN Amb19374038 [2,0,0,0,0,0|1,0,1]=4 5021 B5R0.2 CCC#CC=O Amb25663194 [2,0,0,0,0,0|0,0,2]=4 5022 B5R0.2 CCC/C=C/Br Amb17673688 [2,0,0,0,0,0|1,0,1]=4 5023 B5R0.2 CCCCC=C Amb22338530 [2,0,0,0,0,0|0,0,1]=3 5024 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|0,0,0]=2 5025 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,0]=3 5026 B5R0.2 CCCCC[13CH3] Amb22353529 [2,0,0,0,0,0|0,0,0]=2 5027 B5R0.2 CCCCC[Mg+] Amb22045757 [2,0,0,0,0,0|1,0,0]=3 5028 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|0,1,0]=3 5029 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 5030 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 5031 B5R0.2 CCCCNN Amb22732372 [2,0,0,0,0,0|2,0,0]=4 5032 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,1]=4 5033 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|2,0,0]=4 5034 B5R0.2 CCCCO[2H] Amb16185547 [2,0,0,0,0,0|2,0,0]=4 5035 B5R0.2 CCCCS[Na] Amb22360783 [2,0,0,0,0,0|2,0,0]=4 5036 B5R0.2 CCCC[Hg]Cl Amb22366548 [2,0,0,0,0,0|2,0,0]=4 5037 B5R0.2 CCCC[Mg]Br Amb17666637 [2,0,0,0,0,0|2,0,0]=4 5038 B5R0.2 CCCC[Zn]Br Amb22000415 [2,0,0,0,0,0|2,0,0]=4 5039 B5R0.2 CCCN=C=O Amb22338287 [2,0,0,0,0,0|1,0,1]=4 5040 B5R0.2 CCCNCO Amb25746089 [2,0,0,0,0,0|1,0,1]=4 5041 B5R0.2 CCCOC=C Amb17940706 [2,0,0,0,0,0|1,0,1]=4 5042 B5R0.2 CCCOCBr Amb25351883 [2,0,0,0,0,0|2,0,0]=4 5043 B5R0.2 CCCOCC Amb17673668 [2,0,0,0,0,0|1,0,0]=3 5044 B5R0.2 CCCOCCl Amb22002403 [2,0,0,0,0,0|2,0,0]=4 5045 B5R0.2 CCCON=O Amb22732190 [2,0,0,0,0,0|2,0,0]=4 5046 B5R0.2 CCCONC Amb25109607 [2,0,0,0,0,0|2,0,0]=4 5047 B5R0.2 CCCSCO Amb24466323 [2,0,0,0,0,0|1,0,1]=4 5048 B5R0.2 CCC\C=C\Cl Amb25026521 [2,0,0,0,0,0|1,0,1]=4 5049 B5R0.2 CCC\C=C\I Amb24333664 [2,0,0,0,0,0|1,0,1]=4 5050 B5R0.2 CCN=NCC Amb25224763 [2,0,0,0,0,0|2,0,0]=4 5051 B5R0.2 CCNCC=C Amb13951161 [2,0,0,0,0,0|1,0,1]=4 5052 B5R0.2 CCNCCN Amb22284539 [2,0,0,0,0,0|2,0,0]=4 5053 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,1]=4 5054 B5R0.2 CCNCCO Amb22284537 [2,0,0,0,0,0|1,0,1]=4 5055 B5R0.2 CCNCCS Amb18640505 [2,0,0,0,0,0|1,1,0]=4 5056 B5R0.2 CCNCN=O Amb24382131 [2,0,0,0,0,0|2,0,0]=4 5057 B5R0.2 CCNNCC Amb16233609 [2,0,0,0,0,0|2,0,0]=4 5058 B5R0.2 CCNNCC Amb22347978 [2,0,0,0,0,0|2,0,0]=4 5059 B5R0.2 CCOCCI Amb25117446 [2,0,0,0,0,0|2,0,0]=4 5060 B5R0.2 CCOCCN Amb21954038 [2,0,0,0,0,0|2,0,0]=4 5061 B5R0.2 CCPCCN Amb24560329 [2,0,0,0,0,0|2,0,0]=4 5062 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,0]=3 5063 B5R0.2 CCSCCC Amb22168047 [2,0,0,0,0,0|1,0,0]=3 5064 B5R0.2 CC[Se][Se]CC Amb17670683 [2,0,0,0,0,0|2,0,0]=4 5065 B5R0.2 CC\C=C\CC Amb22734067 [2,0,0,0,0,0|0,0,2]=4 5066 B5R0.2 CNCCC=C Amb18993048 [2,0,0,0,0,0|1,0,1]=4 5067 B5R0.2 CNCCCCl Amb22002154 [2,0,0,0,0,0|2,0,0]=4 5068 B5R0.2 CNCCCS Amb18121219 [2,0,0,0,0,0|1,1,0]=4 5069 B5R0.2 CNCCOC Amb10609606 [2,0,0,0,0,0|2,0,0]=4 5070 B5R0.2 CNCCSC Amb15701319 [2,0,0,0,0,0|2,0,0]=4 5071 B5R0.2 CNCCSC Amb20625111 [2,0,0,0,0,0|2,0,0]=4 5072 B5R0.2 CNNCCC Amb24057117 [2,0,0,0,0,0|2,0,0]=4 5073 B5R0.2 CNNCCC Amb25283190 [2,0,0,0,0,0|2,0,0]=4 5074 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,0]=3 5075 B5R0.2 COCCCF Amb22007998 [2,0,0,0,0,0|2,0,0]=4 5076 B5R0.2 COCCCI Amb22755452 [2,0,0,0,0,0|2,0,0]=4 5077 B5R0.2 COCCCS Amb13952794 [2,0,0,0,0,0|1,1,0]=4 5078 B5R0.2 COCCOC Amb22338452 [2,0,0,0,0,0|2,0,0]=4 5079 B5R0.2 COCCOC Amb22729734 [2,0,0,0,0,0|2,0,0]=4 5080 B5R0.2 COCCOC Amb22733818 [2,0,0,0,0,0|2,0,0]=4 5081 B5R0.2 CSCCC=C Amb24431590 [2,0,0,0,0,0|1,0,1]=4 5082 B5R0.2 CSCCCBr Amb18180189 [2,0,0,0,0,0|2,0,0]=4 5083 B5R0.2 CSCCCCl Amb10602296 [2,0,0,0,0,0|2,0,0]=4 5084 B5R0.2 CSCCCS Amb25744031 [2,0,0,0,0,0|1,1,0]=4 5085 B5R0.2 CSCCSC Amb25101746 [2,0,0,0,0,0|2,0,0]=4 5086 B5R0.2 CSCNC=O Amb24421815 [2,0,0,0,0,0|2,0,0]=4 5087 B5R0.2 CSCSCC Amb24619526 [2,0,0,0,0,0|2,0,0]=4 5088 B5R0.2 C[SiH2]CCCCl Amb24594928 [2,0,0,0,0,0|1,1,0]=4 5089 B5R0.2 C[SiH2]CCCI Amb24673429 [2,0,0,0,0,0|1,1,0]=4 5090 B5R0.2 C[SiH2]CC[SiH2]C Amb22227708 [2,0,0,0,0,0|0,2,0]=4 5091 B5R0.2 C\C=C/CC=O Amb24728871 [2,0,0,0,0,0|0,0,2]=4 5092 B5R0.2 C\C=C/CCO Amb19930204 [2,0,0,0,0,0|1,0,1]=4 5093 B5R0.2 C\C=C\CCBr Amb25808954 [2,0,0,0,0,0|1,0,1]=4 5094 B5R0.2 C\C=C\CCI Amb25744699 [2,0,0,0,0,0|1,0,1]=4 5095 B5R0.2 C\C=C\CCN Amb10601619 [2,0,0,0,0,0|1,0,1]=4 5096 B5R0.2 C\C=C\CCN Amb24271068 [2,0,0,0,0,0|1,0,1]=4 5097 B5R0.2 C\C=C\CCO Amb24655557 [2,0,0,0,0,0|1,0,1]=4 5098 B5R0.2 C\C=C\CSC Amb24634458 [2,0,0,0,0,0|1,0,1]=4 5099 B5R0.2 C\C=C\NCC Amb25141439 [2,0,0,0,0,0|1,0,1]=4 5100 B5R0.2 ClCCNCC Amb17334050 [2,0,0,0,0,0|2,0,0]=4 5101 B5R0.2 FCCCCF Amb10839858 [2,0,0,0,0,0|2,0,0]=4 5102 B5R0.2 FCCCCS Amb25065453 [2,0,0,0,0,0|1,1,0]=4 5103 B5R0.2 ICCCCI Amb17672573 [2,0,0,0,0,0|2,0,0]=4 5104 B5R0.2 NCCCCBr Amb18644498 [2,0,0,0,0,0|2,0,0]=4 5105 B5R0.2 NCCCCBr Amb21858985 [2,0,0,0,0,0|2,0,0]=4 5106 B5R0.2 NCCCCCl Amb18640687 [2,0,0,0,0,0|2,0,0]=4 5107 B5R0.2 NCCCCCl Amb22233734 [2,0,0,0,0,0|2,0,0]=4 5108 B5R0.2 NCCCCN Amb22352431 [2,0,0,0,0,0|2,0,0]=4 5109 B5R0.2 NCCCCN Amb22489528 [2,0,0,0,0,0|2,0,0]=4 5110 B5R0.2 NCCCCS Amb17500976 [2,0,0,0,0,0|1,1,0]=4 5111 B5R0.2 NCCCCS Amb22546260 [2,0,0,0,0,0|1,1,0]=4 5112 B5R0.2 NCCNC=O Amb25213948 [2,0,0,0,0,0|2,0,0]=4 5113 B5R0.2 NCCOC=O Amb24612320 [2,0,0,0,0,0|2,0,0]=4 5114 B5R0.2 NCCOCC Amb1130918 [2,0,0,0,0,0|2,0,0]=4 5115 B5R0.2 N[13CH2]CC[13CH2]N Amb22367523 [2,0,0,0,0,0|2,0,0]=4 5116 B5R0.2 N[13CH2][13CH2][13CH2][13CH2]N Amb22336801 [2,0,0,0,0,0|2,0,0]=4 5117 B5R0.2 O=CCCC=O Amb22231966 [2,0,0,0,0,0|1,0,1]=4 5118 B5R0.2 O=CCCCBr Amb18644189 [2,0,0,0,0,0|1,0,0]=3 5119 B5R0.2 O=CCCCF Amb24056028 [2,0,0,0,0,0|1,0,0]=3 5120 B5R0.2 O=CCCSCl Amb25146622 [2,0,0,0,0,0|2,0,0]=4 5121 B5R0.2 O=CCCSS Amb22524519 [2,0,0,0,0,0|2,0,0]=4 5122 B5R0.2 O=CCOCBr Amb25765436 [2,0,0,0,0,0|2,0,0]=4 5123 B5R0.2 O=CCOCC Amb24052108 [2,0,0,0,0,0|1,0,0]=3 5124 B5R0.2 O=CCOCCl Amb24671305 [2,0,0,0,0,0|2,0,0]=4 5125 B5R0.2 O=COCCCl Amb22345927 [2,0,0,0,0,0|2,0,0]=4 5126 B5R0.2 O=CSCCCl Amb25808568 [2,0,0,0,0,0|2,0,0]=4 5127 B5R0.2 OCCCC=O Amb24589235 [2,0,0,0,0,0|1,0,0]=3 5128 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,1]=4 5129 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,1]=4 5130 B5R0.2 OCCCCI Amb25689806 [2,0,0,0,0,0|1,0,1]=4 5131 B5R0.2 OCCCCS Amb22229807 [2,0,0,0,0,0|1,0,1]=4 5132 B5R0.2 OCCSCC Amb1085958 [2,0,0,0,0,0|1,0,1]=4 5133 B5R0.2 SCCCC=C Amb17939241 [2,0,0,0,0,0|1,0,1]=4 5134 B5R0.2 SCCCCCl Amb24665692 [2,0,0,0,0,0|1,1,0]=4 5135 B5R0.2 [15NH2]CCCC[15NH2] Amb22353369 [2,0,0,0,0,0|2,0,0]=4 5136 B5R0.2 [C-]#[N+]CCC=O Amb24706723 [2,0,0,0,0,0|1,0,1]=4 5137 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|1,0,1]=4 5138 B7R0.2 CC(=C)CC(N)CO Amb24665584 [1,1,0,0,0,0|2,0,0]=4 5139 B7R0.2 CC(=C)CC(O)CCl Amb25322238 [1,1,0,0,0,0|2,0,0]=4 5140 B7R0.2 CC(=C)C[C@H](O)CO Amb25235652 [1,1,0,0,0,0|2,0,0]=4 5141 B7R0.2 CC(=N)CC(=O)CC Amb24734350 [1,1,0,0,0,0|1,0,1]=4 5142 B7R0.2 CC(=O)C=C(Br)CC Amb25327796 [1,1,0,0,0,0|0,0,2]=4 5143 B7R0.2 CC(=O)C=C(Cl)CC Amb25809857 [1,1,0,0,0,0|0,0,2]=4 5144 B7R0.2 CC(=O)CC(=C)CCl Amb25092223 [1,1,0,0,0,0|1,0,1]=4 5145 B7R0.2 CC(=O)CC(=N)CF Amb25087799 [1,1,0,0,0,0|1,0,1]=4 5146 B7R0.2 CC(=O)CC(=N)NC Amb24096720 [1,1,0,0,0,0|1,0,1]=4 5147 B7R0.2 CC(=O)CC(=O)CBr Amb24442011 [1,1,0,0,0,0|1,0,1]=4 5148 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [1,1,0,0,0,0|1,0,1]=4 5149 B7R0.2 CC(=O)CC(=S)CC Amb24378474 [1,1,0,0,0,0|0,0,1]=3 5150 B7R0.2 CC(=O)CC(=S)NC Amb24096719 [1,1,0,0,0,0|1,0,1]=4 5151 B7R0.2 CC(=O)CC(=S)OC Amb24096829 [1,1,0,0,0,0|1,0,1]=4 5152 B7R0.2 CC(=O)CC(Cl)CCl Amb25335495 [1,1,0,0,0,0|1,0,0]=3 5153 B7R0.2 CC(=O)CC(O)C#C Amb24690832 [1,1,0,0,0,0|0,0,2]=4 5154 B7R0.2 CC(=O)CC(O)C=C Amb25103770 [1,1,0,0,0,0|0,0,2]=4 5155 B7R0.2 CC(=O)CC(O)C=O Amb24481554 [1,1,0,0,0,0|1,0,1]=4 5156 B7R0.2 CC(=O)CC(O)CO Amb25304727 [1,1,0,0,0,0|1,0,0]=3 5157 B7R0.2 CC(=O)CC(S)C=O Amb25838806 [1,1,0,0,0,0|1,0,1]=4 5158 B7R0.2 CC(=O)C[C@@H](O)CO Amb24640954 [1,1,0,0,0,0|1,0,0]=3 5159 B7R0.2 CC(=O)C[C@H](O)C=C Amb25051451 [1,1,0,0,0,0|0,0,2]=4 5160 B7R0.2 CC(=O)C[C@H](O)CCl Amb25810138 [1,1,0,0,0,0|1,0,0]=3 5161 B7R0.2 CC(=O)C\C(\Cl)=C/C Amb24553550 [1,1,0,0,0,0|0,0,2]=4 5162 B7R0.2 CC(=O)C\C(\Cl)=C\C Amb25834378 [1,1,0,0,0,0|0,0,2]=4 5163 B7R0.2 CC(=O)NC(=C)CC Amb25804486 [1,1,0,0,0,0|1,0,1]=4 5164 B7R0.2 CC(=O)NC(=S)CC Amb25828544 [1,1,0,0,0,0|1,0,1]=4 5165 B7R0.2 CC(=O)OC(=C)CC Amb25202254 [1,1,0,0,0,0|1,0,1]=4 5166 B7R0.2 CC(=O)OC(=O)CC Amb21858081 [1,1,0,0,0,0|1,0,1]=4 5167 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [1,1,0,0,0,0|2,0,0]=4 5168 B7R0.2 CC(=O)OC(Cl)CBr Amb25843189 [1,1,0,0,0,0|2,0,0]=4 5169 B7R0.2 CC(=O)OC(Cl)CCl Amb22729073 [1,1,0,0,0,0|2,0,0]=4 5170 B7R0.2 CC(=O)\C=C(/Br)\CC Amb24434628 [1,1,0,0,0,0|0,0,2]=4 5171 B7R0.2 CC(=O)\C=C(/Cl)\CC Amb25065790 [1,1,0,0,0,0|0,0,2]=4 5172 B7R0.2 CC(=O)\C=C(/[O-])\CC Amb19960031 [1,1,0,0,0,0|0,0,2]=4 5173 B7R0.2 CC(C)CC(Br)CC Amb24346666 [1,1,0,0,0,0|1,0,1]=4 5174 B7R0.2 CC(C)CC(C)CC Amb22228298 [1,1,0,0,0,0|1,0,1]=4 5175 B7R0.2 CC(C)CC(N)CC Amb18523780 [1,1,0,0,0,0|1,0,1]=4 5176 B7R0.2 CC(C)C[C@@H](N)CC Amb24675860 [1,1,0,0,0,0|1,0,1]=4 5177 B7R0.2 CC(C)C[C@@H](O)CC Amb25795362 [1,1,0,0,0,0|1,0,1]=4 5178 B7R0.2 CC(CBr)CC(C)=O Amb24365894 [1,1,0,0,0,0|1,0,0]=3 5179 B7R0.2 CC(CBr)NC(C)=O Amb25223671 [1,1,0,0,0,0|2,0,0]=4 5180 B7R0.2 CC(CC(C)=O)=NC Amb25250042 [1,1,0,0,0,0|1,0,1]=4 5181 B7R0.2 CC(CC(C)=O)C#C Amb24738456 [1,1,0,0,0,0|0,0,2]=4 5182 B7R0.2 CC(CC(C)=O)C#N Amb18124227 [1,1,0,0,0,0|1,0,1]=4 5183 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [1,1,0,0,0,0|1,0,1]=4 5184 B7R0.2 CC(CC(N)=O)CN Amb18641899 [1,1,0,0,0,0|2,0,0]=4 5185 B7R0.2 CC(CC(O)=O)CO Amb18198168 [1,1,0,0,0,0|2,0,0]=4 5186 B7R0.2 CC(CC)CC(=N)N Amb10607625 [1,1,0,0,0,0|2,0,0]=4 5187 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [1,1,0,0,0,0|1,0,0]=3 5188 B7R0.2 CC(CCl)OC(C)=O Amb24481416 [1,1,0,0,0,0|2,0,0]=4 5189 B7R0.2 CC(CF)NC(C)=O Amb25077726 [1,1,0,0,0,0|2,0,0]=4 5190 B7R0.2 CC(CN)CC(C)=O Amb18251072 [1,1,0,0,0,0|1,0,0]=3 5191 B7R0.2 CC(CN)CC(O)=O Amb18124263 [1,1,0,0,0,0|2,0,0]=4 5192 B7R0.2 CC(CN)CC(O)=O Amb20669501 [1,1,0,0,0,0|2,0,0]=4 5193 B7R0.2 CC(CN)NC(C)=O Amb18251073 [1,1,0,0,0,0|2,0,0]=4 5194 B7R0.2 CC(CN)SC(C)=O Amb25255492 [1,1,0,0,0,0|2,0,0]=4 5195 B7R0.2 CC(CO)CC(C)=O Amb24606485 [1,1,0,0,0,0|1,0,0]=3 5196 B7R0.2 CC(CO)CC(N)=O Amb24452895 [1,1,0,0,0,0|2,0,0]=4 5197 B7R0.2 CC(CO)OC(C)=O Amb25144303 [1,1,0,0,0,0|2,0,0]=4 5198 B7R0.2 CC(Cl)CC(O)CC Amb25053890 [1,1,0,0,0,0|1,0,1]=4 5199 B7R0.2 CC(F)CC(O)CC Amb24675431 [1,1,0,0,0,0|1,0,1]=4 5200 B7R0.2 CC(NC(=O)N)CC Amb1105272 [1,1,0,0,0,0|2,0,0]=4 5201 B7R0.2 CC(NC)CC(=O)N Amb17231826 [1,1,0,0,0,0|2,0,0]=4 5202 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [1,1,0,0,0,0|1,0,1]=4 5203 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [1,1,0,0,0,0|1,0,1]=4 5204 B7R0.2 CCC(Br)CC(C)=C Amb24355903 [1,1,0,0,0,0|1,0,0]=3 5205 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [1,1,0,0,0,0|1,0,0]=3 5206 B7R0.2 CCC(C)CC(C)=C Amb22228340 [1,1,0,0,0,0|1,0,0]=3 5207 B7R0.2 CCC(C)CC(C)Br Amb24757470 [1,1,0,0,0,0|1,0,1]=4 5208 B7R0.2 CCC(C)CC(N)=N Amb19890168 [1,1,0,0,0,0|2,0,0]=4 5209 B7R0.2 CCC(C)CC(N)=O Amb25230669 [1,1,0,0,0,0|1,0,0]=3 5210 B7R0.2 CCC(C)CN(C)C Amb25851027 [1,1,0,0,0,0|2,0,0]=4 5211 B7R0.2 CCC(C)C[N+]([O-])=O Amb25075983 [1,1,0,0,0,0|2,0,0]=4 5212 B7R0.2 CCC(C)NC(C)=N Amb25081674 [1,1,0,0,0,0|2,0,0]=4 5213 B7R0.2 CCC(C)NC(C)=S Amb24332642 [1,1,0,0,0,0|1,1,0]=4 5214 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [1,1,0,0,0,0|2,0,0]=4 5215 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [1,1,0,0,0,0|2,0,0]=4 5216 B7R0.2 CCC(CC(=O)C)C Amb10608208 [1,1,0,0,0,0|0,0,0]=2 5217 B7R0.2 CCC(CC(=O)O)N Amb1993862 [1,1,0,0,0,0|1,0,0]=3 5218 B7R0.2 CCC(CC(=O)O)O Amb10844270 [1,1,0,0,0,0|1,0,0]=3 5219 B7R0.2 CCC(CC(N)C)C Amb10069423 [1,1,0,0,0,0|1,0,1]=4 5220 B7R0.2 CCC(Cl)C=C(C)C Amb25295453 [1,1,0,0,0,0|1,0,1]=4 5221 B7R0.2 CCC(Cl)CC(=O)Cl Amb24390220 [1,1,0,0,0,0|1,0,0]=3 5222 B7R0.2 CCC(Cl)CC(C)=C Amb24735482 [1,1,0,0,0,0|1,0,0]=3 5223 B7R0.2 CCC(Cl)CN(C)C Amb25328843 [1,1,0,0,0,0|2,0,0]=4 5224 B7R0.2 CCC(Cl)OC(=O)Cl Amb25853933 [1,1,0,0,0,0|2,0,0]=4 5225 B7R0.2 CCC(N)CC(C)=C Amb24367516 [1,1,0,0,0,0|1,0,0]=3 5226 B7R0.2 CCC(N)CC(C)=O Amb18631696 [1,1,0,0,0,0|0,0,0]=2 5227 B7R0.2 CCC(N)CC(N)=O Amb25727686 [1,1,0,0,0,0|1,0,0]=3 5228 B7R0.2 CCC(N)CS(C)=O Amb24481377 [1,1,0,0,0,0|1,0,0]=3 5229 B7R0.2 CCC(N)NC(C)=O Amb25062531 [1,1,0,0,0,0|1,0,0]=3 5230 B7R0.2 CCC(O)C=C(C)C Amb25340896 [1,1,0,0,0,0|1,0,1]=4 5231 B7R0.2 CCC(O)CC(C)=C Amb24062975 [1,1,0,0,0,0|1,0,0]=3 5232 B7R0.2 CCC(O)CC(C)=O Amb25065181 [1,1,0,0,0,0|0,0,0]=2 5233 B7R0.2 CCC(O)CC(N)=O Amb24616660 [1,1,0,0,0,0|1,0,0]=3 5234 B7R0.2 CCC(O)CC(O)=O Amb22363067 [1,1,0,0,0,0|1,0,0]=3 5235 B7R0.2 CCC(O)C[N+]([O-])=O Amb25136685 [1,1,0,0,0,0|2,0,0]=4 5236 B7R0.2 CCC(O)SC(C)=S Amb25332463 [1,1,0,0,0,0|1,1,0]=4 5237 B7R0.2 CCC(S)CC(O)=O Amb18303084 [1,1,0,0,0,0|1,0,0]=3 5238 B7R0.2 CCN(C)NC(C)=O Amb24675229 [1,1,0,0,0,0|2,0,0]=4 5239 B7R0.2 CCN(N)CC(O)=O Amb25738005 [1,1,0,0,0,0|2,0,0]=4 5240 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|2,0,0]=4 5241 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [1,1,0,0,0,0|1,0,0]=3 5242 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [1,1,0,0,0,0|1,0,0]=3 5243 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [1,1,0,0,0,0|1,0,0]=3 5244 B7R0.2 CC[C@@H](C)NC(C)=O Amb25169508 [1,1,0,0,0,0|1,0,0]=3 5245 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [1,1,0,0,0,0|1,0,0]=3 5246 B7R0.2 CC[C@@H](N)CN(C)C Amb22587558 [1,1,0,0,0,0|2,0,0]=4 5247 B7R0.2 CC[C@@H](O)C=C(C)C Amb24475081 [1,1,0,0,0,0|1,0,1]=4 5248 B7R0.2 CC[C@@H](O)CC(C)=C Amb25136335 [1,1,0,0,0,0|1,0,0]=3 5249 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [1,1,0,0,0,0|0,0,0]=2 5250 B7R0.2 CC[C@@H](O)CN(C)C Amb24446828 [1,1,0,0,0,0|2,0,0]=4 5251 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [1,1,0,0,0,0|1,0,0]=3 5252 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [1,1,0,0,0,0|0,0,0]=2 5253 B7R0.2 CC[C@H](C)CC(C)N Amb25062813 [1,1,0,0,0,0|1,0,1]=4 5254 B7R0.2 CC[C@H](C)CC(N)=N Amb24409491 [1,1,0,0,0,0|2,0,0]=4 5255 B7R0.2 CC[C@H](C)NC(C)=O Amb25823467 [1,1,0,0,0,0|1,0,0]=3 5256 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [1,1,0,0,0,0|1,0,0]=3 5257 B7R0.2 CC[C@H](N)CN(C)C Amb22587381 [1,1,0,0,0,0|2,0,0]=4 5258 B7R0.2 CC[C@H](N)CN(C)C Amb23385277 [1,1,0,0,0,0|2,0,0]=4 5259 B7R0.2 CC[C@H](O)CN(C)C Amb25749217 [1,1,0,0,0,0|2,0,0]=4 5260 B7R0.2 CC[C@H](O)C[N+]([O-])=O Amb25854053 [1,1,0,0,0,0|2,0,0]=4 5261 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [1,1,0,0,0,0|2,0,0]=4 5262 B7R0.2 CNC(C)CC(N)=O Amb19960012 [1,1,0,0,0,0|2,0,0]=4 5263 B7R0.2 CNC(C)CC(O)=O Amb21959674 [1,1,0,0,0,0|2,0,0]=4 5264 B7R0.2 CNC(C)CS(C)=O Amb24410768 [1,1,0,0,0,0|2,0,0]=4 5265 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [1,1,0,0,0,0|2,0,0]=4 5266 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [1,1,0,0,0,0|2,0,0]=4 5267 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [1,1,0,0,0,0|2,0,0]=4 5268 B7R0.2 CO[C@@H](O)CC(C)=O Amb24450127 [1,1,0,0,0,0|1,0,0]=3 5269 B7R0.2 CS(=O)CC(O)CN Amb24482487 [1,1,0,0,0,0|2,0,0]=4 5270 B7R0.2 CS(=O)C[C@@H](O)CN Amb25284334 [1,1,0,0,0,0|2,0,0]=4 5271 B7R0.2 CS(=O)C[C@H](N)CO Amb24436533 [1,1,0,0,0,0|2,0,0]=4 5272 B7R0.2 CS(=O)C[C@H](O)CN Amb25811520 [1,1,0,0,0,0|2,0,0]=4 5273 B7R0.2 CSC(C)CC(C)=O Amb25714199 [1,1,0,0,0,0|1,0,0]=3 5274 B7R0.2 CSC(C)CC(O)=O Amb18967824 [1,1,0,0,0,0|2,0,0]=4 5275 B7R0.2 C[C@@H](CC(C)=O)C#C Amb25721483 [1,1,0,0,0,0|0,0,2]=4 5276 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [1,1,0,0,0,0|1,0,1]=4 5277 B7R0.2 C[C@@H](CCl)OC(C)=O Amb24419691 [1,1,0,0,0,0|2,0,0]=4 5278 B7R0.2 C[C@@H](CO)CC(C)=C Amb25845281 [1,1,0,0,0,0|2,0,0]=4 5279 B7R0.2 C[C@@H](CO)CC(C)=O Amb25072788 [1,1,0,0,0,0|1,0,0]=3 5280 B7R0.2 C[C@@H](CO)OC(C)=O Amb25681753 [1,1,0,0,0,0|2,0,0]=4 5281 B7R0.2 C[C@H](CBr)NC(C)=O Amb24690410 [1,1,0,0,0,0|2,0,0]=4 5282 B7R0.2 C[C@H](CO)NC(C)=O Amb24426644 [1,1,0,0,0,0|2,0,0]=4 5283 B7R0.2 C[C@H](S)C[C@@H](O)CC Amb25237174 [1,1,0,0,0,0|0,1,1]=4 5284 B7R0.2 C\C(\CC(C)=O)=N/C Amb25093198 [1,1,0,0,0,0|1,0,1]=4 5285 B7R0.2 C\C(\CC(C)=O)=N\C Amb25285772 [1,1,0,0,0,0|1,0,1]=4 5286 B7R0.2 NC(=O)CC(O)CO Amb25662216 [1,1,0,0,0,0|2,0,0]=4 5287 B7R0.2 NC(=O)C[C@H](O)CCl Amb25791271 [1,1,0,0,0,0|2,0,0]=4 5288 B7R0.2 NC(CF)CC(O)=O Amb24428065 [1,1,0,0,0,0|2,0,0]=4 5289 B7R0.2 NC(CO)CC(N)=O Amb24384089 [1,1,0,0,0,0|2,0,0]=4 5290 B7R0.2 NC(CS)CC(O)=O Amb25090412 [1,1,0,0,0,0|2,0,0]=4 5291 B7R0.2 NCC(F)CC(O)=O Amb24550169 [1,1,0,0,0,0|2,0,0]=4 5292 B7R0.2 NCC(N)CC(O)=O Amb19515145 [1,1,0,0,0,0|2,0,0]=4 5293 B7R0.2 NCC(N)CC(O)=O Amb21858324 [1,1,0,0,0,0|2,0,0]=4 5294 B7R0.2 NCC(N)CC(O)=O Amb22751661 [1,1,0,0,0,0|2,0,0]=4 5295 B7R0.2 NCC(O)CC(N)=O Amb18641952 [1,1,0,0,0,0|2,0,0]=4 5296 B7R0.2 NC[C@@H](N)CC(O)=O Amb22751651 [1,1,0,0,0,0|2,0,0]=4 5297 B7R0.2 NC[C@@H](N)CC(O)=O Amb25829509 [1,1,0,0,0,0|2,0,0]=4 5298 B7R0.2 NC[C@H](CC(=O)O)N Amb10603267 [1,1,0,0,0,0|2,0,0]=4 5299 B7R0.2 NC[C@H](N)CC(O)=O Amb25378712 [1,1,0,0,0,0|2,0,0]=4 5300 B7R0.2 N[C@@H](CO)CC(N)=O Amb24704927 [1,1,0,0,0,0|2,0,0]=4 5301 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [1,1,0,0,0,0|2,0,0]=4 5302 B7R0.2 N[C@H](CO)CC(N)=O Amb24599306 [1,1,0,0,0,0|2,0,0]=4 5303 B7R0.2 O=C(Cl)CC(Cl)CCl Amb25138703 [1,1,0,0,0,0|2,0,0]=4 5304 B7R0.2 OC(=O)CC(Br)CCl Amb25834578 [1,1,0,0,0,0|2,0,0]=4 5305 B7R0.2 OC(=O)CC(Cl)CCl Amb25335414 [1,1,0,0,0,0|2,0,0]=4 5306 B7R0.2 OC(CC(=O)Cl)CCl Amb25806118 [1,1,0,0,0,0|2,0,0]=4 5307 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [1,1,0,0,0,0|2,0,0]=4 5308 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [1,1,0,0,0,0|2,0,0]=4 5309 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [1,1,0,0,0,0|2,0,0]=4 5310 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [1,1,0,0,0,0|2,0,0]=4 5311 B7R0.2 [O-]C(=O)CC(O)CO Amb24117078 [1,1,0,0,0,0|2,0,0]=4 5312 B7R0.3 C#CCCC(=O)CBr Amb25362236 [1,1,0,0,0,0|0,0,2]=4 5313 B7R0.3 C#CCCC(=O)CN Amb25678834 [1,1,0,0,0,0|0,0,2]=4 5314 B7R0.3 C=C(CCl)CCCBr Amb25266982 [1,1,0,0,0,0|2,0,0]=4 5315 B7R0.3 C=C(CO)CCCN Amb25747319 [1,1,0,0,0,0|2,0,0]=4 5316 B7R0.3 C=CC(=O)CCCBr Amb24726349 [1,1,0,0,0,0|1,0,1]=4 5317 B7R0.3 C=CC(=O)CCCCl Amb24568327 [1,1,0,0,0,0|1,0,1]=4 5318 B7R0.3 C=CC(=O)CCCN Amb25662517 [1,1,0,0,0,0|1,0,1]=4 5319 B7R0.3 C=CC(=O)CCCO Amb25284731 [1,1,0,0,0,0|1,0,1]=4 5320 B7R0.3 C=CCCC(=O)CBr Amb22059627 [1,1,0,0,0,0|0,0,2]=4 5321 B7R0.3 C=CCCC(=O)CCl Amb22059504 [1,1,0,0,0,0|0,0,2]=4 5322 B7R0.3 C=CCCC(=O)CN Amb24411061 [1,1,0,0,0,0|0,0,2]=4 5323 B7R0.3 C=CCCC(=O)CO Amb25763185 [1,1,0,0,0,0|0,0,2]=4 5324 B7R0.3 CC#CCC(=O)CN Amb24679249 [1,1,0,0,0,0|0,0,2]=4 5325 B7R0.3 CC(=CCCO)C=O Amb25366501 [1,1,0,0,0,0|1,0,1]=4 5326 B7R0.3 CC(C=O)=CCCBr Amb25366526 [1,1,0,0,0,0|1,0,1]=4 5327 B7R0.3 CC(C=O)CCCC Amb17593191 [1,1,0,0,0,0|0,0,1]=3 5328 B7R0.3 CC(CCCCl)=CCl Amb25328852 [1,1,0,0,0,0|2,0,0]=4 5329 B7R0.3 CC(CCCCl)=NO Amb24353583 [1,1,0,0,0,0|1,0,1]=4 5330 B7R0.3 CC(CCCCl)C=O Amb24376628 [1,1,0,0,0,0|1,0,1]=4 5331 B7R0.3 CC(CCCO)=CBr Amb24355350 [1,1,0,0,0,0|2,0,0]=4 5332 B7R0.3 CC(CCCO)=CCl Amb25073713 [1,1,0,0,0,0|2,0,0]=4 5333 B7R0.3 CC(CCCO)C=O Amb24690170 [1,1,0,0,0,0|1,0,1]=4 5334 B7R0.3 CCC#CC(=O)CO Amb25705398 [1,1,0,0,0,0|0,0,2]=4 5335 B7R0.3 CCC(=O)CCC#N Amb25321503 [1,1,0,0,0,0|1,0,1]=4 5336 B7R0.3 CCC(=O)CCC=O Amb18641783 [1,1,0,0,0,0|1,0,1]=4 5337 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,1,0,0,0,0|1,0,0]=3 5338 B7R0.3 CCC(=O)CCCF Amb25101437 [1,1,0,0,0,0|1,0,0]=3 5339 B7R0.3 CCC(=O)CCCN Amb18833012 [1,1,0,0,0,0|1,0,0]=3 5340 B7R0.3 CCC(=O)CCCO Amb24629709 [1,1,0,0,0,0|1,0,0]=3 5341 B7R0.3 CCC(=O)CCSC Amb25680024 [1,1,0,0,0,0|1,0,0]=3 5342 B7R0.3 CCC(=O)CNCC Amb25032080 [1,1,0,0,0,0|1,0,0]=3 5343 B7R0.3 CCC(=O)CSCC Amb24715230 [1,1,0,0,0,0|1,0,0]=3 5344 B7R0.3 CCC(=O)NCCI Amb24436232 [1,1,0,0,0,0|2,0,0]=4 5345 B7R0.3 CCC(=O)NCCS Amb24505089 [1,1,0,0,0,0|2,0,0]=4 5346 B7R0.3 CCC(=O)NOCC Amb24481448 [1,1,0,0,0,0|2,0,0]=4 5347 B7R0.3 CCC(=O)SCCCl Amb24447033 [1,1,0,0,0,0|2,0,0]=4 5348 B7R0.3 CCC(=O)\C=C/CC Amb25128986 [1,1,0,0,0,0|0,0,2]=4 5349 B7R0.3 CCC(=O)\C=C\CC Amb25283354 [1,1,0,0,0,0|0,0,2]=4 5350 B7R0.3 CCC(=S)NCCC Amb25848578 [1,1,0,0,0,0|1,1,0]=4 5351 B7R0.3 CCCCC(=C)CBr Amb25249105 [1,1,0,0,0,0|1,0,0]=3 5352 B7R0.3 CCCCC(=C)CO Amb25079813 [1,1,0,0,0,0|1,0,0]=3 5353 B7R0.3 CCCCC(=N)NC Amb24377157 [1,1,0,0,0,0|1,0,0]=3 5354 B7R0.3 CCCCC(=N)OC Amb17617956 [1,1,0,0,0,0|1,0,0]=3 5355 B7R0.3 CCCCC(=N)OC Amb25353357 [1,1,0,0,0,0|1,0,0]=3 5356 B7R0.3 CCCCC(=O)C#N Amb22729179 [1,1,0,0,0,0|0,0,1]=3 5357 B7R0.3 CCCCC(=O)C=C Amb25062494 [1,1,0,0,0,0|0,0,1]=3 5358 B7R0.3 CCCCC(=O)C=O Amb18124252 [1,1,0,0,0,0|0,0,1]=3 5359 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,1,0,0,0,0|0,0,0]=2 5360 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,1,0,0,0,0|0,0,0]=2 5361 B7R0.3 CCCCC(=O)CF Amb24483296 [1,1,0,0,0,0|0,0,0]=2 5362 B7R0.3 CCCCC(=O)CN Amb24473062 [1,1,0,0,0,0|0,0,0]=2 5363 B7R0.3 CCCCC(=O)SC Amb25225724 [1,1,0,0,0,0|0,0,0]=2 5364 B7R0.3 CCCCC(Br)CC Amb18804679 [1,1,0,0,0,0|1,0,1]=4 5365 B7R0.3 CCCCC(Br)CN Amb25287843 [1,1,0,0,0,0|1,0,1]=4 5366 B7R0.3 CCCCC(C)=CC Amb22229367 [1,1,0,0,0,0|1,0,0]=3 5367 B7R0.3 CCCCC(C)=NO Amb19515982 [1,1,0,0,0,0|0,0,1]=3 5368 B7R0.3 CCCCC(C)C#N Amb18641663 [1,1,0,0,0,0|1,0,1]=4 5369 B7R0.3 CCCCC(C)C=C Amb22641469 [1,1,0,0,0,0|1,0,1]=4 5370 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|1,0,1]=4 5371 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|1,0,1]=4 5372 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|1,0,1]=4 5373 B7R0.3 CCCCC(C)[Mg]Br Amb22897309 [1,1,0,0,0,0|1,0,1]=4 5374 B7R0.3 CCCCC(C)[Zn]Br Amb22000400 [1,1,0,0,0,0|1,0,1]=4 5375 B7R0.3 CCCCC(C=O)Br Amb17594581 [1,1,0,0,0,0|1,0,1]=4 5376 B7R0.3 CCCCC(CC)C Amb10071971 [1,1,0,0,0,0|1,0,1]=4 5377 B7R0.3 CCCCC(CC)O Amb10844720 [1,1,0,0,0,0|0,0,2]=4 5378 B7R0.3 CCCCC(CO)C Amb17593205 [1,1,0,0,0,0|0,0,2]=4 5379 B7R0.3 CCCCC(CO)N Amb2236185 [1,1,0,0,0,0|1,0,1]=4 5380 B7R0.3 CCCCC(Cl)=CBr Amb24552431 [1,1,0,0,0,0|1,0,1]=4 5381 B7R0.3 CCCCC(Cl)=CCl Amb24512078 [1,1,0,0,0,0|1,0,1]=4 5382 B7R0.3 CCCCC(Cl)C=O Amb18642973 [1,1,0,0,0,0|1,0,1]=4 5383 B7R0.3 CCCCC(Cl)CC Amb25361621 [1,1,0,0,0,0|1,0,1]=4 5384 B7R0.3 CCCCC(Cl)CN Amb24550911 [1,1,0,0,0,0|1,0,1]=4 5385 B7R0.3 CCCCC(Cl)CO Amb25760827 [1,1,0,0,0,0|1,0,1]=4 5386 B7R0.3 CCCCC(Cl)OC Amb24433133 [1,1,0,0,0,0|1,0,1]=4 5387 B7R0.3 CCCCC(F)=CBr Amb24483089 [1,1,0,0,0,0|1,0,1]=4 5388 B7R0.3 CCCCC(F)CCl Amb25091588 [1,1,0,0,0,0|1,0,1]=4 5389 B7R0.3 CCCCC(F)CN Amb24117055 [1,1,0,0,0,0|1,0,1]=4 5390 B7R0.3 CCCCC(F)CO Amb25134893 [1,1,0,0,0,0|1,0,1]=4 5391 B7R0.3 CCCCC(N)=NN Amb25781596 [1,1,0,0,0,0|2,0,0]=4 5392 B7R0.3 CCCCC(N)CN Amb19009750 [1,1,0,0,0,0|1,0,1]=4 5393 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|0,0,2]=4 5394 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|0,0,2]=4 5395 B7R0.3 CCCCC(O)CS Amb24554468 [1,1,0,0,0,0|0,0,2]=4 5396 B7R0.3 CCCCC(O)OC Amb24448002 [1,1,0,0,0,0|0,0,2]=4 5397 B7R0.3 CCCCC(S)CC Amb25314909 [1,1,0,0,0,0|0,1,1]=4 5398 B7R0.3 CCCCN(C)N=O Amb22231185 [1,1,0,0,0,0|1,0,0]=3 5399 B7R0.3 CCCCN(C)OC Amb24354551 [1,1,0,0,0,0|1,0,1]=4 5400 B7R0.3 CCCCN(CC)N Amb17593206 [1,1,0,0,0,0|2,0,0]=4 5401 B7R0.3 CCCC[14C](=O)O[Na] Amb22734535 [1,1,0,0,0,0|1,0,0]=3 5402 B7R0.3 CCCC[C@@H](Br)CC Amb25273533 [1,1,0,0,0,0|1,0,1]=4 5403 B7R0.3 CCCC[C@@H](C)CBr Amb25322055 [1,1,0,0,0,0|1,0,1]=4 5404 B7R0.3 CCCC[C@@H](Cl)CC Amb24546428 [1,1,0,0,0,0|1,0,1]=4 5405 B7R0.3 CCCC[C@@H](N)CO Amb23440322 [1,1,0,0,0,0|1,0,1]=4 5406 B7R0.3 CCCC[C@@H](O)C=O Amb24481527 [1,1,0,0,0,0|1,0,1]=4 5407 B7R0.3 CCCC[C@@H](O)CC Amb25675670 [1,1,0,0,0,0|0,0,2]=4 5408 B7R0.3 CCCC[C@@H](O)CO Amb25315976 [1,1,0,0,0,0|0,0,2]=4 5409 B7R0.3 CCCC[C@H](Br)CC Amb25765583 [1,1,0,0,0,0|1,0,1]=4 5410 B7R0.3 CCCC[C@H](C)NC Amb25745887 [1,1,0,0,0,0|1,0,1]=4 5411 B7R0.3 CCCC[C@H](F)C=O Amb25143375 [1,1,0,0,0,0|1,0,1]=4 5412 B7R0.3 CCCC[C@H](N)CN Amb25725218 [1,1,0,0,0,0|1,0,1]=4 5413 B7R0.3 CCCC[C@H](O)CCl Amb24561798 [1,1,0,0,0,0|0,0,2]=4 5414 B7R0.3 CCCC\C(\Br)=C/Cl Amb25663235 [1,1,0,0,0,0|1,0,1]=4 5415 B7R0.3 CCCC\C(\C)=C/Cl Amb24627150 [1,1,0,0,0,0|1,0,0]=3 5416 B7R0.3 CCCC\C(\C)=N\O Amb21520448 [1,1,0,0,0,0|0,0,1]=3 5417 B7R0.3 CCCC\C(\Cl)=C/Cl Amb25745924 [1,1,0,0,0,0|1,0,1]=4 5418 B7R0.3 CCCNC(=N)CCl Amb25292181 [1,1,0,0,0,0|2,0,0]=4 5419 B7R0.3 CCCNC(=N)CF Amb24483075 [1,1,0,0,0,0|2,0,0]=4 5420 B7R0.3 CCCNC(=N)CO Amb23514974 [1,1,0,0,0,0|2,0,0]=4 5421 B7R0.3 CCCNC(=O)C#C Amb25101832 [1,1,0,0,0,0|1,0,1]=4 5422 B7R0.3 CCCNC(=O)CBr Amb17330843 [1,1,0,0,0,0|1,0,0]=3 5423 B7R0.3 CCCNC(=O)CCl Amb1207068 [1,1,0,0,0,0|1,0,0]=3 5424 B7R0.3 CCCNC(=O)CF Amb25141943 [1,1,0,0,0,0|1,0,0]=3 5425 B7R0.3 CCCNC(=O)CI Amb23512283 [1,1,0,0,0,0|1,0,0]=3 5426 B7R0.3 CCCNC(=O)CN Amb10781813 [1,1,0,0,0,0|1,0,0]=3 5427 B7R0.3 CCCNC(=O)OC Amb17797997 [1,1,0,0,0,0|1,0,0]=3 5428 B7R0.3 CCCNC(=O)SC Amb24746599 [1,1,0,0,0,0|1,0,0]=3 5429 B7R0.3 CCCNC(=S)SC Amb25844084 [1,1,0,0,0,0|1,1,0]=4 5430 B7R0.3 CCCOC(=C)C=O Amb24483012 [1,1,0,0,0,0|1,0,1]=4 5431 B7R0.3 CCCOC(=O)C=C Amb22045218 [1,1,0,0,0,0|1,0,1]=4 5432 B7R0.3 CCCOC(=O)C=O Amb18641875 [1,1,0,0,0,0|1,0,1]=4 5433 B7R0.3 CCCOC(=O)NO Amb24630559 [1,1,0,0,0,0|2,0,0]=4 5434 B7R0.3 CCCSC(=C)CO Amb25694154 [1,1,0,0,0,0|2,0,0]=4 5435 B7R0.3 CCCSC(=S)OC Amb25758079 [1,1,0,0,0,0|1,1,0]=4 5436 B7R0.3 CCCSC(C)C=O Amb18124367 [1,1,0,0,0,0|1,0,1]=4 5437 B7R0.3 CCC\C=C(/C)\C=O Amb25194656 [1,1,0,0,0,0|0,0,1]=3 5438 B7R0.3 CCC\C=C(/F)\C=O Amb24653634 [1,1,0,0,0,0|1,0,1]=4 5439 B7R0.3 CCC\C=C(\Br)/CO Amb25306515 [1,1,0,0,0,0|1,0,1]=4 5440 B7R0.3 CCC\C=C(\C)/C=O Amb18641699 [1,1,0,0,0,0|0,0,1]=3 5441 B7R0.3 CCC\C=C(\C)/CCl Amb24656043 [1,1,0,0,0,0|1,0,1]=4 5442 B7R0.3 CCC\C=C(\C)/CO Amb25206584 [1,1,0,0,0,0|0,0,2]=4 5443 B7R0.3 CCC\C=C(\Cl)/C=O Amb18124371 [1,1,0,0,0,0|1,0,1]=4 5444 B7R0.3 CCC\C=C(\F)/C=O Amb18641881 [1,1,0,0,0,0|1,0,1]=4 5445 B7R0.3 CCC\C=C(\F)/CBr Amb24602495 [1,1,0,0,0,0|1,0,1]=4 5446 B7R0.3 CCC\C=C(\F)/CO Amb25093759 [1,1,0,0,0,0|1,0,1]=4 5447 B7R0.3 CCNCC(=O)C#C Amb25062852 [1,1,0,0,0,0|1,0,1]=4 5448 B7R0.3 CCNCC(=O)OC Amb19514718 [1,1,0,0,0,0|1,0,0]=3 5449 B7R0.3 CCNNC(=O)OC Amb25191868 [1,1,0,0,0,0|2,0,0]=4 5450 B7R0.3 CCOCC(=C)CCl Amb24682763 [1,1,0,0,0,0|2,0,0]=4 5451 B7R0.3 CCOCC(=C)CO Amb25222257 [1,1,0,0,0,0|2,0,0]=4 5452 B7R0.3 CCOCC(=N)NC Amb24591387 [1,1,0,0,0,0|2,0,0]=4 5453 B7R0.3 CCOCC(=O)C#C Amb24483100 [1,1,0,0,0,0|1,0,1]=4 5454 B7R0.3 CCOCC(=O)CBr Amb25261639 [1,1,0,0,0,0|1,0,0]=3 5455 B7R0.3 CCOCC(=O)CCl Amb25087764 [1,1,0,0,0,0|1,0,0]=3 5456 B7R0.3 CCOCC(=O)CS Amb24406072 [1,1,0,0,0,0|1,0,0]=3 5457 B7R0.3 CCOCC(=O)NN Amb2111918 [1,1,0,0,0,0|2,0,0]=4 5458 B7R0.3 CCOCC(C)=CBr Amb24433949 [1,1,0,0,0,0|2,0,0]=4 5459 B7R0.3 CCOCC(C)=CCl Amb24586962 [1,1,0,0,0,0|2,0,0]=4 5460 B7R0.3 CCOCC(C)=NN Amb25847659 [1,1,0,0,0,0|2,0,0]=4 5461 B7R0.3 CCONC(=O)CBr Amb25249598 [1,1,0,0,0,0|2,0,0]=4 5462 B7R0.3 CCONC(=O)CN Amb24445788 [1,1,0,0,0,0|2,0,0]=4 5463 B7R0.3 CCS(=O)CCCN Amb18306016 [1,1,0,0,0,0|2,0,0]=4 5464 B7R0.3 CCS(=O)CCCO Amb25226262 [1,1,0,0,0,0|2,0,0]=4 5465 B7R0.3 CCS(=O)CCNC Amb21984659 [1,1,0,0,0,0|2,0,0]=4 5466 B7R0.3 CCSCC(=C)C=O Amb18642813 [1,1,0,0,0,0|1,0,1]=4 5467 B7R0.3 CCSCC(=C)CCl Amb24529097 [1,1,0,0,0,0|2,0,0]=4 5468 B7R0.3 CCSCC(=O)C#C Amb25068174 [1,1,0,0,0,0|1,0,1]=4 5469 B7R0.3 CCSCC(=O)C=O Amb24741839 [1,1,0,0,0,0|1,0,1]=4 5470 B7R0.3 CCSCC(=O)CCl Amb24545960 [1,1,0,0,0,0|1,0,0]=3 5471 B7R0.3 CCSCC(=O)CO Amb25686953 [1,1,0,0,0,0|1,0,0]=3 5472 B7R0.3 CCSCC(=O)NC Amb24333216 [1,1,0,0,0,0|1,0,0]=3 5473 B7R0.3 CCSCC(C)=NO Amb25066024 [1,1,0,0,0,0|1,0,1]=4 5474 B7R0.3 CCSNC(=O)CO Amb24631959 [1,1,0,0,0,0|2,0,0]=4 5475 B7R0.3 CC\C(\C)=C/CCC Amb25227654 [1,1,0,0,0,0|1,0,1]=4 5476 B7R0.3 CC\C(\C)=C\CCC Amb25260956 [1,1,0,0,0,0|1,0,1]=4 5477 B7R0.3 CC\C=C/C(=O)OC Amb10071549 [1,1,0,0,0,0|0,0,2]=4 5478 B7R0.3 CC\C=C\C(=O)CBr Amb25251595 [1,1,0,0,0,0|0,0,2]=4 5479 B7R0.3 CC\C=C\C(=O)NC Amb25345934 [1,1,0,0,0,0|0,0,2]=4 5480 B7R0.3 CN(C=O)CCCO Amb17593211 [1,1,0,0,0,0|2,0,0]=4 5481 B7R0.3 CN(CCCCl)C=O Amb24589375 [1,1,0,0,0,0|2,0,0]=4 5482 B7R0.3 CNC(=N)CCOC Amb24526950 [1,1,0,0,0,0|2,0,0]=4 5483 B7R0.3 CNC(=O)CCC#C Amb18636143 [1,1,0,0,0,0|0,0,2]=4 5484 B7R0.3 CNC(=O)CCC#N Amb17334052 [1,1,0,0,0,0|1,0,1]=4 5485 B7R0.3 CNC(=O)CCC=C Amb25041195 [1,1,0,0,0,0|0,0,2]=4 5486 B7R0.3 CNC(=O)CCCBr Amb24552452 [1,1,0,0,0,0|1,0,0]=3 5487 B7R0.3 CNC(=O)CCCCl Amb1137464 [1,1,0,0,0,0|1,0,0]=3 5488 B7R0.3 CNC(=O)CCCO Amb17231829 [1,1,0,0,0,0|1,0,0]=3 5489 B7R0.3 CNC(=O)CCN=C Amb24713898 [1,1,0,0,0,0|1,0,1]=4 5490 B7R0.3 CNC(=O)CCON Amb25744608 [1,1,0,0,0,0|2,0,0]=4 5491 B7R0.3 CNC(=O)NCCF Amb25757414 [1,1,0,0,0,0|2,0,0]=4 5492 B7R0.3 CNC(=O)NCCN Amb17231831 [1,1,0,0,0,0|2,0,0]=4 5493 B7R0.3 CNC(=O)NCCO Amb24376074 [1,1,0,0,0,0|2,0,0]=4 5494 B7R0.3 CNC(=O)NCSC Amb25082930 [1,1,0,0,0,0|2,0,0]=4 5495 B7R0.3 CNC(=O)OCCBr Amb25104424 [1,1,0,0,0,0|2,0,0]=4 5496 B7R0.3 CNC(=O)OCCCl Amb22363563 [1,1,0,0,0,0|2,0,0]=4 5497 B7R0.3 CNCCC(=O)C#C Amb24528728 [1,1,0,0,0,0|1,0,1]=4 5498 B7R0.3 CNCCC(=O)NC Amb19959924 [1,1,0,0,0,0|1,0,0]=3 5499 B7R0.3 CNCCC(=O)OC Amb22168213 [1,1,0,0,0,0|1,0,0]=3 5500 B7R0.3 CNCCN(C)N=O Amb25770805 [1,1,0,0,0,0|2,0,0]=4 5501 B7R0.3 COC(=C)CCCCl Amb25703575 [1,1,0,0,0,0|2,0,0]=4 5502 B7R0.3 COC(=N)CCCCl Amb16231406 [1,1,0,0,0,0|2,0,0]=4 5503 B7R0.3 COC(=N)COCC Amb25315918 [1,1,0,0,0,0|2,0,0]=4 5504 B7R0.3 COC(=O)CCC#C Amb18115985 [1,1,0,0,0,0|0,0,2]=4 5505 B7R0.3 COC(=O)CCC=C Amb2369959 [1,1,0,0,0,0|0,0,2]=4 5506 B7R0.3 COC(=O)CCC=O Amb18124259 [1,1,0,0,0,0|1,0,1]=4 5507 B7R0.3 COC(=O)CCCS Amb19373761 [1,1,0,0,0,0|1,0,0]=3 5508 B7R0.3 COC(=O)CCNN Amb24524272 [1,1,0,0,0,0|2,0,0]=4 5509 B7R0.3 COC(=O)CCNO Amb24644523 [1,1,0,0,0,0|2,0,0]=4 5510 B7R0.3 COC(=O)CCON Amb18641968 [1,1,0,0,0,0|2,0,0]=4 5511 B7R0.3 COC(=O)CC[Zn]Br Amb22898090 [1,1,0,0,0,0|2,0,0]=4 5512 B7R0.3 COC(=O)CNCO Amb25369412 [1,1,0,0,0,0|2,0,0]=4 5513 B7R0.3 COC(=O)CNOC Amb25725740 [1,1,0,0,0,0|2,0,0]=4 5514 B7R0.3 COC(=O)COCBr Amb25288082 [1,1,0,0,0,0|2,0,0]=4 5515 B7R0.3 COC(=O)CSCCl Amb25689724 [1,1,0,0,0,0|2,0,0]=4 5516 B7R0.3 COC(=O)NCCBr Amb10608897 [1,1,0,0,0,0|2,0,0]=4 5517 B7R0.3 COC(=O)NCCCl Amb24526396 [1,1,0,0,0,0|2,0,0]=4 5518 B7R0.3 COC(=O)NCCN Amb18970459 [1,1,0,0,0,0|2,0,0]=4 5519 B7R0.3 COC(=O)NOCC Amb24735360 [1,1,0,0,0,0|2,0,0]=4 5520 B7R0.3 COC(=O)OCCCl Amb25261257 [1,1,0,0,0,0|2,0,0]=4 5521 B7R0.3 COCCC(=N)OC Amb24334438 [1,1,0,0,0,0|2,0,0]=4 5522 B7R0.3 COCCC(=O)C#N Amb24645428 [1,1,0,0,0,0|1,0,1]=4 5523 B7R0.3 COCCC(=O)C=C Amb24744935 [1,1,0,0,0,0|1,0,1]=4 5524 B7R0.3 COCCC(=O)C=O Amb24722152 [1,1,0,0,0,0|1,0,1]=4 5525 B7R0.3 COCCC(=O)CBr Amb25708389 [1,1,0,0,0,0|1,0,0]=3 5526 B7R0.3 COCCC(=O)CCl Amb20622320 [1,1,0,0,0,0|1,0,0]=3 5527 B7R0.3 COCCC(=O)CO Amb25049164 [1,1,0,0,0,0|1,0,0]=3 5528 B7R0.3 COCCC(=O)CS Amb24646143 [1,1,0,0,0,0|1,0,0]=3 5529 B7R0.3 COCCC(C)=NN Amb24614445 [1,1,0,0,0,0|2,0,0]=4 5530 B7R0.3 COCNC(=O)CCl Amb25141907 [1,1,0,0,0,0|2,0,0]=4 5531 B7R0.3 COC\C=C(\C)/C=O Amb24686454 [1,1,0,0,0,0|1,0,1]=4 5532 B7R0.3 CSC(=O)NCCO Amb24460774 [1,1,0,0,0,0|2,0,0]=4 5533 B7R0.3 CSC(=S)CCCCl Amb25354350 [1,1,0,0,0,0|1,1,0]=4 5534 B7R0.3 CSCCC(=O)C#C Amb24402673 [1,1,0,0,0,0|1,0,1]=4 5535 B7R0.3 CSCCC(=O)C#N Amb25730124 [1,1,0,0,0,0|1,0,1]=4 5536 B7R0.3 CSCCC(=O)C=C Amb25334636 [1,1,0,0,0,0|1,0,1]=4 5537 B7R0.3 CSCCC(=O)NO Amb25756883 [1,1,0,0,0,0|2,0,0]=4 5538 B7R0.3 CSCCN(C)C=O Amb25716635 [1,1,0,0,0,0|2,0,0]=4 5539 B7R0.3 CSCNC(=O)CCl Amb24591194 [1,1,0,0,0,0|2,0,0]=4 5540 B7R0.3 CSCOC(=O)CBr Amb25257938 [1,1,0,0,0,0|2,0,0]=4 5541 B7R0.3 CSSCC(=O)CC Amb24584424 [1,1,0,0,0,0|2,0,0]=4 5542 B7R0.3 CSSCC(=O)NC Amb24729863 [1,1,0,0,0,0|2,0,0]=4 5543 B7R0.3 C\C(\C=O)=C/CCBr Amb25783964 [1,1,0,0,0,0|1,0,1]=4 5544 B7R0.3 C\C(\C=O)=C/NCC Amb25799956 [1,1,0,0,0,0|1,0,1]=4 5545 B7R0.3 C\C(\C=O)=C\NCC Amb24745542 [1,1,0,0,0,0|1,0,1]=4 5546 B7R0.3 C\C(\C=O)=C\OCC Amb18641771 [1,1,0,0,0,0|1,0,1]=4 5547 B7R0.3 C\C(\CC)=C/CCC Amb22732739 [1,1,0,0,0,0|1,0,1]=4 5548 B7R0.3 C\C(\CCCC)=C/C Amb22731328 [1,1,0,0,0,0|1,0,0]=3 5549 B7R0.3 C\C=C(\C)/CCCCl Amb25082428 [1,1,0,0,0,0|2,0,0]=4 5550 B7R0.3 C\C=C(\C)/CCCO Amb25080181 [1,1,0,0,0,0|2,0,0]=4 5551 B7R0.3 C\C=C(\Cl)/CCCO Amb25344045 [1,1,0,0,0,0|2,0,0]=4 5552 B7R0.3 C\C=C/CC(=O)CC Amb25357896 [1,1,0,0,0,0|0,0,2]=4 5553 B7R0.3 C\C=C\CC(=O)CC Amb24590969 [1,1,0,0,0,0|0,0,2]=4 5554 B7R0.3 C\C=C\CC(=O)CCl Amb24349552 [1,1,0,0,0,0|0,0,2]=4 5555 B7R0.3 C\C=C\CC(=O)NC Amb25026166 [1,1,0,0,0,0|0,0,2]=4 5556 B7R0.3 ClCCCC(=O)CC Amb17593423 [1,1,0,0,0,0|1,0,0]=3 5557 B7R0.3 ClCCNC(=O)CC Amb17103188 [1,1,0,0,0,0|2,0,0]=4 5558 B7R0.3 NCC(=O)CCCO Amb24471240 [1,1,0,0,0,0|1,0,0]=3 5559 B7R0.3 NCC(=O)NCCN Amb18292756 [1,1,0,0,0,0|2,0,0]=4 5560 B7R0.3 NCC(=O)NCCO Amb21958723 [1,1,0,0,0,0|2,0,0]=4 5561 B7R0.3 NCC(=O)OCCBr Amb18522183 [1,1,0,0,0,0|2,0,0]=4 5562 B7R0.3 NCC(=O)OCCN Amb25831229 [1,1,0,0,0,0|2,0,0]=4 5563 B7R0.3 NCC(=O)SCCN Amb24579413 [1,1,0,0,0,0|2,0,0]=4 5564 B7R0.3 NCCCC(=O)NN Amb18061734 [1,1,0,0,0,0|2,0,0]=4 5565 B7R0.3 NCCNC(=O)CC Amb1137732 [1,1,0,0,0,0|2,0,0]=4 5566 B7R0.3 NCCNC(=O)CCl Amb18290714 [1,1,0,0,0,0|2,0,0]=4 5567 B7R0.3 NCCNC(=O)CO Amb18973279 [1,1,0,0,0,0|2,0,0]=4 5568 B7R0.3 NNC(=O)CCCS Amb24706258 [1,1,0,0,0,0|2,0,0]=4 5569 B7R0.3 O=C(CBr)NCCBr Amb24104073 [1,1,0,0,0,0|2,0,0]=4 5570 B7R0.3 O=C(CBr)NCCF Amb22896639 [1,1,0,0,0,0|2,0,0]=4 5571 B7R0.3 O=C(CCCCl)CCl Amb22395285 [1,1,0,0,0,0|1,0,0]=3 5572 B7R0.3 O=C(CCl)CCCBr Amb22395325 [1,1,0,0,0,0|1,0,0]=3 5573 B7R0.3 O=C(CCl)NCCCl Amb22261518 [1,1,0,0,0,0|2,0,0]=4 5574 B7R0.3 O=C(CCl)NCCS Amb25350349 [1,1,0,0,0,0|2,0,0]=4 5575 B7R0.3 O=C(CCl)OCCBr Amb24753748 [1,1,0,0,0,0|2,0,0]=4 5576 B7R0.3 O=C(CCl)OCCF Amb24481440 [1,1,0,0,0,0|2,0,0]=4 5577 B7R0.3 O=C(CCl)SCCBr Amb24740244 [1,1,0,0,0,0|2,0,0]=4 5578 B7R0.3 O=C(CF)NCCCl Amb24505240 [1,1,0,0,0,0|2,0,0]=4 5579 B7R0.3 O=C(CF)OCCCl Amb25112007 [1,1,0,0,0,0|2,0,0]=4 5580 B7R0.3 O=C(CS)OCCCl Amb24409565 [1,1,0,0,0,0|2,0,0]=4 5581 B7R0.3 O=CC(=O)CCCCl Amb24385284 [1,1,0,0,0,0|1,0,1]=4 5582 B7R0.3 OCC(=O)CCCCl Amb24481374 [1,1,0,0,0,0|1,0,0]=3 5583 B7R0.3 OCCNC(=O)CBr Amb17325573 [1,1,0,0,0,0|2,0,0]=4 5584 B7R0.3 OCCOC(=O)CCl Amb25173827 [1,1,0,0,0,0|2,0,0]=4 5585 B7R0.5 CC#CC(C)C(C)=O Amb24481199 [1,1,0,0,0,0|0,0,2]=4 5586 B7R0.5 CC(=C)C(F)CCO Amb25189994 [1,1,0,0,0,0|2,0,0]=4 5587 B7R0.5 CC(=C)C(O)CCCl Amb25746696 [1,1,0,0,0,0|2,0,0]=4 5588 B7R0.5 CC(=C)C(O)CCO Amb25781203 [1,1,0,0,0,0|2,0,0]=4 5589 B7R0.5 CC(=O)C(=C)CCO Amb25831249 [1,1,0,0,0,0|1,0,1]=4 5590 B7R0.5 CC(=O)C(=C)COC Amb25796652 [1,1,0,0,0,0|1,0,1]=4 5591 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [1,1,0,0,0,0|1,0,1]=4 5592 B7R0.5 CC(=O)C(=O)COC Amb24694271 [1,1,0,0,0,0|1,0,1]=4 5593 B7R0.5 CC(=O)C(=O)CSC Amb24623163 [1,1,0,0,0,0|1,0,1]=4 5594 B7R0.5 CC(=O)C(Cl)CC#N Amb18124339 [1,1,0,0,0,0|1,0,1]=4 5595 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,1,0,0,0,0|1,0,1]=4 5596 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [1,1,0,0,0,0|1,0,0]=3 5597 B7R0.5 CC(=O)C(F)CC=C Amb19889753 [1,1,0,0,0,0|0,0,2]=4 5598 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,1,0,0,0,0|1,0,0]=3 5599 B7R0.5 CC(=O)C(O)CC#N Amb24463934 [1,1,0,0,0,0|1,0,1]=4 5600 B7R0.5 CC(=O)C(O)CCS Amb24516694 [1,1,0,0,0,0|1,0,0]=3 5601 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,1,0,0,0,0|1,0,0]=3 5602 B7R0.5 CC(=O)N(Br)CCN Amb24424501 [1,1,0,0,0,0|2,0,0]=4 5603 B7R0.5 CC(=O)N(C)CCS Amb25335665 [1,1,0,0,0,0|2,0,0]=4 5604 B7R0.5 CC(=O)N(N)CCO Amb18641953 [1,1,0,0,0,0|2,0,0]=4 5605 B7R0.5 CC(=O)[C@@H](O)CC=O Amb25839860 [1,1,0,0,0,0|1,0,1]=4 5606 B7R0.5 CC(=O)[C@H](O)CC=C Amb24662420 [1,1,0,0,0,0|0,0,2]=4 5607 B7R0.5 CC(=O)\C(\Br)=C\CC Amb25205445 [1,1,0,0,0,0|0,0,2]=4 5608 B7R0.5 CC(=O)\C(\F)=C/CC Amb24565632 [1,1,0,0,0,0|0,0,2]=4 5609 B7R0.5 CC(Br)C(Br)CCC Amb22732685 [1,1,0,0,0,0|1,0,1]=4 5610 B7R0.5 CC(Br)C(F)CCC Amb24738916 [1,1,0,0,0,0|1,0,1]=4 5611 B7R0.5 CC(C(=O)C)CCO Amb13881368 [1,1,0,0,0,0|1,0,0]=3 5612 B7R0.5 CC(C(=O)O)CNC Amb13952364 [1,1,0,0,0,0|2,0,0]=4 5613 B7R0.5 CC(C)C(Br)CCC Amb18184742 [1,1,0,0,0,0|1,0,1]=4 5614 B7R0.5 CC(C)[C@@H](O)CCC Amb25043106 [1,1,0,0,0,0|1,0,1]=4 5615 B7R0.5 CC(C)[C@H](O)CCC Amb25693041 [1,1,0,0,0,0|1,0,1]=4 5616 B7R0.5 CC(CC=C)C(C)=O Amb19373098 [1,1,0,0,0,0|0,0,2]=4 5617 B7R0.5 CC(CC=O)C(C)=O Amb18641772 [1,1,0,0,0,0|1,0,1]=4 5618 B7R0.5 CC(CCBr)C(=O)Cl Amb25798925 [1,1,0,0,0,0|2,0,0]=4 5619 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,1,0,0,0,0|2,0,0]=4 5620 B7R0.5 CC(CCCl)C(=O)F Amb25839945 [1,1,0,0,0,0|2,0,0]=4 5621 B7R0.5 CC(CCCl)C(C)=C Amb25757706 [1,1,0,0,0,0|2,0,0]=4 5622 B7R0.5 CC(CCF)C(O)=O Amb24678386 [1,1,0,0,0,0|2,0,0]=4 5623 B7R0.5 CC(CCN)C(C)=O Amb18251071 [1,1,0,0,0,0|1,0,0]=3 5624 B7R0.5 CC(CCN)C(N)=O Amb18641900 [1,1,0,0,0,0|2,0,0]=4 5625 B7R0.5 CC(CCN)C(O)=O Amb20667970 [1,1,0,0,0,0|2,0,0]=4 5626 B7R0.5 CC(CCN)S(C)=O Amb20668090 [1,1,0,0,0,0|2,0,0]=4 5627 B7R0.5 CC(CCO)C(O)=O Amb18641949 [1,1,0,0,0,0|2,0,0]=4 5628 B7R0.5 CC(CCS)C(O)=O Amb25133689 [1,1,0,0,0,0|2,0,0]=4 5629 B7R0.5 CC(F)C(Br)CCC Amb24608180 [1,1,0,0,0,0|1,0,1]=4 5630 B7R0.5 CC(O)C(Cl)CCC Amb25700952 [1,1,0,0,0,0|0,0,2]=4 5631 B7R0.5 CC(O)C(N)CCC Amb24656798 [1,1,0,0,0,0|0,0,2]=4 5632 B7R0.5 CCCC(=C)C(=O)Cl Amb25081936 [1,1,0,0,0,0|1,0,1]=4 5633 B7R0.5 CCCC(=C)C(N)=O Amb25189878 [1,1,0,0,0,0|1,0,1]=4 5634 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [1,1,0,0,0,0|1,0,1]=4 5635 B7R0.5 CCCC(=O)C(=O)Cl Amb24690783 [1,1,0,0,0,0|1,0,1]=4 5636 B7R0.5 CCCC(=O)C(N)=O Amb24473081 [1,1,0,0,0,0|1,0,1]=4 5637 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [1,1,0,0,0,0|1,0,1]=4 5638 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [1,1,0,0,0,0|1,0,1]=4 5639 B7R0.5 CCCC(Br)C(=O)Br Amb24369503 [1,1,0,0,0,0|1,0,0]=3 5640 B7R0.5 CCCC(Br)C(N)=S Amb25805593 [1,1,0,0,0,0|1,1,0]=4 5641 B7R0.5 CCCC(Br)[N+]([O-])=O Amb17949822 [1,1,0,0,0,0|2,0,0]=4 5642 B7R0.5 CCCC(C(=O)Cl)Br Amb17569837 [1,1,0,0,0,0|1,0,0]=3 5643 B7R0.5 CCCC(C(=O)O)Cl Amb17593470 [1,1,0,0,0,0|1,0,0]=3 5644 B7R0.5 CCCC(C(=O)O)O Amb2582532 [1,1,0,0,0,0|1,0,0]=3 5645 B7R0.5 CCCC(C)C(C)=C Amb22730210 [1,1,0,0,0,0|1,0,0]=3 5646 B7R0.5 CCCC(C)C(C)Br Amb18184253 [1,1,0,0,0,0|1,0,1]=4 5647 B7R0.5 CCCC(C)C(C)Cl Amb25074279 [1,1,0,0,0,0|1,0,1]=4 5648 B7R0.5 CCCC(C)C(C)N Amb18289572 [1,1,0,0,0,0|1,0,1]=4 5649 B7R0.5 CCCC(C)C(N)=S Amb25138492 [1,1,0,0,0,0|1,1,0]=4 5650 B7R0.5 CCCC(C)N(C)C Amb25761134 [1,1,0,0,0,0|2,0,0]=4 5651 B7R0.5 CCCC(C)N(C)N Amb24732766 [1,1,0,0,0,0|2,0,0]=4 5652 B7R0.5 CCCC(C)[N+]([O-])=O Amb17940330 [1,1,0,0,0,0|2,0,0]=4 5653 B7R0.5 CCCC(Cl)C(N)=O Amb25024550 [1,1,0,0,0,0|1,0,0]=3 5654 B7R0.5 CCCC(Cl)S(C)=O Amb25101399 [1,1,0,0,0,0|1,0,0]=3 5655 B7R0.5 CCCC(F)C(O)=O Amb25842008 [1,1,0,0,0,0|1,0,0]=3 5656 B7R0.5 CCCC(N)C(=O)S Amb25378817 [1,1,0,0,0,0|1,0,0]=3 5657 B7R0.5 CCCC(N)C(C)=C Amb24643425 [1,1,0,0,0,0|1,0,0]=3 5658 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,1,0,0,0,0|1,0,0]=3 5659 B7R0.5 CCCC(O)C(=C)Cl Amb25346262 [1,1,0,0,0,0|1,0,1]=4 5660 B7R0.5 CCCC(O)C(C)=C Amb25141736 [1,1,0,0,0,0|1,0,0]=3 5661 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,1,0,0,0,0|0,0,0]=2 5662 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,1,0,0,0,0|1,0,0]=3 5663 B7R0.5 CCCC(O)C([O-])=O Amb22731263 [1,1,0,0,0,0|1,0,0]=3 5664 B7R0.5 CCCC(O)P(O)=O Amb25143218 [1,1,0,0,0,0|2,0,0]=4 5665 B7R0.5 CCCC(S)C(C)=O Amb24689502 [1,1,0,0,0,0|0,0,0]=2 5666 B7R0.5 CCCC(S)C(O)=O Amb18124440 [1,1,0,0,0,0|1,0,0]=3 5667 B7R0.5 CCCN(C)C(C)=N Amb25235167 [1,1,0,0,0,0|2,0,0]=4 5668 B7R0.5 CCCN(C)C(C)=O Amb24451102 [1,1,0,0,0,0|1,0,0]=3 5669 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [1,1,0,0,0,0|0,0,0]=2 5670 B7R0.5 CCC[C@@H](C)C(N)=O Amb25257881 [1,1,0,0,0,0|1,0,0]=3 5671 B7R0.5 CCC[C@@H](C)[C@@H](C)N Amb25843225 [1,1,0,0,0,0|1,0,1]=4 5672 B7R0.5 CCC[C@@H](C)[C@H](C)N Amb24392737 [1,1,0,0,0,0|1,0,1]=4 5673 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,1,0,0,0,0|1,0,0]=3 5674 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,1,0,0,0,0|1,0,0]=3 5675 B7R0.5 CCC[C@@H](O)C(C)=O Amb24432580 [1,1,0,0,0,0|0,0,0]=2 5676 B7R0.5 CCC[C@@H](O)C(O)=O Amb22746731 [1,1,0,0,0,0|1,0,0]=3 5677 B7R0.5 CCC[C@H](C)C(C)O Amb25662135 [1,1,0,0,0,0|0,0,2]=4 5678 B7R0.5 CCC[C@H](C)C(N)=O Amb25305606 [1,1,0,0,0,0|1,0,0]=3 5679 B7R0.5 CCC[C@H](C)[C@H](C)N Amb24460677 [1,1,0,0,0,0|1,0,1]=4 5680 B7R0.5 CCC[C@H](F)C(O)=O Amb24657412 [1,1,0,0,0,0|1,0,0]=3 5681 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,1,0,0,0,0|0,0,0]=2 5682 B7R0.5 CCC[C@H](O)C(N)=O Amb25082239 [1,1,0,0,0,0|1,0,0]=3 5683 B7R0.5 CCC[C@H](O)C(O)=O Amb22226514 [1,1,0,0,0,0|1,0,0]=3 5684 B7R0.5 CCNC(=O)C(=O)C Amb17399798 [1,1,0,0,0,0|1,0,1]=4 5685 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,1,0,0,0,0|2,0,0]=4 5686 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [1,1,0,0,0,0|2,0,0]=4 5687 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,1,0,0,0,0|2,0,0]=4 5688 B7R0.5 CCOC(O)C(C)=O Amb25189063 [1,1,0,0,0,0|1,0,0]=3 5689 B7R0.5 CCOC(O)C(O)=O Amb24680848 [1,1,0,0,0,0|2,0,0]=4 5690 B7R0.5 CCON(C)C(C)=O Amb25296888 [1,1,0,0,0,0|2,0,0]=4 5691 B7R0.5 CCO[13C](=O)C(C)=O Amb22056123 [1,1,0,0,0,0|1,0,1]=4 5692 B7R0.5 CCO[C@@H](O)C(C)=O Amb25092956 [1,1,0,0,0,0|1,0,0]=3 5693 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [1,1,0,0,0,0|2,0,0]=4 5694 B7R0.5 CCSC(O)C(O)=O Amb24444218 [1,1,0,0,0,0|2,0,0]=4 5695 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [1,1,0,0,0,0|2,0,0]=4 5696 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [1,1,0,0,0,0|2,0,0]=4 5697 B7R0.5 CN(C(=O)C)CCN Amb17046786 [1,1,0,0,0,0|2,0,0]=4 5698 B7R0.5 CNCC(C(=O)O)N Amb10071505 [1,1,0,0,0,0|2,0,0]=4 5699 B7R0.5 CNCC(C(=O)O)N Amb10845350 [1,1,0,0,0,0|2,0,0]=4 5700 B7R0.5 CNCC(C)C(C)=O Amb25340555 [1,1,0,0,0,0|1,0,0]=3 5701 B7R0.5 CNCC(F)C(O)=O Amb24666017 [1,1,0,0,0,0|2,0,0]=4 5702 B7R0.5 CNCC(N)C(N)=O Amb25316352 [1,1,0,0,0,0|2,0,0]=4 5703 B7R0.5 CNCC(O)C(C)=C Amb24716760 [1,1,0,0,0,0|2,0,0]=4 5704 B7R0.5 CNC[C@@H](C(=O)O)N Amb17617148 [1,1,0,0,0,0|2,0,0]=4 5705 B7R0.5 CNC[C@@H](N)C(O)=O Amb19133072 [1,1,0,0,0,0|2,0,0]=4 5706 B7R0.5 CNC[C@@H](N)C(O)=O Amb22746009 [1,1,0,0,0,0|2,0,0]=4 5707 B7R0.5 CNC[C@@H](N)C(O)=O Amb22748835 [1,1,0,0,0,0|2,0,0]=4 5708 B7R0.5 CNC[C@H](N)C(O)=O Amb19892230 [1,1,0,0,0,0|2,0,0]=4 5709 B7R0.5 CNC[C@H](O)C(O)=O Amb25689188 [1,1,0,0,0,0|2,0,0]=4 5710 B7R0.5 COCC(Br)C(C)=O Amb24483184 [1,1,0,0,0,0|1,0,0]=3 5711 B7R0.5 COCC(Br)C(N)=O Amb24740751 [1,1,0,0,0,0|2,0,0]=4 5712 B7R0.5 COCC(C(=O)O)Br Amb17594709 [1,1,0,0,0,0|2,0,0]=4 5713 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [1,1,0,0,0,0|2,0,0]=4 5714 B7R0.5 COCC(C)C(C)=O Amb24683449 [1,1,0,0,0,0|1,0,0]=3 5715 B7R0.5 COCC(Cl)C(C)=O Amb25073897 [1,1,0,0,0,0|1,0,0]=3 5716 B7R0.5 COCC(F)C(O)=O Amb24526772 [1,1,0,0,0,0|2,0,0]=4 5717 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,1,0,0,0,0|2,0,0]=4 5718 B7R0.5 COCC(O)C(C)=O Amb25072841 [1,1,0,0,0,0|1,0,0]=3 5719 B7R0.5 COCC(O)C(O)=O Amb18124273 [1,1,0,0,0,0|2,0,0]=4 5720 B7R0.5 COC[C@@H](N)C(N)=O Amb25211762 [1,1,0,0,0,0|2,0,0]=4 5721 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [1,1,0,0,0,0|2,0,0]=4 5722 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [1,1,0,0,0,0|2,0,0]=4 5723 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [1,1,0,0,0,0|2,0,0]=4 5724 B7R0.5 CSCC(C)C(=O)Cl Amb20247150 [1,1,0,0,0,0|2,0,0]=4 5725 B7R0.5 CSCC(C)C(C)=O Amb25268934 [1,1,0,0,0,0|1,0,0]=3 5726 B7R0.5 CSCC(C)C(N)=O Amb24475326 [1,1,0,0,0,0|2,0,0]=4 5727 B7R0.5 CSCC(C)C(O)=O Amb18967825 [1,1,0,0,0,0|2,0,0]=4 5728 B7R0.5 CSCC(Cl)C(C)=C Amb25123921 [1,1,0,0,0,0|2,0,0]=4 5729 B7R0.5 CSCC(N)C(C)=C Amb25142968 [1,1,0,0,0,0|2,0,0]=4 5730 B7R0.5 CSCC(N)C(N)=O Amb18294390 [1,1,0,0,0,0|2,0,0]=4 5731 B7R0.5 CSCC(O)C(O)=O Amb25131873 [1,1,0,0,0,0|2,0,0]=4 5732 B7R0.5 CSC[C@H](O)C(O)=O Amb24435256 [1,1,0,0,0,0|2,0,0]=4 5733 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [1,1,0,0,0,0|1,0,0]=3 5734 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [1,1,0,0,0,0|2,0,0]=4 5735 B7R0.5 C[C@@H](O)[C@@H](O)CCC Amb25686304 [1,1,0,0,0,0|0,0,2]=4 5736 B7R0.5 C[C@@H](O)[C@H](N)CCC Amb25328641 [1,1,0,0,0,0|0,0,2]=4 5737 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [1,1,0,0,0,0|1,0,0]=3 5738 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [1,1,0,0,0,0|2,0,0]=4 5739 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [1,1,0,0,0,0|2,0,0]=4 5740 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [1,1,0,0,0,0|2,0,0]=4 5741 B7R0.5 C[C@H](O)[C@@H](Cl)CCC Amb25111275 [1,1,0,0,0,0|0,0,2]=4 5742 B7R0.5 C[C@H](O)[C@H](N)CCC Amb24604367 [1,1,0,0,0,0|0,0,2]=4 5743 B7R0.5 C[C@H](O)[C@H](O)CCC Amb24671438 [1,1,0,0,0,0|0,0,2]=4 5744 B7R0.5 C[Se]C[C@@H](C(=O)O)N Amb10601626 [1,1,0,0,0,0|2,0,0]=4 5745 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22350259 [1,1,0,0,0,0|2,0,0]=4 5746 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22745692 [1,1,0,0,0,0|2,0,0]=4 5747 B7R0.5 C\C(=C/CC)\C(C)=O Amb25067970 [1,1,0,0,0,0|0,0,2]=4 5748 B7R0.5 C\C(=C\CC)\C(C)=O Amb24575271 [1,1,0,0,0,0|0,0,2]=4 5749 B7R0.5 C\C=C/C(O)C(C)=O Amb24526785 [1,1,0,0,0,0|0,0,2]=4 5750 B7R0.5 C\C=C\[C@H](O)C(C)=O Amb25287343 [1,1,0,0,0,0|0,0,2]=4 5751 B7R0.5 NC(=O)C(Br)CCBr Amb25174083 [1,1,0,0,0,0|2,0,0]=4 5752 B7R0.5 NC(=O)C(O)CCO Amb25703294 [1,1,0,0,0,0|2,0,0]=4 5753 B7R0.5 NC(=O)C(S)CCO Amb24525295 [1,1,0,0,0,0|2,0,0]=4 5754 B7R0.5 NC(C(=O)O)CCBr Amb10576584 [1,1,0,0,0,0|2,0,0]=4 5755 B7R0.5 NC(CCBr)C(O)=O Amb21858417 [1,1,0,0,0,0|2,0,0]=4 5756 B7R0.5 NC(CCF)C(N)=O Amb24391278 [1,1,0,0,0,0|2,0,0]=4 5757 B7R0.5 NC(CCI)C(O)=O Amb25339674 [1,1,0,0,0,0|2,0,0]=4 5758 B7R0.5 NC(CCO)C(N)=O Amb24481392 [1,1,0,0,0,0|2,0,0]=4 5759 B7R0.5 NC(CCS)C(N)=O Amb24599383 [1,1,0,0,0,0|2,0,0]=4 5760 B7R0.5 NC(CCS)C(O)=O Amb19267093 [1,1,0,0,0,0|2,0,0]=4 5761 B7R0.5 NCCC(C(=O)O)F Amb10838221 [1,1,0,0,0,0|2,0,0]=4 5762 B7R0.5 NCCC(C(=O)O)O Amb16232090 [1,1,0,0,0,0|2,0,0]=4 5763 B7R0.5 NCCC(Cl)C(O)=O Amb18124502 [1,1,0,0,0,0|2,0,0]=4 5764 B7R0.5 NCCC(F)C(O)=O Amb22229524 [1,1,0,0,0,0|2,0,0]=4 5765 B7R0.5 NCCC(N)C(N)=O Amb24634873 [1,1,0,0,0,0|2,0,0]=4 5766 B7R0.5 NCCC(N)C(O)=O Amb17678762 [1,1,0,0,0,0|2,0,0]=4 5767 B7R0.5 NCCC(N)C(O)=O Amb22348212 [1,1,0,0,0,0|2,0,0]=4 5768 B7R0.5 NCCC(S)C(O)=O Amb25083375 [1,1,0,0,0,0|2,0,0]=4 5769 B7R0.5 NCC[C@@H](Cl)C(O)=O Amb24481492 [1,1,0,0,0,0|2,0,0]=4 5770 B7R0.5 NCC[C@@H](F)C(O)=O Amb24055858 [1,1,0,0,0,0|2,0,0]=4 5771 B7R0.5 NCC[C@@H](N)C(O)=O Amb22750574 [1,1,0,0,0,0|2,0,0]=4 5772 B7R0.5 NCC[C@@H](N)C(O)=O Amb23438994 [1,1,0,0,0,0|2,0,0]=4 5773 B7R0.5 NCC[C@@H](O)C(O)=O Amb22225364 [1,1,0,0,0,0|2,0,0]=4 5774 B7R0.5 NCC[C@@H](O)C(O)=O Amb22748225 [1,1,0,0,0,0|2,0,0]=4 5775 B7R0.5 NCC[C@H](F)C(O)=O Amb24055857 [1,1,0,0,0,0|2,0,0]=4 5776 B7R0.5 NCC[C@H](N)C(O)=O Amb22886961 [1,1,0,0,0,0|2,0,0]=4 5777 B7R0.5 N[C@@H](C(=O)O)CCN Amb16183852 [1,1,0,0,0,0|2,0,0]=4 5778 B7R0.5 N[C@@H](CCBr)C(O)=O Amb22748283 [1,1,0,0,0,0|2,0,0]=4 5779 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [1,1,0,0,0,0|2,0,0]=4 5780 B7R0.5 N[C@H](C(=O)O)CCN Amb16183862 [1,1,0,0,0,0|2,0,0]=4 5781 B7R0.5 N[C@H](CCS)C(O)=O Amb22230515 [1,1,0,0,0,0|2,0,0]=4 5782 B7R0.5 O=C(Br)C(Br)CCBr Amb22234970 [1,1,0,0,0,0|2,0,0]=4 5783 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [1,1,0,0,0,0|2,0,0]=4 5784 B7R0.5 O=C(Cl)C(Cl)CCCl Amb24423919 [1,1,0,0,0,0|2,0,0]=4 5785 B7R0.5 OC(=O)C(Br)CCBr Amb19889695 [1,1,0,0,0,0|2,0,0]=4 5786 B7R0.5 OC(=O)C(Br)CCF Amb25073798 [1,1,0,0,0,0|2,0,0]=4 5787 B7R0.5 OC(=O)C(Cl)CCCl Amb18126030 [1,1,0,0,0,0|2,0,0]=4 5788 B7R0.5 OC(=O)[C@H](S)CCS Amb24483251 [1,1,0,0,0,0|2,0,0]=4 5789 B7R0.5 OC(CCS)C(O)=O Amb24586206 [1,1,0,0,0,0|2,0,0]=4 5790 B7R0.5 OCCC(O)C(O)=O Amb24689942 [1,1,0,0,0,0|2,0,0]=4 5791 B7R0.5 O[C@@H](CCF)C(O)=O Amb24481351 [1,1,0,0,0,0|2,0,0]=4 5792 B7R0.6 CC(=C)CCC(=O)Cl Amb24640436 [1,1,0,0,0,0|1,0,1]=4 5793 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [1,1,0,0,0,0|1,0,1]=4 5794 B7R0.6 CC(=C)CNC(C)C Amb17308679 [1,1,0,0,0,0|2,0,0]=4 5795 B7R0.6 CC(=CCC(=O)C)C Amb17593170 [1,1,0,0,0,0|0,0,2]=4 5796 B7R0.6 CC(=O)CCB(O)O Amb25095502 [1,1,0,0,0,0|2,0,0]=4 5797 B7R0.6 CC(=O)CCC(=C)Br Amb24690678 [1,1,0,0,0,0|0,0,2]=4 5798 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [1,1,0,0,0,0|1,0,1]=4 5799 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [1,1,0,0,0,0|1,0,1]=4 5800 B7R0.6 CC(=O)CCC(Cl)Cl Amb25724918 [1,1,0,0,0,0|1,0,0]=3 5801 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [1,1,0,0,0,0|1,0,1]=4 5802 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [1,1,0,0,0,0|2,0,0]=4 5803 B7R0.6 CC(=O)CCS(=O)=O Amb25730256 [1,1,0,0,0,0|2,0,0]=4 5804 B7R0.6 CC(=O)CC[N+]([O-])=O Amb18198961 [1,1,0,0,0,0|2,0,0]=4 5805 B7R0.6 CC(=O)CSC(C)=C Amb25809979 [1,1,0,0,0,0|1,0,1]=4 5806 B7R0.6 CC(=O)CSC(C)=N Amb24634756 [1,1,0,0,0,0|1,0,1]=4 5807 B7R0.6 CC(=O)NCC(C)=C Amb25126091 [1,1,0,0,0,0|1,0,1]=4 5808 B7R0.6 CC(=O)NCC(O)O Amb25378443 [1,1,0,0,0,0|2,0,0]=4 5809 B7R0.6 CC(=O)OCC(=C)C Amb16187121 [1,1,0,0,0,0|1,0,1]=4 5810 B7R0.6 CC(=O)OCC(F)Cl Amb25116212 [1,1,0,0,0,0|2,0,0]=4 5811 B7R0.6 CC(=O)OCS(C)=O Amb24667100 [1,1,0,0,0,0|2,0,0]=4 5812 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [1,1,0,0,0,0|1,0,1]=4 5813 B7R0.6 CC(Br)CCC(=O)Cl Amb24483133 [1,1,0,0,0,0|1,0,0]=3 5814 B7R0.6 CC(Br)CCC(C)Cl Amb25216975 [1,1,0,0,0,0|1,0,1]=4 5815 B7R0.6 CC(Br)CCC(N)=O Amb24065438 [1,1,0,0,0,0|1,0,0]=3 5816 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [1,1,0,0,0,0|1,0,0]=3 5817 B7R0.6 CC(Br)CNC(C)=O Amb24727885 [1,1,0,0,0,0|1,0,0]=3 5818 B7R0.6 CC(Br)COC(C)=O Amb25360690 [1,1,0,0,0,0|1,0,0]=3 5819 B7R0.6 CC(Br)\C=C\C(C)=O Amb25334067 [1,1,0,0,0,0|0,0,2]=4 5820 B7R0.6 CC(C)CC=C(C)C Amb22731329 [1,1,0,0,0,0|1,0,1]=4 5821 B7R0.6 CC(C)CCC(C)=C Amb22734286 [1,1,0,0,0,0|1,0,0]=3 5822 B7R0.6 CC(C)CCC(N)=N Amb19890005 [1,1,0,0,0,0|2,0,0]=4 5823 B7R0.6 CC(C)CCN(C)C Amb25761687 [1,1,0,0,0,0|2,0,0]=4 5824 B7R0.6 CC(C)CCN(C)N Amb25344743 [1,1,0,0,0,0|2,0,0]=4 5825 B7R0.6 CC(C)CCS(C)=O Amb24369501 [1,1,0,0,0,0|1,0,0]=3 5826 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [1,1,0,0,0,0|1,0,0]=3 5827 B7R0.6 CC(C)CC[13C]([O-])=O Amb22369748 [1,1,0,0,0,0|1,0,0]=3 5828 B7R0.6 CC(C)CC[N+]([O-])=O Amb17672612 [1,1,0,0,0,0|2,0,0]=4 5829 B7R0.6 CC(C)CC[S+](C)C Amb24581198 [1,1,0,0,0,0|2,0,0]=4 5830 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [1,1,0,0,0,0|2,0,0]=4 5831 B7R0.6 CC(C)NNC(C)=O Amb22233621 [1,1,0,0,0,0|2,0,0]=4 5832 B7R0.6 CC(C)OCC([O-])=O Amb22754781 [1,1,0,0,0,0|2,0,0]=4 5833 B7R0.6 CC(C)ONC(C)=O Amb25091857 [1,1,0,0,0,0|2,0,0]=4 5834 B7R0.6 CC(C)SCC(C)=C Amb25058431 [1,1,0,0,0,0|2,0,0]=4 5835 B7R0.6 CC(C)SCC(C)=O Amb22549127 [1,1,0,0,0,0|1,0,0]=3 5836 B7R0.6 CC(CCC(=O)O)C Amb1153016 [1,1,0,0,0,0|1,0,0]=3 5837 B7R0.6 CC(CCC(=O)O)N Amb17593212 [1,1,0,0,0,0|1,0,0]=3 5838 B7R0.6 CC(CNC(=O)N)C Amb1151241 [1,1,0,0,0,0|2,0,0]=4 5839 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [1,1,0,0,0,0|1,0,0]=3 5840 B7R0.6 CC(Cl)CCC(C)O Amb25136164 [1,1,0,0,0,0|0,0,2]=4 5841 B7R0.6 CC(Cl)CCC(N)=O Amb24469692 [1,1,0,0,0,0|1,0,0]=3 5842 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [1,1,0,0,0,0|1,0,0]=3 5843 B7R0.6 CC(Cl)CCN(C)C Amb25074217 [1,1,0,0,0,0|2,0,0]=4 5844 B7R0.6 CC(Cl)CNC(C)=O Amb25702921 [1,1,0,0,0,0|1,0,0]=3 5845 B7R0.6 CC(Cl)CNC(N)=O Amb25068414 [1,1,0,0,0,0|2,0,0]=4 5846 B7R0.6 CC(Cl)COC(=O)F Amb24470183 [1,1,0,0,0,0|2,0,0]=4 5847 B7R0.6 CC(Cl)COC(C)=O Amb25783984 [1,1,0,0,0,0|1,0,0]=3 5848 B7R0.6 CC(Cl)CSC(=O)Cl Amb24456190 [1,1,0,0,0,0|2,0,0]=4 5849 B7R0.6 CC(Cl)CSC(C)=O Amb24530194 [1,1,0,0,0,0|1,0,0]=3 5850 B7R0.6 CC(Cl)\C=C\C(C)=O Amb25782801 [1,1,0,0,0,0|0,0,2]=4 5851 B7R0.6 CC(F)CCC(O)=O Amb24682772 [1,1,0,0,0,0|1,0,0]=3 5852 B7R0.6 CC(N)CCC(C)=C Amb18641752 [1,1,0,0,0,0|1,0,0]=3 5853 B7R0.6 CC(N)CCC(C)=O Amb24698356 [1,1,0,0,0,0|0,0,0]=2 5854 B7R0.6 CC(N)CCC(N)=O Amb18641901 [1,1,0,0,0,0|1,0,0]=3 5855 B7R0.6 CC(N)CCC(O)=O Amb19515603 [1,1,0,0,0,0|1,0,0]=3 5856 B7R0.6 CC(N)CCS(C)=O Amb19337158 [1,1,0,0,0,0|1,0,0]=3 5857 B7R0.6 CC(N)CCS(C)=O Amb22059582 [1,1,0,0,0,0|1,0,0]=3 5858 B7R0.6 CC(N)CNC(C)=O Amb18631377 [1,1,0,0,0,0|1,0,0]=3 5859 B7R0.6 CC(N)CNC(N)=O Amb18202688 [1,1,0,0,0,0|2,0,0]=4 5860 B7R0.6 CC(NCC(=O)N)C Amb2370772 [1,1,0,0,0,0|2,0,0]=4 5861 B7R0.6 CC(NCC(=O)O)C Amb2372347 [1,1,0,0,0,0|2,0,0]=4 5862 B7R0.6 CC(O)CC=C(C)C Amb24645341 [1,1,0,0,0,0|1,0,1]=4 5863 B7R0.6 CC(O)CCC(C)=C Amb24062974 [1,1,0,0,0,0|1,0,0]=3 5864 B7R0.6 CC(O)CCC(C)=O Amb25829594 [1,1,0,0,0,0|0,0,0]=2 5865 B7R0.6 CC(O)CCC(C)N Amb18641930 [1,1,0,0,0,0|0,0,2]=4 5866 B7R0.6 CC(O)CCC(O)=O Amb18294804 [1,1,0,0,0,0|1,0,0]=3 5867 B7R0.6 CC(O)CCN(C)N Amb24370255 [1,1,0,0,0,0|2,0,0]=4 5868 B7R0.6 CC(O)CN=C(C)N Amb24370924 [1,1,0,0,0,0|2,0,0]=4 5869 B7R0.6 CC(O)CNS(C)=O Amb24536649 [1,1,0,0,0,0|2,0,0]=4 5870 B7R0.6 CC(O)COC(C)=O Amb24056158 [1,1,0,0,0,0|1,0,0]=3 5871 B7R0.6 CC(O)NCC(O)=O Amb25141558 [1,1,0,0,0,0|2,0,0]=4 5872 B7R0.6 CC(O)OCC(C)=C Amb24333382 [1,1,0,0,0,0|2,0,0]=4 5873 B7R0.6 CC(O)\C=C\C(C)=O Amb25334941 [1,1,0,0,0,0|0,0,2]=4 5874 B7R0.6 CC(S)CNC(C)=O Amb24695989 [1,1,0,0,0,0|1,0,0]=3 5875 B7R0.6 CC(SCC(=O)O)C Amb1128460 [1,1,0,0,0,0|2,0,0]=4 5876 B7R0.6 CN(C)CCC(O)=O Amb19888182 [1,1,0,0,0,0|2,0,0]=4 5877 B7R0.6 CN(CCC(=O)C)C Amb1129203 [1,1,0,0,0,0|1,0,0]=3 5878 B7R0.6 CN(CCC(=O)N)C Amb17231825 [1,1,0,0,0,0|2,0,0]=4 5879 B7R0.6 CN(CCC(N)C)C Amb1141214 [1,1,0,0,0,0|2,0,0]=4 5880 B7R0.6 CS(=O)CCC(N)=O Amb24475802 [1,1,0,0,0,0|2,0,0]=4 5881 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [1,1,0,0,0,0|2,0,0]=4 5882 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [1,1,0,0,0,0|2,0,0]=4 5883 B7R0.6 C[C@@H](O)CCC(C)=C Amb22896943 [1,1,0,0,0,0|1,0,0]=3 5884 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [1,1,0,0,0,0|0,0,0]=2 5885 B7R0.6 C[C@@H](O)CCC(C)O Amb25846912 [1,1,0,0,0,0|0,0,2]=4 5886 B7R0.6 C[C@@H](O)CN=C(C)N Amb25026449 [1,1,0,0,0,0|2,0,0]=4 5887 B7R0.6 C[C@@H](O)CNC(C)=O Amb25133822 [1,1,0,0,0,0|1,0,0]=3 5888 B7R0.6 C[C@@H](O)COC(C)=O Amb25832756 [1,1,0,0,0,0|1,0,0]=3 5889 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [1,1,0,0,0,0|1,0,0]=3 5890 B7R0.6 C[C@H](Br)CC[C@@H](C)Br Amb25706509 [1,1,0,0,0,0|1,0,1]=4 5891 B7R0.6 C[C@H](Cl)CC[C@@H](C)Cl Amb24390387 [1,1,0,0,0,0|1,0,1]=4 5892 B7R0.6 C[C@H](Cl)CC[C@H](C)Cl Amb24532115 [1,1,0,0,0,0|1,0,1]=4 5893 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [1,1,0,0,0,0|1,0,0]=3 5894 B7R0.6 C[C@H](O)CNC(N)=O Amb24384732 [1,1,0,0,0,0|2,0,0]=4 5895 B7R0.6 C[C@H](O)CSC(C)=O Amb25256687 [1,1,0,0,0,0|1,0,0]=3 5896 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [1,1,0,0,0,0|2,0,0]=4 5897 B7R0.6 C[S+](C)CCC([O-])=O Amb20247306 [1,1,0,0,0,0|2,0,0]=4 5898 B7R0.6 FC(COC(=O)C)F Amb10839327 [1,1,0,0,0,0|2,0,0]=4 5899 B7R0.6 NC(=O)CCC(F)F Amb25271130 [1,1,0,0,0,0|2,0,0]=4 5900 B7R0.6 O=C(Cl)CCC(Cl)Cl Amb24441999 [1,1,0,0,0,0|2,0,0]=4 5901 B7R0.6 OC(=O)CCC(Cl)Cl Amb25059214 [1,1,0,0,0,0|2,0,0]=4 5902 B7R0.6 OC(=O)CCC(F)F Amb20623135 [1,1,0,0,0,0|2,0,0]=4 5903 B7R0.6 OC(O)CCC(O)=O Amb25762802 [1,1,0,0,0,0|2,0,0]=4 5904 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [1,1,0,0,0,0|1,0,1]=4 5905 B7R0.8 CCCCC(Br)(Br)C Amb15692624 [1,1,0,0,0,0|1,0,1]=4 5906 B7R0.8 CCCCC(C)(C)Br Amb24401418 [1,1,0,0,0,0|1,0,1]=4 5907 B7R0.8 CCCCC(C)(C)C Amb22045826 [1,1,0,0,0,0|1,0,1]=4 5908 B7R0.8 CCCCC(C)(C)C Amb22228234 [1,1,0,0,0,0|1,0,1]=4 5909 B7R0.8 CCCCC(C)(C)Cl Amb22052659 [1,1,0,0,0,0|1,0,1]=4 5910 B7R0.8 CCCCC(C)(C)N Amb18993512 [1,1,0,0,0,0|1,0,1]=4 5911 B7R0.8 CCCCC(C)(F)F Amb24667247 [1,1,0,0,0,0|1,0,1]=4 5912 B7R0.8 CCCCP(O)(O)=O Amb22053921 [1,1,0,0,0,0|2,0,0]=4 5913 B7R0.8 CCCCS(=O)(=O)Br Amb23555505 [1,1,0,0,0,0|2,0,0]=4 5914 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [1,1,0,0,0,0|2,0,0]=4 5915 B7R0.8 CCCCS(=O)(=O)N Amb1132715 [1,1,0,0,0,0|2,0,0]=4 5916 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [1,1,0,0,0,0|2,0,0]=4 5917 B7R0.8 CCCCS(C)(=O)=O Amb24643027 [1,1,0,0,0,0|1,0,0]=3 5918 B7R0.8 CCCCS(O)(=O)=O Amb22269868 [1,1,0,0,0,0|2,0,0]=4 5919 B7R0.8 CCCC[N+](C)(C)C Amb22360338 [1,1,0,0,0,0|2,0,0]=4 5920 B7R0.8 CCCC[Si](C)(C)C Amb22360219 [1,1,0,0,0,0|1,1,0]=4 5921 B7R0.8 CCCC[Si](C)(C)F Amb19883807 [1,1,0,0,0,0|1,1,0]=4 5922 B7R0.8 CCCC[Si](C)(Cl)Cl Amb19893670 [1,1,0,0,0,0|1,1,0]=4 5923 B7R0.8 CCCC[Sn](C)(C)Cl Amb22730074 [1,1,0,0,0,0|2,0,0]=4 5924 B7R0.8 CCCOP(C)(O)=O Amb24553958 [1,1,0,0,0,0|2,0,0]=4 5925 B7R0.8 CCCOS(C)(=O)=O Amb22388704 [1,1,0,0,0,0|2,0,0]=4 5926 B7R0.8 CCCSS(=O)(=O)C Amb17619610 [1,1,0,0,0,0|2,0,0]=4 5927 B7R0.8 COCCS(C)(=O)=O Amb24476598 [1,1,0,0,0,0|2,0,0]=4 5928 B7R0.8 CP(C)(=O)CCCN Amb24481153 [1,1,0,0,0,0|2,0,0]=4 5929 B7R0.8 CP(O)(=O)CCCO Amb24448096 [1,1,0,0,0,0|2,0,0]=4 5930 B7R0.8 CS(=O)(=O)CCCBr Amb18320185 [1,1,0,0,0,0|2,0,0]=4 5931 B7R0.8 CS(=O)(=O)CCCCl Amb18034011 [1,1,0,0,0,0|2,0,0]=4 5932 B7R0.8 CS(=O)(=O)CCCI Amb20623053 [1,1,0,0,0,0|2,0,0]=4 5933 B7R0.8 CS(=O)(=O)CCCS Amb25092985 [1,1,0,0,0,0|2,0,0]=4 5934 B7R0.8 NCCCS(=O)(=O)C Amb10609368 [1,1,0,0,0,0|2,0,0]=4 5935 B7R0.8 OCCCS(=O)(=O)C Amb10608209 [1,1,0,0,0,0|2,0,0]=4 5936 B7R0.8 [NH3+]CCCS(=O)(=O)C Amb13883038 [1,1,0,0,0,0|2,0,0]=4 5937 B7R0.1 BrCCCCCC=C Amb16234121 [1,1,0,0,0,0|0,0,1]=3 5938 B7R0.1 C#CCCCCC=O Amb25743704 [1,1,0,0,0,0|0,0,1]=3 5939 B7R0.1 C#CCCCCCCl Amb24586504 [1,1,0,0,0,0|0,0,2]=4 5940 B7R0.1 C#CCCCCCF Amb24538507 [1,1,0,0,0,0|0,0,2]=4 5941 B7R0.1 C#CCCCCCN Amb24481464 [1,1,0,0,0,0|0,0,2]=4 5942 B7R0.1 C#CCCOCC=O Amb22896801 [1,1,0,0,0,0|0,0,2]=4 5943 B7R0.1 C=CCCCCC#C Amb22367006 [1,1,0,0,0,0|0,0,2]=4 5944 B7R0.1 C=CCCCCCI Amb24483139 [1,1,0,0,0,0|0,0,1]=3 5945 B7R0.1 C=CCCCCCN Amb18641754 [1,1,0,0,0,0|0,0,1]=3 5946 B7R0.1 C=CCCCCNN Amb25244349 [1,1,0,0,0,0|1,0,1]=4 5947 B7R0.1 C=CCCCCON Amb25781717 [1,1,0,0,0,0|1,0,1]=4 5948 B7R0.1 C=CCCCC[Mg]Br Amb22897457 [1,1,0,0,0,0|1,0,1]=4 5949 B7R0.1 C=CCCCC[Zn]Br Amb22000398 [1,1,0,0,0,0|1,0,1]=4 5950 B7R0.1 C=CCCCNC=O Amb25228418 [1,1,0,0,0,0|0,0,2]=4 5951 B7R0.1 C=CCCNCCCl Amb24529620 [1,1,0,0,0,0|1,0,1]=4 5952 B7R0.1 C=CCCNCCF Amb25811610 [1,1,0,0,0,0|1,0,1]=4 5953 B7R0.1 C=CCCNCCN Amb25699590 [1,1,0,0,0,0|1,0,1]=4 5954 B7R0.1 C=CCCOCCN Amb22059113 [1,1,0,0,0,0|1,0,1]=4 5955 B7R0.1 C=CCNCCCBr Amb25811711 [1,1,0,0,0,0|1,0,1]=4 5956 B7R0.1 C=CCNCCCF Amb25830367 [1,1,0,0,0,0|1,0,1]=4 5957 B7R0.1 C=CCNCCCS Amb25792575 [1,1,0,0,0,0|1,0,1]=4 5958 B7R0.1 C=CCOCCCF Amb22008259 [1,1,0,0,0,0|1,0,1]=4 5959 B7R0.1 C=CCOCCCN Amb25190295 [1,1,0,0,0,0|1,0,1]=4 5960 B7R0.1 C=CCOCCCO Amb25097051 [1,1,0,0,0,0|1,0,1]=4 5961 B7R0.1 C=CCOCCCS Amb25809864 [1,1,0,0,0,0|1,0,1]=4 5962 B7R0.1 C=CCSCCC=O Amb18642815 [1,1,0,0,0,0|0,0,2]=4 5963 B7R0.1 C=CCSCCCF Amb24476606 [1,1,0,0,0,0|1,0,1]=4 5964 B7R0.1 C=COCCCCBr Amb25237502 [1,1,0,0,0,0|1,0,1]=4 5965 B7R0.1 CC#CCCCCN Amb24529557 [1,1,0,0,0,0|0,0,2]=4 5966 B7R0.1 CC#CCCCNC Amb19026206 [1,1,0,0,0,0|0,0,2]=4 5967 B7R0.1 CC#CCCNC=O Amb25836411 [1,1,0,0,0,0|0,0,2]=4 5968 B7R0.1 CC#CCCNCC Amb18312537 [1,1,0,0,0,0|0,0,2]=4 5969 B7R0.1 CC#CCNCCC Amb24543429 [1,1,0,0,0,0|0,0,2]=4 5970 B7R0.1 CC=C=CCCCCl Amb25715820 [1,1,0,0,0,0|0,0,2]=4 5971 B7R0.1 CC=NCCCCN Amb25746482 [1,1,0,0,0,0|1,0,0]=3 5972 B7R0.1 CCC#CCCC=O Amb25046712 [1,1,0,0,0,0|0,0,1]=3 5973 B7R0.1 CCCC#CCC=C Amb22227987 [1,1,0,0,0,0|0,0,2]=4 5974 B7R0.1 CCCC=C=CCO Amb24748543 [1,1,0,0,0,0|0,0,2]=4 5975 B7R0.1 CCCCC#CC=C Amb17673844 [1,1,0,0,0,0|0,0,2]=4 5976 B7R0.1 CCCCC#CC=O Amb17593134 [1,1,0,0,0,0|0,0,1]=3 5977 B7R0.1 CCCCC#CCBr Amb17670640 [1,1,0,0,0,0|0,0,2]=4 5978 B7R0.1 CCCCC=C=CBr Amb24650210 [1,1,0,0,0,0|1,0,1]=4 5979 B7R0.1 CCCCCC#CI Amb17940367 [1,1,0,0,0,0|0,0,2]=4 5980 B7R0.1 CCCCCCC=N Amb24634610 [1,1,0,0,0,0|1,0,0]=3 5981 B7R0.1 CCCCCCCF Amb10840026 [1,1,0,0,0,0|0,0,1]=3 5982 B7R0.1 CCCCCCCP Amb25824639 [1,1,0,0,0,0|0,0,1]=3 5983 B7R0.1 CCCCCCC[Mg+] Amb22351260 [1,1,0,0,0,0|0,0,1]=3 5984 B7R0.1 CCCCCCC[Sn+3] Amb17620886 [1,1,0,0,0,0|0,0,1]=3 5985 B7R0.1 CCCCCCC[Zn+] Amb22336241 [1,1,0,0,0,0|0,0,1]=3 5986 B7R0.1 CCCCCCNO Amb24591654 [1,1,0,0,0,0|0,0,2]=4 5987 B7R0.1 CCCCCCOC Amb2582536 [1,1,0,0,0,0|0,0,1]=3 5988 B7R0.1 CCCCCCON Amb18641933 [1,1,0,0,0,0|0,0,2]=4 5989 B7R0.1 CCCCCCSC Amb22359692 [1,1,0,0,0,0|0,0,1]=3 5990 B7R0.1 CCCCCC[14CH2]O Amb22350258 [1,1,0,0,0,0|0,0,1]=3 5991 B7R0.1 CCCCCC[Hg]Cl Amb22359873 [1,1,0,0,0,0|1,0,1]=4 5992 B7R0.1 CCCCCC[Mg]Br Amb22337740 [1,1,0,0,0,0|1,0,1]=4 5993 B7R0.1 CCCCCC[Mg]Cl Amb22337541 [1,1,0,0,0,0|1,0,1]=4 5994 B7R0.1 CCCCCC[N+]#[C-] Amb2235425 [1,1,0,0,0,0|0,0,2]=4 5995 B7R0.1 CCCCCC[Zn]Br Amb22000389 [1,1,0,0,0,0|1,0,1]=4 5996 B7R0.1 CCCCCN=[N+]=[N-] Amb17939435 [1,1,0,0,0,0|2,0,0]=4 5997 B7R0.1 CCCCCNC=O Amb22360637 [1,1,0,0,0,0|0,0,0]=2 5998 B7R0.1 CCCCCNOC Amb24566046 [1,1,0,0,0,0|1,0,0]=3 5999 B7R0.1 CCCCCOCC Amb22733705 [1,1,0,0,0,0|0,0,1]=3 6000 B7R0.1 CCCCCOCCl Amb24603055 [1,1,0,0,0,0|1,0,0]=3 6001 B7R0.1 CCCCCON=O Amb17939401 [1,1,0,0,0,0|1,0,0]=3 6002 B7R0.1 CCCCCSCC Amb22730787 [1,1,0,0,0,0|0,0,1]=3 6003 B7R0.1 CCCCCSCO Amb24703606 [1,1,0,0,0,0|1,0,0]=3 6004 B7R0.1 CCCCC\C=C\I Amb22641605 [1,1,0,0,0,0|0,0,1]=3 6005 B7R0.1 CCCCNC=NC Amb24481322 [1,1,0,0,0,0|1,0,0]=3 6006 B7R0.1 CCCCNCCBr Amb25092365 [1,1,0,0,0,0|1,0,1]=4 6007 B7R0.1 CCCCNCCCl Amb17334144 [1,1,0,0,0,0|1,0,1]=4 6008 B7R0.1 CCCCNCCI Amb25065614 [1,1,0,0,0,0|1,0,1]=4 6009 B7R0.1 CCCCNCCS Amb22232390 [1,1,0,0,0,0|0,1,1]=4 6010 B7R0.1 CCCCNCSC Amb24427497 [1,1,0,0,0,0|1,0,0]=3 6011 B7R0.1 CCCCNOCC Amb25695162 [1,1,0,0,0,0|1,0,1]=4 6012 B7R0.1 CCCCO/C=C/Cl Amb17689420 [1,1,0,0,0,0|1,0,1]=4 6013 B7R0.1 CCCCOCCI Amb24474438 [1,1,0,0,0,0|1,0,1]=4 6014 B7R0.1 CCCCOCCN Amb21959654 [1,1,0,0,0,0|1,0,1]=4 6015 B7R0.1 CCCCSCCN Amb2182886 [1,1,0,0,0,0|1,0,1]=4 6016 B7R0.1 CCCCSCCN Amb2209242 [1,1,0,0,0,0|1,0,1]=4 6017 B7R0.1 CCCCSCCO Amb1032995 [1,1,0,0,0,0|0,0,2]=4 6018 B7R0.1 CCCC\C=C/C=O Amb25278292 [1,1,0,0,0,0|0,0,1]=3 6019 B7R0.1 CCCC\C=C\C#N Amb18641342 [1,1,0,0,0,0|0,0,2]=4 6020 B7R0.1 CCCC\C=C\C=C Amb22729011 [1,1,0,0,0,0|0,0,2]=4 6021 B7R0.1 CCCC\C=C\CBr Amb24507687 [1,1,0,0,0,0|0,0,1]=3 6022 B7R0.1 CCCC\C=C\CCl Amb24483085 [1,1,0,0,0,0|0,0,1]=3 6023 B7R0.1 CCCC\C=C\CN Amb25175053 [1,1,0,0,0,0|0,0,1]=3 6024 B7R0.1 CCCC\C=C\OC Amb25810618 [1,1,0,0,0,0|0,0,1]=3 6025 B7R0.1 CCCNCCC#C Amb18312420 [1,1,0,0,0,0|0,0,2]=4 6026 B7R0.1 CCCNCCCI Amb25180012 [1,1,0,0,0,0|1,0,1]=4 6027 B7R0.1 CCCNCCCN Amb22292470 [1,1,0,0,0,0|1,0,1]=4 6028 B7R0.1 CCCNCCCO Amb22292465 [1,1,0,0,0,0|0,0,2]=4 6029 B7R0.1 CCCNCCCS Amb24627837 [1,1,0,0,0,0|0,1,1]=4 6030 B7R0.1 CCCNCCN=O Amb22231337 [1,1,0,0,0,0|1,0,0]=3 6031 B7R0.1 CCCNC\C=C\Cl Amb25340126 [1,1,0,0,0,0|1,0,1]=4 6032 B7R0.1 CCCNNCCC Amb22641920 [1,1,0,0,0,0|1,0,1]=4 6033 B7R0.1 CCCOCCC=C Amb25733577 [1,1,0,0,0,0|0,0,1]=3 6034 B7R0.1 CCCOCCCO Amb19962968 [1,1,0,0,0,0|0,0,2]=4 6035 B7R0.1 CCCOCCNN Amb25758309 [1,1,0,0,0,0|2,0,0]=4 6036 B7R0.1 CCCOCCON Amb24456928 [1,1,0,0,0,0|2,0,0]=4 6037 B7R0.1 CCCOCN=C=O Amb25286687 [1,1,0,0,0,0|1,0,1]=4 6038 B7R0.1 CCCOC\C=C\Br Amb25075093 [1,1,0,0,0,0|1,0,1]=4 6039 B7R0.1 CCCO\C=C\C=O Amb25300597 [1,1,0,0,0,0|0,0,2]=4 6040 B7R0.1 CCCSCCCF Amb25741227 [1,1,0,0,0,0|1,0,1]=4 6041 B7R0.1 CCCSCCOC Amb25058036 [1,1,0,0,0,0|1,0,0]=3 6042 B7R0.1 CCCSC\C=C\Cl Amb25690181 [1,1,0,0,0,0|1,0,1]=4 6043 B7R0.1 CCCS\C=C\CO Amb25092280 [1,1,0,0,0,0|1,0,1]=4 6044 B7R0.1 CCC\C=C/CC=O Amb24481514 [1,1,0,0,0,0|0,0,1]=3 6045 B7R0.1 CCC\C=C\CC=O Amb24356718 [1,1,0,0,0,0|0,0,1]=3 6046 B7R0.1 CCC\C=C\CCC Amb16192905 [1,1,0,0,0,0|0,0,2]=4 6047 B7R0.1 CCC\C=C\CNC Amb25849352 [1,1,0,0,0,0|1,0,1]=4 6048 B7R0.1 CCC\C=C\COC Amb25839741 [1,1,0,0,0,0|1,0,1]=4 6049 B7R0.1 CCNCCC=C=C Amb25327429 [1,1,0,0,0,0|1,0,1]=4 6050 B7R0.1 CCNCCCC#C Amb18311079 [1,1,0,0,0,0|0,0,2]=4 6051 B7R0.1 CCNCCCC=O Amb24481334 [1,1,0,0,0,0|0,0,0]=2 6052 B7R0.1 CCNCCCCBr Amb25250968 [1,1,0,0,0,0|1,0,1]=4 6053 B7R0.1 CCNCCCCCl Amb25042682 [1,1,0,0,0,0|1,0,1]=4 6054 B7R0.1 CCNCCCCF Amb25129606 [1,1,0,0,0,0|1,0,1]=4 6055 B7R0.1 CCNCCCN=O Amb22274434 [1,1,0,0,0,0|1,0,0]=3 6056 B7R0.1 CCNC\C=C\CO Amb24605921 [1,1,0,0,0,0|1,0,1]=4 6057 B7R0.1 CCOCCCC#C Amb25700120 [1,1,0,0,0,0|0,0,2]=4 6058 B7R0.1 CCOCCCCCl Amb20242741 [1,1,0,0,0,0|1,0,1]=4 6059 B7R0.1 CCOCCCCI Amb25097177 [1,1,0,0,0,0|1,0,1]=4 6060 B7R0.1 CCOCCCCO Amb19148112 [1,1,0,0,0,0|0,0,2]=4 6061 B7R0.1 CCOCCCCS Amb25129585 [1,1,0,0,0,0|0,1,1]=4 6062 B7R0.1 CCOCCCON Amb18061683 [1,1,0,0,0,0|2,0,0]=4 6063 B7R0.1 CCOCCCSC Amb25143651 [1,1,0,0,0,0|1,0,0]=3 6064 B7R0.1 CCOCCNC=O Amb24713535 [1,1,0,0,0,0|1,0,0]=3 6065 B7R0.1 CCOCCOC=C Amb17674189 [1,1,0,0,0,0|1,0,1]=4 6066 B7R0.1 CCOCCOCCl Amb24410742 [1,1,0,0,0,0|2,0,0]=4 6067 B7R0.1 CCOC\C=C\C=O Amb24743396 [1,1,0,0,0,0|0,0,2]=4 6068 B7R0.1 CCOC\C=C\CCl Amb24665371 [1,1,0,0,0,0|1,0,1]=4 6069 B7R0.1 CCOC\C=C\CN Amb24366343 [1,1,0,0,0,0|1,0,1]=4 6070 B7R0.1 CCOC\C=C\CO Amb25221278 [1,1,0,0,0,0|1,0,1]=4 6071 B7R0.1 CCONCCC=C Amb25350070 [1,1,0,0,0,0|1,0,1]=4 6072 B7R0.1 CCONCCSC Amb25726212 [1,1,0,0,0,0|2,0,0]=4 6073 B7R0.1 CCPCCNCC Amb25185102 [1,1,0,0,0,0|1,0,1]=4 6074 B7R0.1 CCSCCC=NN Amb24476601 [1,1,0,0,0,0|2,0,0]=4 6075 B7R0.1 CCSCCCCCl Amb18796695 [1,1,0,0,0,0|1,0,1]=4 6076 B7R0.1 CCSCCCCF Amb25104763 [1,1,0,0,0,0|1,0,1]=4 6077 B7R0.1 CCSCCCNC Amb25044529 [1,1,0,0,0,0|1,0,0]=3 6078 B7R0.1 CCSCCCOC Amb24421462 [1,1,0,0,0,0|1,0,0]=3 6079 B7R0.1 CCSCCN=C=O Amb25110059 [1,1,0,0,0,0|1,0,1]=4 6080 B7R0.1 CCSCCOC=C Amb25720739 [1,1,0,0,0,0|1,0,1]=4 6081 B7R0.1 CCSCCOCC Amb25821568 [1,1,0,0,0,0|1,0,1]=4 6082 B7R0.1 CCSCCOCCl Amb25697750 [1,1,0,0,0,0|2,0,0]=4 6083 B7R0.1 CCSC\C=C\CCl Amb24695245 [1,1,0,0,0,0|1,0,1]=4 6084 B7R0.1 CCSC\C=C\CN Amb25241426 [1,1,0,0,0,0|1,0,1]=4 6085 B7R0.1 CCSC\C=C\CO Amb24734797 [1,1,0,0,0,0|1,0,1]=4 6086 B7R0.1 CCSC\C=C\CS Amb25107944 [1,1,0,0,0,0|1,0,1]=4 6087 B7R0.1 CC\C=C/CCCN Amb25809455 [1,1,0,0,0,0|1,0,1]=4 6088 B7R0.1 CC\C=C/CCCO Amb22053865 [1,1,0,0,0,0|1,0,1]=4 6089 B7R0.1 CC\C=C\CCCC Amb19930202 [1,1,0,0,0,0|0,0,1]=3 6090 B7R0.1 CC\C=C\CCCN Amb24576334 [1,1,0,0,0,0|1,0,1]=4 6091 B7R0.1 CC\C=C\CCCO Amb25287379 [1,1,0,0,0,0|1,0,1]=4 6092 B7R0.1 CC\C=C\CCNC Amb18641744 [1,1,0,0,0,0|1,0,1]=4 6093 B7R0.1 CN=NCNCCC Amb25326841 [1,1,0,0,0,0|2,0,0]=4 6094 B7R0.1 CNCCCC=C=C Amb25843272 [1,1,0,0,0,0|1,0,1]=4 6095 B7R0.1 CNCCCCC#C Amb24438101 [1,1,0,0,0,0|0,0,2]=4 6096 B7R0.1 CNCCCCC#N Amb18307043 [1,1,0,0,0,0|1,0,1]=4 6097 B7R0.1 CNCCCCC=C Amb19886674 [1,1,0,0,0,0|0,0,1]=3 6098 B7R0.1 CNCCCCC=C Amb22495849 [1,1,0,0,0,0|0,0,1]=3 6099 B7R0.1 CNCCCCCBr Amb25681456 [1,1,0,0,0,0|1,0,0]=3 6100 B7R0.1 CNCCCCCN Amb23448496 [1,1,0,0,0,0|1,0,0]=3 6101 B7R0.1 CNCCCCNC Amb19374448 [1,1,0,0,0,0|1,0,0]=3 6102 B7R0.1 CNCCCCOC Amb17569912 [1,1,0,0,0,0|1,0,0]=3 6103 B7R0.1 CNCCCOC=O Amb24505269 [1,1,0,0,0,0|1,0,0]=3 6104 B7R0.1 CNCCNCC=C Amb24582376 [1,1,0,0,0,0|1,0,1]=4 6105 B7R0.1 CNCCNCCBr Amb24483284 [1,1,0,0,0,0|2,0,0]=4 6106 B7R0.1 CNCCNCCN Amb18641939 [1,1,0,0,0,0|2,0,0]=4 6107 B7R0.1 CNCCNN=CC Amb24529624 [1,1,0,0,0,0|2,0,0]=4 6108 B7R0.1 CNCCOCC=C Amb25764665 [1,1,0,0,0,0|1,0,1]=4 6109 B7R0.1 CNCCOCCCl Amb25708208 [1,1,0,0,0,0|2,0,0]=4 6110 B7R0.1 CNCCOCCO Amb24444485 [1,1,0,0,0,0|2,0,0]=4 6111 B7R0.1 CNCCSCOC Amb25304713 [1,1,0,0,0,0|2,0,0]=4 6112 B7R0.1 COCC#CCC=O Amb24481553 [1,1,0,0,0,0|0,0,2]=4 6113 B7R0.1 COCCCCC#C Amb25191860 [1,1,0,0,0,0|0,0,2]=4 6114 B7R0.1 COCCCCC#N Amb13951615 [1,1,0,0,0,0|1,0,1]=4 6115 B7R0.1 COCCCCCBr Amb18182548 [1,1,0,0,0,0|1,0,0]=3 6116 B7R0.1 COCCCCCO Amb19374978 [1,1,0,0,0,0|1,0,0]=3 6117 B7R0.1 COCCCCCS Amb25138209 [1,1,0,0,0,0|1,0,0]=3 6118 B7R0.1 COCCCCON Amb25357703 [1,1,0,0,0,0|2,0,0]=4 6119 B7R0.1 COCCCNOC Amb25730378 [1,1,0,0,0,0|2,0,0]=4 6120 B7R0.1 COCCNCCCl Amb17334160 [1,1,0,0,0,0|2,0,0]=4 6121 B7R0.1 COCCNCCF Amb25677392 [1,1,0,0,0,0|2,0,0]=4 6122 B7R0.1 COCCNCCI Amb24407745 [1,1,0,0,0,0|2,0,0]=4 6123 B7R0.1 COCCNCCN Amb17091020 [1,1,0,0,0,0|2,0,0]=4 6124 B7R0.1 COCCOCC=C Amb21858464 [1,1,0,0,0,0|1,0,1]=4 6125 B7R0.1 COCCOCCI Amb22497515 [1,1,0,0,0,0|2,0,0]=4 6126 B7R0.1 COCCSCC=C Amb17799422 [1,1,0,0,0,0|1,0,1]=4 6127 B7R0.1 COCCSCC=O Amb24464910 [1,1,0,0,0,0|1,0,0]=3 6128 B7R0.1 COCCSCCS Amb24406761 [1,1,0,0,0,0|2,0,0]=4 6129 B7R0.1 COCC\C=C\CCl Amb10844762 [1,1,0,0,0,0|1,0,1]=4 6130 B7R0.1 COCC\C=C\CN Amb25746444 [1,1,0,0,0,0|1,0,1]=4 6131 B7R0.1 COCC\C=C\CO Amb25084911 [1,1,0,0,0,0|1,0,1]=4 6132 B7R0.1 COCOCCC=O Amb25804170 [1,1,0,0,0,0|1,0,0]=3 6133 B7R0.1 COCOCCCO Amb23591016 [1,1,0,0,0,0|2,0,0]=4 6134 B7R0.1 COCOCCNC Amb25369852 [1,1,0,0,0,0|2,0,0]=4 6135 B7R0.1 COCSCCCN Amb24641251 [1,1,0,0,0,0|2,0,0]=4 6136 B7R0.1 COCSCCCO Amb25209905 [1,1,0,0,0,0|2,0,0]=4 6137 B7R0.1 CON=CCCC=O Amb25277284 [1,1,0,0,0,0|1,0,1]=4 6138 B7R0.1 CONCCCC=C Amb24332287 [1,1,0,0,0,0|1,0,1]=4 6139 B7R0.1 CONCCCCO Amb24481428 [1,1,0,0,0,0|2,0,0]=4 6140 B7R0.1 CONCCCSC Amb25265970 [1,1,0,0,0,0|2,0,0]=4 6141 B7R0.1 CONCCOCC Amb24481427 [1,1,0,0,0,0|2,0,0]=4 6142 B7R0.1 CO\C=C\CCC=O Amb18641790 [1,1,0,0,0,0|0,0,2]=4 6143 B7R0.1 CO\C=C\CCCBr Amb24423752 [1,1,0,0,0,0|1,0,1]=4 6144 B7R0.1 CO\C=C\CCCN Amb24629714 [1,1,0,0,0,0|1,0,1]=4 6145 B7R0.1 CO\N=C\CCC=O Amb25785571 [1,1,0,0,0,0|1,0,1]=4 6146 B7R0.1 CSCCCCC=O Amb25760866 [1,1,0,0,0,0|0,0,0]=2 6147 B7R0.1 CSCCCCCBr Amb25052398 [1,1,0,0,0,0|1,0,0]=3 6148 B7R0.1 CSCCCCCCl Amb18179464 [1,1,0,0,0,0|1,0,0]=3 6149 B7R0.1 CSCCCCCN Amb24271082 [1,1,0,0,0,0|1,0,0]=3 6150 B7R0.1 CSCCCCCO Amb24271084 [1,1,0,0,0,0|1,0,0]=3 6151 B7R0.1 CSCCCCCS Amb24633807 [1,1,0,0,0,0|1,0,0]=3 6152 B7R0.1 CSCCCCNO Amb25763086 [1,1,0,0,0,0|1,0,1]=4 6153 B7R0.1 CSCCCNC=O Amb24407269 [1,1,0,0,0,0|1,0,0]=3 6154 B7R0.1 CSCCCOCCl Amb24725065 [1,1,0,0,0,0|2,0,0]=4 6155 B7R0.1 CSCCCSCC Amb24721149 [1,1,0,0,0,0|1,0,0]=3 6156 B7R0.1 CSCCCSCCl Amb24504417 [1,1,0,0,0,0|2,0,0]=4 6157 B7R0.1 CSCCNCC=C Amb25360313 [1,1,0,0,0,0|1,0,1]=4 6158 B7R0.1 CSCCNCCF Amb24332620 [1,1,0,0,0,0|2,0,0]=4 6159 B7R0.1 CSCCNCCN Amb25726571 [1,1,0,0,0,0|2,0,0]=4 6160 B7R0.1 CSCCNCCO Amb24529583 [1,1,0,0,0,0|2,0,0]=4 6161 B7R0.1 CSCCOCC=O Amb24692371 [1,1,0,0,0,0|1,0,0]=3 6162 B7R0.1 CSCCOCCCl Amb24471259 [1,1,0,0,0,0|2,0,0]=4 6163 B7R0.1 CSCCOCCN Amb17501991 [1,1,0,0,0,0|2,0,0]=4 6164 B7R0.1 CSCCSCC=O Amb24504422 [1,1,0,0,0,0|1,0,0]=3 6165 B7R0.1 CSCCSCCBr Amb24504429 [1,1,0,0,0,0|2,0,0]=4 6166 B7R0.1 CSCCSCCCl Amb25821438 [1,1,0,0,0,0|2,0,0]=4 6167 B7R0.1 CSCCSCCO Amb25031503 [1,1,0,0,0,0|2,0,0]=4 6168 B7R0.1 CSCC\C=C\C=O Amb25093794 [1,1,0,0,0,0|0,0,2]=4 6169 B7R0.1 CSCOCCCO Amb25187331 [1,1,0,0,0,0|2,0,0]=4 6170 B7R0.1 CSCSCCCC Amb24661862 [1,1,0,0,0,0|1,0,0]=3 6171 B7R0.1 CSCSCCOC Amb25768891 [1,1,0,0,0,0|2,0,0]=4 6172 B7R0.1 CSSCCCCC Amb25679654 [1,1,0,0,0,0|1,0,0]=3 6173 B7R0.1 CS\C=C\CCCO Amb25796405 [1,1,0,0,0,0|1,0,1]=4 6174 B7R0.1 C\C=C/CCCC=O Amb24483048 [1,1,0,0,0,0|0,0,1]=3 6175 B7R0.1 C\C=C/CCCNC Amb18641753 [1,1,0,0,0,0|0,0,1]=3 6176 B7R0.1 C\C=C/CCC[Mg]Cl Amb22897308 [1,1,0,0,0,0|1,0,1]=4 6177 B7R0.1 C\C=C/CSCC=O Amb24666778 [1,1,0,0,0,0|0,0,2]=4 6178 B7R0.1 C\C=C\CCCC=C Amb24700388 [1,1,0,0,0,0|0,0,2]=4 6179 B7R0.1 C\C=C\CCCC=O Amb18641700 [1,1,0,0,0,0|0,0,1]=3 6180 B7R0.1 C\C=C\CCCCBr Amb25053891 [1,1,0,0,0,0|0,0,1]=3 6181 B7R0.1 C\C=C\CCCCO Amb24634714 [1,1,0,0,0,0|0,0,1]=3 6182 B7R0.1 C\C=C\CCCNC Amb24514320 [1,1,0,0,0,0|0,0,1]=3 6183 B7R0.1 C\C=C\CCCNO Amb25252150 [1,1,0,0,0,0|1,0,1]=4 6184 B7R0.1 C\C=C\CCNCC Amb18312572 [1,1,0,0,0,0|0,0,1]=3 6185 B7R0.1 C\C=C\CC\C=C\C Amb21520377 [1,1,0,0,0,0|0,0,2]=4 6186 B7R0.1 C\C=C\CNCCBr Amb25257774 [1,1,0,0,0,0|1,0,1]=4 6187 B7R0.1 C\C=C\CNCCF Amb24353820 [1,1,0,0,0,0|1,0,1]=4 6188 B7R0.1 C\C=C\CNCCO Amb23592253 [1,1,0,0,0,0|1,0,1]=4 6189 B7R0.1 C\C=C\COCC=O Amb24579425 [1,1,0,0,0,0|0,0,2]=4 6190 B7R0.1 C\C=C\COCCN Amb18523861 [1,1,0,0,0,0|1,0,1]=4 6191 B7R0.1 C\C=C\COCCO Amb24593801 [1,1,0,0,0,0|1,0,1]=4 6192 B7R0.1 C\C=C\CSCCCl Amb24469908 [1,1,0,0,0,0|1,0,1]=4 6193 B7R0.1 C\C=C\NCCCC Amb25259223 [1,1,0,0,0,0|0,0,1]=3 6194 B7R0.1 ClCCCCCC=O Amb16185781 [1,1,0,0,0,0|0,0,0]=2 6195 B7R0.1 ClCCCCCCBr Amb10602445 [1,1,0,0,0,0|1,0,1]=4 6196 B7R0.1 ClCCCCCCI Amb20670134 [1,1,0,0,0,0|1,0,1]=4 6197 B7R0.1 ClCCCCC[Zn]Br Amb22000392 [1,1,0,0,0,0|2,0,0]=4 6198 B7R0.1 ClCCCC\C=C\Br Amb25173197 [1,1,0,0,0,0|1,0,1]=4 6199 B7R0.1 ClCCC\C=C\CBr Amb25209980 [1,1,0,0,0,0|1,0,1]=4 6200 B7R0.1 FCCCCCC#N Amb17593193 [1,1,0,0,0,0|1,0,1]=4 6201 B7R0.1 FCCCCCCBr Amb24063182 [1,1,0,0,0,0|1,0,1]=4 6202 B7R0.1 FCCCCCCI Amb25080138 [1,1,0,0,0,0|1,0,1]=4 6203 B7R0.1 FCCCCCCS Amb24569228 [1,1,0,0,0,0|0,1,1]=4 6204 B7R0.1 F\C=C\CCCCBr Amb25101586 [1,1,0,0,0,0|1,0,1]=4 6205 B7R0.1 N#CCCCCCCl Amb21936053 [1,1,0,0,0,0|1,0,1]=4 6206 B7R0.1 N#CCCCOC=O Amb25175583 [1,1,0,0,0,0|1,0,1]=4 6207 B7R0.1 NCCCCCC=O Amb25680164 [1,1,0,0,0,0|0,0,0]=2 6208 B7R0.1 NCCCCCCBr Amb17610010 [1,1,0,0,0,0|1,0,1]=4 6209 B7R0.1 NCCCCCCBr Amb18648322 [1,1,0,0,0,0|1,0,1]=4 6210 B7R0.1 NCCCCCCBr Amb22831848 [1,1,0,0,0,0|1,0,1]=4 6211 B7R0.1 NCCCCCCCl Amb22831847 [1,1,0,0,0,0|1,0,1]=4 6212 B7R0.1 NCCCCCCI Amb25088255 [1,1,0,0,0,0|1,0,1]=4 6213 B7R0.1 NCCCCCCN Amb22347970 [1,1,0,0,0,0|1,0,1]=4 6214 B7R0.1 NCCCCCCN Amb2553272 [1,1,0,0,0,0|1,0,1]=4 6215 B7R0.1 NCCCCCCN Amb2573303 [1,1,0,0,0,0|1,0,1]=4 6216 B7R0.1 NCCCCCCS Amb18642745 [1,1,0,0,0,0|0,1,1]=4 6217 B7R0.1 NCCCCCCS Amb24099361 [1,1,0,0,0,0|0,1,1]=4 6218 B7R0.1 NCCCCCNO Amb24381036 [1,1,0,0,0,0|1,0,1]=4 6219 B7R0.1 NCCCCCOC Amb13951647 [1,1,0,0,0,0|1,0,0]=3 6220 B7R0.1 NCCCCNC=O Amb18641902 [1,1,0,0,0,0|1,0,0]=3 6221 B7R0.1 NCCCCNCC Amb17334065 [1,1,0,0,0,0|1,0,1]=4 6222 B7R0.1 NCCCNCC=C Amb17315274 [1,1,0,0,0,0|1,0,1]=4 6223 B7R0.1 NCCCSCC=C Amb17500693 [1,1,0,0,0,0|1,0,1]=4 6224 B7R0.1 NCCC\C=C\CO Amb24117506 [1,1,0,0,0,0|1,0,1]=4 6225 B7R0.1 NNCCCCCO Amb24660104 [1,1,0,0,0,0|2,0,0]=4 6226 B7R0.1 NOCCCCCF Amb24501720 [1,1,0,0,0,0|2,0,0]=4 6227 B7R0.1 N[13CH2]CCCC[13CH2]N Amb22336714 [1,1,0,0,0,0|1,0,1]=4 6228 B7R0.1 O=CCCCC#CC Amb17593142 [1,1,0,0,0,0|0,0,1]=3 6229 B7R0.1 O=CCCCCC#N Amb17593149 [1,1,0,0,0,0|0,0,1]=3 6230 B7R0.1 O=CCCCCC=O Amb17593185 [1,1,0,0,0,0|0,0,1]=3 6231 B7R0.1 O=CCCCCCBr Amb18127461 [1,1,0,0,0,0|0,0,0]=2 6232 B7R0.1 O=CCCCCCF Amb24533888 [1,1,0,0,0,0|0,0,0]=2 6233 B7R0.1 O=CCCCNC=O Amb25247142 [1,1,0,0,0,0|1,0,1]=4 6234 B7R0.1 O=CCCOCCBr Amb24693863 [1,1,0,0,0,0|1,0,0]=3 6235 B7R0.1 O=CCCOCCCl Amb24472908 [1,1,0,0,0,0|1,0,0]=3 6236 B7R0.1 O=CCC\C=C\CBr Amb25173135 [1,1,0,0,0,0|0,0,2]=4 6237 B7R0.1 O=CC\C=C\CCBr Amb24628936 [1,1,0,0,0,0|0,0,2]=4 6238 B7R0.1 O=CNCCCCBr Amb25300317 [1,1,0,0,0,0|1,0,0]=3 6239 B7R0.1 O=COCCCCCl Amb24599108 [1,1,0,0,0,0|1,0,0]=3 6240 B7R0.1 O=C\C=C\CCCBr Amb24358710 [1,1,0,0,0,0|0,0,2]=4 6241 B7R0.1 O=NOCCCCCl Amb25732797 [1,1,0,0,0,0|2,0,0]=4 6242 B7R0.1 OCCCCC#CC Amb17593158 [1,1,0,0,0,0|0,0,2]=4 6243 B7R0.1 OCCCCC=C=C Amb17593159 [1,1,0,0,0,0|1,0,1]=4 6244 B7R0.1 OCCCCC=NO Amb22229987 [1,1,0,0,0,0|1,0,1]=4 6245 B7R0.1 OCCCCCC#C Amb10603074 [1,1,0,0,0,0|0,0,2]=4 6246 B7R0.1 OCCCCCC=O Amb18641885 [1,1,0,0,0,0|0,0,0]=2 6247 B7R0.1 OCCCCCCBr Amb24063183 [1,1,0,0,0,0|0,0,2]=4 6248 B7R0.1 OCCCCCCCl Amb24063192 [1,1,0,0,0,0|0,0,2]=4 6249 B7R0.1 OCCCCCCF Amb24428671 [1,1,0,0,0,0|0,0,2]=4 6250 B7R0.1 OCCCCCCO Amb22336515 [1,1,0,0,0,0|0,0,2]=4 6251 B7R0.1 OCCCCCCO Amb22338595 [1,1,0,0,0,0|0,0,2]=4 6252 B7R0.1 OCCCCCCO Amb22338770 [1,1,0,0,0,0|0,0,2]=4 6253 B7R0.1 OCCCCCNC Amb17334069 [1,1,0,0,0,0|1,0,0]=3 6254 B7R0.1 OCCCCOC=O Amb25244169 [1,1,0,0,0,0|1,0,0]=3 6255 B7R0.1 OCCCCOCO Amb25043698 [1,1,0,0,0,0|2,0,0]=4 6256 B7R0.1 OCCCC\C=C\Cl Amb25725026 [1,1,0,0,0,0|1,0,1]=4 6257 B7R0.1 OCCCC\C=N\O Amb22336271 [1,1,0,0,0,0|1,0,1]=4 6258 B7R0.1 OCCCNCC=C Amb17308751 [1,1,0,0,0,0|1,0,1]=4 6259 B7R0.1 OCCCSCC=C Amb17502836 [1,1,0,0,0,0|1,0,1]=4 6260 B7R0.1 OCCC\C=C\C=O Amb25734444 [1,1,0,0,0,0|0,0,2]=4 6261 B7R0.1 OCCC\C=C\CCl Amb24617361 [1,1,0,0,0,0|1,0,1]=4 6262 B7R0.1 OCCOCCC=O Amb18641946 [1,1,0,0,0,0|1,0,0]=3 6263 B7R0.1 OCCSCCC=O Amb25077144 [1,1,0,0,0,0|1,0,0]=3 6264 B7R0.1 OC\C=C/CCC=O Amb25827491 [1,1,0,0,0,0|0,0,2]=4 6265 B7R0.1 OC\C=C\CCCCl Amb25174931 [1,1,0,0,0,0|1,0,1]=4 6266 B7R0.1 ON=CCCCC=O Amb25303136 [1,1,0,0,0,0|1,0,1]=4 6267 B7R0.1 O\N=C\CCCC=O Amb24663073 [1,1,0,0,0,0|1,0,1]=4 6268 B7R0.1 [15NH2]CCCCCC[15NH2] Amb22353416 [1,1,0,0,0,0|1,0,1]=4 6269 B7R0.1 [C-]#[N+]CCCCC=O Amb25713544 [1,1,0,0,0,0|0,0,1]=3 6270 B7R0.1 [C-]#[N+]CCCCCO Amb24354421 [1,1,0,0,0,0|1,0,1]=4 6271 B7R0.1 [C-]#[N+]CCOCCC Amb1981102 [1,1,0,0,0,0|1,0,1]=4 6272 B7R0.7 C=CCC(O)CCO Amb24379908 [1,1,0,0,0,0|1,0,1]=4 6273 B7R0.7 C=CC[C@@H](O)CCBr Amb25347848 [1,1,0,0,0,0|1,0,1]=4 6274 B7R0.7 C=CC[C@@H](O)CCO Amb25762096 [1,1,0,0,0,0|1,0,1]=4 6275 B7R0.7 C=CC[C@H](N)CCO Amb25138355 [1,1,0,0,0,0|1,0,1]=4 6276 B7R0.7 C=CC[C@H](O)CCO Amb25219225 [1,1,0,0,0,0|1,0,1]=4 6277 B7R0.7 CC#CC(O)CCC Amb24397090 [1,1,0,0,0,0|0,0,2]=4 6278 B7R0.7 CC(CC=O)CC#C Amb25173462 [1,1,0,0,0,0|0,0,2]=4 6279 B7R0.7 CC(CCBr)CC=C Amb25211241 [1,1,0,0,0,0|1,0,1]=4 6280 B7R0.7 CC(CCC)CCC Amb22229829 [1,1,0,0,0,0|0,0,1]=3 6281 B7R0.7 CCCC(=C)CCC Amb25088297 [1,1,0,0,0,0|0,0,2]=4 6282 B7R0.7 CCCC(=O)CSC Amb24429589 [1,1,0,0,0,0|1,0,1]=4 6283 B7R0.7 CCCC(=O)NC=O Amb25662604 [1,1,0,0,0,0|1,0,1]=4 6284 B7R0.7 CCCC(Br)/C=C/C Amb17672603 [1,1,0,0,0,0|0,0,1]=3 6285 B7R0.7 CCCC(Br)=CC=O Amb24513209 [1,1,0,0,0,0|0,0,2]=4 6286 B7R0.7 CCCC(Br)CC=C Amb24483087 [1,1,0,0,0,0|0,0,1]=3 6287 B7R0.7 CCCC(Br)CCBr Amb23455635 [1,1,0,0,0,0|1,0,1]=4 6288 B7R0.7 CCCC(Br)COC Amb18184675 [1,1,0,0,0,0|1,0,0]=3 6289 B7R0.7 CCCC(C)CC=O Amb18641815 [1,1,0,0,0,0|0,0,0]=2 6290 B7R0.7 CCCC(C)CC=S Amb22168291 [1,1,0,0,0,0|0,1,0]=3 6291 B7R0.7 CCCC(C)CCBr Amb24526467 [1,1,0,0,0,0|1,0,1]=4 6292 B7R0.7 CCCC(C)CCCl Amb24333870 [1,1,0,0,0,0|1,0,1]=4 6293 B7R0.7 CCCC(C)CCO Amb22733616 [1,1,0,0,0,0|0,0,2]=4 6294 B7R0.7 CCCC(C)C[Mg]Cl Amb22897342 [1,1,0,0,0,0|2,0,0]=4 6295 B7R0.7 CCCC(C)C[Zn]Cl Amb22897377 [1,1,0,0,0,0|2,0,0]=4 6296 B7R0.7 CCCC(C)N=C=O Amb21961819 [1,1,0,0,0,0|1,0,1]=4 6297 B7R0.7 CCCC(C)NOC Amb25299098 [1,1,0,0,0,0|2,0,0]=4 6298 B7R0.7 CCCC(C)OC=C Amb25069569 [1,1,0,0,0,0|1,0,1]=4 6299 B7R0.7 CCCC(CCC)N Amb1102706 [1,1,0,0,0,0|0,0,1]=3 6300 B7R0.7 CCCC(Cl)CC#C Amb24398029 [1,1,0,0,0,0|0,0,2]=4 6301 B7R0.7 CCCC(Cl)CCCl Amb24481328 [1,1,0,0,0,0|1,0,1]=4 6302 B7R0.7 CCCC(Cl)COC Amb24444031 [1,1,0,0,0,0|1,0,0]=3 6303 B7R0.7 CCCC(Cl)\C=C\Cl Amb25363202 [1,1,0,0,0,0|1,0,1]=4 6304 B7R0.7 CCCC(F)CCCl Amb25744393 [1,1,0,0,0,0|1,0,1]=4 6305 B7R0.7 CCCC(N)CC#C Amb18296097 [1,1,0,0,0,0|0,0,2]=4 6306 B7R0.7 CCCC(N)CC=C Amb19015526 [1,1,0,0,0,0|0,0,1]=3 6307 B7R0.7 CCCC(N)CCBr Amb24739585 [1,1,0,0,0,0|1,0,1]=4 6308 B7R0.7 CCCC(N)CCCl Amb25290129 [1,1,0,0,0,0|1,0,1]=4 6309 B7R0.7 CCCC(N)CCO Amb22050841 [1,1,0,0,0,0|0,0,2]=4 6310 B7R0.7 CCCC(N)CCS Amb25084085 [1,1,0,0,0,0|0,1,1]=4 6311 B7R0.7 CCCC(N)CNC Amb19009733 [1,1,0,0,0,0|1,0,0]=3 6312 B7R0.7 CCCC(N)COC Amb18311156 [1,1,0,0,0,0|1,0,0]=3 6313 B7R0.7 CCCC(N)CSC Amb18313615 [1,1,0,0,0,0|1,0,0]=3 6314 B7R0.7 CCCC(O)=CC=O Amb25745986 [1,1,0,0,0,0|0,0,2]=4 6315 B7R0.7 CCCC(O)CC#C Amb17940358 [1,1,0,0,0,0|0,0,2]=4 6316 B7R0.7 CCCC(O)CC#N Amb18641730 [1,1,0,0,0,0|1,0,1]=4 6317 B7R0.7 CCCC(O)CC=O Amb18641890 [1,1,0,0,0,0|0,0,0]=2 6318 B7R0.7 CCCC(O)CCBr Amb24483148 [1,1,0,0,0,0|1,0,1]=4 6319 B7R0.7 CCCC(O)CCCl Amb24481417 [1,1,0,0,0,0|1,0,1]=4 6320 B7R0.7 CCCC(O)CCN Amb22642684 [1,1,0,0,0,0|1,0,1]=4 6321 B7R0.7 CCCC(O)CCO Amb24181777 [1,1,0,0,0,0|0,0,2]=4 6322 B7R0.7 CCCC(O)CNC Amb18314672 [1,1,0,0,0,0|1,0,0]=3 6323 B7R0.7 CCCC(O)CSC Amb24729041 [1,1,0,0,0,0|1,0,0]=3 6324 B7R0.7 CCCC(S)CC=O Amb24481552 [1,1,0,0,0,0|0,0,0]=2 6325 B7R0.7 CCCN(C)CC=O Amb25820883 [1,1,0,0,0,0|1,0,0]=3 6326 B7R0.7 CCCN(CCC)N Amb17593208 [1,1,0,0,0,0|1,0,1]=4 6327 B7R0.7 CCCP(Cl)CCC Amb24120641 [1,1,0,0,0,0|1,0,1]=4 6328 B7R0.7 CCCS(=O)CC=O Amb24483295 [1,1,0,0,0,0|1,0,0]=3 6329 B7R0.7 CCC[C@@H](C)CCO Amb24351627 [1,1,0,0,0,0|0,0,2]=4 6330 B7R0.7 CCC[C@@H](N)CC#N Amb24481561 [1,1,0,0,0,0|1,0,1]=4 6331 B7R0.7 CCC[C@@H](N)CC=C Amb25324586 [1,1,0,0,0,0|0,0,1]=3 6332 B7R0.7 CCC[C@@H](N)CCBr Amb24651964 [1,1,0,0,0,0|1,0,1]=4 6333 B7R0.7 CCC[C@@H](N)CCCl Amb25287301 [1,1,0,0,0,0|1,0,1]=4 6334 B7R0.7 CCC[C@@H](N)CCO Amb22745145 [1,1,0,0,0,0|0,0,2]=4 6335 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [1,1,0,0,0,0|0,0,2]=4 6336 B7R0.7 CCC[C@@H](N)CSC Amb25051682 [1,1,0,0,0,0|1,0,0]=3 6337 B7R0.7 CCC[C@@H](O)CC=O Amb25290213 [1,1,0,0,0,0|0,0,0]=2 6338 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [1,1,0,0,0,0|0,0,2]=4 6339 B7R0.7 CCC[C@@H](S)CCO Amb25676566 [1,1,0,0,0,0|0,0,2]=4 6340 B7R0.7 CCC[C@H](C)CC=O Amb24696396 [1,1,0,0,0,0|0,0,0]=2 6341 B7R0.7 CCC[C@H](C)CCCl Amb24481438 [1,1,0,0,0,0|1,0,1]=4 6342 B7R0.7 CCC[C@H](C)CCN Amb25836227 [1,1,0,0,0,0|1,0,1]=4 6343 B7R0.7 CCC[C@H](N)CCBr Amb25724940 [1,1,0,0,0,0|1,0,1]=4 6344 B7R0.7 CCC[C@H](O)CC#N Amb25346246 [1,1,0,0,0,0|1,0,1]=4 6345 B7R0.7 CCC[C@H](O)CCO Amb25058562 [1,1,0,0,0,0|0,0,2]=4 6346 B7R0.7 CCC\C(\C)=C/C=O Amb25039965 [1,1,0,0,0,0|0,0,2]=4 6347 B7R0.7 CCC\C(\O)=C\C=O Amb24481551 [1,1,0,0,0,0|0,0,2]=4 6348 B7R0.7 CCNC(C)CC=C Amb19015834 [1,1,0,0,0,0|1,0,1]=4 6349 B7R0.7 CCNC(C)CCC Amb22586730 [1,1,0,0,0,0|1,0,1]=4 6350 B7R0.7 CCNC(C)CSC Amb18313762 [1,1,0,0,0,0|2,0,0]=4 6351 B7R0.7 CCOC(C)CC=O Amb25702447 [1,1,0,0,0,0|1,0,0]=3 6352 B7R0.7 CCOC(C)CCC Amb22733741 [1,1,0,0,0,0|1,0,1]=4 6353 B7R0.7 CCOC(Cl)CCC Amb24334118 [1,1,0,0,0,0|1,0,1]=4 6354 B7R0.7 CCOC(Cl)CSC Amb25321920 [1,1,0,0,0,0|2,0,0]=4 6355 B7R0.7 CCOC(O)CNC Amb24693762 [1,1,0,0,0,0|2,0,0]=4 6356 B7R0.7 CCSC(C)CC=O Amb22232285 [1,1,0,0,0,0|1,0,0]=3 6357 B7R0.7 CCSC(C)CNC Amb19025498 [1,1,0,0,0,0|2,0,0]=4 6358 B7R0.7 CCSC(C)COC Amb25805617 [1,1,0,0,0,0|2,0,0]=4 6359 B7R0.7 CCSC(Cl)CCC Amb25107901 [1,1,0,0,0,0|1,0,1]=4 6360 B7R0.7 CNCC(C)CC=C Amb24699091 [1,1,0,0,0,0|1,0,1]=4 6361 B7R0.7 CNCC(C)CCCl Amb25359085 [1,1,0,0,0,0|2,0,0]=4 6362 B7R0.7 CNCC(C)CSC Amb24464854 [1,1,0,0,0,0|2,0,0]=4 6363 B7R0.7 CNCC(C)NCC Amb19022873 [1,1,0,0,0,0|2,0,0]=4 6364 B7R0.7 CNCC(CCN)C Amb17334067 [1,1,0,0,0,0|2,0,0]=4 6365 B7R0.7 CNCC(CCO)C Amb17569901 [1,1,0,0,0,0|2,0,0]=4 6366 B7R0.7 CNCC(COC)C Amb17569917 [1,1,0,0,0,0|2,0,0]=4 6367 B7R0.7 CNCC(N)CC=C Amb25685521 [1,1,0,0,0,0|1,0,1]=4 6368 B7R0.7 CNCC(N)COC Amb25688119 [1,1,0,0,0,0|2,0,0]=4 6369 B7R0.7 CNCC(O)CC=C Amb24471234 [1,1,0,0,0,0|1,0,1]=4 6370 B7R0.7 CNCC(O)CCN Amb18559793 [1,1,0,0,0,0|2,0,0]=4 6371 B7R0.7 CNCC(O)CSC Amb19008591 [1,1,0,0,0,0|2,0,0]=4 6372 B7R0.7 CNCC(OCC)C Amb10608191 [1,1,0,0,0,0|2,0,0]=4 6373 B7R0.7 COCC(Br)CCBr Amb23456164 [1,1,0,0,0,0|2,0,0]=4 6374 B7R0.7 COCC(Br)CCO Amb25286452 [1,1,0,0,0,0|2,0,0]=4 6375 B7R0.7 COCC(Br)COC Amb24407024 [1,1,0,0,0,0|2,0,0]=4 6376 B7R0.7 COCC(C)CC=C Amb25662892 [1,1,0,0,0,0|1,0,1]=4 6377 B7R0.7 COCC(C)CC=O Amb24761492 [1,1,0,0,0,0|1,0,0]=3 6378 B7R0.7 COCC(C)CCO Amb24604394 [1,1,0,0,0,0|2,0,0]=4 6379 B7R0.7 COCC(CCN)C Amb17569914 [1,1,0,0,0,0|2,0,0]=4 6380 B7R0.7 COCC(Cl)CCCl Amb24392625 [1,1,0,0,0,0|2,0,0]=4 6381 B7R0.7 COCC(N)CC=C Amb19018008 [1,1,0,0,0,0|1,0,1]=4 6382 B7R0.7 COCC(N)CCBr Amb24706241 [1,1,0,0,0,0|2,0,0]=4 6383 B7R0.7 COCC(N)CCO Amb19338150 [1,1,0,0,0,0|2,0,0]=4 6384 B7R0.7 COCC(O)CC=C Amb25222392 [1,1,0,0,0,0|1,0,1]=4 6385 B7R0.7 COCC(O)CC=O Amb25696549 [1,1,0,0,0,0|1,0,0]=3 6386 B7R0.7 COCC(O)CCCl Amb25314601 [1,1,0,0,0,0|2,0,0]=4 6387 B7R0.7 COCC(O)CCN Amb18203347 [1,1,0,0,0,0|2,0,0]=4 6388 B7R0.7 COCC(O)CCO Amb23512858 [1,1,0,0,0,0|2,0,0]=4 6389 B7R0.7 COC[C@@H](O)CCN Amb24474146 [1,1,0,0,0,0|2,0,0]=4 6390 B7R0.7 COC[C@@H](O)CCO Amb25086103 [1,1,0,0,0,0|2,0,0]=4 6391 B7R0.7 CP(CCC)CCC Amb22731330 [1,1,0,0,0,0|1,0,1]=4 6392 B7R0.7 CSCC(C)NC=O Amb25138963 [1,1,0,0,0,0|2,0,0]=4 6393 B7R0.7 CSCC(N)CC=C Amb18523850 [1,1,0,0,0,0|1,0,1]=4 6394 B7R0.7 CSCC(N)CCN Amb25738000 [1,1,0,0,0,0|2,0,0]=4 6395 B7R0.7 CSCC(N)CCO Amb19515713 [1,1,0,0,0,0|2,0,0]=4 6396 B7R0.7 CSCC(O)CCN Amb25078322 [1,1,0,0,0,0|2,0,0]=4 6397 B7R0.7 CSC[C@H](N)CCN Amb25214681 [1,1,0,0,0,0|2,0,0]=4 6398 B7R0.7 C[C@@H](CC=O)CC#C Amb24419911 [1,1,0,0,0,0|0,0,2]=4 6399 B7R0.7 C[C@@H](CCO)CC=C Amb25332119 [1,1,0,0,0,0|1,0,1]=4 6400 B7R0.7 C[C@H](CCO)CC=C Amb24575596 [1,1,0,0,0,0|1,0,1]=4 6401 B7R0.7 C\C=C/C(C)CCC Amb22359470 [1,1,0,0,0,0|0,0,1]=3 6402 B7R0.7 C\C=C/C(Cl)COC Amb24483208 [1,1,0,0,0,0|1,0,1]=4 6403 B7R0.7 C\C=C\C(=O)CCC Amb25717214 [1,1,0,0,0,0|0,0,2]=4 6404 B7R0.7 C\C=C\C(C)CC=O Amb25366468 [1,1,0,0,0,0|0,0,2]=4 6405 B7R0.7 C\C=C\C(C)CCBr Amb25829354 [1,1,0,0,0,0|1,0,1]=4 6406 B7R0.7 C\C=C\C(C)CCN Amb25313440 [1,1,0,0,0,0|1,0,1]=4 6407 B7R0.7 C\C=C\C(Cl)COC Amb25233403 [1,1,0,0,0,0|1,0,1]=4 6408 B7R0.7 C\C=C\C(Cl)OCC Amb25662994 [1,1,0,0,0,0|1,0,1]=4 6409 B7R0.7 C\C=C\C(O)CNC Amb25238066 [1,1,0,0,0,0|1,0,1]=4 6410 B7R0.7 C\C=C\C(O)CSC Amb24475686 [1,1,0,0,0,0|1,0,1]=4 6411 B7R0.7 C\C=C\[C@@H](Cl)CCC Amb24736621 [1,1,0,0,0,0|0,0,1]=3 6412 B7R0.7 C\C=C\[C@@H](O)CCC Amb25145389 [1,1,0,0,0,0|0,0,1]=3 6413 B7R0.7 C\C=C\[C@H](Cl)CCC Amb24483246 [1,1,0,0,0,0|0,0,1]=3 6414 B7R0.7 C\C=C\[C@H](O)CCC Amb25045794 [1,1,0,0,0,0|0,0,1]=3 6415 B7R0.7 NC(CC=O)CC=O Amb25349657 [1,1,0,0,0,0|1,0,1]=4 6416 B7R0.7 O=CCC(CC=O)C Amb17593183 [1,1,0,0,0,0|1,0,1]=4 6417 B7R0.7 OC(CC=O)CC=O Amb18641864 [1,1,0,0,0,0|1,0,1]=4 6418 B9R0.4 C=CCCC(N)CC(N)=O Amb25367476 [0,2,0,0,0,0|1,0,1]=4 6419 B9R0.4 C=CCCC(N)CC(O)=O Amb22641959 [0,2,0,0,0,0|1,0,1]=4 6420 B9R0.4 C=CCCC(O)CC(O)=O Amb24763775 [0,2,0,0,0,0|1,0,1]=4 6421 B9R0.4 C=CCC[C@@H](CC(=O)O)N Amb10066917 [0,2,0,0,0,0|1,0,1]=4 6422 B9R0.4 C=CCC[C@H](CC(=O)O)N Amb10066925 [0,2,0,0,0,0|1,0,1]=4 6423 B9R0.4 CC#CCC(C)CC(O)=O Amb24350965 [0,2,0,0,0,0|1,0,1]=4 6424 B9R0.4 CC#CC[C@@H](C)CC(O)=O Amb24616270 [0,2,0,0,0,0|1,0,1]=4 6425 B9R0.4 CC(=C)CC(=O)CCCC Amb25303713 [0,2,0,0,0,0|1,0,0]=3 6426 B9R0.4 CC(=C)CC(=O)CCCO Amb24657665 [0,2,0,0,0,0|1,0,1]=4 6427 B9R0.4 CC(=C)CC(=O)CCNC Amb25744681 [0,2,0,0,0,0|1,0,1]=4 6428 B9R0.4 CC(=C)CC(=O)CNCC Amb25843637 [0,2,0,0,0,0|1,0,1]=4 6429 B9R0.4 CC(=C)CC(=O)NCCC Amb24482634 [0,2,0,0,0,0|1,0,1]=4 6430 B9R0.4 CC(=C)CC(O)CCC=C Amb25229172 [0,2,0,0,0,0|1,0,1]=4 6431 B9R0.4 CC(=C)CC(O)CCCO Amb25825831 [0,2,0,0,0,0|1,0,0]=3 6432 B9R0.4 CC(=C)CN(C)CCCF Amb24482534 [0,2,0,0,0,0|2,0,0]=4 6433 B9R0.4 CC(=C)CN(C)CCCI Amb24703937 [0,2,0,0,0,0|2,0,0]=4 6434 B9R0.4 CC(=C)C[C@@H](O)CCCO Amb25306276 [0,2,0,0,0,0|1,0,0]=3 6435 B9R0.4 CC(=N)CC(=O)CCCC Amb25090358 [0,2,0,0,0,0|1,0,0]=3 6436 B9R0.4 CC(=N)CC(=O)COCC Amb25146788 [0,2,0,0,0,0|1,0,1]=4 6437 B9R0.4 CC(=O)C=C(N)COCC Amb24759167 [0,2,0,0,0,0|0,0,2]=4 6438 B9R0.4 CC(=O)CC(=N)COCC Amb24478367 [0,2,0,0,0,0|0,0,1]=3 6439 B9R0.4 CC(=O)CC(=O)CCC#C Amb25837200 [0,2,0,0,0,0|0,0,2]=4 6440 B9R0.4 CC(=O)CC(=O)CCC#N Amb25146878 [0,2,0,0,0,0|0,0,2]=4 6441 B9R0.4 CC(=O)CC(=O)CCC=C Amb25251407 [0,2,0,0,0,0|0,0,2]=4 6442 B9R0.4 CC(=O)CC(=O)CCC=O Amb25365156 [0,2,0,0,0,0|0,0,2]=4 6443 B9R0.4 CC(=O)CC(=O)CCCBr Amb24477432 [0,2,0,0,0,0|0,0,1]=3 6444 B9R0.4 CC(=O)CC(=O)CCCC Amb22347234 [0,2,0,0,0,0|0,0,0]=2 6445 B9R0.4 CC(=O)CC(=O)CCOC Amb25760850 [0,2,0,0,0,0|0,0,1]=3 6446 B9R0.4 CC(=O)CC(=O)COCC Amb23482990 [0,2,0,0,0,0|0,0,1]=3 6447 B9R0.4 CC(=O)CC(=O)C\C=C\C Amb24512678 [0,2,0,0,0,0|0,0,2]=4 6448 B9R0.4 CC(=O)CC(=O)NCCN Amb19011382 [0,2,0,0,0,0|1,0,1]=4 6449 B9R0.4 CC(=O)CC(=O)NCCS Amb25798412 [0,2,0,0,0,0|1,0,1]=4 6450 B9R0.4 CC(=O)CC(=O)NOCC Amb25146795 [0,2,0,0,0,0|1,0,1]=4 6451 B9R0.4 CC(=O)CC(=O)OCCCl Amb20620698 [0,2,0,0,0,0|1,0,1]=4 6452 B9R0.4 CC(=O)CC(=O)OCCO Amb24620465 [0,2,0,0,0,0|1,0,1]=4 6453 B9R0.4 CC(=O)CC(=O)OCCS Amb25263652 [0,2,0,0,0,0|1,0,1]=4 6454 B9R0.4 CC(=O)CC(=O)O[BrH]CC Amb24609870 [0,2,0,0,0,0|1,0,1]=4 6455 B9R0.4 CC(=O)CC(=O)SCCO Amb24416749 [0,2,0,0,0,0|1,0,1]=4 6456 B9R0.4 CC(=O)CC(=O)\C=C\CC Amb24686488 [0,2,0,0,0,0|0,0,2]=4 6457 B9R0.4 CC(=O)CC(O)CCC#N Amb18643718 [0,2,0,0,0,0|0,0,1]=3 6458 B9R0.4 CC(=O)CC(O)CCC=C Amb25735760 [0,2,0,0,0,0|0,0,1]=3 6459 B9R0.4 CC(=O)CC(O)CCCCl Amb24502163 [0,2,0,0,0,0|0,0,0]=2 6460 B9R0.4 CC(=O)CN(C)CCCO Amb25281520 [0,2,0,0,0,0|1,0,0]=3 6461 B9R0.4 CC(=O)C[C@@H](O)CCC=C Amb25723265 [0,2,0,0,0,0|0,0,1]=3 6462 B9R0.4 CC(=O)NC(=O)CNCC Amb25710685 [0,2,0,0,0,0|1,0,1]=4 6463 B9R0.4 CC(=O)NC(=O)NCCC Amb24684678 [0,2,0,0,0,0|1,0,1]=4 6464 B9R0.4 CC(=O)NC(=S)SCCC Amb25212880 [0,2,0,0,0,0|1,0,1]=4 6465 B9R0.4 CC(=O)\C=C(/Cl)\CCCC Amb25712728 [0,2,0,0,0,0|0,0,1]=3 6466 B9R0.4 CC(=O)\C=C(/N)\CCCC Amb25317904 [0,2,0,0,0,0|0,0,1]=3 6467 B9R0.4 CC(=O)\C=C(/N)\COCC Amb25793057 [0,2,0,0,0,0|0,0,2]=4 6468 B9R0.4 CC(=O)\C=C(/N)\SCCC Amb24415410 [0,2,0,0,0,0|0,0,2]=4 6469 B9R0.4 CC(=S)NC(=O)CCCC Amb24435382 [0,2,0,0,0,0|0,1,1]=4 6470 B9R0.4 CC(C)=CC(O)CCCO Amb25244620 [0,2,0,0,0,0|1,0,1]=4 6471 B9R0.4 CC(C)CC(Br)CCCC Amb24678300 [0,2,0,0,0,0|1,0,1]=4 6472 B9R0.4 CC(C)CC(C)CCCBr Amb24064688 [0,2,0,0,0,0|1,0,1]=4 6473 B9R0.4 CC(C)CC(C)CCCCl Amb24432723 [0,2,0,0,0,0|1,0,1]=4 6474 B9R0.4 CC(C)CC(C)CCCO Amb22641875 [0,2,0,0,0,0|1,0,1]=4 6475 B9R0.4 CC(C)CC(C)CNCC Amb24609761 [0,2,0,0,0,0|1,0,1]=4 6476 B9R0.4 CC(C)CC(Cl)CNCC Amb24481109 [0,2,0,0,0,0|1,0,1]=4 6477 B9R0.4 CC(C)CC(N)CCOC Amb24459674 [0,2,0,0,0,0|1,0,1]=4 6478 B9R0.4 CC(C)CC(N)COCC Amb25307588 [0,2,0,0,0,0|1,0,1]=4 6479 B9R0.4 CC(C)CC(O)CCCC Amb22734801 [0,2,0,0,0,0|1,0,1]=4 6480 B9R0.4 CC(C)CC(O)CCOC Amb24734274 [0,2,0,0,0,0|1,0,1]=4 6481 B9R0.4 CC(C)CC(O)CCSC Amb24379287 [0,2,0,0,0,0|1,0,1]=4 6482 B9R0.4 CC(C)CC(O)CNCC Amb24388082 [0,2,0,0,0,0|1,0,1]=4 6483 B9R0.4 CC(C)C[C@@H](N)CNCC Amb24424286 [0,2,0,0,0,0|1,0,1]=4 6484 B9R0.4 CC(C)C[C@@H](N)COCC Amb18529653 [0,2,0,0,0,0|1,0,1]=4 6485 B9R0.4 CC(C)C[C@H](N)CCCC Amb24543788 [0,2,0,0,0,0|1,0,1]=4 6486 B9R0.4 CC(C)C[C@H](N)CCOC Amb24684733 [0,2,0,0,0,0|1,0,1]=4 6487 B9R0.4 CC(C)C[C@H](N)CNCC Amb25118400 [0,2,0,0,0,0|1,0,1]=4 6488 B9R0.4 CC(CC(C)=O)=NCCO Amb24662323 [0,2,0,0,0,0|1,0,1]=4 6489 B9R0.4 CC(CC(C)=O)CCC#C Amb24685891 [0,2,0,0,0,0|0,0,1]=3 6490 B9R0.4 CC(CC(C)=O)CCC=C Amb24738371 [0,2,0,0,0,0|0,0,1]=3 6491 B9R0.4 CC(CC(C)=O)SCCO Amb25777590 [0,2,0,0,0,0|1,0,0]=3 6492 B9R0.4 CC(CC(N)=O)NCCBr Amb24482960 [0,2,0,0,0,0|2,0,0]=4 6493 B9R0.4 CC(CC(N)=O)NCCF Amb25225173 [0,2,0,0,0,0|2,0,0]=4 6494 B9R0.4 CC(CC(N)=O)NCCO Amb19981205 [0,2,0,0,0,0|2,0,0]=4 6495 B9R0.4 CC(CC(O)=O)CCC#N Amb25789692 [0,2,0,0,0,0|1,0,1]=4 6496 B9R0.4 CC(CC(O)=O)CCC=C Amb18643923 [0,2,0,0,0,0|1,0,1]=4 6497 B9R0.4 CC(CC(O)=O)NCCCl Amb25806095 [0,2,0,0,0,0|2,0,0]=4 6498 B9R0.4 CC(CC(O)=O)SCCF Amb24399399 [0,2,0,0,0,0|2,0,0]=4 6499 B9R0.4 CC(CC(O)=O)SCCN Amb18788220 [0,2,0,0,0,0|2,0,0]=4 6500 B9R0.4 CC(CCC=C)NC(C)=O Amb24478962 [0,2,0,0,0,0|0,0,2]=4 6501 B9R0.4 CC(CCC=C)OC(C)=O Amb24412700 [0,2,0,0,0,0|0,0,2]=4 6502 B9R0.4 CC(CCCBr)OC(C)=O Amb24415699 [0,2,0,0,0,0|1,0,0]=3 6503 B9R0.4 CC(CCCC)=CC(N)=O Amb25840047 [0,2,0,0,0,0|1,0,1]=4 6504 B9R0.4 CC(CCCC)=NC(N)=O Amb24695360 [0,2,0,0,0,0|1,0,1]=4 6505 B9R0.4 CC(CCCCl)CC(O)=O Amb18646190 [0,2,0,0,0,0|1,0,0]=3 6506 B9R0.4 CC(CCCCl)OC(=O)Cl Amb24563810 [0,2,0,0,0,0|2,0,0]=4 6507 B9R0.4 CC(CCCCl)OC(C)=O Amb24470649 [0,2,0,0,0,0|1,0,0]=3 6508 B9R0.4 CC(CCCN)CC(O)=O Amb24761313 [0,2,0,0,0,0|1,0,0]=3 6509 B9R0.4 CC(CCCN)NC(C)=O Amb25765187 [0,2,0,0,0,0|1,0,0]=3 6510 B9R0.4 CC(CCCN)NC(N)=O Amb25084805 [0,2,0,0,0,0|2,0,0]=4 6511 B9R0.4 CC(CCCO)NC(N)=O Amb25197805 [0,2,0,0,0,0|2,0,0]=4 6512 B9R0.4 CC(CCCO)OC(C)=O Amb24387041 [0,2,0,0,0,0|1,0,0]=3 6513 B9R0.4 CC(CCOC)=CC(C)=O Amb24479504 [0,2,0,0,0,0|0,0,2]=4 6514 B9R0.4 CC(CCSC)CC(C)Br Amb25235675 [0,2,0,0,0,0|1,0,1]=4 6515 B9R0.4 CC(CCSC)CC(C)O Amb25662534 [0,2,0,0,0,0|0,0,2]=4 6516 B9R0.4 CC(CS(C)=O)NCCF Amb24725028 [0,2,0,0,0,0|2,0,0]=4 6517 B9R0.4 CC(CS(C)=O)NCCO Amb24524661 [0,2,0,0,0,0|2,0,0]=4 6518 B9R0.4 CC(Cl)CC(Cl)OCCC Amb24482260 [0,2,0,0,0,0|1,0,1]=4 6519 B9R0.4 CC(O)CC(N)CCOC Amb25718482 [0,2,0,0,0,0|0,0,2]=4 6520 B9R0.4 CC(OCCCl)OC(C)=O Amb24480651 [0,2,0,0,0,0|2,0,0]=4 6521 B9R0.4 CCCCC(=C)CC(O)=O Amb18643896 [0,2,0,0,0,0|1,0,0]=3 6522 B9R0.4 CCCCC(=O)CC(C)C Amb10807381 [0,2,0,0,0,0|1,0,1]=4 6523 B9R0.4 CCCCC(=O)C[C@@H](C)O Amb24752471 [0,2,0,0,0,0|0,0,2]=4 6524 B9R0.4 CCCCC(=O)C[C@H](C)O Amb24582786 [0,2,0,0,0,0|0,0,2]=4 6525 B9R0.4 CCCCC(C)CC(C)=O Amb25051695 [0,2,0,0,0,0|0,0,0]=2 6526 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [0,2,0,0,0,0|1,0,0]=3 6527 B9R0.4 CCCCC(C)NC(C)=N Amb25204023 [0,2,0,0,0,0|1,0,0]=3 6528 B9R0.4 CCCCC(C)NC(N)=S Amb18800481 [0,2,0,0,0,0|1,1,0]=4 6529 B9R0.4 CCCCC(C)OC(C)=S Amb25823564 [0,2,0,0,0,0|0,1,0]=3 6530 B9R0.4 CCCCC(CC(=O)O)N Amb1993866 [0,2,0,0,0,0|1,0,0]=3 6531 B9R0.4 CCCCC(Cl)=CC(O)=O Amb25179107 [0,2,0,0,0,0|1,0,1]=4 6532 B9R0.4 CCCCC(Cl)C=C(Cl)Cl Amb25770583 [0,2,0,0,0,0|2,0,0]=4 6533 B9R0.4 CCCCC(Cl)CC(=O)Cl Amb24563246 [0,2,0,0,0,0|1,0,0]=3 6534 B9R0.4 CCCCC(Cl)CC(C)=C Amb24482312 [0,2,0,0,0,0|1,0,0]=3 6535 B9R0.4 CCCCC(Cl)OC(=O)Cl Amb24571701 [0,2,0,0,0,0|1,0,0]=3 6536 B9R0.4 CCCCC(Cl)OC(C)=O Amb24724411 [0,2,0,0,0,0|0,0,0]=2 6537 B9R0.4 CCCCC(F)=CC(O)=O Amb24568324 [0,2,0,0,0,0|1,0,1]=4 6538 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [0,2,0,0,0,0|1,0,0]=3 6539 B9R0.4 CCCCC(O)CC(N)=O Amb24563459 [0,2,0,0,0,0|1,0,0]=3 6540 B9R0.4 CCCCC(O)CC(O)=O Amb22388888 [0,2,0,0,0,0|1,0,0]=3 6541 B9R0.4 CCCCC(O)CN(C)C Amb25717161 [0,2,0,0,0,0|2,0,0]=4 6542 B9R0.4 CCCCN(C)CC(C)Cl Amb24387172 [0,2,0,0,0,0|1,0,1]=4 6543 B9R0.4 CCCCN(C)C[C@@H](C)N Amb18014373 [0,2,0,0,0,0|1,0,1]=4 6544 B9R0.4 CCCCN(C)C[C@@H](C)O Amb25678015 [0,2,0,0,0,0|0,0,2]=4 6545 B9R0.4 CCCCN(CC(=O)Cl)C Amb17142904 [0,2,0,0,0,0|1,0,0]=3 6546 B9R0.4 CCCCN(CC(=O)N)C Amb17142865 [0,2,0,0,0,0|1,0,0]=3 6547 B9R0.4 CCCCN(CC(O)C)C Amb17138401 [0,2,0,0,0,0|0,0,2]=4 6548 B9R0.4 CCCCS(=O)CC(C)=O Amb25139843 [0,2,0,0,0,0|0,0,0]=2 6549 B9R0.4 CCCCS(=O)CC(C)O Amb25717943 [0,2,0,0,0,0|0,0,2]=4 6550 B9R0.4 CCCCS(=O)CC(O)=O Amb18792577 [0,2,0,0,0,0|1,0,0]=3 6551 B9R0.4 CCCC[C@@H](C)NC(C)=O Amb24681561 [0,2,0,0,0,0|0,0,0]=2 6552 B9R0.4 CCCC[C@@H](O)CC(N)=O Amb24549040 [0,2,0,0,0,0|1,0,0]=3 6553 B9R0.4 CCCC[C@@H](O)CC(O)=O Amb24350627 [0,2,0,0,0,0|1,0,0]=3 6554 B9R0.4 CCCC[C@H](N)CC(N)=O Amb25147366 [0,2,0,0,0,0|1,0,0]=3 6555 B9R0.4 CCCC[C@H](O)CC(C)=O Amb25245692 [0,2,0,0,0,0|0,0,0]=2 6556 B9R0.4 CCCC\C(\C)=C\C(C)=O Amb24698890 [0,2,0,0,0,0|0,0,1]=3 6557 B9R0.4 CCCC\C(\Cl)=C/C(O)=O Amb25279577 [0,2,0,0,0,0|1,0,1]=4 6558 B9R0.4 CCCC\C(\F)=C/C(O)=O Amb18124779 [0,2,0,0,0,0|1,0,1]=4 6559 B9R0.4 CCCN=C(C)CC(C)=O Amb24707162 [0,2,0,0,0,0|0,0,1]=3 6560 B9R0.4 CCCNC(=N)CC(N)=O Amb24482890 [0,2,0,0,0,0|1,0,1]=4 6561 B9R0.4 CCCNC(=O)CC(=O)O Amb17399888 [0,2,0,0,0,0|1,0,1]=4 6562 B9R0.4 CCCNC(=O)CC(N)=O Amb25355941 [0,2,0,0,0,0|1,0,1]=4 6563 B9R0.4 CCCNC(C)C=C(C)C Amb24609745 [0,2,0,0,0,0|1,0,1]=4 6564 B9R0.4 CCCNC(C)CC(C)=C Amb24442467 [0,2,0,0,0,0|1,0,0]=3 6565 B9R0.4 CCCNC(C)CC(C)Cl Amb24441849 [0,2,0,0,0,0|1,0,1]=4 6566 B9R0.4 CCCNC(C)CC(C)O Amb24365066 [0,2,0,0,0,0|0,0,2]=4 6567 B9R0.4 CCCNC(C)CN(C)C Amb24457360 [0,2,0,0,0,0|2,0,0]=4 6568 B9R0.4 CCCNC(C)CS(C)=O Amb25205194 [0,2,0,0,0,0|1,0,0]=3 6569 B9R0.4 CCCNC(CC(=O)N)C Amb17231986 [0,2,0,0,0,0|1,0,0]=3 6570 B9R0.4 CCCN\C(\C)=C\C(C)=O Amb24467024 [0,2,0,0,0,0|0,0,2]=4 6571 B9R0.4 CCCOC(=O)CC(=O)C Amb17593619 [0,2,0,0,0,0|0,0,1]=3 6572 B9R0.4 CCCOC(C)CC(C)N Amb25206456 [0,2,0,0,0,0|1,0,1]=4 6573 B9R0.4 CCCOC(C)CC(C)O Amb24423186 [0,2,0,0,0,0|0,0,2]=4 6574 B9R0.4 CCCOC(C)NC(N)=O Amb25060078 [0,2,0,0,0,0|2,0,0]=4 6575 B9R0.4 CCCO[C@H](C)CC(O)=O Amb24450437 [0,2,0,0,0,0|1,0,0]=3 6576 B9R0.4 CCCSC(C)CC(C)=O Amb24456282 [0,2,0,0,0,0|0,0,0]=2 6577 B9R0.4 CCCSC(C)CC(C)N Amb24734389 [0,2,0,0,0,0|1,0,1]=4 6578 B9R0.4 CCCSC(C)CC(N)=N Amb18792300 [0,2,0,0,0,0|2,0,0]=4 6579 B9R0.4 CCC\C=C(/C)\CC(C)=O Amb25146596 [0,2,0,0,0,0|0,0,1]=3 6580 B9R0.4 CCNCC(C)CC(C)Cl Amb24566425 [0,2,0,0,0,0|1,0,1]=4 6581 B9R0.4 CCNCC(O)CS(C)=O Amb25225761 [0,2,0,0,0,0|1,0,0]=3 6582 B9R0.4 CCNCC(O)OC(C)=O Amb24478853 [0,2,0,0,0,0|1,0,0]=3 6583 B9R0.4 CCOCC(C)CC(C)=O Amb25144963 [0,2,0,0,0,0|0,0,0]=2 6584 B9R0.4 CCOCC(C)CC(O)=O Amb18202330 [0,2,0,0,0,0|1,0,0]=3 6585 B9R0.4 CCOCC(C)NC(C)=N Amb24477913 [0,2,0,0,0,0|2,0,0]=4 6586 B9R0.4 CCOCC(C)NC(N)=O Amb25253424 [0,2,0,0,0,0|2,0,0]=4 6587 B9R0.4 CCOCC(C)OC(C)=O Amb22732225 [0,2,0,0,0,0|1,0,0]=3 6588 B9R0.4 CCOCC(Cl)CC(O)=O Amb24426131 [0,2,0,0,0,0|1,0,0]=3 6589 B9R0.4 CCOCC(N)CC(C)=C Amb25058742 [0,2,0,0,0,0|1,0,0]=3 6590 B9R0.4 CCOCC(O)C=C(C)C Amb25803049 [0,2,0,0,0,0|1,0,1]=4 6591 B9R0.4 CCOC[C@@H](C)OC(C)=O Amb24369884 [0,2,0,0,0,0|1,0,0]=3 6592 B9R0.4 CCOC[C@H](C)NC(C)=O Amb25086188 [0,2,0,0,0,0|1,0,0]=3 6593 B9R0.4 CCOC[C@H](CC(C)C)N Amb17061644 [0,2,0,0,0,0|1,0,1]=4 6594 B9R0.4 CCON=C(C)CC(C)=O Amb25371763 [0,2,0,0,0,0|1,0,1]=4 6595 B9R0.4 CCSCC(C)NC(C)=O Amb24697310 [0,2,0,0,0,0|1,0,0]=3 6596 B9R0.4 CCSCC(Cl)OC(C)=O Amb17940617 [0,2,0,0,0,0|1,0,0]=3 6597 B9R0.4 CCSCC(N)C=C(C)C Amb25046506 [0,2,0,0,0,0|1,0,1]=4 6598 B9R0.4 CCSCC(N)CC(C)=C Amb24363136 [0,2,0,0,0,0|1,0,0]=3 6599 B9R0.4 CCSCC(O)CC(C)=C Amb25692067 [0,2,0,0,0,0|1,0,0]=3 6600 B9R0.4 CC[ClH]CC(=O)CC([O-])=O Amb22274860 [0,2,0,0,0,0|1,0,1]=4 6601 B9R0.4 CC\C=C\C(C)CC(O)=O Amb18643922 [0,2,0,0,0,0|1,0,1]=4 6602 B9R0.4 CC\C=C\C(N)CC(N)=O Amb25241346 [0,2,0,0,0,0|1,0,1]=4 6603 B9R0.4 CC\C=C\C(N)CC(O)=O Amb25843767 [0,2,0,0,0,0|1,0,1]=4 6604 B9R0.4 CC\C=C\C(O)CC(O)=O Amb22831930 [0,2,0,0,0,0|1,0,1]=4 6605 B9R0.4 CN(C)CC(O)CCCO Amb24466217 [0,2,0,0,0,0|2,0,0]=4 6606 B9R0.4 CN(CCCF)CC(O)=O Amb24340278 [0,2,0,0,0,0|2,0,0]=4 6607 B9R0.4 CN(CCCI)CC(N)=O Amb25305970 [0,2,0,0,0,0|2,0,0]=4 6608 B9R0.4 CN(CCCN)CC(O)=O Amb25794990 [0,2,0,0,0,0|2,0,0]=4 6609 B9R0.4 CN(CCCO)CC(N)=O Amb25853093 [0,2,0,0,0,0|2,0,0]=4 6610 B9R0.4 CNCCC(C)CC(C)=C Amb25332578 [0,2,0,0,0,0|1,0,0]=3 6611 B9R0.4 CNCCC(C)CC(O)=O Amb24694269 [0,2,0,0,0,0|1,0,0]=3 6612 B9R0.4 CNCCC(O)CN(C)C Amb18644293 [0,2,0,0,0,0|2,0,0]=4 6613 B9R0.4 CNCCN(C)CC(C)=O Amb25853560 [0,2,0,0,0,0|1,0,0]=3 6614 B9R0.4 CNCCS(=O)CC(N)=O Amb25213853 [0,2,0,0,0,0|2,0,0]=4 6615 B9R0.4 CNCC[C@@H](N)CC(O)=O Amb24117036 [0,2,0,0,0,0|1,0,0]=3 6616 B9R0.4 CNCC[C@H](N)CC(O)=O Amb25789535 [0,2,0,0,0,0|1,0,0]=3 6617 B9R0.4 COCCC(C)CC(N)=O Amb25842751 [0,2,0,0,0,0|1,0,0]=3 6618 B9R0.4 COCCC(C)OC(C)=O Amb24482618 [0,2,0,0,0,0|1,0,0]=3 6619 B9R0.4 COCCC(N)C=C(C)C Amb24561586 [0,2,0,0,0,0|1,0,1]=4 6620 B9R0.4 COCCC(N)CC(C)=C Amb25724746 [0,2,0,0,0,0|1,0,0]=3 6621 B9R0.4 COCCC(N)CC(C)=O Amb25147726 [0,2,0,0,0,0|0,0,0]=2 6622 B9R0.4 COCCC(N)CN(C)C Amb25733819 [0,2,0,0,0,0|2,0,0]=4 6623 B9R0.4 COCCC(O)C=C(C)C Amb25851629 [0,2,0,0,0,0|1,0,1]=4 6624 B9R0.4 COCCC(O)CC(C)=C Amb25101354 [0,2,0,0,0,0|1,0,0]=3 6625 B9R0.4 COCCN(C)CC(C)=O Amb24642711 [0,2,0,0,0,0|1,0,0]=3 6626 B9R0.4 COCCN(C)CC(O)=O Amb22587006 [0,2,0,0,0,0|2,0,0]=4 6627 B9R0.4 COCCN(C)CC(O)=O Amb22587626 [0,2,0,0,0,0|2,0,0]=4 6628 B9R0.4 COCCS(=O)CC(C)=C Amb25344573 [0,2,0,0,0,0|2,0,0]=4 6629 B9R0.4 COCCS(=O)CC(C)=O Amb25277844 [0,2,0,0,0,0|1,0,0]=3 6630 B9R0.4 COCCS(=O)CC(O)=O Amb18792760 [0,2,0,0,0,0|2,0,0]=4 6631 B9R0.4 COCOC(C)CC(C)=O Amb25146513 [0,2,0,0,0,0|1,0,0]=3 6632 B9R0.4 COCO[C@H](C)CC(C)=O Amb25320140 [0,2,0,0,0,0|1,0,0]=3 6633 B9R0.4 COCO[C@H](C)CC(O)=O Amb24715879 [0,2,0,0,0,0|2,0,0]=4 6634 B9R0.4 CSCCC(C)NC(C)=N Amb25681700 [0,2,0,0,0,0|2,0,0]=4 6635 B9R0.4 CSCCC(N)CC(O)=O Amb22353181 [0,2,0,0,0,0|1,0,0]=3 6636 B9R0.4 CSCCC(N)CN(C)C Amb23511552 [0,2,0,0,0,0|2,0,0]=4 6637 B9R0.4 CSCCC(O)CC(O)=O Amb18798349 [0,2,0,0,0,0|1,0,0]=3 6638 B9R0.4 CSCC[C@@H](CC(=O)O)N Amb16184019 [0,2,0,0,0,0|1,0,0]=3 6639 B9R0.4 CSCC[C@H](N)CC(O)=O Amb22352993 [0,2,0,0,0,0|1,0,0]=3 6640 B9R0.4 CSCC[C@H](N)CN(C)C Amb24381963 [0,2,0,0,0,0|2,0,0]=4 6641 B9R0.4 C[C@@H](CCCN)CC(O)=O Amb24744945 [0,2,0,0,0,0|1,0,0]=3 6642 B9R0.4 C[C@@H](O)C[C@@H](N)CCCC Amb25234742 [0,2,0,0,0,0|0,0,2]=4 6643 B9R0.4 C[C@H](CC(C)=O)CCC=O Amb25131149 [0,2,0,0,0,0|0,0,1]=3 6644 B9R0.4 C[C@H](CC(O)=O)CCC#C Amb25064050 [0,2,0,0,0,0|1,0,1]=4 6645 B9R0.4 C[C@H](CC(O)=O)CCC=C Amb24674116 [0,2,0,0,0,0|1,0,1]=4 6646 B9R0.4 C[C@H](CC(O)=O)OCCO Amb24713383 [0,2,0,0,0,0|2,0,0]=4 6647 B9R0.4 C[C@H](CCCN)CC(O)=O Amb24715301 [0,2,0,0,0,0|1,0,0]=3 6648 B9R0.4 C[C@H](CCCS)CC(O)=O Amb24358051 [0,2,0,0,0,0|1,0,0]=3 6649 B9R0.4 C[C@H](O)C[C@H](O)CCCC Amb25284375 [0,2,0,0,0,0|0,0,2]=4 6650 B9R0.4 C\C(\CC(C)=O)=N\CCS Amb25073348 [0,2,0,0,0,0|1,0,1]=4 6651 B9R0.4 C\C(\N)=C\C(=O)CCCC Amb24608603 [0,2,0,0,0,0|1,0,1]=4 6652 B9R0.4 C\C(\O)=C/C(=O)CCCC Amb25146869 [0,2,0,0,0,0|0,0,2]=4 6653 B9R0.4 C\C(\O)=C\C(=O)CCCC Amb25729180 [0,2,0,0,0,0|0,0,2]=4 6654 B9R0.4 C\C=C/CC(C)CC(C)=O Amb25146817 [0,2,0,0,0,0|0,0,1]=3 6655 B9R0.4 C\C=C/OC(C)CC(C)=O Amb24415259 [0,2,0,0,0,0|0,0,2]=4 6656 B9R0.4 C\C=C\OC(C)CC(C)=O Amb24518461 [0,2,0,0,0,0|0,0,2]=4 6657 B9R0.4 NC(CCCS)CC(O)=O Amb24524306 [0,2,0,0,0,0|1,0,0]=3 6658 B9R0.4 NCCCC(N)CC(O)=O Amb18644278 [0,2,0,0,0,0|1,0,0]=3 6659 B9R0.4 NCCC[C@@H](N)CC(N)=O Amb25794069 [0,2,0,0,0,0|1,0,0]=3 6660 B9R0.4 NCCC[C@@H](N)CC(O)=O Amb24117039 [0,2,0,0,0,0|1,0,0]=3 6661 B9R0.4 NCCC[C@@H](N)CC(O)=O Amb24117927 [0,2,0,0,0,0|1,0,0]=3 6662 B9R0.4 NCCC[C@H](N)CC(O)=O Amb25757485 [0,2,0,0,0,0|1,0,0]=3 6663 B9R0.4 OC(=O)CS(=O)CCCF Amb25117795 [0,2,0,0,0,0|2,0,0]=4 6664 B9R0.4 O[C@@H](CCCBr)CC(O)=O Amb24605609 [0,2,0,0,0,0|1,0,0]=3 6665 B9R0.6 CC(=C)C(=O)C(C)CCC Amb25169347 [0,2,0,0,0,0|1,0,1]=4 6666 B9R0.6 CC(=O)C(=O)N(C)CCC Amb24357284 [0,2,0,0,0,0|1,0,1]=4 6667 B9R0.6 CC(=O)C(Br)C(=O)OCC Amb22232107 [0,2,0,0,0,0|1,0,1]=4 6668 B9R0.6 CC(=O)C(C)C(=O)NCC Amb24096571 [0,2,0,0,0,0|1,0,1]=4 6669 B9R0.6 CC(=O)C(N)C(=O)OCC Amb18124722 [0,2,0,0,0,0|1,0,1]=4 6670 B9R0.6 CC(=O)C(O)C(=O)CCC Amb25686201 [0,2,0,0,0,0|0,0,1]=3 6671 B9R0.6 CC(=O)C(O)C(O)CCO Amb24458926 [0,2,0,0,0,0|1,0,0]=3 6672 B9R0.6 CC(=O)[C@@H](O)C(=O)CCC Amb25317546 [0,2,0,0,0,0|0,0,1]=3 6673 B9R0.6 CC(=O)[C@@H](O)[C@H](O)CCO Amb24409676 [0,2,0,0,0,0|1,0,0]=3 6674 B9R0.6 CC(=O)[C@H](C)C(=O)OCC Amb24524695 [0,2,0,0,0,0|1,0,1]=4 6675 B9R0.6 CC(=O)[C@H](O)C(=O)CCC Amb25682412 [0,2,0,0,0,0|0,0,1]=3 6676 B9R0.6 CC(C(C)=O)N(C)CCO Amb24475705 [0,2,0,0,0,0|2,0,0]=4 6677 B9R0.6 CC(C(C)CCO)C(C)=C Amb25055319 [0,2,0,0,0,0|2,0,0]=4 6678 B9R0.6 CC(C(C)CNC)C(O)=O Amb25379230 [0,2,0,0,0,0|2,0,0]=4 6679 B9R0.6 CC(C(C)COC)C(C)=O Amb24701910 [0,2,0,0,0,0|1,0,0]=3 6680 B9R0.6 CC(C(C)COC)C(N)=O Amb25682872 [0,2,0,0,0,0|2,0,0]=4 6681 B9R0.6 CC(C(N)CCC)C(O)=O Amb24763852 [0,2,0,0,0,0|1,0,0]=3 6682 B9R0.6 CC(C(O)CCC)C(O)=O Amb18310700 [0,2,0,0,0,0|1,0,0]=3 6683 B9R0.6 CC(C(O)CCO)C(C)=C Amb25357402 [0,2,0,0,0,0|2,0,0]=4 6684 B9R0.6 CC(C(O)\C=C\C)C(C)=O Amb24380970 [0,2,0,0,0,0|0,0,2]=4 6685 B9R0.6 CC(C)C(Br)C(C)CCC Amb24421917 [0,2,0,0,0,0|1,0,1]=4 6686 B9R0.6 CC(C)C(C)C(Br)CCC Amb24677321 [0,2,0,0,0,0|1,0,1]=4 6687 B9R0.6 CC(C)C(C)C(Cl)CCC Amb24478420 [0,2,0,0,0,0|1,0,1]=4 6688 B9R0.6 CC(C)C(Cl)C(C)CCC Amb25792584 [0,2,0,0,0,0|1,0,1]=4 6689 B9R0.6 CC(C)C(N)C(C)CCC Amb25221571 [0,2,0,0,0,0|1,0,1]=4 6690 B9R0.6 CC(C)C(N)C(O)CCC Amb18644213 [0,2,0,0,0,0|1,0,1]=4 6691 B9R0.6 CC(C)C(O)C(O)CCC Amb25235412 [0,2,0,0,0,0|1,0,1]=4 6692 B9R0.6 CC(C)[C@@H](N)[C@@H](O)CCC Amb25147610 [0,2,0,0,0,0|1,0,1]=4 6693 B9R0.6 CC(C)[C@@H](N)[C@H](O)CCC Amb25082097 [0,2,0,0,0,0|1,0,1]=4 6694 B9R0.6 CC(CCC)C(Br)C(N)=O Amb24451592 [0,2,0,0,0,0|1,0,0]=3 6695 B9R0.6 CC(CCC)C(Cl)C(N)=O Amb18800738 [0,2,0,0,0,0|1,0,0]=3 6696 B9R0.6 CC(CCC)C(F)C(C)=O Amb25146866 [0,2,0,0,0,0|0,0,0]=2 6697 B9R0.6 CC(CCC)C(N)C(C)=C Amb25357806 [0,2,0,0,0,0|1,0,0]=3 6698 B9R0.6 CC(CCC)C(N)C(O)=O Amb20622789 [0,2,0,0,0,0|1,0,0]=3 6699 B9R0.6 CC(CCC)C(O)C(C)=C Amb25140812 [0,2,0,0,0,0|1,0,0]=3 6700 B9R0.6 CC(CCC)C(S)C(O)=O Amb24438702 [0,2,0,0,0,0|1,0,0]=3 6701 B9R0.6 CC(CCCl)C(N)C(O)=O Amb25803640 [0,2,0,0,0,0|2,0,0]=4 6702 B9R0.6 CC(CCN)C(N)C(O)=O Amb25309114 [0,2,0,0,0,0|2,0,0]=4 6703 B9R0.6 CC(CCO)C(N)C(O)=O Amb25054791 [0,2,0,0,0,0|2,0,0]=4 6704 B9R0.6 CC(CCO)C(O)C(C)=C Amb24704631 [0,2,0,0,0,0|2,0,0]=4 6705 B9R0.6 CC(CCO)C(O)C(O)=O Amb24392760 [0,2,0,0,0,0|2,0,0]=4 6706 B9R0.6 CC(CCO)[C@H](N)C(O)=O Amb24744497 [0,2,0,0,0,0|2,0,0]=4 6707 B9R0.6 CC(COC)C(N)C(N)=O Amb24468545 [0,2,0,0,0,0|2,0,0]=4 6708 B9R0.6 CC(COC)C(N)C(O)=O Amb24116980 [0,2,0,0,0,0|2,0,0]=4 6709 B9R0.6 CC(COC)[C@H](N)C(O)=O Amb25729786 [0,2,0,0,0,0|2,0,0]=4 6710 B9R0.6 CC(CSC)[C@@H](N)C(O)=O Amb24482316 [0,2,0,0,0,0|2,0,0]=4 6711 B9R0.6 CC(F)=C(F)C(O)CCC Amb24748256 [0,2,0,0,0,0|1,0,1]=4 6712 B9R0.6 CC(NCC)C(O)C(O)=O Amb25679409 [0,2,0,0,0,0|2,0,0]=4 6713 B9R0.6 CC(O)C(O)C(Br)CCC Amb25123722 [0,2,0,0,0,0|0,0,2]=4 6714 B9R0.6 CC(OCC)C(Br)C(O)=O Amb24416715 [0,2,0,0,0,0|2,0,0]=4 6715 B9R0.6 CC(OCC)[C@H](S)C(O)=O Amb25053429 [0,2,0,0,0,0|2,0,0]=4 6716 B9R0.6 CC([C@H](N)CCC)C(O)=O Amb25238448 [0,2,0,0,0,0|1,0,0]=3 6717 B9R0.6 CCCC(=O)C(C(=O)C)C Amb17593599 [0,2,0,0,0,0|0,0,1]=3 6718 B9R0.6 CCCC(Br)C(O)C(O)=O Amb25229083 [0,2,0,0,0,0|1,0,0]=3 6719 B9R0.6 CCCC(C(C(=O)C)C)O Amb17593628 [0,2,0,0,0,0|0,0,0]=2 6720 B9R0.6 CCCC(C(C(=O)O)N)F Amb10839857 [0,2,0,0,0,0|1,0,0]=3 6721 B9R0.6 CCCC(C)C(=O)C(O)=O Amb24747027 [0,2,0,0,0,0|1,0,1]=4 6722 B9R0.6 CCCC(C)C(C)C(C)=O Amb24396748 [0,2,0,0,0,0|0,0,0]=2 6723 B9R0.6 CCCC(C)C(C)C(C)Br Amb25042128 [0,2,0,0,0,0|1,0,1]=4 6724 B9R0.6 CCCC(C)C(C)C(C)Cl Amb25341724 [0,2,0,0,0,0|1,0,1]=4 6725 B9R0.6 CCCC(C)C(C)C(C)N Amb24687459 [0,2,0,0,0,0|1,0,1]=4 6726 B9R0.6 CCCC(C)C(C)C(N)=O Amb25361926 [0,2,0,0,0,0|1,0,0]=3 6727 B9R0.6 CCCC(C)C(O)C(C)N Amb25724654 [0,2,0,0,0,0|1,0,1]=4 6728 B9R0.6 CCCC(N)C(O)C(N)=O Amb20247342 [0,2,0,0,0,0|1,0,0]=3 6729 B9R0.6 CCCC(N)C(O)C(O)=O Amb20242874 [0,2,0,0,0,0|1,0,0]=3 6730 B9R0.6 CCCC(O)C(=C)C(O)=O Amb25131217 [0,2,0,0,0,0|1,0,1]=4 6731 B9R0.6 CCCC(O)C(Br)C(O)=O Amb24633342 [0,2,0,0,0,0|1,0,0]=3 6732 B9R0.6 CCCC(O)C(C)C(C)O Amb17779410 [0,2,0,0,0,0|0,0,2]=4 6733 B9R0.6 CCCC(O)C(Cl)[N+]([O-])=O Amb25258469 [0,2,0,0,0,0|2,0,0]=4 6734 B9R0.6 CCCC(O)C(N)C(N)=O Amb25375285 [0,2,0,0,0,0|1,0,0]=3 6735 B9R0.6 CCCC(O)C(N)C(O)=O Amb18124815 [0,2,0,0,0,0|1,0,0]=3 6736 B9R0.6 CCCC(O)[C@@H](N)C(O)=O Amb25268432 [0,2,0,0,0,0|1,0,0]=3 6737 B9R0.6 CCCC(S)[C@H](N)C(O)=O Amb24359854 [0,2,0,0,0,0|1,0,0]=3 6738 B9R0.6 CCCN(C)C(C)C(N)=O Amb25663070 [0,2,0,0,0,0|2,0,0]=4 6739 B9R0.6 CCCN(C)[C@@H](C)C(O)=O Amb25834811 [0,2,0,0,0,0|2,0,0]=4 6740 B9R0.6 CCCN(C)[C@H](C)C(N)=O Amb25686765 [0,2,0,0,0,0|2,0,0]=4 6741 B9R0.6 CCCS(=O)C(C)C(O)=O Amb18304634 [0,2,0,0,0,0|2,0,0]=4 6742 B9R0.6 CCC[C@@H](N)[C@@H](O)C(O)=O Amb22747816 [0,2,0,0,0,0|1,0,0]=3 6743 B9R0.6 CCC[C@@H](N)[C@H](O)C(O)=O Amb22747809 [0,2,0,0,0,0|1,0,0]=3 6744 B9R0.6 CCC[C@@H](O)[C@@H](N)C(O)=O Amb25367288 [0,2,0,0,0,0|1,0,0]=3 6745 B9R0.6 CCC[C@@H](O)[C@H](C)[C@H](C)O Amb24415014 [0,2,0,0,0,0|0,0,2]=4 6746 B9R0.6 CCC[C@@H](O)[C@H](N)C(O)=O Amb24715802 [0,2,0,0,0,0|1,0,0]=3 6747 B9R0.6 CCC[C@@H](O)[C@H](O)C(C)=O Amb25282703 [0,2,0,0,0,0|0,0,0]=2 6748 B9R0.6 CCC[C@@H](O)[C@H](O)C(O)=O Amb24480722 [0,2,0,0,0,0|1,0,0]=3 6749 B9R0.6 CCC[C@H](N)C(O)C(N)=O Amb25303990 [0,2,0,0,0,0|1,0,0]=3 6750 B9R0.6 CCC[C@H](N)[C@H](O)C(O)=O Amb25084552 [0,2,0,0,0,0|1,0,0]=3 6751 B9R0.6 CCC[C@H](O)[C@@H](Br)C(O)=O Amb25309541 [0,2,0,0,0,0|1,0,0]=3 6752 B9R0.6 CCC[C@H](O)[C@H](Br)C(O)=O Amb24727027 [0,2,0,0,0,0|1,0,0]=3 6753 B9R0.6 CCC[C@H](O)[C@H](C)[C@H](C)O Amb24431745 [0,2,0,0,0,0|0,0,2]=4 6754 B9R0.6 CCC[C@H](O)[C@H](N)C(O)=O Amb25113866 [0,2,0,0,0,0|1,0,0]=3 6755 B9R0.6 CCC\C(\C)=C(/C)\C(C)=O Amb25318975 [0,2,0,0,0,0|0,0,2]=4 6756 B9R0.6 CCOC(=O)C(C(=O)C)O Amb17593653 [0,2,0,0,0,0|1,0,1]=4 6757 B9R0.6 CNCC(C)N(C)C(C)=O Amb24096768 [0,2,0,0,0,0|2,0,0]=4 6758 B9R0.6 COCC(O)C(N)C(O)=O Amb25147551 [0,2,0,0,0,0|2,0,0]=4 6759 B9R0.6 CSCC(C)N(C)C(C)=O Amb24432891 [0,2,0,0,0,0|2,0,0]=4 6760 B9R0.6 CSCC(O)C(N)C(O)=O Amb18646340 [0,2,0,0,0,0|2,0,0]=4 6761 B9R0.6 C[C@@H](CCC)[C@H](O)C(C)=C Amb25136114 [0,2,0,0,0,0|1,0,0]=3 6762 B9R0.6 C[C@@H](CCC)[C@H](O)C(O)=O Amb25368297 [0,2,0,0,0,0|1,0,0]=3 6763 B9R0.6 C[C@@H](CCF)[C@H](N)C(O)=O Amb25147533 [0,2,0,0,0,0|2,0,0]=4 6764 B9R0.6 C[C@@H](CCO)[C@@H](O)C(C)=C Amb25346351 [0,2,0,0,0,0|2,0,0]=4 6765 B9R0.6 C[C@@H](CCO)[C@H](N)C(O)=O Amb25709206 [0,2,0,0,0,0|2,0,0]=4 6766 B9R0.6 C[C@@H](OCC)[C@@H](N)C(O)=O Amb22747686 [0,2,0,0,0,0|2,0,0]=4 6767 B9R0.6 C[C@@H]([C@@H](C(=O)O)N)OCC Amb10807408 [0,2,0,0,0,0|2,0,0]=4 6768 B9R0.6 C[C@@H]([C@@H](O)CCC)C(O)=O Amb24445556 [0,2,0,0,0,0|1,0,0]=3 6769 B9R0.6 C[C@@H]([C@H](O)CCC)C(O)=O Amb24529277 [0,2,0,0,0,0|1,0,0]=3 6770 B9R0.6 C[C@H](C(O)CCC)C(O)=O Amb25096562 [0,2,0,0,0,0|1,0,0]=3 6771 B9R0.6 C[C@H](CCC)[C@H](N)C(O)=O Amb25062732 [0,2,0,0,0,0|1,0,0]=3 6772 B9R0.6 C[C@H](CCC)[C@H](O)C(O)=O Amb25786123 [0,2,0,0,0,0|1,0,0]=3 6773 B9R0.6 C[C@H](CCF)[C@H](N)C(O)=O Amb25132099 [0,2,0,0,0,0|2,0,0]=4 6774 B9R0.6 C[C@H](CCO)[C@H](N)C(O)=O Amb25111969 [0,2,0,0,0,0|2,0,0]=4 6775 B9R0.6 C[C@H](CCO)[C@H](O)C(O)=O Amb25122108 [0,2,0,0,0,0|2,0,0]=4 6776 B9R0.6 C[C@H](CSC)[C@@H](N)C(O)=O Amb24642749 [0,2,0,0,0,0|2,0,0]=4 6777 B9R0.6 C[C@H](CSC)[C@H](N)C(O)=O Amb25851133 [0,2,0,0,0,0|2,0,0]=4 6778 B9R0.6 C[C@H](O)[C@@H](O)[C@@H](Br)CCC Amb24743463 [0,2,0,0,0,0|0,0,2]=4 6779 B9R0.6 C[C@H]([C@@H](O)CCC)C(C)=O Amb25145582 [0,2,0,0,0,0|0,0,0]=2 6780 B9R0.6 C[C@H]([C@@H](O)CCC)C(O)=O Amb25789993 [0,2,0,0,0,0|1,0,0]=3 6781 B9R0.6 C[C@H]([C@H](O)CCC)C(C)=O Amb25128812 [0,2,0,0,0,0|0,0,0]=2 6782 B9R0.6 C\C(=C/CC)\C(C)C(C)=O Amb25146561 [0,2,0,0,0,0|0,0,2]=4 6783 B9R0.6 C\C(=C/CC)\[C@@H](O)C(C)=O Amb25821326 [0,2,0,0,0,0|0,0,2]=4 6784 B9R0.6 C\C=C\C(C)C(C)C(C)=O Amb24570391 [0,2,0,0,0,0|0,0,2]=4 6785 B9R0.6 NC(C(S)CCO)C(O)=O Amb24724703 [0,2,0,0,0,0|2,0,0]=4 6786 B9R0.6 N[C@@H](C(S)CCO)C(O)=O Amb25320812 [0,2,0,0,0,0|2,0,0]=4 6787 B9R0.6 OCCC(O)C(O)C(O)=O Amb24482452 [0,2,0,0,0,0|2,0,0]=4 6788 B9R0.14 C=CC(CCO)CC(O)=O Amb24595877 [0,2,0,0,0,0|2,0,0]=4 6789 B9R0.14 C=C[C@H](CCO)CC(O)=O Amb24674139 [0,2,0,0,0,0|2,0,0]=4 6790 B9R0.14 CC(=O)CC(=NO)OCC Amb24646518 [0,2,0,0,0,0|1,0,1]=4 6791 B9R0.14 CC(=O)CC(CCO)CO Amb24586786 [0,2,0,0,0,0|1,0,0]=3 6792 B9R0.14 CC(=O)CC(CO)CC=C Amb25142660 [0,2,0,0,0,0|0,0,2]=4 6793 B9R0.14 CC(=O)NC(CCC)=NC Amb24741054 [0,2,0,0,0,0|1,0,1]=4 6794 B9R0.14 CC(=O)OC(CBr)CCO Amb24616879 [0,2,0,0,0,0|2,0,0]=4 6795 B9R0.14 CC(=O)OC(CCBr)CBr Amb24561129 [0,2,0,0,0,0|2,0,0]=4 6796 B9R0.14 CC(=O)OC(CCCl)C#C Amb24117909 [0,2,0,0,0,0|2,0,0]=4 6797 B9R0.14 CC(=O)OC(CCCl)CCl Amb22359668 [0,2,0,0,0,0|2,0,0]=4 6798 B9R0.14 CC(=O)O[C@H](CCO)C#C Amb24735085 [0,2,0,0,0,0|2,0,0]=4 6799 B9R0.14 CC(=O)\C=C(\CCC)/OC Amb24504940 [0,2,0,0,0,0|0,0,2]=4 6800 B9R0.14 CC(C)CC(CBr)CCC Amb25712263 [0,2,0,0,0,0|1,0,1]=4 6801 B9R0.14 CC(C)CC(CCC)C=O Amb25119191 [0,2,0,0,0,0|1,0,1]=4 6802 B9R0.14 CC(C)CC(CCl)CCC Amb25039933 [0,2,0,0,0,0|1,0,1]=4 6803 B9R0.14 CC(C)CC(CN)CCC Amb25301156 [0,2,0,0,0,0|1,0,1]=4 6804 B9R0.14 CC(C)C[C@H](CO)CCC Amb24748268 [0,2,0,0,0,0|1,0,1]=4 6805 B9R0.14 CC(O)CC(CCC)SC Amb25723606 [0,2,0,0,0,0|0,0,2]=4 6806 B9R0.14 CC(O)CC(CO)CCC Amb25847449 [0,2,0,0,0,0|0,0,2]=4 6807 B9R0.14 CCC(CC#N)CC(C)=O Amb24698909 [0,2,0,0,0,0|1,0,1]=4 6808 B9R0.14 CCC(CC(N)=O)NCC Amb24682966 [0,2,0,0,0,0|2,0,0]=4 6809 B9R0.14 CCC(CC(N)=O)OCC Amb24502290 [0,2,0,0,0,0|2,0,0]=4 6810 B9R0.14 CCC(CC(O)=O)SCC Amb18788141 [0,2,0,0,0,0|2,0,0]=4 6811 B9R0.14 CCC(CC=C)CC(C)=O Amb24478304 [0,2,0,0,0,0|0,0,2]=4 6812 B9R0.14 CCC(CCBr)NC(C)=O Amb24375542 [0,2,0,0,0,0|2,0,0]=4 6813 B9R0.14 CCC(CCC)NC(C)=O Amb25327258 [0,2,0,0,0,0|1,0,0]=3 6814 B9R0.14 CCC(CCC)OC(N)=O Amb25848639 [0,2,0,0,0,0|2,0,0]=4 6815 B9R0.14 CCC(CCCl)NC(C)=O Amb25248606 [0,2,0,0,0,0|2,0,0]=4 6816 B9R0.14 CCC(CCCl)OC(C)=O Amb25744059 [0,2,0,0,0,0|2,0,0]=4 6817 B9R0.14 CCC(CCN)NC(C)=O Amb19028043 [0,2,0,0,0,0|2,0,0]=4 6818 B9R0.14 CCC(CCO)NC(C)=O Amb25265131 [0,2,0,0,0,0|2,0,0]=4 6819 B9R0.14 CCC(COC)CC(O)=O Amb18202336 [0,2,0,0,0,0|2,0,0]=4 6820 B9R0.14 CCC(COC)NC(C)=O Amb25799274 [0,2,0,0,0,0|2,0,0]=4 6821 B9R0.14 CCCC(C#C)NC(N)=O Amb24391478 [0,2,0,0,0,0|2,0,0]=4 6822 B9R0.14 CCCC(C#C)NS(C)=O Amb25177284 [0,2,0,0,0,0|2,0,0]=4 6823 B9R0.14 CCCC(C#N)NC(C)=O Amb24477998 [0,2,0,0,0,0|1,0,0]=3 6824 B9R0.14 CCCC(C=C(C)C)NN Amb25775740 [0,2,0,0,0,0|1,0,1]=4 6825 B9R0.14 CCCC(C=C)NC(C)=O Amb25125308 [0,2,0,0,0,0|1,0,0]=3 6826 B9R0.14 CCCC(C=C)OC(C)=O Amb22227963 [0,2,0,0,0,0|1,0,0]=3 6827 B9R0.14 CCCC(C=O)OC(C)=O Amb18644107 [0,2,0,0,0,0|1,0,0]=3 6828 B9R0.14 CCCC(CBr)CN(C)C Amb25054970 [0,2,0,0,0,0|2,0,0]=4 6829 B9R0.14 CCCC(CBr)OC(C)=O Amb24399943 [0,2,0,0,0,0|1,0,0]=3 6830 B9R0.14 CCCC(CC(=O)Cl)CC Amb25090544 [0,2,0,0,0,0|1,0,0]=3 6831 B9R0.14 CCCC(CC(C)=C)NN Amb25054242 [0,2,0,0,0,0|1,0,0]=3 6832 B9R0.14 CCCC(CC(C)=O)C#N Amb25714287 [0,2,0,0,0,0|0,0,0]=2 6833 B9R0.14 CCCC(CC(C)=O)C=C Amb24478388 [0,2,0,0,0,0|0,0,0]=2 6834 B9R0.14 CCCC(CC(C)=O)OC Amb25076204 [0,2,0,0,0,0|0,0,0]=2 6835 B9R0.14 CCCC(CC(N)=O)C=C Amb24712938 [0,2,0,0,0,0|1,0,0]=3 6836 B9R0.14 CCCC(CC(N)=O)NC Amb25069096 [0,2,0,0,0,0|1,0,0]=3 6837 B9R0.14 CCCC(CC(O)=O)C#C Amb25330154 [0,2,0,0,0,0|1,0,0]=3 6838 B9R0.14 CCCC(CC(O)=O)CC Amb18124694 [0,2,0,0,0,0|1,0,0]=3 6839 B9R0.14 CCCC(CC(O)=O)CO Amb24509175 [0,2,0,0,0,0|1,0,0]=3 6840 B9R0.14 CCCC(CC(O)=O)OC Amb25844554 [0,2,0,0,0,0|1,0,0]=3 6841 B9R0.14 CCCC(CCl)CC(C)=C Amb25132141 [0,2,0,0,0,0|1,0,0]=3 6842 B9R0.14 CCCC(CCl)OC(C)=O Amb24480605 [0,2,0,0,0,0|1,0,0]=3 6843 B9R0.14 CCCC(CN(C)C)C=O Amb18644037 [0,2,0,0,0,0|2,0,0]=4 6844 B9R0.14 CCCC(CN(C)C)NC Amb25208897 [0,2,0,0,0,0|2,0,0]=4 6845 B9R0.14 CCCC(CN)CC(O)=O Amb24587738 [0,2,0,0,0,0|1,0,0]=3 6846 B9R0.14 CCCC(CN)CN(C)C Amb25822653 [0,2,0,0,0,0|2,0,0]=4 6847 B9R0.14 CCCC(CN)NC(N)=O Amb24357472 [0,2,0,0,0,0|2,0,0]=4 6848 B9R0.14 CCCC(CO)CC(C)=O Amb24708488 [0,2,0,0,0,0|0,0,0]=2 6849 B9R0.14 CCCC(CS(C)=O)NC Amb25806877 [0,2,0,0,0,0|1,0,0]=3 6850 B9R0.14 CCCN(CC(N)=O)C=O Amb24482824 [0,2,0,0,0,0|2,0,0]=4 6851 B9R0.14 CCCN(CC(N)=O)CC Amb25849535 [0,2,0,0,0,0|2,0,0]=4 6852 B9R0.14 CCCN(CC(O)=O)C=O Amb18307978 [0,2,0,0,0,0|2,0,0]=4 6853 B9R0.14 CCC[C@@H](CC(C)=O)C#N Amb25358879 [0,2,0,0,0,0|0,0,0]=2 6854 B9R0.14 CCC[C@@H](CN)CC(O)=O Amb25835673 [0,2,0,0,0,0|1,0,0]=3 6855 B9R0.14 CCC[C@@H](CO)OC(C)=O Amb25307611 [0,2,0,0,0,0|1,0,0]=3 6856 B9R0.14 CCC[C@H](C=C)NC(C)=O Amb24434937 [0,2,0,0,0,0|1,0,0]=3 6857 B9R0.14 CCC[C@H](CC(C)=O)CC Amb24646153 [0,2,0,0,0,0|0,0,0]=2 6858 B9R0.14 CCC[C@H](CC(O)=O)CC Amb24480703 [0,2,0,0,0,0|1,0,0]=3 6859 B9R0.14 CCNC(CC(N)=O)C#N Amb25306677 [0,2,0,0,0,0|2,0,0]=4 6860 B9R0.14 CCOC(CBr)OC(C)=O Amb25141497 [0,2,0,0,0,0|2,0,0]=4 6861 B9R0.14 CCOC(CC(N)=O)CN Amb24505233 [0,2,0,0,0,0|2,0,0]=4 6862 B9R0.14 CCOC(CC(O)=O)C#N Amb24480747 [0,2,0,0,0,0|2,0,0]=4 6863 B9R0.14 CCOC(CCl)OC(C)=O Amb25129465 [0,2,0,0,0,0|2,0,0]=4 6864 B9R0.14 CCOC(CN)CC(O)=O Amb24672836 [0,2,0,0,0,0|2,0,0]=4 6865 B9R0.14 CCOC(CN)CS(C)=O Amb24669032 [0,2,0,0,0,0|2,0,0]=4 6866 B9R0.14 CCO[C@@H](CC(O)=O)C#N Amb24383647 [0,2,0,0,0,0|2,0,0]=4 6867 B9R0.14 CC[C@@H](CC=O)CC(C)=O Amb25768389 [0,2,0,0,0,0|1,0,1]=4 6868 B9R0.14 CC[C@H](CC=O)CC(C)=O Amb25299211 [0,2,0,0,0,0|1,0,1]=4 6869 B9R0.14 COC(CC(O)=O)OCC Amb24682697 [0,2,0,0,0,0|2,0,0]=4 6870 B9R0.14 COCC(C#N)OC(C)=O Amb24482599 [0,2,0,0,0,0|2,0,0]=4 6871 B9R0.14 COCC(C=C)NC(C)=O Amb24355098 [0,2,0,0,0,0|2,0,0]=4 6872 B9R0.14 COCC(CBr)NC(C)=O Amb25725579 [0,2,0,0,0,0|2,0,0]=4 6873 B9R0.14 COCC(CN)NC(C)=O Amb24475242 [0,2,0,0,0,0|2,0,0]=4 6874 B9R0.14 COCC(CO)NC(C)=O Amb25324512 [0,2,0,0,0,0|2,0,0]=4 6875 B9R0.14 COCC(CO)OC(C)=O Amb25098534 [0,2,0,0,0,0|2,0,0]=4 6876 B9R0.14 COC[C@@H](CO)OC(C)=O Amb24430030 [0,2,0,0,0,0|2,0,0]=4 6877 B9R0.14 CS(=O)CC(CC)NCC Amb25139771 [0,2,0,0,0,0|2,0,0]=4 6878 B9R0.14 CSCC(CC(O)=O)SC Amb25201534 [0,2,0,0,0,0|2,0,0]=4 6879 B9R0.14 C\C=C\C(CC(C)=O)C#C Amb24512772 [0,2,0,0,0,0|0,0,2]=4 6880 B9R0.14 C\C=C\C(CC(C)=O)CC Amb24454326 [0,2,0,0,0,0|0,0,2]=4 6881 B9R0.14 C\C=C\C(CC(C)=O)OC Amb25091874 [0,2,0,0,0,0|0,0,2]=4 6882 B9R0.23 CC(=C)CC(=O)C(O)CC Amb25255917 [0,2,0,0,0,0|1,0,1]=4 6883 B9R0.23 CC(=C)CC(C)C(=O)CC Amb25690530 [0,2,0,0,0,0|1,0,1]=4 6884 B9R0.23 CC(=C)CC(F)C(O)CO Amb25043250 [0,2,0,0,0,0|2,0,0]=4 6885 B9R0.23 CC(=C)CC(O)C(Cl)CCl Amb24677658 [0,2,0,0,0,0|2,0,0]=4 6886 B9R0.23 CC(=C)CC(O)C(F)CO Amb25222216 [0,2,0,0,0,0|2,0,0]=4 6887 B9R0.23 CC(=C)C[C@@H](O)[C@@H](Cl)CCl Amb24627042 [0,2,0,0,0,0|2,0,0]=4 6888 B9R0.23 CC(=C)C[C@H](O)[C@@H](Cl)CCl Amb24677674 [0,2,0,0,0,0|2,0,0]=4 6889 B9R0.23 CC(=C)C[C@H](O)[C@H](Cl)CCl Amb24651096 [0,2,0,0,0,0|2,0,0]=4 6890 B9R0.23 CC(=O)CC(=O)C(C)CC Amb24544654 [0,2,0,0,0,0|0,0,1]=3 6891 B9R0.23 CC(=O)CC(=O)N(O)CC Amb24560535 [0,2,0,0,0,0|1,0,1]=4 6892 B9R0.23 CC(=O)CC(N)C(=O)OC Amb25367296 [0,2,0,0,0,0|1,0,1]=4 6893 B9R0.23 CC(=O)CC(O)C(=O)CC Amb25767775 [0,2,0,0,0,0|0,0,1]=3 6894 B9R0.23 CC(=O)CC(O)C(Cl)C=C Amb24477069 [0,2,0,0,0,0|0,0,2]=4 6895 B9R0.23 CC(=O)CC(O)C(O)CO Amb24737444 [0,2,0,0,0,0|1,0,0]=3 6896 B9R0.23 CC(=O)C[C@@H](O)C(=O)OC Amb24408458 [0,2,0,0,0,0|1,0,1]=4 6897 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,2,0,0,0,0|1,0,0]=3 6898 B9R0.23 CC(=O)C[C@@H](O)[C@H](Cl)C=C Amb25111101 [0,2,0,0,0,0|0,0,2]=4 6899 B9R0.23 CC(=O)C[C@H](O)C(=O)OC Amb25146504 [0,2,0,0,0,0|1,0,1]=4 6900 B9R0.23 CC(=O)OC(=C)C(Br)CC Amb25790345 [0,2,0,0,0,0|1,0,1]=4 6901 B9R0.23 CC(=O)OC(Cl)C(Cl)CCl Amb25771056 [0,2,0,0,0,0|2,0,0]=4 6902 B9R0.23 CC(C(CC(=O)O)N)CC Amb2438880 [0,2,0,0,0,0|1,0,0]=3 6903 B9R0.23 CC(C)CC(C)C(Br)CC Amb25116718 [0,2,0,0,0,0|1,0,1]=4 6904 B9R0.23 CC(C)CC(C)C(N)CC Amb18202424 [0,2,0,0,0,0|1,0,1]=4 6905 B9R0.23 CC(C)CC(Cl)C(C)CC Amb25827471 [0,2,0,0,0,0|1,0,1]=4 6906 B9R0.23 CC(C)CC(N)C(O)CC Amb18201587 [0,2,0,0,0,0|1,0,1]=4 6907 B9R0.23 CC(C)CC(O)C(N)CC Amb18201727 [0,2,0,0,0,0|1,0,1]=4 6908 B9R0.23 CC(C)C[C@H](N)C(O)CC Amb25324435 [0,2,0,0,0,0|1,0,1]=4 6909 B9R0.23 CC(C)C[C@H](N)[C@@H](O)CC Amb25378738 [0,2,0,0,0,0|1,0,1]=4 6910 B9R0.23 CC(C)C[C@H](N)[C@H](O)CC Amb25147537 [0,2,0,0,0,0|1,0,1]=4 6911 B9R0.23 CC(C=C)C(O)CC(C)=O Amb24592151 [0,2,0,0,0,0|0,0,2]=4 6912 B9R0.23 CC(CC(C)=C)C(O)CC Amb24529238 [0,2,0,0,0,0|1,0,0]=3 6913 B9R0.23 CC(CC(O)=O)C(N)CC Amb25820735 [0,2,0,0,0,0|1,0,0]=3 6914 B9R0.23 CC(CC)C(Cl)OC(C)=O Amb24509719 [0,2,0,0,0,0|1,0,0]=3 6915 B9R0.23 CC(CC)C(N)CC(N)=O Amb25312995 [0,2,0,0,0,0|1,0,0]=3 6916 B9R0.23 CC(CC)C(O)CC(O)=O Amb18310690 [0,2,0,0,0,0|1,0,0]=3 6917 B9R0.23 CC(CC)C(O)CN(C)C Amb25305264 [0,2,0,0,0,0|2,0,0]=4 6918 B9R0.23 CC(CC)[C@@H](N)CC(N)=O Amb25823252 [0,2,0,0,0,0|1,0,0]=3 6919 B9R0.23 CC(CC)[C@H](N)CC(O)=O Amb25117039 [0,2,0,0,0,0|1,0,0]=3 6920 B9R0.23 CC(CC)[C@H](N)CN(C)C Amb24356504 [0,2,0,0,0,0|2,0,0]=4 6921 B9R0.23 CC(CC)[C@H](O)CC(C)=C Amb25085716 [0,2,0,0,0,0|1,0,0]=3 6922 B9R0.23 CC(CN(C)C)C(O)CC Amb25069671 [0,2,0,0,0,0|2,0,0]=4 6923 B9R0.23 CC(CO)C(O)CC(C)=C Amb25333528 [0,2,0,0,0,0|2,0,0]=4 6924 B9R0.23 CC(NC(C)=O)C(C)CBr Amb24723278 [0,2,0,0,0,0|2,0,0]=4 6925 B9R0.23 CC(NC(C)=O)C(C)CCl Amb25147745 [0,2,0,0,0,0|2,0,0]=4 6926 B9R0.23 CC(NC(C)=O)C(Cl)CC Amb25286454 [0,2,0,0,0,0|1,0,0]=3 6927 B9R0.23 CC(NC(N)=O)C(O)CC Amb24584317 [0,2,0,0,0,0|2,0,0]=4 6928 B9R0.23 CC(OC(C)=O)C(O)CC Amb25225668 [0,2,0,0,0,0|1,0,0]=3 6929 B9R0.23 CC(OC(C)=O)C(O)CCl Amb25367346 [0,2,0,0,0,0|2,0,0]=4 6930 B9R0.23 CC(OC(C)=O)C(O)OC Amb24481205 [0,2,0,0,0,0|2,0,0]=4 6931 B9R0.23 CC(OC(C)=O)[C@H](C)CCl Amb24480603 [0,2,0,0,0,0|2,0,0]=4 6932 B9R0.23 CC(OC)C(C)CC(O)=O Amb18202340 [0,2,0,0,0,0|2,0,0]=4 6933 B9R0.23 CC(OC)C(N)CC(C)=C Amb24745048 [0,2,0,0,0,0|2,0,0]=4 6934 B9R0.23 CCC(=C)C(N)CC(O)=O Amb25068441 [0,2,0,0,0,0|1,0,1]=4 6935 B9R0.23 CCC(=O)[C@@H](C)CC(O)=O Amb24504994 [0,2,0,0,0,0|1,0,1]=4 6936 B9R0.23 CCC(=O)[C@H](C)CC(O)=O Amb24426900 [0,2,0,0,0,0|1,0,1]=4 6937 B9R0.23 CCC(C)C(=C)CC(O)=O Amb24451006 [0,2,0,0,0,0|1,0,1]=4 6938 B9R0.23 CCC(C)C(C)CC(C)Br Amb24459573 [0,2,0,0,0,0|1,0,1]=4 6939 B9R0.23 CCC(C)C(C)CC(C)N Amb24604991 [0,2,0,0,0,0|1,0,1]=4 6940 B9R0.23 CCC(C)C(C)CC(O)=O Amb18304200 [0,2,0,0,0,0|1,0,0]=3 6941 B9R0.23 CCC(C)C(C)NC(C)=N Amb24466538 [0,2,0,0,0,0|2,0,0]=4 6942 B9R0.23 CCC(C)C(C)NC(N)=O Amb25261427 [0,2,0,0,0,0|2,0,0]=4 6943 B9R0.23 CCC(C)C(C)OC(N)=O Amb25732527 [0,2,0,0,0,0|2,0,0]=4 6944 B9R0.23 CCC(C)C(O)CC(C)O Amb25796350 [0,2,0,0,0,0|0,0,2]=4 6945 B9R0.23 CCC(C)S(=O)CC(O)=O Amb18523822 [0,2,0,0,0,0|2,0,0]=4 6946 B9R0.23 CCC(Cl)C(O)CC(C)=C Amb25256305 [0,2,0,0,0,0|1,0,0]=3 6947 B9R0.23 CCC(Cl)C(O)CC(C)=O Amb25321887 [0,2,0,0,0,0|0,0,0]=2 6948 B9R0.23 CCC(Cl)C(O)CC(O)=O Amb25111208 [0,2,0,0,0,0|1,0,0]=3 6949 B9R0.23 CCC(O)C(C)CC(C)O Amb24529317 [0,2,0,0,0,0|0,0,2]=4 6950 B9R0.23 CCC(O)C(O)CC(C)=C Amb25043880 [0,2,0,0,0,0|1,0,0]=3 6951 B9R0.23 CCC(O)C(O)CC(O)=O Amb25132101 [0,2,0,0,0,0|1,0,0]=3 6952 B9R0.23 CCN(C)C(C)CC(O)=O Amb22587145 [0,2,0,0,0,0|2,0,0]=4 6953 B9R0.23 CCN(O)C(C)CC(O)=O Amb25379050 [0,2,0,0,0,0|2,0,0]=4 6954 B9R0.23 CCS(=O)C(C)CC(C)=O Amb24593680 [0,2,0,0,0,0|1,0,0]=3 6955 B9R0.23 CCS(=O)C(C)CC(O)=O Amb19012075 [0,2,0,0,0,0|2,0,0]=4 6956 B9R0.23 CC[C@@H](C)[C@H](C)CC(O)=O Amb24715562 [0,2,0,0,0,0|1,0,0]=3 6957 B9R0.23 CC[C@H](O)[C@H](N)CC(O)=O Amb25204323 [0,2,0,0,0,0|1,0,0]=3 6958 B9R0.23 COC(O)C(O)CC(O)=O Amb24650997 [0,2,0,0,0,0|2,0,0]=4 6959 B9R0.23 C[C@@H](C=C)[C@H](C)CC(C)=O Amb25859239 [0,2,0,0,0,0|0,0,2]=4 6960 B9R0.23 C[C@@H](CC([O-])=O)C(O)CO Amb24334935 [0,2,0,0,0,0|2,0,0]=4 6961 B9R0.23 C[C@@H](CC)[C@@H](O)CC(O)=O Amb25068472 [0,2,0,0,0,0|1,0,0]=3 6962 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb19944304 [0,2,0,0,0,0|1,0,0]=3 6963 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb25068405 [0,2,0,0,0,0|1,0,0]=3 6964 B9R0.23 C[C@@H](CC)[C@H](O)CC(O)=O Amb24409363 [0,2,0,0,0,0|1,0,0]=3 6965 B9R0.23 C[C@@H]([C@@H](CC(=O)O)N)CC Amb16184028 [0,2,0,0,0,0|1,0,0]=3 6966 B9R0.23 C[C@H](C=C)[C@@H](O)CC(C)=O Amb25846221 [0,2,0,0,0,0|0,0,2]=4 6967 B9R0.23 C[C@H](CC(O)=O)[C@H](O)CN Amb25131743 [0,2,0,0,0,0|2,0,0]=4 6968 B9R0.23 C[C@H](CC)[C@@H](N)CC(O)=O Amb25689818 [0,2,0,0,0,0|1,0,0]=3 6969 B9R0.23 C[C@H](CN(C)C)[C@@H](O)CC Amb25285655 [0,2,0,0,0,0|2,0,0]=4 6970 B9R0.23 C[C@H](CN(C)C)[C@H](O)CC Amb25346286 [0,2,0,0,0,0|2,0,0]=4 6971 B9R0.23 C[C@H](CO)[C@H](O)CC(C)=C Amb25760423 [0,2,0,0,0,0|2,0,0]=4 6972 B9R0.23 C[C@H](NC(C)=O)[C@@H](O)CC Amb25730625 [0,2,0,0,0,0|1,0,0]=3 6973 B9R0.23 C[C@H](NC(C)=O)[C@H](O)CC Amb24427505 [0,2,0,0,0,0|1,0,0]=3 6974 B9R0.23 C[C@H](OC(C)=O)[C@@H](Cl)CC Amb24634242 [0,2,0,0,0,0|1,0,0]=3 6975 B9R0.23 C[C@H]([C@H](CC(=O)O)N)CC Amb16184016 [0,2,0,0,0,0|1,0,0]=3 6976 B9R0.23 C\C(=C/C(C)=O)\C(C)CC Amb25142682 [0,2,0,0,0,0|0,0,2]=4 6977 B9R0.23 C\C(=C/C)\C(O)CC(C)=O Amb24578333 [0,2,0,0,0,0|0,0,2]=4 6978 B9R0.23 C\C(=C\C(C)=O)\C(C)CC Amb25718396 [0,2,0,0,0,0|0,0,2]=4 6979 B9R0.23 C\C(=C\C)\C(O)CC(C)=O Amb24686498 [0,2,0,0,0,0|0,0,2]=4 6980 B9R0.23 NC(=O)CC(O)C(O)CO Amb25139467 [0,2,0,0,0,0|2,0,0]=4 6981 B9R0.23 NC(CC(N)=O)C(O)CO Amb24460353 [0,2,0,0,0,0|2,0,0]=4 6982 B9R0.23 N[C@@H](CC(O)=O)[C@@H](N)CO Amb25788533 [0,2,0,0,0,0|2,0,0]=4 6983 B9R0.23 OC[C@@H](O)[C@@H](O)CC(O)=O Amb24509722 [0,2,0,0,0,0|2,0,0]=4 6984 B9R0.23 OC[C@@H](O)[C@H](O)CC(O)=O Amb25258026 [0,2,0,0,0,0|2,0,0]=4 6985 B9R0.23 OC[C@H](O)[C@H](O)CC(O)=O Amb24726353 [0,2,0,0,0,0|2,0,0]=4 6986 B9R0.34 CC#CC(O)CC(=O)OC Amb25094142 [0,2,0,0,0,0|0,0,2]=4 6987 B9R0.34 CC(CC(=C)CC)NCC Amb25032485 [0,2,0,0,0,0|2,0,0]=4 6988 B9R0.34 CC(CC(=O)CC)NCC Amb24480804 [0,2,0,0,0,0|1,0,0]=3 6989 B9R0.34 CC(CC(=O)CC)OCC Amb24631573 [0,2,0,0,0,0|1,0,0]=3 6990 B9R0.34 CC(CC(O)CCC)CO Amb24529165 [0,2,0,0,0,0|0,0,2]=4 6991 B9R0.34 CC(CC(O)CCC)NC Amb24685190 [0,2,0,0,0,0|1,0,1]=4 6992 B9R0.34 CC(CCC)=CC(=O)OC Amb25347310 [0,2,0,0,0,0|0,0,2]=4 6993 B9R0.34 CC(CCC)CC(C)CC Amb22229086 [0,2,0,0,0,0|1,0,1]=4 6994 B9R0.34 CC(CCC)CC(N)CC Amb25309654 [0,2,0,0,0,0|1,0,1]=4 6995 B9R0.34 CC(CCC)CC(O)C=O Amb25778304 [0,2,0,0,0,0|1,0,1]=4 6996 B9R0.34 CC(CCC)CC(O)CCl Amb24418324 [0,2,0,0,0,0|0,0,2]=4 6997 B9R0.34 CC(CCC)CC(O)CN Amb24718688 [0,2,0,0,0,0|0,0,2]=4 6998 B9R0.34 CC(CCN)CC(=O)NO Amb25210106 [0,2,0,0,0,0|2,0,0]=4 6999 B9R0.34 CC(CCO)NC(=O)CN Amb24375622 [0,2,0,0,0,0|2,0,0]=4 7000 B9R0.34 CC(CCO)NC(=O)CS Amb24479315 [0,2,0,0,0,0|2,0,0]=4 7001 B9R0.34 CC(CCO)OC(=O)CS Amb25345165 [0,2,0,0,0,0|2,0,0]=4 7002 B9R0.34 CC(CS(=O)CC)NCC Amb25730346 [0,2,0,0,0,0|2,0,0]=4 7003 B9R0.34 CC(NC(=O)CBr)COC Amb17327377 [0,2,0,0,0,0|2,0,0]=4 7004 B9R0.34 CC(NC(=O)CCl)COC Amb1204382 [0,2,0,0,0,0|2,0,0]=4 7005 B9R0.34 CCC(=C)CC(O)COC Amb24405482 [0,2,0,0,0,0|2,0,0]=4 7006 B9R0.34 CCC(=N)NC(C)CCC Amb24387583 [0,2,0,0,0,0|2,0,0]=4 7007 B9R0.34 CCC(=O)C=C(Cl)CCC Amb24760119 [0,2,0,0,0,0|0,0,2]=4 7008 B9R0.34 CCC(=O)CC(=S)OCC Amb25834381 [0,2,0,0,0,0|1,0,1]=4 7009 B9R0.34 CCC(=O)CC(C)CC=C Amb25712973 [0,2,0,0,0,0|0,0,2]=4 7010 B9R0.34 CCC(=O)CC(C)COC Amb25315701 [0,2,0,0,0,0|1,0,0]=3 7011 B9R0.34 CCC(=O)CC(O)CCO Amb24662474 [0,2,0,0,0,0|1,0,0]=3 7012 B9R0.34 CCC(=O)C[C@H](C)CC=C Amb24620054 [0,2,0,0,0,0|0,0,2]=4 7013 B9R0.34 CCC(=O)NC(C)CCBr Amb25247063 [0,2,0,0,0,0|2,0,0]=4 7014 B9R0.34 CCC(=O)NC(C)CCN Amb25809430 [0,2,0,0,0,0|2,0,0]=4 7015 B9R0.34 CCC(=O)NC(C)CCO Amb24479310 [0,2,0,0,0,0|2,0,0]=4 7016 B9R0.34 CCC(=O)N[C@@H](C)CCO Amb24482920 [0,2,0,0,0,0|2,0,0]=4 7017 B9R0.34 CCC(=O)N[C@H](C)COC Amb25120535 [0,2,0,0,0,0|2,0,0]=4 7018 B9R0.34 CCC(=O)OC(C)CCC Amb25044387 [0,2,0,0,0,0|1,0,0]=3 7019 B9R0.34 CCCC(=N)NC(=O)OC Amb24409618 [0,2,0,0,0,0|1,0,1]=4 7020 B9R0.34 CCCC(=O)CC(=O)C#N Amb25128286 [0,2,0,0,0,0|0,0,2]=4 7021 B9R0.34 CCCC(=O)CC(=O)NN Amb25066431 [0,2,0,0,0,0|1,0,1]=4 7022 B9R0.34 CCCC(=O)NC(=O)CCl Amb24660479 [0,2,0,0,0,0|1,0,1]=4 7023 B9R0.34 CCCC(=O)OC(=O)CCl Amb25809476 [0,2,0,0,0,0|1,0,1]=4 7024 B9R0.34 CCCC(Br)CC(=O)OC Amb25278221 [0,2,0,0,0,0|0,0,0]=2 7025 B9R0.34 CCCC(C)CC(=O)C=C Amb24432206 [0,2,0,0,0,0|0,0,1]=3 7026 B9R0.34 CCCC(C)CC(=O)CC Amb25363636 [0,2,0,0,0,0|0,0,0]=2 7027 B9R0.34 CCCC(C)CC(=O)NC Amb24478965 [0,2,0,0,0,0|0,0,0]=2 7028 B9R0.34 CCCC(C)CC(=O)OC Amb25125122 [0,2,0,0,0,0|0,0,0]=2 7029 B9R0.34 CCCC(C)CC(C)C=O Amb25375062 [0,2,0,0,0,0|0,0,1]=3 7030 B9R0.34 CCCC(C)CC(C)CCl Amb25853124 [0,2,0,0,0,0|1,0,1]=4 7031 B9R0.34 CCCC(C)CC(C)CN Amb24394211 [0,2,0,0,0,0|1,0,1]=4 7032 B9R0.34 CCCC(C)CC(C)NN Amb25081446 [0,2,0,0,0,0|1,0,1]=4 7033 B9R0.34 CCCC(C)C[C@@H](C)CBr Amb24477136 [0,2,0,0,0,0|1,0,1]=4 7034 B9R0.34 CCCC(C)C[C@@H](C)CO Amb24588411 [0,2,0,0,0,0|0,0,2]=4 7035 B9R0.34 CCCC(C)NC(=O)C#C Amb25344377 [0,2,0,0,0,0|1,0,1]=4 7036 B9R0.34 CCCC(C)NC(=O)CBr Amb24395881 [0,2,0,0,0,0|1,0,0]=3 7037 B9R0.34 CCCC(C)NC(=O)CF Amb24538004 [0,2,0,0,0,0|1,0,0]=3 7038 B9R0.34 CCCC(C)NC(=O)CS Amb24529304 [0,2,0,0,0,0|1,0,0]=3 7039 B9R0.34 CCCC(C)OC(=O)CS Amb25710936 [0,2,0,0,0,0|1,0,0]=3 7040 B9R0.34 CCCC(C)SC(=S)OC Amb25343465 [0,2,0,0,0,0|1,1,0]=4 7041 B9R0.34 CCCC(C)\C=C(/C)\C=O Amb24381942 [0,2,0,0,0,0|0,0,1]=3 7042 B9R0.34 CCCC(C)\C=C(\C)/CN Amb24398277 [0,2,0,0,0,0|1,0,1]=4 7043 B9R0.34 CCCC(N)CC(=O)CC Amb24504347 [0,2,0,0,0,0|0,0,0]=2 7044 B9R0.34 CCCC(N)CC(=O)NC Amb24650708 [0,2,0,0,0,0|0,0,0]=2 7045 B9R0.34 CCCC(N)CC(=O)NN Amb25232933 [0,2,0,0,0,0|1,0,0]=3 7046 B9R0.34 CCCC(N)CC(=O)OC Amb22059489 [0,2,0,0,0,0|0,0,0]=2 7047 B9R0.34 CCCC(NC(=O)OC)C Amb16205053 [0,2,0,0,0,0|1,0,0]=3 7048 B9R0.34 CCCC(O)CC(=C)C=C Amb24704780 [0,2,0,0,0,0|1,0,1]=4 7049 B9R0.34 CCCC(O)CC(=O)C=C Amb25706988 [0,2,0,0,0,0|0,0,1]=3 7050 B9R0.34 CCCC(O)CC(=O)NC Amb25766510 [0,2,0,0,0,0|0,0,0]=2 7051 B9R0.34 CCCC(O)CC(=O)NN Amb25702693 [0,2,0,0,0,0|1,0,0]=3 7052 B9R0.34 CCCC(O)CC(=O)OC Amb21928831 [0,2,0,0,0,0|0,0,0]=2 7053 B9R0.34 CCCC(O)CC(C)=NO Amb24509368 [0,2,0,0,0,0|0,0,1]=3 7054 B9R0.34 CCCC(O)OC(=O)C=C Amb24688191 [0,2,0,0,0,0|1,0,1]=4 7055 B9R0.34 CCCN(C)CC(=C)CBr Amb24705458 [0,2,0,0,0,0|2,0,0]=4 7056 B9R0.34 CCCN(C)CC(=C)CN Amb25681776 [0,2,0,0,0,0|2,0,0]=4 7057 B9R0.34 CCCN(C)CC(=C)CS Amb25107057 [0,2,0,0,0,0|2,0,0]=4 7058 B9R0.34 CCCN(C)CC(=O)NC Amb24482927 [0,2,0,0,0,0|1,0,0]=3 7059 B9R0.34 CCCN(C)CC(=O)NN Amb24476956 [0,2,0,0,0,0|2,0,0]=4 7060 B9R0.34 CCCN(C)CC(=O)NO Amb24643894 [0,2,0,0,0,0|2,0,0]=4 7061 B9R0.34 CCCS(=O)CC(=O)OC Amb18788303 [0,2,0,0,0,0|1,0,0]=3 7062 B9R0.34 CCC[C@@H](C)C[C@@H](C)CBr Amb25756729 [0,2,0,0,0,0|1,0,1]=4 7063 B9R0.34 CCC[C@@H](C)C[C@H](C)CBr Amb24477137 [0,2,0,0,0,0|1,0,1]=4 7064 B9R0.34 CCC[C@@H](C)\C=C(\C)/CO Amb25762036 [0,2,0,0,0,0|0,0,2]=4 7065 B9R0.34 CCC[C@@H](N)CN(C)CC Amb24445821 [0,2,0,0,0,0|2,0,0]=4 7066 B9R0.34 CCC[C@@H](O)CC(=O)C=C Amb24448964 [0,2,0,0,0,0|0,0,1]=3 7067 B9R0.34 CCC[C@@H](O)CC(=O)NN Amb24419272 [0,2,0,0,0,0|1,0,0]=3 7068 B9R0.34 CCC[C@H](C)C[C@H](C)C=O Amb25717745 [0,2,0,0,0,0|0,0,1]=3 7069 B9R0.34 CCC[C@H](C)C[C@H](C)CO Amb25781733 [0,2,0,0,0,0|0,0,2]=4 7070 B9R0.34 CCC[C@H](N)CC(=O)OC Amb25147500 [0,2,0,0,0,0|0,0,0]=2 7071 B9R0.34 CCC[C@H](N)CN(C)CC Amb25721805 [0,2,0,0,0,0|2,0,0]=4 7072 B9R0.34 CCNC(=O)CC(=O)OC Amb17399890 [0,2,0,0,0,0|1,0,1]=4 7073 B9R0.34 CCNC(C)CC(=O)C#C Amb25378395 [0,2,0,0,0,0|1,0,1]=4 7074 B9R0.34 CCNC(C)CC(=O)C=C Amb24586663 [0,2,0,0,0,0|1,0,1]=4 7075 B9R0.34 CCNC(C)CC(=O)NN Amb25146440 [0,2,0,0,0,0|2,0,0]=4 7076 B9R0.34 CCNC(C)CC(=O)NO Amb25146433 [0,2,0,0,0,0|2,0,0]=4 7077 B9R0.34 CCOC(=O)CC(=O)CF Amb25140068 [0,2,0,0,0,0|1,0,1]=4 7078 B9R0.34 CCOC(=O)CC(=O)CI Amb10070790 [0,2,0,0,0,0|1,0,1]=4 7079 B9R0.34 CCOC(=O)CC(=O)CN Amb18636481 [0,2,0,0,0,0|1,0,1]=4 7080 B9R0.34 CCOC(=O)CC(=O)CO Amb25759916 [0,2,0,0,0,0|1,0,1]=4 7081 B9R0.34 CCOC(=O)CC(=O)CS Amb20623663 [0,2,0,0,0,0|1,0,1]=4 7082 B9R0.34 CCOC(=O)CC(=O)C[Na] Amb24478276 [0,2,0,0,0,0|1,0,1]=4 7083 B9R0.34 CCOC(C)OC(=O)CCl Amb24480498 [0,2,0,0,0,0|2,0,0]=4 7084 B9R0.34 CCO[13C](=O)[13CH2][13C](=O)[13CH2]Cl Amb17613990 [0,2,0,0,0,0|1,0,1]=4 7085 B9R0.34 CCO[C@@H](O)CC(=O)CCl Amb25141554 [0,2,0,0,0,0|1,0,0]=3 7086 B9R0.34 CCO[C@@H](O)CC(=O)CO Amb25129047 [0,2,0,0,0,0|1,0,0]=3 7087 B9R0.34 CCO[C@H](O)CC(=O)CCl Amb24585158 [0,2,0,0,0,0|1,0,0]=3 7088 B9R0.34 CCS(=O)CC(N)CCO Amb24555006 [0,2,0,0,0,0|2,0,0]=4 7089 B9R0.34 CCS(=O)CC(N)COC Amb24593109 [0,2,0,0,0,0|2,0,0]=4 7090 B9R0.34 CCSC(=O)CC(=O)CC Amb24402033 [0,2,0,0,0,0|1,0,1]=4 7091 B9R0.34 CCSC(C)CC(=O)NN Amb24411866 [0,2,0,0,0,0|2,0,0]=4 7092 B9R0.34 CC[C@@H](O)C[C@H](O)CCC Amb25092750 [0,2,0,0,0,0|0,0,2]=4 7093 B9R0.34 CC\C(\C)=C/C(O)CCC Amb25056452 [0,2,0,0,0,0|1,0,1]=4 7094 B9R0.34 CN(N=O)CC(CCC)O Amb17593662 [0,2,0,0,0,0|1,0,0]=3 7095 B9R0.34 CNC(=O)CC(=O)NCC Amb24544279 [0,2,0,0,0,0|1,0,1]=4 7096 B9R0.34 CNC(=O)CC(C)NCC Amb18314891 [0,2,0,0,0,0|1,0,0]=3 7097 B9R0.34 CNC(=O)CN(C)CCF Amb24459070 [0,2,0,0,0,0|2,0,0]=4 7098 B9R0.34 CNC(=O)CN(C)CCO Amb24502264 [0,2,0,0,0,0|2,0,0]=4 7099 B9R0.34 CNC(=O)CS(=O)CCN Amb24350294 [0,2,0,0,0,0|2,0,0]=4 7100 B9R0.34 CNC(=O)NC(C)CCC Amb24749519 [0,2,0,0,0,0|1,0,0]=3 7101 B9R0.34 CNC(=O)NC(C)CCN Amb18251285 [0,2,0,0,0,0|2,0,0]=4 7102 B9R0.34 CNC(=O)NC(C)CCO Amb25853732 [0,2,0,0,0,0|2,0,0]=4 7103 B9R0.34 CNC(=O)NC(C)COC Amb25788874 [0,2,0,0,0,0|2,0,0]=4 7104 B9R0.34 CNC(=O)N[C@H](C)CCO Amb25318045 [0,2,0,0,0,0|2,0,0]=4 7105 B9R0.34 CNC(=O)OC(C)CNC Amb24720954 [0,2,0,0,0,0|2,0,0]=4 7106 B9R0.34 CNCC(C)NC(=O)CC Amb24730299 [0,2,0,0,0,0|2,0,0]=4 7107 B9R0.34 COC(=O)CC(=O)CCO Amb25833665 [0,2,0,0,0,0|1,0,1]=4 7108 B9R0.34 COC(=O)CC(=O)CSC Amb24441248 [0,2,0,0,0,0|1,0,1]=4 7109 B9R0.34 COC(=O)CC(C)CC=O Amb18644136 [0,2,0,0,0,0|1,0,1]=4 7110 B9R0.34 COC(=O)CC(C)CCBr Amb24477385 [0,2,0,0,0,0|1,0,0]=3 7111 B9R0.34 COC(=O)CC(C)CCN Amb24546678 [0,2,0,0,0,0|1,0,0]=3 7112 B9R0.34 COC(=O)CC(N)CC=C Amb25799423 [0,2,0,0,0,0|0,0,2]=4 7113 B9R0.34 COC(=O)CC(O)CC#C Amb25136248 [0,2,0,0,0,0|0,0,2]=4 7114 B9R0.34 COC(=O)CC(O)CC#N Amb24391893 [0,2,0,0,0,0|1,0,1]=4 7115 B9R0.34 COC(=O)CC(O)CCBr Amb25760946 [0,2,0,0,0,0|1,0,0]=3 7116 B9R0.34 COC(=O)CC(O)CSC Amb24412887 [0,2,0,0,0,0|1,0,0]=3 7117 B9R0.34 COC(=O)CN(C)CCI Amb25807165 [0,2,0,0,0,0|2,0,0]=4 7118 B9R0.34 COC(=O)CN(C)CCN Amb22059127 [0,2,0,0,0,0|2,0,0]=4 7119 B9R0.34 COC(=O)CS(=O)CCCl Amb25277573 [0,2,0,0,0,0|2,0,0]=4 7120 B9R0.34 COC(=O)C[C@@H](C)CC=O Amb24365488 [0,2,0,0,0,0|1,0,1]=4 7121 B9R0.34 COC(=O)C[C@@H](N)CC=C Amb25259760 [0,2,0,0,0,0|0,0,2]=4 7122 B9R0.34 COC(=O)C[C@@H](N)CCO Amb25132686 [0,2,0,0,0,0|1,0,0]=3 7123 B9R0.34 COC(=O)C[C@@H](O)CSC Amb25266160 [0,2,0,0,0,0|1,0,0]=3 7124 B9R0.34 COC(=O)C[C@H](C)CC=O Amb25799016 [0,2,0,0,0,0|1,0,1]=4 7125 B9R0.34 COC(=O)C[C@H](C)CCO Amb24449995 [0,2,0,0,0,0|1,0,0]=3 7126 B9R0.34 COC(=O)C[C@H](N)CC#N Amb24367695 [0,2,0,0,0,0|1,0,1]=4 7127 B9R0.34 COC(=O)C[C@H](N)CC=C Amb25294467 [0,2,0,0,0,0|0,0,2]=4 7128 B9R0.34 COC(=O)C[C@H](N)CCO Amb25776064 [0,2,0,0,0,0|1,0,0]=3 7129 B9R0.34 COC(=O)C[C@H](O)CC#C Amb24457417 [0,2,0,0,0,0|0,0,2]=4 7130 B9R0.34 COC(=O)C[C@H](O)CC=C Amb24672394 [0,2,0,0,0,0|0,0,2]=4 7131 B9R0.34 COC(=O)NC(C)CCO Amb24479314 [0,2,0,0,0,0|2,0,0]=4 7132 B9R0.34 COC(=O)NC(C)OCC Amb25068640 [0,2,0,0,0,0|2,0,0]=4 7133 B9R0.34 COC(=O)N[C@@H](C)CCO Amb24676467 [0,2,0,0,0,0|2,0,0]=4 7134 B9R0.34 COC(=O)N[C@H](C)COC Amb25686727 [0,2,0,0,0,0|2,0,0]=4 7135 B9R0.34 COC(=O)OC(C)CCCl Amb25724505 [0,2,0,0,0,0|2,0,0]=4 7136 B9R0.34 COCC(C)CC(=O)C#C Amb25686303 [0,2,0,0,0,0|1,0,1]=4 7137 B9R0.34 COCC(C)OC(=O)CBr Amb18602730 [0,2,0,0,0,0|2,0,0]=4 7138 B9R0.34 COCC(C)OC(=O)CC Amb22167298 [0,2,0,0,0,0|2,0,0]=4 7139 B9R0.34 COCC(C)OC(=O)CN Amb18114762 [0,2,0,0,0,0|2,0,0]=4 7140 B9R0.34 COCC(C)OC(=O)CO Amb24632862 [0,2,0,0,0,0|2,0,0]=4 7141 B9R0.34 COCC(C)OC(=O)CS Amb24700867 [0,2,0,0,0,0|2,0,0]=4 7142 B9R0.34 COCC(N)CC(=O)OC Amb24393406 [0,2,0,0,0,0|1,0,0]=3 7143 B9R0.34 COC[C@@H](C)NC(=O)CO Amb24482690 [0,2,0,0,0,0|2,0,0]=4 7144 B9R0.34 COC[C@@H](N)CC(=O)OC Amb25118860 [0,2,0,0,0,0|1,0,0]=3 7145 B9R0.34 COC[C@H](N)CC(=O)OC Amb24518573 [0,2,0,0,0,0|1,0,0]=3 7146 B9R0.34 CSCC(C)NC(=O)CS Amb24469962 [0,2,0,0,0,0|2,0,0]=4 7147 B9R0.34 C[C@H](CC(Br)CCC)CC Amb25827553 [0,2,0,0,0,0|1,0,1]=4 7148 B9R0.34 C[C@H](CCO)C[C@@H](C)C=O Amb24686545 [0,2,0,0,0,0|1,0,1]=4 7149 B9R0.34 C\C(\CCC)=C/C(=O)CC Amb25855257 [0,2,0,0,0,0|0,0,2]=4 7150 B9R0.34 C\C=C\C(C)CC(=O)CC Amb25347493 [0,2,0,0,0,0|0,0,2]=4 7151 B9R0.34 C\C=C\C(N)CC(=O)OC Amb24746604 [0,2,0,0,0,0|0,0,2]=4 7152 B9R0.34 C\C=C\[C@H](N)CC(=O)OC Amb25147608 [0,2,0,0,0,0|0,0,2]=4 7153 B9R0.44 CC(CCO)CP(C)(C)=O Amb25763876 [0,2,0,0,0,0|2,0,0]=4 7154 B9R0.44 CCCC(=O)CS(C)(=O)=O Amb18800832 [0,2,0,0,0,0|1,0,1]=4 7155 B9R0.44 CCCC(C)CC(C)(C)N Amb19026064 [0,2,0,0,0,0|1,0,1]=4 7156 B9R0.44 CCCC(C)CS(=O)(=O)Cl Amb18325512 [0,2,0,0,0,0|2,0,0]=4 7157 B9R0.44 CCCC(C)CS(=O)(=O)F Amb19515127 [0,2,0,0,0,0|2,0,0]=4 7158 B9R0.44 CCCC(C)CS(N)(=O)=O Amb18800966 [0,2,0,0,0,0|2,0,0]=4 7159 B9R0.44 CCCC(Cl)CP(O)(O)=O Amb24433873 [0,2,0,0,0,0|2,0,0]=4 7160 B9R0.44 CCCC(F)CC(C)(C)N Amb25806991 [0,2,0,0,0,0|1,0,1]=4 7161 B9R0.44 CCCC(N)CC(C)(C)C Amb18831522 [0,2,0,0,0,0|1,0,1]=4 7162 B9R0.44 CCCC(N)CS(C)(=O)=O Amb18311386 [0,2,0,0,0,0|1,0,0]=3 7163 B9R0.44 CCCC(O)CC(C)(C)N Amb24689779 [0,2,0,0,0,0|1,0,1]=4 7164 B9R0.44 CCCC(O)CS(C)(=O)=O Amb18801120 [0,2,0,0,0,0|1,0,0]=3 7165 B9R0.44 CCC[C@H](N)CC(C)(C)C Amb24529135 [0,2,0,0,0,0|1,0,1]=4 7166 B9R0.44 CCC[C@H](O)CC(C)(C)C Amb24422628 [0,2,0,0,0,0|1,0,1]=4 7167 B9R0.44 CCNC(C)CS(C)(=O)=O Amb19029792 [0,2,0,0,0,0|2,0,0]=4 7168 B9R0.44 CNCC(CS(=O)(=O)C)O Amb17082868 [0,2,0,0,0,0|2,0,0]=4 7169 B9R0.44 COCC(N)CS(C)(=O)=O Amb25206380 [0,2,0,0,0,0|2,0,0]=4 7170 B9R0.44 COCC(O)CS(C)(=O)=O Amb25787702 [0,2,0,0,0,0|2,0,0]=4 7171 B9R0.44 CS(=O)(=O)CC(O)CCN Amb24435108 [0,2,0,0,0,0|2,0,0]=4 7172 B9R0.44 CSCC(C)CS(C)(=O)=O Amb24590860 [0,2,0,0,0,0|2,0,0]=4 7173 B9R0.53 CC(=C)CC(=O)CC(C)C Amb25827965 [0,2,0,0,0,0|1,0,1]=4 7174 B9R0.53 CC(=C)CC(=O)CC(C)N Amb25329079 [0,2,0,0,0,0|1,0,1]=4 7175 B9R0.53 CC(=C)CC(C)CC(O)=O Amb18643943 [0,2,0,0,0,0|1,0,1]=4 7176 B9R0.53 CC(=C)CC(N)CC(C)=C Amb18124562 [0,2,0,0,0,0|1,0,1]=4 7177 B9R0.53 CC(=C)CC(N)CN(C)C Amb24641599 [0,2,0,0,0,0|2,0,0]=4 7178 B9R0.53 CC(=O)CC(=N)CC(C)C Amb24706662 [0,2,0,0,0,0|0,0,1]=3 7179 B9R0.53 CC(=O)CC(=O)CN(C)C Amb25358908 [0,2,0,0,0,0|1,0,1]=4 7180 B9R0.53 CC(=O)CC(=O)OC(C)Cl Amb24509721 [0,2,0,0,0,0|1,0,1]=4 7181 B9R0.53 CC(=O)CC(C)CC(O)=O Amb18644106 [0,2,0,0,0,0|1,0,1]=4 7182 B9R0.53 CC(=O)CN(C)CC(F)F Amb25041242 [0,2,0,0,0,0|2,0,0]=4 7183 B9R0.53 CC(=O)C[C@@H](CC(=O)O)C Amb10844399 [0,2,0,0,0,0|1,0,1]=4 7184 B9R0.53 CC(=O)C[C@H](O)CC(C)=C Amb25318972 [0,2,0,0,0,0|0,0,1]=3 7185 B9R0.53 CC(=O)NC(=O)CC(C)C Amb24333719 [0,2,0,0,0,0|1,0,1]=4 7186 B9R0.53 CC(=O)NC(C)CC(C)=O Amb24096345 [0,2,0,0,0,0|1,0,1]=4 7187 B9R0.53 CC(=O)N[C@H](C)CC(C)=O Amb24478882 [0,2,0,0,0,0|1,0,1]=4 7188 B9R0.53 CC(=O)OC(C)CC(C)=O Amb25690313 [0,2,0,0,0,0|1,0,1]=4 7189 B9R0.53 CC(=O)\C=C(/O)\CC(C)C Amb24524653 [0,2,0,0,0,0|0,0,2]=4 7190 B9R0.53 CC(=S)NC(C)CC(C)=O Amb25329355 [0,2,0,0,0,0|1,0,1]=4 7191 B9R0.53 CC(C)=CC(C)CC(C)=O Amb25093185 [0,2,0,0,0,0|0,0,2]=4 7192 B9R0.53 CC(C)CC(=C)CC(O)=O Amb18643897 [0,2,0,0,0,0|1,0,1]=4 7193 B9R0.53 CC(C)CC(=O)CS(C)=O Amb24676845 [0,2,0,0,0,0|1,0,1]=4 7194 B9R0.53 CC(C)CC(C)CC(C)=O Amb20621119 [0,2,0,0,0,0|0,0,0]=2 7195 B9R0.53 CC(C)CC(C)CC(C)Cl Amb24396788 [0,2,0,0,0,0|1,0,1]=4 7196 B9R0.53 CC(C)CC(C)CC(C)N Amb25064296 [0,2,0,0,0,0|1,0,1]=4 7197 B9R0.53 CC(C)CC(C)CC(C)O Amb24271139 [0,2,0,0,0,0|0,0,2]=4 7198 B9R0.53 CC(C)CC(C)CC(N)=N Amb24479387 [0,2,0,0,0,0|2,0,0]=4 7199 B9R0.53 CC(C)CC(C)CC(N)=S Amb24565637 [0,2,0,0,0,0|1,1,0]=4 7200 B9R0.53 CC(C)CC(C)CN(C)C Amb24744220 [0,2,0,0,0,0|2,0,0]=4 7201 B9R0.53 CC(C)CC(C)NC(C)=O Amb25824393 [0,2,0,0,0,0|1,0,0]=3 7202 B9R0.53 CC(C)CC(C)OC(C)=O Amb22733405 [0,2,0,0,0,0|1,0,0]=3 7203 B9R0.53 CC(C)CC(Cl)CC(=O)Cl Amb25241016 [0,2,0,0,0,0|1,0,0]=3 7204 B9R0.53 CC(C)CC(Cl)CC(C)=C Amb24579888 [0,2,0,0,0,0|1,0,0]=3 7205 B9R0.53 CC(C)CC(Cl)NC(=O)Cl Amb25177573 [0,2,0,0,0,0|2,0,0]=4 7206 B9R0.53 CC(C)CC(Cl)OC(C)=O Amb24424956 [0,2,0,0,0,0|1,0,0]=3 7207 B9R0.53 CC(C)CC(N)C=C(C)C Amb25822562 [0,2,0,0,0,0|1,0,1]=4 7208 B9R0.53 CC(C)CC(N)CC(C)C Amb19373200 [0,2,0,0,0,0|1,0,1]=4 7209 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [0,2,0,0,0,0|1,0,0]=3 7210 B9R0.53 CC(C)CC(O)C=C(C)C Amb25364031 [0,2,0,0,0,0|1,0,1]=4 7211 B9R0.53 CC(C)CC(O)CC(C)=O Amb25054426 [0,2,0,0,0,0|0,0,0]=2 7212 B9R0.53 CC(C)CC(O)CC(C)O Amb25787141 [0,2,0,0,0,0|0,0,2]=4 7213 B9R0.53 CC(C)CC(S)CC(C)C Amb25056368 [0,2,0,0,0,0|1,0,1]=4 7214 B9R0.53 CC(C)CS(=O)CC(C)=O Amb25052491 [0,2,0,0,0,0|1,0,0]=3 7215 B9R0.53 CC(C)CS(=O)CC(O)=O Amb18792576 [0,2,0,0,0,0|2,0,0]=4 7216 B9R0.53 CC(C)C[C@@H](C)CC(C)=O Amb24480437 [0,2,0,0,0,0|0,0,0]=2 7217 B9R0.53 CC(C)C[C@@H](C)CC(O)=O Amb24455134 [0,2,0,0,0,0|1,0,0]=3 7218 B9R0.53 CC(C)C[C@@H](O)CC(C)=C Amb25788084 [0,2,0,0,0,0|1,0,0]=3 7219 B9R0.53 CC(C)C[C@@H](O)CC(C)=O Amb24480617 [0,2,0,0,0,0|0,0,0]=2 7220 B9R0.53 CC(C)C[C@@H](O)C[C@@H](C)O Amb24475825 [0,2,0,0,0,0|0,0,2]=4 7221 B9R0.53 CC(C)C[C@H](C)CC(C)=O Amb25707831 [0,2,0,0,0,0|0,0,0]=2 7222 B9R0.53 CC(C)C[C@H](N)CC(O)=O Amb19944305 [0,2,0,0,0,0|1,0,0]=3 7223 B9R0.53 CC(C)C[C@H](N)CN(C)C Amb24435743 [0,2,0,0,0,0|2,0,0]=4 7224 B9R0.53 CC(C)C[C@H](O)CC(O)=O Amb24505145 [0,2,0,0,0,0|1,0,0]=3 7225 B9R0.53 CC(C)C[C@H](O)CN(C)C Amb25218574 [0,2,0,0,0,0|2,0,0]=4 7226 B9R0.53 CC(C)NC(C)NC(C)=O Amb24553224 [0,2,0,0,0,0|2,0,0]=4 7227 B9R0.53 CC(C)OC(C)NC(C)=O Amb22729317 [0,2,0,0,0,0|2,0,0]=4 7228 B9R0.53 CC(C)O[C@H](C)CC(O)=O Amb24463494 [0,2,0,0,0,0|2,0,0]=4 7229 B9R0.53 CC(C)SC(C)CC(C)=O Amb25126446 [0,2,0,0,0,0|1,0,0]=3 7230 B9R0.53 CC(C)SC(C)CC(O)=O Amb18303284 [0,2,0,0,0,0|2,0,0]=4 7231 B9R0.53 CC(CC(=O)N)NC(C)C Amb17231987 [0,2,0,0,0,0|2,0,0]=4 7232 B9R0.53 CC(CC(C)Br)CC(C)=C Amb24583898 [0,2,0,0,0,0|1,0,0]=3 7233 B9R0.53 CC(CC(C)C)CC(C)C Amb10069382 [0,2,0,0,0,0|1,0,1]=4 7234 B9R0.53 CC(CC(C)Cl)C=C(C)C Amb24634208 [0,2,0,0,0,0|1,0,1]=4 7235 B9R0.53 CC(CC(C)Cl)CC(C)=C Amb24581835 [0,2,0,0,0,0|1,0,0]=3 7236 B9R0.53 CC(CC(C)Cl)CC(C)Cl Amb24476986 [0,2,0,0,0,0|1,0,1]=4 7237 B9R0.53 CC(CC(C)Cl)CN(C)C Amb25100993 [0,2,0,0,0,0|2,0,0]=4 7238 B9R0.53 CC(CC(C)N)CC(C)=C Amb24688721 [0,2,0,0,0,0|1,0,0]=3 7239 B9R0.53 CC(CC(C)N)NS(C)=O Amb24433491 [0,2,0,0,0,0|2,0,0]=4 7240 B9R0.53 CC(CC(C)O)NC(C)=O Amb25211368 [0,2,0,0,0,0|1,0,0]=3 7241 B9R0.53 CC(CC(C)O)OC(C)=C Amb24463537 [0,2,0,0,0,0|2,0,0]=4 7242 B9R0.53 CC(CC(CC(=O)O)N)C Amb2438867 [0,2,0,0,0,0|1,0,0]=3 7243 B9R0.53 CC(CC(CC(=O)O)O)C Amb17232005 [0,2,0,0,0,0|1,0,0]=3 7244 B9R0.53 CC(CC(F)F)NC(C)=O Amb25257113 [0,2,0,0,0,0|2,0,0]=4 7245 B9R0.53 CC(CN(C)C)NC(C)=O Amb25127012 [0,2,0,0,0,0|2,0,0]=4 7246 B9R0.53 CC(C[C@@H](CC(=O)O)C)C Amb10844383 [0,2,0,0,0,0|1,0,0]=3 7247 B9R0.53 CC(C[C@@H](CC(=O)O)N)C Amb16184017 [0,2,0,0,0,0|1,0,0]=3 7248 B9R0.53 CC(N)CC(C)NC(N)=O Amb25828986 [0,2,0,0,0,0|2,0,0]=4 7249 B9R0.53 CC(N)CN(C)CC(N)=O Amb25060268 [0,2,0,0,0,0|2,0,0]=4 7250 B9R0.53 CC(N)CN(C)CC(O)=O Amb25140627 [0,2,0,0,0,0|2,0,0]=4 7251 B9R0.53 CC(O)CN(C)CC(C)=O Amb24441836 [0,2,0,0,0,0|1,0,0]=3 7252 B9R0.53 CC(O)CN(C)CC(O)=O Amb18312778 [0,2,0,0,0,0|2,0,0]=4 7253 B9R0.53 CN(C)CC(N)CC(O)=O Amb18644281 [0,2,0,0,0,0|2,0,0]=4 7254 B9R0.53 CN(C)CC(O)CC(N)=O Amb24744547 [0,2,0,0,0,0|2,0,0]=4 7255 B9R0.53 CN(C)C[C@@H](O)CC(O)=O Amb25084529 [0,2,0,0,0,0|2,0,0]=4 7256 B9R0.53 CN(CC(=O)C)CC(=O)C Amb10604213 [0,2,0,0,0,0|1,0,1]=4 7257 B9R0.53 CN(C[C@@H](CC(=O)O)O)C Amb10069803 [0,2,0,0,0,0|2,0,0]=4 7258 B9R0.53 CN(O)CC(O)CC(O)=O Amb24611959 [0,2,0,0,0,0|2,0,0]=4 7259 B9R0.53 CS(=O)CC(N)CC(O)=O Amb25766509 [0,2,0,0,0,0|2,0,0]=4 7260 B9R0.53 CS(=O)C[C@@H](N)CC(O)=O Amb25321945 [0,2,0,0,0,0|2,0,0]=4 7261 B9R0.53 C[C@@H](C[C@@H](C)O)OC(C)=O Amb25722158 [0,2,0,0,0,0|1,0,0]=3 7262 B9R0.53 C[C@H](C[C@@H](C)O)NC(C)=O Amb24597644 [0,2,0,0,0,0|1,0,0]=3 7263 B9R0.53 C[C@H](C[C@@H](C)O)OC(C)=O Amb24386965 [0,2,0,0,0,0|1,0,0]=3 7264 B9R0.53 C[C@H](C[C@H](C)O)OC(C)=O Amb24474272 [0,2,0,0,0,0|1,0,0]=3 7265 B9R0.53 C[C@H](Cl)CC(Cl)C[C@H](C)Cl Amb25857065 [0,2,0,0,0,0|1,0,1]=4 7266 B9R0.53 C[C@H](N)C[C@H](N)CC(O)=O Amb24418565 [0,2,0,0,0,0|1,0,0]=3 7267 B9R0.53 C[C@H](O)C[C@H](O)C[C@@H](C)O Amb25226329 [0,2,0,0,0,0|0,0,2]=4 7268 B9R0.53 C\C(\CC(C)=O)=C\C(C)C Amb24614276 [0,2,0,0,0,0|0,0,2]=4 7269 B9R0.53 C\C(\CC(C)=O)=N/C(C)C Amb25833982 [0,2,0,0,0,0|1,0,1]=4 7270 B9R0.53 C\C(\CC(C)=O)=N/C(C)O Amb25730154 [0,2,0,0,0,0|1,0,1]=4 7271 B9R0.53 [13CH3]C([13CH3])CC(O)CC([13CH3])[13CH3] Amb22055142 [0,2,0,0,0,0|1,0,1]=4 7272 B9R0.58 C#CCC(CC(=O)C)(C)C Amb17593505 [0,2,0,0,0,0|0,0,2]=4 7273 B9R0.58 CC(=C)CC(C)(C)CCO Amb25318561 [0,2,0,0,0,0|2,0,0]=4 7274 B9R0.58 CC(=C)CC(Cl)(Cl)CCCl Amb25328440 [0,2,0,0,0,0|2,0,0]=4 7275 B9R0.58 CC(=O)CC(C)(C)CC=C Amb24475264 [0,2,0,0,0,0|0,0,2]=4 7276 B9R0.58 CC(=O)CC(C)(C)CC=O Amb18643928 [0,2,0,0,0,0|1,0,1]=4 7277 B9R0.58 CC(=O)CC(C)(O)CC#N Amb25319900 [0,2,0,0,0,0|1,0,1]=4 7278 B9R0.58 CC(=O)CC(C)(O)CC=C Amb24712053 [0,2,0,0,0,0|0,0,2]=4 7279 B9R0.58 CC(=O)C[C@@](C)(O)CC=C Amb24633653 [0,2,0,0,0,0|0,0,2]=4 7280 B9R0.58 CC(=O)NC(C)(C)CCN Amb25223376 [0,2,0,0,0,0|2,0,0]=4 7281 B9R0.58 CC(=O)OC(C)(C)CCO Amb25796231 [0,2,0,0,0,0|2,0,0]=4 7282 B9R0.58 CC(C)(CCCl)CC(O)=O Amb18646188 [0,2,0,0,0,0|2,0,0]=4 7283 B9R0.58 CC(C)(CCN)CC(O)=O Amb24637226 [0,2,0,0,0,0|2,0,0]=4 7284 B9R0.58 CC(C)(CCO)CC(O)=O Amb24682986 [0,2,0,0,0,0|2,0,0]=4 7285 B9R0.58 CC(O)(CCO)CC(O)=O Amb18644354 [0,2,0,0,0,0|2,0,0]=4 7286 B9R0.58 CCCC(C)(C)CC(C)=O Amb24413025 [0,2,0,0,0,0|0,0,0]=2 7287 B9R0.58 CCCC(C)(C)CC(N)=O Amb25051244 [0,2,0,0,0,0|1,0,0]=3 7288 B9R0.58 CCCC(C)(C)CC(O)=O Amb22229019 [0,2,0,0,0,0|1,0,0]=3 7289 B9R0.58 CCCC(C)(C)NC(C)=N Amb25353244 [0,2,0,0,0,0|2,0,0]=4 7290 B9R0.58 CCCC(C)(N)CN(C)C Amb18523812 [0,2,0,0,0,0|2,0,0]=4 7291 B9R0.58 CCCC(C)(O)C=C(C)C Amb24474333 [0,2,0,0,0,0|1,0,1]=4 7292 B9R0.58 CCCC(C)(O)CC(O)=O Amb18310709 [0,2,0,0,0,0|1,0,0]=3 7293 B9R0.58 CCCC(Cl)(Cl)CC(C)Cl Amb24451348 [0,2,0,0,0,0|1,0,1]=4 7294 B9R0.58 CCCC(Cl)(Cl)CC(C)N Amb25084531 [0,2,0,0,0,0|1,0,1]=4 7295 B9R0.58 CCCC(F)(F)CC(O)=O Amb24482478 [0,2,0,0,0,0|1,0,0]=3 7296 B9R0.58 CCCS(=O)(=O)CC(C)=C Amb25305884 [0,2,0,0,0,0|2,0,0]=4 7297 B9R0.58 CCCS(=O)(=O)NC(C)=O Amb25320333 [0,2,0,0,0,0|2,0,0]=4 7298 B9R0.58 CCNC(C)(C)CC(C)=O Amb25147479 [0,2,0,0,0,0|1,0,0]=3 7299 B9R0.58 CCOP(O)(=O)CC(C)=O Amb25146532 [0,2,0,0,0,0|2,0,0]=4 7300 B9R0.58 CCSC(C)(C)CC(C)=O Amb24456707 [0,2,0,0,0,0|1,0,0]=3 7301 B9R0.58 CNCC(C)(C)CC(C)=C Amb25124246 [0,2,0,0,0,0|2,0,0]=4 7302 B9R0.58 CNCC(C)(C)CC(O)=O Amb24116872 [0,2,0,0,0,0|2,0,0]=4 7303 B9R0.58 CNCC(C)(C)NC(C)=O Amb24552111 [0,2,0,0,0,0|2,0,0]=4 7304 B9R0.58 CNNC(C)(O)CC(C)=O Amb24647850 [0,2,0,0,0,0|2,0,0]=4 7305 B9R0.58 COCC(C)(C)CC(O)=O Amb24116871 [0,2,0,0,0,0|2,0,0]=4 7306 B9R0.58 C[C@@](O)(CCO)CC(O)=O Amb21856037 [0,2,0,0,0,0|2,0,0]=4 7307 B9R0.58 C\C=C\C(C)(C)CC(C)=O Amb24378948 [0,2,0,0,0,0|0,0,2]=4 7308 B9R0.58 NCCS(=O)(=O)CC(=O)C Amb17500567 [0,2,0,0,0,0|2,0,0]=4 7309 B9R0.1 BrCC(=O)NCCC(C)C Amb17325046 [0,2,0,0,0,0|1,0,0]=3 7310 B9R0.1 BrCC(=O)NCCN(C)C Amb17331884 [0,2,0,0,0,0|2,0,0]=4 7311 B9R0.1 C#CC(F)CCCC(O)=O Amb25340465 [0,2,0,0,0,0|1,0,1]=4 7312 B9R0.1 C#C[C@H](F)CCCC(O)=O Amb25113496 [0,2,0,0,0,0|1,0,1]=4 7313 B9R0.1 C=CC(O)CCCC(O)=O Amb25137244 [0,2,0,0,0,0|1,0,1]=4 7314 B9R0.1 C=C[C@@H](O)CCCC(O)=O Amb24352126 [0,2,0,0,0,0|1,0,1]=4 7315 B9R0.1 CC(=C)CCCC(=O)C=C Amb25146598 [0,2,0,0,0,0|0,0,2]=4 7316 B9R0.1 CC(=C)CCCC(=O)CC Amb25832230 [0,2,0,0,0,0|0,0,1]=3 7317 B9R0.1 CC(=C)CCNC(=O)CC Amb24544729 [0,2,0,0,0,0|1,0,1]=4 7318 B9R0.1 CC(=C)CCNC(=O)CN Amb24578382 [0,2,0,0,0,0|1,0,1]=4 7319 B9R0.1 CC(=C)CCNC(=O)NC Amb25321294 [0,2,0,0,0,0|1,0,1]=4 7320 B9R0.1 CC(=C)CCOC(=O)CBr Amb24477369 [0,2,0,0,0,0|1,0,1]=4 7321 B9R0.1 CC(=C)CNCC(=O)OC Amb25139895 [0,2,0,0,0,0|1,0,1]=4 7322 B9R0.1 CC(=C)CNCC(O)CF Amb25263943 [0,2,0,0,0,0|2,0,0]=4 7323 B9R0.1 CC(=C)CNCC(O)CO Amb25100715 [0,2,0,0,0,0|2,0,0]=4 7324 B9R0.1 CC(=C)CNC[C@H](O)CO Amb25363682 [0,2,0,0,0,0|2,0,0]=4 7325 B9R0.1 CC(=C)COC[C@@H](N)CO Amb24701313 [0,2,0,0,0,0|2,0,0]=4 7326 B9R0.1 CC(=C)CSCC(O)CO Amb25221934 [0,2,0,0,0,0|2,0,0]=4 7327 B9R0.1 CC(=O)CCCC(=C)C=C Amb25755744 [0,2,0,0,0,0|0,0,2]=4 7328 B9R0.1 CC(=O)CCCC(=N)NN Amb25146305 [0,2,0,0,0,0|1,0,1]=4 7329 B9R0.1 CC(=O)CCCC(=O)CC Amb24093547 [0,2,0,0,0,0|0,0,0]=2 7330 B9R0.1 CC(=O)CCCC(=O)NC Amb25790088 [0,2,0,0,0,0|0,0,1]=3 7331 B9R0.1 CC(=O)CCCC(Br)C#N Amb24680273 [0,2,0,0,0,0|0,0,1]=3 7332 B9R0.1 CC(=O)CCCC(Cl)C=O Amb24653770 [0,2,0,0,0,0|0,0,1]=3 7333 B9R0.1 CC(=O)CCCN(C)C=O Amb24631603 [0,2,0,0,0,0|1,0,0]=3 7334 B9R0.1 CC(=O)CCC[C@H](Cl)C=O Amb25101587 [0,2,0,0,0,0|0,0,1]=3 7335 B9R0.1 CC(=O)CCOC(=O)CC Amb25318811 [0,2,0,0,0,0|0,0,1]=3 7336 B9R0.1 CC(=O)CCOC(=O)CCl Amb24480607 [0,2,0,0,0,0|1,0,1]=4 7337 B9R0.1 CC(=O)CCOC(=O)CO Amb24482823 [0,2,0,0,0,0|1,0,1]=4 7338 B9R0.1 CC(=O)CCOC(=O)CS Amb25286689 [0,2,0,0,0,0|1,0,1]=4 7339 B9R0.1 CC(=O)CC\C=C(/C)\C=C Amb24646563 [0,2,0,0,0,0|0,0,2]=4 7340 B9R0.1 CC(=O)CC\C=C(/C)\C=O Amb18124577 [0,2,0,0,0,0|0,0,2]=4 7341 B9R0.1 CC(=O)CC\C=C(\C)/C=C Amb24504939 [0,2,0,0,0,0|0,0,2]=4 7342 B9R0.1 CC(=O)CSCC(=C)CC Amb24465878 [0,2,0,0,0,0|0,0,1]=3 7343 B9R0.1 CC(=O)CSCC(=O)NC Amb25783382 [0,2,0,0,0,0|1,0,1]=4 7344 B9R0.1 CC(=O)NCCC(=O)CBr Amb24551664 [0,2,0,0,0,0|1,0,1]=4 7345 B9R0.1 CC(=O)NCCC(=O)NC Amb25793084 [0,2,0,0,0,0|1,0,1]=4 7346 B9R0.1 CC(=O)NCCC(=O)SC Amb25279099 [0,2,0,0,0,0|1,0,1]=4 7347 B9R0.1 CC(=O)NCCC(O)C=C Amb24505298 [0,2,0,0,0,0|0,0,2]=4 7348 B9R0.1 CC(=O)NCCN(C)C#N Amb24353521 [0,2,0,0,0,0|2,0,0]=4 7349 B9R0.1 CC(=O)NCC[C@H](N)CN Amb24505131 [0,2,0,0,0,0|1,0,0]=3 7350 B9R0.1 CC(=O)OCCC(=C)CCl Amb24363129 [0,2,0,0,0,0|1,0,1]=4 7351 B9R0.1 CC(=O)OCCC(=O)CCl Amb25707775 [0,2,0,0,0,0|1,0,1]=4 7352 B9R0.1 CC(=O)OCCC(Br)C=O Amb25293178 [0,2,0,0,0,0|1,0,1]=4 7353 B9R0.1 CC(=O)OCCC(Cl)CCl Amb24709893 [0,2,0,0,0,0|1,0,0]=3 7354 B9R0.1 CC(=O)OCC[C@H](O)CCl Amb24480674 [0,2,0,0,0,0|1,0,0]=3 7355 B9R0.1 CC(=O)SCCC(=O)CC Amb24633438 [0,2,0,0,0,0|0,0,1]=3 7356 B9R0.1 CC(=O)SCCC(=O)CCl Amb24436675 [0,2,0,0,0,0|1,0,1]=4 7357 B9R0.1 CC(C#C)NCCC(C)=C Amb25325911 [0,2,0,0,0,0|2,0,0]=4 7358 B9R0.1 CC(C#C)NCCC(N)=O Amb25774260 [0,2,0,0,0,0|2,0,0]=4 7359 B9R0.1 CC(C#C)NCCS(C)=O Amb24650534 [0,2,0,0,0,0|2,0,0]=4 7360 B9R0.1 CC(C#N)NCCC(C)=C Amb25360126 [0,2,0,0,0,0|2,0,0]=4 7361 B9R0.1 CC(C#N)NCCS(C)=O Amb25047954 [0,2,0,0,0,0|2,0,0]=4 7362 B9R0.1 CC(C#N)OCCS(C)=O Amb24355204 [0,2,0,0,0,0|2,0,0]=4 7363 B9R0.1 CC(C#N)SCCC(N)=O Amb24602315 [0,2,0,0,0,0|2,0,0]=4 7364 B9R0.1 CC(C#N)SCCC(O)=O Amb18800092 [0,2,0,0,0,0|2,0,0]=4 7365 B9R0.1 CC(C)=CCCC(=O)CBr Amb25826520 [0,2,0,0,0,0|0,0,2]=4 7366 B9R0.1 CC(C)=CCCC(C)NC Amb22055566 [0,2,0,0,0,0|1,0,1]=4 7367 B9R0.1 CC(C)=CCCC(O)CCl Amb24505270 [0,2,0,0,0,0|1,0,1]=4 7368 B9R0.1 CC(C)=CCCC(O)CO Amb24477029 [0,2,0,0,0,0|1,0,1]=4 7369 B9R0.1 CC(C)=CCC[C@@H](O)CO Amb25686569 [0,2,0,0,0,0|1,0,1]=4 7370 B9R0.1 CC(C)CCCC(=O)CBr Amb25243040 [0,2,0,0,0,0|0,0,0]=2 7371 B9R0.1 CC(C)CCCC(Br)CC Amb25255283 [0,2,0,0,0,0|1,0,1]=4 7372 B9R0.1 CC(C)CCCC(C)=NN Amb25285502 [0,2,0,0,0,0|1,0,0]=3 7373 B9R0.1 CC(C)CCCC(C)C=C Amb22229110 [0,2,0,0,0,0|1,0,1]=4 7374 B9R0.1 CC(C)CCCC(C)C=O Amb18124610 [0,2,0,0,0,0|0,0,1]=3 7375 B9R0.1 CC(C)CCCC(C)CCl Amb25056436 [0,2,0,0,0,0|1,0,1]=4 7376 B9R0.1 CC(C)CCCC(C)CN Amb18644042 [0,2,0,0,0,0|1,0,1]=4 7377 B9R0.1 CC(C)CCCC(C)CO Amb24082368 [0,2,0,0,0,0|0,0,2]=4 7378 B9R0.1 CC(C)CCCC(C)NC Amb25683551 [0,2,0,0,0,0|1,0,1]=4 7379 B9R0.1 CC(C)CCCC(Cl)CC Amb24366924 [0,2,0,0,0,0|1,0,1]=4 7380 B9R0.1 CC(C)CCCC(F)CO Amb25105959 [0,2,0,0,0,0|1,0,1]=4 7381 B9R0.1 CC(C)CCCC(O)C=O Amb24479252 [0,2,0,0,0,0|1,0,1]=4 7382 B9R0.1 CC(C)CCCC(O)CC Amb24478002 [0,2,0,0,0,0|0,0,2]=4 7383 B9R0.1 CC(C)CCCC(O)CCl Amb24502306 [0,2,0,0,0,0|0,0,2]=4 7384 B9R0.1 CC(C)CCC[C@@H](C)CN Amb25147597 [0,2,0,0,0,0|1,0,1]=4 7385 B9R0.1 CC(C)CCC[C@@H](O)CCl Amb24505277 [0,2,0,0,0,0|0,0,2]=4 7386 B9R0.1 CC(C)CCC[C@H](O)CO Amb25069735 [0,2,0,0,0,0|0,0,2]=4 7387 B9R0.1 CC(C)CCNC(=O)C#C Amb24482628 [0,2,0,0,0,0|1,0,1]=4 7388 B9R0.1 CC(C)CCNC(=O)CF Amb25733429 [0,2,0,0,0,0|1,0,0]=3 7389 B9R0.1 CC(C)CCNC(=O)CS Amb24757445 [0,2,0,0,0,0|1,0,0]=3 7390 B9R0.1 CC(C)CCOC(=O)C=C Amb17933945 [0,2,0,0,0,0|1,0,1]=4 7391 B9R0.1 CC(C)CCOC(=O)CBr Amb25828483 [0,2,0,0,0,0|1,0,0]=3 7392 B9R0.1 CC(C)CCOC(=O)CS Amb22230770 [0,2,0,0,0,0|1,0,0]=3 7393 B9R0.1 CC(C)CCOC(=O)NN Amb24374172 [0,2,0,0,0,0|2,0,0]=4 7394 B9R0.1 CC(C)CCSC(C)CC Amb24450679 [0,2,0,0,0,0|1,0,1]=4 7395 B9R0.1 CC(C)CNCC(N)CC Amb25083649 [0,2,0,0,0,0|1,0,1]=4 7396 B9R0.1 CC(C)CNCC(O)CC Amb24558054 [0,2,0,0,0,0|1,0,1]=4 7397 B9R0.1 CC(C)CNC[C@@H](N)CC Amb24395705 [0,2,0,0,0,0|1,0,1]=4 7398 B9R0.1 CC(C)CNC[C@@H](O)CC Amb24425124 [0,2,0,0,0,0|1,0,1]=4 7399 B9R0.1 CC(C)CNC[C@H](N)CC Amb24361562 [0,2,0,0,0,0|1,0,1]=4 7400 B9R0.1 CC(C)COCC(=O)NN Amb19960441 [0,2,0,0,0,0|2,0,0]=4 7401 B9R0.1 CC(C)COCC(O)CC Amb25728347 [0,2,0,0,0,0|1,0,1]=4 7402 B9R0.1 CC(C)CONC(=O)CCl Amb25169313 [0,2,0,0,0,0|2,0,0]=4 7403 B9R0.1 CC(C)CONC(=O)CN Amb24415654 [0,2,0,0,0,0|2,0,0]=4 7404 B9R0.1 CC(C)CSCC(=C)CCl Amb25306863 [0,2,0,0,0,0|2,0,0]=4 7405 B9R0.1 CC(C)CSCC(=O)C=C Amb25353956 [0,2,0,0,0,0|1,0,1]=4 7406 B9R0.1 CC(C)CSCC(=O)NO Amb24380503 [0,2,0,0,0,0|2,0,0]=4 7407 B9R0.1 CC(C)CSCC(C)=NO Amb24522981 [0,2,0,0,0,0|1,0,1]=4 7408 B9R0.1 CC(C)CSCC(O)CC Amb18792450 [0,2,0,0,0,0|1,0,1]=4 7409 B9R0.1 CC(C)CSC[C@@H](O)CC Amb25272476 [0,2,0,0,0,0|1,0,1]=4 7410 B9R0.1 CC(C)NCCC(=O)C#C Amb24524424 [0,2,0,0,0,0|1,0,1]=4 7411 B9R0.1 CC(C)NCCC(=O)C=C Amb25027994 [0,2,0,0,0,0|1,0,1]=4 7412 B9R0.1 CC(C)NCCC(O)CC Amb24458822 [0,2,0,0,0,0|1,0,1]=4 7413 B9R0.1 CC(C)OCCC(=O)C#C Amb24520902 [0,2,0,0,0,0|1,0,1]=4 7414 B9R0.1 CC(C)OCCC(=O)NN Amb20076066 [0,2,0,0,0,0|2,0,0]=4 7415 B9R0.1 CC(C)OCCC(N)CC Amb25827331 [0,2,0,0,0,0|1,0,1]=4 7416 B9R0.1 CC(C)OCNC(=O)CCl Amb25698281 [0,2,0,0,0,0|2,0,0]=4 7417 B9R0.1 CC(C)OCOC(=O)CCl Amb24401503 [0,2,0,0,0,0|2,0,0]=4 7418 B9R0.1 CC(C)SCCC(=O)NN Amb24477909 [0,2,0,0,0,0|2,0,0]=4 7419 B9R0.1 CC(C=C)NCCC(O)=O Amb24662882 [0,2,0,0,0,0|2,0,0]=4 7420 B9R0.1 CC(C=C)OCCC(C)=O Amb25318884 [0,2,0,0,0,0|1,0,0]=3 7421 B9R0.1 CC(C=C)SCCC(O)=O Amb18182545 [0,2,0,0,0,0|2,0,0]=4 7422 B9R0.1 CC(C=O)OCOC(C)=O Amb25052860 [0,2,0,0,0,0|2,0,0]=4 7423 B9R0.1 CC(CBr)CCC=C(C)C Amb24548827 [0,2,0,0,0,0|1,0,1]=4 7424 B9R0.1 CC(CBr)CCCC(C)=C Amb25357871 [0,2,0,0,0,0|1,0,0]=3 7425 B9R0.1 CC(CBr)NCCS(C)=O Amb24538833 [0,2,0,0,0,0|2,0,0]=4 7426 B9R0.1 CC(CCC=C(C)C)C#N Amb18124499 [0,2,0,0,0,0|1,0,1]=4 7427 B9R0.1 CC(CCC=C(C)C)C=C Amb20246803 [0,2,0,0,0,0|1,0,1]=4 7428 B9R0.1 CC(CCCC(C)=C)C=O Amb25712471 [0,2,0,0,0,0|1,0,0]=3 7429 B9R0.1 CC(CCCC(C)=O)=C=C Amb25689180 [0,2,0,0,0,0|0,0,1]=3 7430 B9R0.1 CC(CCCC(C)=O)C#N Amb18124539 [0,2,0,0,0,0|0,0,0]=2 7431 B9R0.1 CC(CCCC(C)=O)C=O Amb24453385 [0,2,0,0,0,0|0,0,0]=2 7432 B9R0.1 CC(CCCC(C)Cl)OC Amb24524574 [0,2,0,0,0,0|0,0,2]=4 7433 B9R0.1 CC(CCCC(O)=O)C#N Amb18643710 [0,2,0,0,0,0|1,0,0]=3 7434 B9R0.1 CC(CCCC(O)=O)C=C Amb24716210 [0,2,0,0,0,0|1,0,0]=3 7435 B9R0.1 CC(CCCC(O)=O)CO Amb25068017 [0,2,0,0,0,0|1,0,0]=3 7436 B9R0.1 CC(CCCN(C)C)=NO Amb25287390 [0,2,0,0,0,0|1,0,1]=4 7437 B9R0.1 CC(CCCN(C)C)C=O Amb25174625 [0,2,0,0,0,0|1,0,1]=4 7438 B9R0.1 CC(CCCN(C)C)NN Amb25111563 [0,2,0,0,0,0|2,0,0]=4 7439 B9R0.1 CC(CCC[C@@H](C)O)C=C Amb25740640 [0,2,0,0,0,0|0,0,2]=4 7440 B9R0.1 CC(CCOC(C)=O)=CCl Amb25295488 [0,2,0,0,0,0|1,0,1]=4 7441 B9R0.1 CC(CC\C=C(\C)/Cl)C=O Amb24382901 [0,2,0,0,0,0|1,0,1]=4 7442 B9R0.1 CC(CCl)CCCC(O)=O Amb18646189 [0,2,0,0,0,0|1,0,0]=3 7443 B9R0.1 CC(CCl)CCOC(C)=O Amb25757561 [0,2,0,0,0,0|1,0,0]=3 7444 B9R0.1 CC(CCl)NCCS(C)=O Amb25243809 [0,2,0,0,0,0|2,0,0]=4 7445 B9R0.1 CC(CCl)SCCS(C)=O Amb24563154 [0,2,0,0,0,0|2,0,0]=4 7446 B9R0.1 CC(CN)CCCC(C)=C Amb25338731 [0,2,0,0,0,0|1,0,0]=3 7447 B9R0.1 CC(CN)CCCN(C)C Amb24441148 [0,2,0,0,0,0|2,0,0]=4 7448 B9R0.1 CC(CN)CNCC(O)=O Amb25773527 [0,2,0,0,0,0|2,0,0]=4 7449 B9R0.1 CC(CN)CSCC(C)=C Amb24586090 [0,2,0,0,0,0|2,0,0]=4 7450 B9R0.1 CC(CN)NCCC(N)=O Amb24602322 [0,2,0,0,0,0|2,0,0]=4 7451 B9R0.1 CC(CN)NCCC(O)=O Amb24520910 [0,2,0,0,0,0|2,0,0]=4 7452 B9R0.1 CC(CN)NCCS(C)=O Amb25028006 [0,2,0,0,0,0|2,0,0]=4 7453 B9R0.1 CC(CN)OCCC(C)=C Amb24431935 [0,2,0,0,0,0|2,0,0]=4 7454 B9R0.1 CC(CN)OCCC(C)=O Amb18630514 [0,2,0,0,0,0|1,0,0]=3 7455 B9R0.1 CC(CN)OCCC(O)=O Amb18629690 [0,2,0,0,0,0|2,0,0]=4 7456 B9R0.1 CC(CN)SCCC(C)=C Amb25075504 [0,2,0,0,0,0|2,0,0]=4 7457 B9R0.1 CC(CNCC(N)=O)CN Amb25185175 [0,2,0,0,0,0|2,0,0]=4 7458 B9R0.1 CC(CNCC(O)=O)C#N Amb25027854 [0,2,0,0,0,0|2,0,0]=4 7459 B9R0.1 CC(CO)CCCN(C)C Amb25306850 [0,2,0,0,0,0|2,0,0]=4 7460 B9R0.1 CC(CO)CNCC(C)=C Amb24529752 [0,2,0,0,0,0|2,0,0]=4 7461 B9R0.1 CC(CO)COCC(C)=C Amb24422310 [0,2,0,0,0,0|2,0,0]=4 7462 B9R0.1 CC(CO)CSCC(C)=C Amb25794414 [0,2,0,0,0,0|2,0,0]=4 7463 B9R0.1 CC(CO)CSCC(C)=O Amb24702606 [0,2,0,0,0,0|1,0,0]=3 7464 B9R0.1 CC(CO)NCCC(O)=O Amb17719769 [0,2,0,0,0,0|2,0,0]=4 7465 B9R0.1 CC(CO)SCCC(C)=O Amb24393859 [0,2,0,0,0,0|1,0,0]=3 7466 B9R0.1 CC(CO)SCCC(N)=O Amb25146975 [0,2,0,0,0,0|2,0,0]=4 7467 B9R0.1 CC(COCC(C)=C)C=O Amb24759017 [0,2,0,0,0,0|2,0,0]=4 7468 B9R0.1 CC(Cl)CCOC(=O)CCl Amb24482285 [0,2,0,0,0,0|1,0,0]=3 7469 B9R0.1 CC(Cl)CNCC(C)=CCl Amb24409958 [0,2,0,0,0,0|2,0,0]=4 7470 B9R0.1 CC(N)CCCC(=O)C#C Amb24738059 [0,2,0,0,0,0|0,0,1]=3 7471 B9R0.1 CC(N)CCCC(=O)C=C Amb24504987 [0,2,0,0,0,0|0,0,1]=3 7472 B9R0.1 CC(N)CCCC(=O)NN Amb24365195 [0,2,0,0,0,0|1,0,0]=3 7473 B9R0.1 CC(N)CCNC(=O)CN Amb24416462 [0,2,0,0,0,0|1,0,0]=3 7474 B9R0.1 CC(N)CSCC(N)CC Amb24480948 [0,2,0,0,0,0|1,0,1]=4 7475 B9R0.1 CC(N)CSCC(O)CC Amb24438743 [0,2,0,0,0,0|1,0,1]=4 7476 B9R0.1 CC(O)CCCC(=O)C=C Amb24478307 [0,2,0,0,0,0|0,0,1]=3 7477 B9R0.1 CC(O)CCCC(=O)NN Amb24352284 [0,2,0,0,0,0|1,0,0]=3 7478 B9R0.1 CC(O)CCCC(C)CO Amb24420267 [0,2,0,0,0,0|0,0,2]=4 7479 B9R0.1 CC(O)CCCC(Cl)CCl Amb24751581 [0,2,0,0,0,0|0,0,2]=4 7480 B9R0.1 CC(O)CCCC(O)CC Amb25147814 [0,2,0,0,0,0|0,0,2]=4 7481 B9R0.1 CC(O)CCCC(O)CCl Amb24351651 [0,2,0,0,0,0|0,0,2]=4 7482 B9R0.1 CC(O)CCNC(=O)C#C Amb24718699 [0,2,0,0,0,0|1,0,1]=4 7483 B9R0.1 CC(O)CCNC(=O)CN Amb21958786 [0,2,0,0,0,0|1,0,0]=3 7484 B9R0.1 CC(O)CCNC(=O)CO Amb24482704 [0,2,0,0,0,0|1,0,0]=3 7485 B9R0.1 CC(O)CCOC(=O)C=C Amb25317488 [0,2,0,0,0,0|1,0,1]=4 7486 B9R0.1 CC(O)CC\C=C(\C)/C#N Amb25044536 [0,2,0,0,0,0|1,0,1]=4 7487 B9R0.1 CC(O)CC\C=C(\C)/CO Amb25761912 [0,2,0,0,0,0|0,0,2]=4 7488 B9R0.1 CC(O)CNC[C@@H](O)CC Amb25839101 [0,2,0,0,0,0|0,0,2]=4 7489 B9R0.1 CC(O)COCC(=O)CO Amb24371356 [0,2,0,0,0,0|1,0,0]=3 7490 B9R0.1 CC(O)COCC(O)CC Amb25215417 [0,2,0,0,0,0|0,0,2]=4 7491 B9R0.1 CC(O)CSCC(C)=CCl Amb24430682 [0,2,0,0,0,0|2,0,0]=4 7492 B9R0.1 CCC(=C)CCCC(C)O Amb24529321 [0,2,0,0,0,0|1,0,0]=3 7493 B9R0.1 CCC(=C)CNCC(C)C Amb25848729 [0,2,0,0,0,0|2,0,0]=4 7494 B9R0.1 CCC(=C)CNCC(C)O Amb24474489 [0,2,0,0,0,0|2,0,0]=4 7495 B9R0.1 CCC(=C)CNCC(N)=O Amb24706049 [0,2,0,0,0,0|1,0,1]=4 7496 B9R0.1 CCC(=C)CNC[C@@H](C)O Amb25707181 [0,2,0,0,0,0|2,0,0]=4 7497 B9R0.1 CCC(=C)CNC[C@H](C)O Amb24678199 [0,2,0,0,0,0|2,0,0]=4 7498 B9R0.1 CCC(=C)CSCC(C)N Amb25677030 [0,2,0,0,0,0|2,0,0]=4 7499 B9R0.1 CCC(=N)NCCC(C)C Amb24677149 [0,2,0,0,0,0|2,0,0]=4 7500 B9R0.1 CCC(=O)CCCS(C)=O Amb24452285 [0,2,0,0,0,0|1,0,0]=3 7501 B9R0.1 CCC(=O)CCC[C@H](C)O Amb25723337 [0,2,0,0,0,0|0,0,0]=2 7502 B9R0.1 CCC(=O)CSCC(C)C Amb18800475 [0,2,0,0,0,0|1,0,0]=3 7503 B9R0.1 CCC(=O)CSCC(N)=O Amb25229958 [0,2,0,0,0,0|1,0,1]=4 7504 B9R0.1 CCC(=O)NCCC(=O)C Amb17102869 [0,2,0,0,0,0|0,0,1]=3 7505 B9R0.1 CCC(=O)NCCC(=O)N Amb17231982 [0,2,0,0,0,0|1,0,1]=4 7506 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,2,0,0,0,0|1,0,1]=4 7507 B9R0.1 CCC(=O)NCCC(C)C Amb17738423 [0,2,0,0,0,0|1,0,0]=3 7508 B9R0.1 CCC(=O)NCCC(F)F Amb24612540 [0,2,0,0,0,0|2,0,0]=4 7509 B9R0.1 CCC(=O)NCCN(C)C Amb1207104 [0,2,0,0,0,0|2,0,0]=4 7510 B9R0.1 CCC(=O)NCCS(C)=O Amb24685610 [0,2,0,0,0,0|1,0,1]=4 7511 B9R0.1 CCC(=O)NCC[C@@H](C)O Amb25795858 [0,2,0,0,0,0|1,0,0]=3 7512 B9R0.1 CCC(=O)NCC[C@H](C)O Amb24386638 [0,2,0,0,0,0|1,0,0]=3 7513 B9R0.1 CCC(=O)NCOC(C)C Amb10562770 [0,2,0,0,0,0|2,0,0]=4 7514 B9R0.1 CCC(=O)OCCC(C)O Amb24735173 [0,2,0,0,0,0|1,0,0]=3 7515 B9R0.1 CCC(=O)OCCC(N)=O Amb24482884 [0,2,0,0,0,0|1,0,1]=4 7516 B9R0.1 CCC(=O)OCCN(C)C Amb25802700 [0,2,0,0,0,0|2,0,0]=4 7517 B9R0.1 CCC(=O)SCCN(C)C Amb25084328 [0,2,0,0,0,0|2,0,0]=4 7518 B9R0.1 CCC(=O)\C=C\CC(C)O Amb24524641 [0,2,0,0,0,0|0,0,2]=4 7519 B9R0.1 CCC(Br)CCNC(C)=O Amb24388776 [0,2,0,0,0,0|0,0,0]=2 7520 B9R0.1 CCC(C)C#CCC(C)=O Amb25047884 [0,2,0,0,0,0|0,0,1]=3 7521 B9R0.1 CCC(C)C=NNC(C)=O Amb25106422 [0,2,0,0,0,0|1,0,1]=4 7522 B9R0.1 CCC(C)CC#CC(O)=O Amb24661749 [0,2,0,0,0,0|1,0,1]=4 7523 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [0,2,0,0,0,0|1,0,0]=3 7524 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [0,2,0,0,0,0|0,0,0]=2 7525 B9R0.1 CCC(C)CCCC(C)Cl Amb25107922 [0,2,0,0,0,0|1,0,1]=4 7526 B9R0.1 CCC(C)CCCC(N)=O Amb24350177 [0,2,0,0,0,0|1,0,0]=3 7527 B9R0.1 CCC(C)CCCC(O)=O Amb18124682 [0,2,0,0,0,0|1,0,0]=3 7528 B9R0.1 CCC(C)CCNN(C)C Amb25336763 [0,2,0,0,0,0|2,0,0]=4 7529 B9R0.1 CCC(C)CCOC(C)=O Amb24325171 [0,2,0,0,0,0|0,0,0]=2 7530 B9R0.1 CCC(C)CCOC(N)=O Amb24478211 [0,2,0,0,0,0|1,0,0]=3 7531 B9R0.1 CCC(C)CNCC(=C)Br Amb25044418 [0,2,0,0,0,0|1,0,1]=4 7532 B9R0.1 CCC(C)CNCC(=C)Cl Amb18182593 [0,2,0,0,0,0|1,0,1]=4 7533 B9R0.1 CCC(C)CNCC(C)=C Amb24434834 [0,2,0,0,0,0|1,0,0]=3 7534 B9R0.1 CCC(C)CNC[C@@H](C)O Amb25045168 [0,2,0,0,0,0|0,0,2]=4 7535 B9R0.1 CCC(C)CON=C(C)C Amb24673290 [0,2,0,0,0,0|2,0,0]=4 7536 B9R0.1 CCC(C)CONC(C)=O Amb25097564 [0,2,0,0,0,0|1,0,0]=3 7537 B9R0.1 CCC(C)CSCC(=C)Cl Amb24449060 [0,2,0,0,0,0|1,0,1]=4 7538 B9R0.1 CCC(C)CSCC(C)=C Amb25209723 [0,2,0,0,0,0|1,0,0]=3 7539 B9R0.1 CCC(C)CSCC(C)N Amb24437953 [0,2,0,0,0,0|1,0,1]=4 7540 B9R0.1 CCC(C)CSCC(C)O Amb25733215 [0,2,0,0,0,0|0,0,2]=4 7541 B9R0.1 CCC(C)CSCC(N)=N Amb25115224 [0,2,0,0,0,0|2,0,0]=4 7542 B9R0.1 CCC(C)CSCC(N)=O Amb25218767 [0,2,0,0,0,0|1,0,0]=3 7543 B9R0.1 CCC(C)CSCC(O)=O Amb18800668 [0,2,0,0,0,0|1,0,0]=3 7544 B9R0.1 CCC(C)CSC[C@H](C)N Amb25741594 [0,2,0,0,0,0|1,0,1]=4 7545 B9R0.1 CCC(C)NCCC(C)O Amb25093108 [0,2,0,0,0,0|0,0,2]=4 7546 B9R0.1 CCC(C)NCCC(N)=O Amb19960042 [0,2,0,0,0,0|1,0,0]=3 7547 B9R0.1 CCC(C)NCC[C@@H](C)O Amb25796571 [0,2,0,0,0,0|0,0,2]=4 7548 B9R0.1 CCC(C)NCC[C@H](C)O Amb25769129 [0,2,0,0,0,0|0,0,2]=4 7549 B9R0.1 CCC(C)OCCC(C)=O Amb22229878 [0,2,0,0,0,0|0,0,0]=2 7550 B9R0.1 CCC(C)OCCC(N)=N Amb25769907 [0,2,0,0,0,0|2,0,0]=4 7551 B9R0.1 CCC(C)OCCC(N)=S Amb18180036 [0,2,0,0,0,0|1,1,0]=4 7552 B9R0.1 CCC(C)O\C=C\C(C)=O Amb24690824 [0,2,0,0,0,0|0,0,2]=4 7553 B9R0.1 CCC(C)SCC=C(C)C Amb25740029 [0,2,0,0,0,0|1,0,1]=4 7554 B9R0.1 CCC(C)SCCC(C)N Amb24351929 [0,2,0,0,0,0|1,0,1]=4 7555 B9R0.1 CCC(C)SCCC(N)=O Amb18798042 [0,2,0,0,0,0|1,0,0]=3 7556 B9R0.1 CCC(C)SCCN(C)C Amb24353955 [0,2,0,0,0,0|2,0,0]=4 7557 B9R0.1 CCC(C)\C=C/CC(C)=O Amb24708353 [0,2,0,0,0,0|0,0,1]=3 7558 B9R0.1 CCC(C)\C=C\CC(C)=O Amb24518460 [0,2,0,0,0,0|0,0,1]=3 7559 B9R0.1 CCC(COCC(C)C)N Amb17485994 [0,2,0,0,0,0|1,0,1]=4 7560 B9R0.1 CCC(Cl)CCCC(=O)Cl Amb25088358 [0,2,0,0,0,0|1,0,0]=3 7561 B9R0.1 CCC(Cl)CCCN(C)Cl Amb24524310 [0,2,0,0,0,0|2,0,0]=4 7562 B9R0.1 CCC(Cl)CCNC(C)=O Amb24407934 [0,2,0,0,0,0|0,0,0]=2 7563 B9R0.1 CCC(Cl)CONC(N)=O Amb25102083 [0,2,0,0,0,0|2,0,0]=4 7564 B9R0.1 CCC(F)CCCC(C)=O Amb25320248 [0,2,0,0,0,0|0,0,0]=2 7565 B9R0.1 CCC(F)CONC(C)=O Amb24482758 [0,2,0,0,0,0|1,0,0]=3 7566 B9R0.1 CCC(F)CONC(N)=O Amb25057369 [0,2,0,0,0,0|2,0,0]=4 7567 B9R0.1 CCC(F)CSCC(=C)Br Amb24353956 [0,2,0,0,0,0|1,0,1]=4 7568 B9R0.1 CCC(N)CCCN(C)C Amb18202383 [0,2,0,0,0,0|2,0,0]=4 7569 B9R0.1 CCC(N)CCNC(C)=O Amb25369840 [0,2,0,0,0,0|0,0,0]=2 7570 B9R0.1 CCC(N)COCC(C)=C Amb18111719 [0,2,0,0,0,0|1,0,0]=3 7571 B9R0.1 CCC(N)COCC(C)=O Amb18103858 [0,2,0,0,0,0|0,0,0]=2 7572 B9R0.1 CCC(N)COCC(N)=O Amb25776983 [0,2,0,0,0,0|1,0,0]=3 7573 B9R0.1 CCC(N)COCC(O)=O Amb18630610 [0,2,0,0,0,0|1,0,0]=3 7574 B9R0.1 CCC(O)C=C=CC(C)=O Amb25086229 [0,2,0,0,0,0|0,0,2]=4 7575 B9R0.1 CCC(O)CCCC(C)=C Amb25144775 [0,2,0,0,0,0|1,0,0]=3 7576 B9R0.1 CCC(O)CCCC(C)=O Amb25146602 [0,2,0,0,0,0|0,0,0]=2 7577 B9R0.1 CCC(O)CCCC(O)=O Amb18644263 [0,2,0,0,0,0|1,0,0]=3 7578 B9R0.1 CCC(O)CCCN(C)C Amb24417857 [0,2,0,0,0,0|2,0,0]=4 7579 B9R0.1 CCC(O)CCCS(C)=O Amb25248449 [0,2,0,0,0,0|1,0,0]=3 7580 B9R0.1 CCC(O)CCOC(C)=O Amb25345386 [0,2,0,0,0,0|0,0,0]=2 7581 B9R0.1 CCC(O)CCSC(C)=O Amb24379978 [0,2,0,0,0,0|0,0,0]=2 7582 B9R0.1 CCC(O)CNCC(=C)Br Amb25804653 [0,2,0,0,0,0|1,0,1]=4 7583 B9R0.1 CCC(O)CNCC(=C)Cl Amb25147732 [0,2,0,0,0,0|1,0,1]=4 7584 B9R0.1 CCC(O)CNN=C(C)C Amb25787686 [0,2,0,0,0,0|2,0,0]=4 7585 B9R0.1 CCC(O)COCC(O)=O Amb25805810 [0,2,0,0,0,0|1,0,0]=3 7586 B9R0.1 CCC(O)CONC(N)=O Amb24685077 [0,2,0,0,0,0|2,0,0]=4 7587 B9R0.1 CCC(O)CSCC(O)=O Amb18792573 [0,2,0,0,0,0|1,0,0]=3 7588 B9R0.1 CCN(C)CCCC(C)N Amb25786949 [0,2,0,0,0,0|1,0,1]=4 7589 B9R0.1 CCN(C)CCNC(C)=N Amb24477902 [0,2,0,0,0,0|2,0,0]=4 7590 B9R0.1 CCN(C)CCNC(N)=O Amb25187364 [0,2,0,0,0,0|2,0,0]=4 7591 B9R0.1 CCS(=O)CCCC(O)=O Amb18788302 [0,2,0,0,0,0|1,0,0]=3 7592 B9R0.1 CCS(=O)CCNC(C)C Amb25823367 [0,2,0,0,0,0|2,0,0]=4 7593 B9R0.1 CCS(=O)NCCC(C)O Amb24615171 [0,2,0,0,0,0|2,0,0]=4 7594 B9R0.1 CC[C@@H](O)CC=C=C(C)C Amb24475821 [0,2,0,0,0,0|1,0,1]=4 7595 B9R0.1 CC[C@@H](O)CNCC(=C)Br Amb24633666 [0,2,0,0,0,0|1,0,1]=4 7596 B9R0.1 CC[C@@H](O)CNCC(=C)Cl Amb24735703 [0,2,0,0,0,0|1,0,1]=4 7597 B9R0.1 CC[C@@H](O)CNCC(C)=C Amb24504852 [0,2,0,0,0,0|1,0,0]=3 7598 B9R0.1 CC[C@H](C)CCCC(C)=O Amb25128211 [0,2,0,0,0,0|0,0,0]=2 7599 B9R0.1 CC[C@H](O)CNCC(C)=C Amb25134861 [0,2,0,0,0,0|1,0,0]=3 7600 B9R0.1 CC[C@H](O)CNCC(N)=O Amb24658160 [0,2,0,0,0,0|1,0,0]=3 7601 B9R0.1 CC\C(\C)=C/CCC(C)=O Amb25138109 [0,2,0,0,0,0|0,0,1]=3 7602 B9R0.1 CN(C)CCCC(N)CO Amb18202279 [0,2,0,0,0,0|2,0,0]=4 7603 B9R0.1 CN(C)CCCC(O)CN Amb24760011 [0,2,0,0,0,0|2,0,0]=4 7604 B9R0.1 CN(C)CCCC(O)CO Amb24371392 [0,2,0,0,0,0|2,0,0]=4 7605 B9R0.1 CN(C)CCCN(C)C=O Amb24073110 [0,2,0,0,0,0|2,0,0]=4 7606 B9R0.1 CN(C)CCNC(=O)CN Amb21958846 [0,2,0,0,0,0|2,0,0]=4 7607 B9R0.1 CN(C)CCNC(=O)CS Amb24073112 [0,2,0,0,0,0|2,0,0]=4 7608 B9R0.1 CN(C)CCOC(=O)CCl Amb25215533 [0,2,0,0,0,0|2,0,0]=4 7609 B9R0.1 CN(C)CCOC(=O)CN Amb25305213 [0,2,0,0,0,0|2,0,0]=4 7610 B9R0.1 CN(CCCC(O)=O)C=O Amb19010086 [0,2,0,0,0,0|2,0,0]=4 7611 B9R0.1 CN=C(N)SCCC(C)C Amb24458483 [0,2,0,0,0,0|2,0,0]=4 7612 B9R0.1 CN=C(N)SCCC(C)C Amb24458939 [0,2,0,0,0,0|2,0,0]=4 7613 B9R0.1 CNC(=N)NCCC(C)C Amb20631268 [0,2,0,0,0,0|2,0,0]=4 7614 B9R0.1 CNC(=O)CCCC(N)=O Amb24746424 [0,2,0,0,0,0|1,0,1]=4 7615 B9R0.1 CNC(=O)CCCC([O-])=O Amb24271120 [0,2,0,0,0,0|1,0,1]=4 7616 B9R0.1 CNC(=O)CCCN(C)C Amb24696256 [0,2,0,0,0,0|1,0,0]=3 7617 B9R0.1 CNC(=O)CCNC(C)C Amb20171905 [0,2,0,0,0,0|1,0,0]=3 7618 B9R0.1 CNC(=O)CCSC(F)F Amb25837577 [0,2,0,0,0,0|2,0,0]=4 7619 B9R0.1 CNC(=O)CN=CC(C)C Amb25786125 [0,2,0,0,0,0|1,0,1]=4 7620 B9R0.1 CNC(=O)CNCC(F)F Amb18791494 [0,2,0,0,0,0|2,0,0]=4 7621 B9R0.1 CNC(=O)CNOC(C)C Amb25279054 [0,2,0,0,0,0|2,0,0]=4 7622 B9R0.1 CNC(=O)CSCC(C)N Amb24446135 [0,2,0,0,0,0|1,0,0]=3 7623 B9R0.1 CNC(=O)CSCC(C)O Amb24402730 [0,2,0,0,0,0|1,0,0]=3 7624 B9R0.1 CNC(=O)CSCC(F)F Amb25092605 [0,2,0,0,0,0|2,0,0]=4 7625 B9R0.1 CNC(=O)CSC[C@H](C)O Amb25169392 [0,2,0,0,0,0|1,0,0]=3 7626 B9R0.1 CNC(=O)NCCC(C)C Amb24720484 [0,2,0,0,0,0|1,0,0]=3 7627 B9R0.1 CNC(=O)NCCC(F)F Amb24590613 [0,2,0,0,0,0|2,0,0]=4 7628 B9R0.1 CNC(=O)NCCN(C)C Amb24715836 [0,2,0,0,0,0|2,0,0]=4 7629 B9R0.1 CNC(=O)NCC[C@@H](C)O Amb24482616 [0,2,0,0,0,0|1,0,0]=3 7630 B9R0.1 CNC(=O)OCCN(C)C Amb24478918 [0,2,0,0,0,0|2,0,0]=4 7631 B9R0.1 CNC(=S)NCCC(C)C Amb25040131 [0,2,0,0,0,0|1,1,0]=4 7632 B9R0.1 CNC(=S)NCC[C@@H](C)O Amb24723422 [0,2,0,0,0,0|1,1,0]=4 7633 B9R0.1 CNC(=S)NCC[C@H](C)O Amb25323457 [0,2,0,0,0,0|1,1,0]=4 7634 B9R0.1 CNC(=S)OCCC(C)C Amb25274339 [0,2,0,0,0,0|1,1,0]=4 7635 B9R0.1 CNC(C)CCCC(C)=C Amb24625063 [0,2,0,0,0,0|1,0,0]=3 7636 B9R0.1 CNC(CCC=C(C)C)C Amb17593577 [0,2,0,0,0,0|1,0,1]=4 7637 B9R0.1 COC(=O)CCCB(O)O Amb25676456 [0,2,0,0,0,0|2,0,0]=4 7638 B9R0.1 COC(=O)CCCC(=C)Br Amb24717516 [0,2,0,0,0,0|0,0,2]=4 7639 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,2,0,0,0,0|0,0,1]=3 7640 B9R0.1 COC(=O)CCCC(C)Br Amb24346809 [0,2,0,0,0,0|0,0,0]=2 7641 B9R0.1 COC(=O)CCCC(C)C Amb22586581 [0,2,0,0,0,0|0,0,0]=2 7642 B9R0.1 COC(=O)CCCC(C)Cl Amb24626627 [0,2,0,0,0,0|0,0,0]=2 7643 B9R0.1 COC(=O)CCCC(C)O Amb24414468 [0,2,0,0,0,0|0,0,0]=2 7644 B9R0.1 COC(=O)CCCC(N)=N Amb24410040 [0,2,0,0,0,0|1,0,1]=4 7645 B9R0.1 COC(=O)CCCC(N)=S Amb25360938 [0,2,0,0,0,0|1,0,1]=4 7646 B9R0.1 COC(=O)CCCS(C)=O Amb18788307 [0,2,0,0,0,0|1,0,0]=3 7647 B9R0.1 COC(=O)CCC[N+](=O)[O-] Amb1073683 [0,2,0,0,0,0|2,0,0]=4 7648 B9R0.1 COC(=O)CCNC(=O)C Amb15691935 [0,2,0,0,0,0|1,0,1]=4 7649 B9R0.1 COC(=O)CCNN(C)C Amb24113609 [0,2,0,0,0,0|2,0,0]=4 7650 B9R0.1 COC(=O)CCSC(C)C Amb18800665 [0,2,0,0,0,0|1,0,0]=3 7651 B9R0.1 COC(=O)CCSC(F)F Amb25714489 [0,2,0,0,0,0|2,0,0]=4 7652 B9R0.1 COC(=O)CNCC(F)F Amb18179465 [0,2,0,0,0,0|2,0,0]=4 7653 B9R0.1 COC(=O)CNC[C@H](C)O Amb25773564 [0,2,0,0,0,0|1,0,0]=3 7654 B9R0.1 COC(=O)CNOC(C)C Amb25707401 [0,2,0,0,0,0|2,0,0]=4 7655 B9R0.1 COC(=O)COCC(C)Cl Amb25257984 [0,2,0,0,0,0|1,0,0]=3 7656 B9R0.1 COC(=O)CSCC(=O)C Amb2444691 [0,2,0,0,0,0|1,0,1]=4 7657 B9R0.1 COC(=O)CSCC(C)O Amb18792574 [0,2,0,0,0,0|1,0,0]=3 7658 B9R0.1 COC(=O)CSC[C@@H](C)O Amb24375131 [0,2,0,0,0,0|1,0,0]=3 7659 B9R0.1 COC(=O)CSC[C@H](C)N Amb24396440 [0,2,0,0,0,0|1,0,0]=3 7660 B9R0.1 COC(=O)CSC[C@H](C)O Amb24375132 [0,2,0,0,0,0|1,0,0]=3 7661 B9R0.1 COC(=O)C\C=C\C(C)N Amb24726991 [0,2,0,0,0,0|0,0,2]=4 7662 B9R0.1 COC(=O)NCCC(C)C Amb17793051 [0,2,0,0,0,0|1,0,0]=3 7663 B9R0.1 COC(=O)NCCC(C)N Amb25736003 [0,2,0,0,0,0|1,0,0]=3 7664 B9R0.1 COC(=O)NCCC(C)O Amb24747341 [0,2,0,0,0,0|1,0,0]=3 7665 B9R0.1 COC(=O)NCCC(F)F Amb25075026 [0,2,0,0,0,0|2,0,0]=4 7666 B9R0.1 COC(=O)NCCN(C)C Amb25229032 [0,2,0,0,0,0|2,0,0]=4 7667 B9R0.1 COC(=O)NCC[C@@H](C)O Amb24353280 [0,2,0,0,0,0|1,0,0]=3 7668 B9R0.1 COC(=O)NOCC(C)C Amb25093309 [0,2,0,0,0,0|2,0,0]=4 7669 B9R0.1 COC(=O)\C=C/CC(C)C Amb10071548 [0,2,0,0,0,0|0,0,2]=4 7670 B9R0.1 COC(=O)\C=C\CC(C)N Amb24741139 [0,2,0,0,0,0|0,0,2]=4 7671 B9R0.1 COC(=O)\C=C\CC(C)O Amb24396746 [0,2,0,0,0,0|0,0,2]=4 7672 B9R0.1 COC(=S)SCCC(C)F Amb25712581 [0,2,0,0,0,0|1,1,0]=4 7673 B9R0.1 COC(C)CCCC(C)=O Amb25146522 [0,2,0,0,0,0|0,0,0]=2 7674 B9R0.1 COC(C)CCCC(O)=O Amb25728362 [0,2,0,0,0,0|1,0,0]=3 7675 B9R0.1 COC(C)CCNC(C)=N Amb24421944 [0,2,0,0,0,0|2,0,0]=4 7676 B9R0.1 COC(C)CCOC(=O)Cl Amb22168236 [0,2,0,0,0,0|2,0,0]=4 7677 B9R0.1 COC(C)CCOC(C)=O Amb19958959 [0,2,0,0,0,0|1,0,0]=3 7678 B9R0.1 COC(C)CCOC(N)=O Amb25679672 [0,2,0,0,0,0|2,0,0]=4 7679 B9R0.1 COC(C)CNCC(O)=O Amb25695493 [0,2,0,0,0,0|2,0,0]=4 7680 B9R0.1 COC(O)CCC=C(C)C Amb24645120 [0,2,0,0,0,0|1,0,1]=4 7681 B9R0.1 CON(C)CCCC(C)C Amb25787865 [0,2,0,0,0,0|1,0,1]=4 7682 B9R0.1 CON(C)CCCC(C)N Amb25762236 [0,2,0,0,0,0|1,0,1]=4 7683 B9R0.1 CO[13C](=O)CCC[13C](=O)O Amb17618084 [0,2,0,0,0,0|1,0,1]=4 7684 B9R0.1 CO[13C](=O)CCC[13C](=O)[13CH3] Amb17617715 [0,2,0,0,0,0|0,0,1]=3 7685 B9R0.1 CS(=O)CCNC(=O)CBr Amb25084224 [0,2,0,0,0,0|2,0,0]=4 7686 B9R0.1 CS(=O)CCNC(=O)CS Amb25343940 [0,2,0,0,0,0|2,0,0]=4 7687 B9R0.1 CS(=O)CSC[C@@H](N)CO Amb25722692 [0,2,0,0,0,0|2,0,0]=4 7688 B9R0.1 CSC(C)CCCC(O)=O Amb25265803 [0,2,0,0,0,0|1,0,0]=3 7689 B9R0.1 CSC(C)CCNC(C)=N Amb25690539 [0,2,0,0,0,0|2,0,0]=4 7690 B9R0.1 CSC(C)CCNC(N)=O Amb25685722 [0,2,0,0,0,0|2,0,0]=4 7691 B9R0.1 CSC(C)CNCC(C)=C Amb24734376 [0,2,0,0,0,0|2,0,0]=4 7692 B9R0.1 CSC(C)CNCC(N)=O Amb25766612 [0,2,0,0,0,0|2,0,0]=4 7693 B9R0.1 CSC(C)CNCC(O)=O Amb25137618 [0,2,0,0,0,0|2,0,0]=4 7694 B9R0.1 C[C@@H](CBr)CCC=C(C)C Amb25054445 [0,2,0,0,0,0|1,0,1]=4 7695 B9R0.1 C[C@@H](CCC=C(C)C)C=C Amb22353105 [0,2,0,0,0,0|1,0,1]=4 7696 B9R0.1 C[C@@H](CCCC(C)=O)C=C Amb24379305 [0,2,0,0,0,0|0,0,0]=2 7697 B9R0.1 C[C@@H](CCCC(O)=O)C=C Amb24447465 [0,2,0,0,0,0|1,0,0]=3 7698 B9R0.1 C[C@@H](CO)CCOC(C)=O Amb24464645 [0,2,0,0,0,0|1,0,0]=3 7699 B9R0.1 C[C@@H](COCC(C)=C)C=O Amb24505120 [0,2,0,0,0,0|2,0,0]=4 7700 B9R0.1 C[C@@H](O)CCNC(=O)C#C Amb24370494 [0,2,0,0,0,0|1,0,1]=4 7701 B9R0.1 C[C@@H](O)CCNC(=O)CCl Amb25143749 [0,2,0,0,0,0|1,0,0]=3 7702 B9R0.1 C[C@@H](O)CCNC(=O)CO Amb24570702 [0,2,0,0,0,0|1,0,0]=3 7703 B9R0.1 C[C@H](CCC=C(C)C)C=C Amb22353149 [0,2,0,0,0,0|1,0,1]=4 7704 B9R0.1 C[C@H](CCC=C(C)C)C=O Amb24710827 [0,2,0,0,0,0|1,0,1]=4 7705 B9R0.1 C[C@H](CCCC(C)=O)C=O Amb25119261 [0,2,0,0,0,0|0,0,0]=2 7706 B9R0.1 C[C@H](CCCC(O)=O)C=C Amb25367325 [0,2,0,0,0,0|1,0,0]=3 7707 B9R0.1 C[C@H](CN)CCC=C(C)C Amb24478120 [0,2,0,0,0,0|1,0,1]=4 7708 B9R0.1 C[C@H](CO)CCCC(C)=O Amb25335279 [0,2,0,0,0,0|0,0,0]=2 7709 B9R0.1 C[C@H](CO)CCNC(C)=O Amb24502371 [0,2,0,0,0,0|1,0,0]=3 7710 B9R0.1 C[C@H](O)CCNC(=O)CO Amb25358407 [0,2,0,0,0,0|1,0,0]=3 7711 B9R0.1 C\C(=C/CCC(C)=O)\C#C Amb24615286 [0,2,0,0,0,0|0,0,2]=4 7712 B9R0.1 C\C(=C\CCC(C)=O)\C#C Amb24558023 [0,2,0,0,0,0|0,0,2]=4 7713 B9R0.1 C\C(\CCCC(O)=O)=C\C Amb25063828 [0,2,0,0,0,0|1,0,1]=4 7714 B9R0.1 C\C(\CCCN(C)C)=N\O Amb24480641 [0,2,0,0,0,0|1,0,1]=4 7715 B9R0.1 C\C(\CF)=C/CCC(C)=O Amb25205662 [0,2,0,0,0,0|0,0,2]=4 7716 B9R0.1 C\C(\CF)=C\CCC(C)=O Amb24512770 [0,2,0,0,0,0|0,0,2]=4 7717 B9R0.1 C\C(\CO)=C\CCC(C)=O Amb24545611 [0,2,0,0,0,0|0,0,2]=4 7718 B9R0.1 ClCC(=O)NCCC(C)C Amb1643484 [0,2,0,0,0,0|1,0,0]=3 7719 B9R0.1 ClCC(=O)NCCN(C)C Amb1137595 [0,2,0,0,0,0|2,0,0]=4 7720 B9R0.1 ClCC(=O)NCCN(C)C Amb13951935 [0,2,0,0,0,0|2,0,0]=4 7721 B9R0.1 NC(=O)CNCC(O)CO Amb25096977 [0,2,0,0,0,0|2,0,0]=4 7722 B9R0.1 NC(=O)COCC(O)CCl Amb24675285 [0,2,0,0,0,0|2,0,0]=4 7723 B9R0.1 NC(=O)CSCC(O)CBr Amb25169390 [0,2,0,0,0,0|2,0,0]=4 7724 B9R0.1 NC(=O)CSCC(O)CCl Amb25169389 [0,2,0,0,0,0|2,0,0]=4 7725 B9R0.1 NC(CCCC(O)=O)C=O Amb25075707 [0,2,0,0,0,0|1,0,1]=4 7726 B9R0.1 NC(CO)COCC(N)=O Amb24555209 [0,2,0,0,0,0|2,0,0]=4 7727 B9R0.1 NC(CS)CCCC(N)=O Amb24477264 [0,2,0,0,0,0|1,0,0]=3 7728 B9R0.1 NC(CS)CCCC(O)=O Amb25706315 [0,2,0,0,0,0|1,0,0]=3 7729 B9R0.1 NCC(=O)CCCC(O)=O Amb18202122 [0,2,0,0,0,0|1,0,1]=4 7730 B9R0.1 NCC(=O)CCCC(O)=O Amb22035333 [0,2,0,0,0,0|1,0,1]=4 7731 B9R0.1 NCC(=O)OCCC(C)C Amb17569860 [0,2,0,0,0,0|1,0,0]=3 7732 B9R0.1 NCC(N)CCCC(O)=O Amb24375177 [0,2,0,0,0,0|1,0,0]=3 7733 B9R0.1 NCC(N)COCC(O)=O Amb24677956 [0,2,0,0,0,0|2,0,0]=4 7734 B9R0.1 NC[C@@H](N)CCCC(O)=O Amb25147297 [0,2,0,0,0,0|1,0,0]=3 7735 B9R0.1 NNC(=O)CCNC(C)C Amb17604770 [0,2,0,0,0,0|2,0,0]=4 7736 B9R0.1 N[C@@H](CO)COCC(N)=O Amb24537982 [0,2,0,0,0,0|2,0,0]=4 7737 B9R0.1 N[C@@H](CS)CCCC(O)=O Amb25288626 [0,2,0,0,0,0|1,0,0]=3 7738 B9R0.1 N[C@H](CS)CCCC(O)=O Amb24482180 [0,2,0,0,0,0|1,0,0]=3 7739 B9R0.1 O=NN(CCCC(=O)O)C Amb17618588 [0,2,0,0,0,0|2,0,0]=4 7740 B9R0.1 OC(=O)CCCC(Cl)CCl Amb18649051 [0,2,0,0,0,0|1,0,0]=3 7741 B9R0.1 OC(=O)COCC(S)CS Amb18129098 [0,2,0,0,0,0|2,0,0]=4 7742 B9R0.1 OCC(O)CNCC(O)=O Amb24360971 [0,2,0,0,0,0|2,0,0]=4 7743 B9R0.1 OCC(O)COCC(O)=O Amb24534716 [0,2,0,0,0,0|2,0,0]=4 7744 B9R0.1 [C-]#[N+]C(C)CCCC(C)C Amb19944628 [0,2,0,0,0,0|1,0,1]=4 7745 B9R0.5 BrCCCCC(=O)NCC Amb17239684 [0,2,0,0,0,0|1,0,0]=3 7746 B9R0.5 BrCCCNC(=O)OCC Amb10608871 [0,2,0,0,0,0|2,0,0]=4 7747 B9R0.5 C#CCC(=O)CCCCN Amb25225096 [0,2,0,0,0,0|1,0,0]=3 7748 B9R0.5 C#CCC(=O)COCCN Amb24407388 [0,2,0,0,0,0|2,0,0]=4 7749 B9R0.5 C#CCC(=O)NCCCN Amb24358622 [0,2,0,0,0,0|2,0,0]=4 7750 B9R0.5 C#CCC(=O)NCCCO Amb25239521 [0,2,0,0,0,0|2,0,0]=4 7751 B9R0.5 C=C=CC(=O)CCCCBr Amb25339293 [0,2,0,0,0,0|1,0,1]=4 7752 B9R0.5 C=C=CC(=O)CCCCO Amb25146568 [0,2,0,0,0,0|1,0,1]=4 7753 B9R0.5 C=CCC(=C)CCCCO Amb25133458 [0,2,0,0,0,0|2,0,0]=4 7754 B9R0.5 C=CCC(=O)CCCC=C Amb25807556 [0,2,0,0,0,0|0,0,2]=4 7755 B9R0.5 C=CCC(=O)CCCCBr Amb24477431 [0,2,0,0,0,0|1,0,0]=3 7756 B9R0.5 C=CCC(=O)CCCCF Amb25357850 [0,2,0,0,0,0|1,0,0]=3 7757 B9R0.5 C=CCC(=O)CCCCO Amb25319991 [0,2,0,0,0,0|1,0,0]=3 7758 B9R0.5 C=CCC(=O)NCCCO Amb24445000 [0,2,0,0,0,0|2,0,0]=4 7759 B9R0.5 C=CCC(=O)OCCCO Amb25380659 [0,2,0,0,0,0|2,0,0]=4 7760 B9R0.5 CC#CC(=O)NCCCN Amb24480893 [0,2,0,0,0,0|2,0,0]=4 7761 B9R0.5 CC#CC(=O)NCCSC Amb24437811 [0,2,0,0,0,0|2,0,0]=4 7762 B9R0.5 CC#CCCC(=O)CCN Amb24524426 [0,2,0,0,0,0|0,0,2]=4 7763 B9R0.5 CC#CCCC(=O)COC Amb25341438 [0,2,0,0,0,0|0,0,2]=4 7764 B9R0.5 CC#C[C@H](O)CCCCC Amb25676195 [0,2,0,0,0,0|0,0,2]=4 7765 B9R0.5 CC(CCCCCl)CC=O Amb24446627 [0,2,0,0,0,0|1,0,1]=4 7766 B9R0.5 CC(CCCCN)=CC#C Amb24703339 [0,2,0,0,0,0|2,0,0]=4 7767 B9R0.5 CC(CCCCO)=CCS Amb24733232 [0,2,0,0,0,0|1,1,0]=4 7768 B9R0.5 CC=CC(=O)OCCCF Amb22008271 [0,2,0,0,0,0|2,0,0]=4 7769 B9R0.5 CCCC#CC(=O)CCC Amb25282689 [0,2,0,0,0,0|0,0,2]=4 7770 B9R0.5 CCCC(=N)NCCCC Amb25821725 [0,2,0,0,0,0|2,0,0]=4 7771 B9R0.5 CCCC(=O)CCCC#N Amb18643453 [0,2,0,0,0,0|1,0,1]=4 7772 B9R0.5 CCCC(=O)CCCC=C Amb24370275 [0,2,0,0,0,0|0,0,2]=4 7773 B9R0.5 CCCC(=O)CCCCBr Amb25844585 [0,2,0,0,0,0|1,0,0]=3 7774 B9R0.5 CCCC(=O)CCCCCl Amb25777036 [0,2,0,0,0,0|1,0,0]=3 7775 B9R0.5 CCCC(=O)CCCCF Amb24462311 [0,2,0,0,0,0|1,0,0]=3 7776 B9R0.5 CCCC(=O)CCCNC Amb24400968 [0,2,0,0,0,0|1,0,0]=3 7777 B9R0.5 CCCC(=O)CCNCC Amb24568186 [0,2,0,0,0,0|1,0,0]=3 7778 B9R0.5 CCCC(=O)CCOCC Amb25203937 [0,2,0,0,0,0|1,0,0]=3 7779 B9R0.5 CCCC(=O)CSCCN Amb24525398 [0,2,0,0,0,0|2,0,0]=4 7780 B9R0.5 CCCC(=O)CSCCO Amb18800667 [0,2,0,0,0,0|2,0,0]=4 7781 B9R0.5 CCCC(=O)NCCCI Amb24688716 [0,2,0,0,0,0|2,0,0]=4 7782 B9R0.5 CCCC(=O)NCCOC Amb17738051 [0,2,0,0,0,0|2,0,0]=4 7783 B9R0.5 CCCC(=O)OCCCCl Amb24411552 [0,2,0,0,0,0|2,0,0]=4 7784 B9R0.5 CCCC(=O)OCCCF Amb22008203 [0,2,0,0,0,0|2,0,0]=4 7785 B9R0.5 CCCC(=O)OCCSC Amb24719191 [0,2,0,0,0,0|2,0,0]=4 7786 B9R0.5 CCCCCC(=C)CCO Amb25802346 [0,2,0,0,0,0|1,0,0]=3 7787 B9R0.5 CCCCCC(=C)N=[N+]=[N-] Amb25054727 [0,2,0,0,0,0|1,0,1]=4 7788 B9R0.5 CCCCCC(=O)C=C=O Amb24478254 [0,2,0,0,0,0|0,0,1]=3 7789 B9R0.5 CCCCCC(=O)CC=N Amb25146702 [0,2,0,0,0,0|0,0,0]=2 7790 B9R0.5 CCCCCC(=O)CC=O Amb25365648 [0,2,0,0,0,0|0,0,0]=2 7791 B9R0.5 CCCCCC(=O)CCN Amb25061132 [0,2,0,0,0,0|0,0,0]=2 7792 B9R0.5 CCCCCC(=O)CSC Amb18182560 [0,2,0,0,0,0|0,0,0]=2 7793 B9R0.5 CCCCCC(=O)N=C=O Amb24392136 [0,2,0,0,0,0|0,0,1]=3 7794 B9R0.5 CCCCCC(=O)NCO Amb24478944 [0,2,0,0,0,0|0,0,0]=2 7795 B9R0.5 CCCCCC(=O)OC=C Amb17938956 [0,2,0,0,0,0|0,0,1]=3 7796 B9R0.5 CCCCCC(=O)OCCl Amb24568887 [0,2,0,0,0,0|0,0,0]=2 7797 B9R0.5 CCCCCC(=O)\C=C/N Amb24408490 [0,2,0,0,0,0|0,0,1]=3 7798 B9R0.5 CCCCCC(=S)NCC Amb25375522 [0,2,0,0,0,0|0,1,0]=3 7799 B9R0.5 CCCCCC(C)=CCN Amb25330387 [0,2,0,0,0,0|1,0,0]=3 7800 B9R0.5 CCCCCC(C)=CCO Amb24704431 [0,2,0,0,0,0|0,0,1]=3 7801 B9R0.5 CCCCCC(C)=NNC Amb25056847 [0,2,0,0,0,0|1,0,0]=3 7802 B9R0.5 CCCCCC(C)=NOC Amb25795974 [0,2,0,0,0,0|0,0,1]=3 7803 B9R0.5 CCCCCC(C)CC=C Amb25744101 [0,2,0,0,0,0|1,0,1]=4 7804 B9R0.5 CCCCCC(C)CC=O Amb21953169 [0,2,0,0,0,0|0,0,1]=3 7805 B9R0.5 CCCCCC(C)CCN Amb24738346 [0,2,0,0,0,0|1,0,1]=4 7806 B9R0.5 CCCCCC(C)CCO Amb24733660 [0,2,0,0,0,0|0,0,2]=4 7807 B9R0.5 CCCCCC(C)CNC Amb24477939 [0,2,0,0,0,0|1,0,1]=4 7808 B9R0.5 CCCCCC(C)C[Mg]Br Amb22897331 [0,2,0,0,0,0|1,0,1]=4 7809 B9R0.5 CCCCCC(C)C[Zn]Br Amb22897834 [0,2,0,0,0,0|1,0,1]=4 7810 B9R0.5 CCCCCC(C)N=C=O Amb24476932 [0,2,0,0,0,0|0,0,1]=3 7811 B9R0.5 CCCCCC(C)N=[N+]=[N-] Amb17940338 [0,2,0,0,0,0|1,0,1]=4 7812 B9R0.5 CCCCCC(C)NC#N Amb24590601 [0,2,0,0,0,0|1,0,1]=4 7813 B9R0.5 CCCCCC(C)NOC Amb24636619 [0,2,0,0,0,0|0,0,2]=4 7814 B9R0.5 CCCCCC(Cl)CC#N Amb24429181 [0,2,0,0,0,0|1,0,1]=4 7815 B9R0.5 CCCCCC(Cl)CCS Amb24390339 [0,2,0,0,0,0|1,0,1]=4 7816 B9R0.5 CCCCCC(Cl)CN=O Amb25835529 [0,2,0,0,0,0|1,0,1]=4 7817 B9R0.5 CCCCCC(Cl)COC Amb18798379 [0,2,0,0,0,0|1,0,1]=4 7818 B9R0.5 CCCCCC(Cl)OCC Amb25298178 [0,2,0,0,0,0|1,0,1]=4 7819 B9R0.5 CCCCCC(F)CCN Amb24384525 [0,2,0,0,0,0|1,0,1]=4 7820 B9R0.5 CCCCCC(N)CC#C Amb25689901 [0,2,0,0,0,0|1,0,1]=4 7821 B9R0.5 CCCCCC(N)CC=C Amb24480685 [0,2,0,0,0,0|1,0,1]=4 7822 B9R0.5 CCCCCC(N)CSC Amb18798072 [0,2,0,0,0,0|1,0,1]=4 7823 B9R0.5 CCCCCC(O)=CC=O Amb25224445 [0,2,0,0,0,0|1,0,0]=3 7824 B9R0.5 CCCCCC(O)CC#C Amb25233899 [0,2,0,0,0,0|0,0,2]=4 7825 B9R0.5 CCCCCC(O)CC#N Amb18643749 [0,2,0,0,0,0|0,0,2]=4 7826 B9R0.5 CCCCCC(O)CCBr Amb24350551 [0,2,0,0,0,0|0,0,2]=4 7827 B9R0.5 CCCCCC(O)CCCl Amb24674167 [0,2,0,0,0,0|0,0,2]=4 7828 B9R0.5 CCCCCC(O)CCN Amb24730197 [0,2,0,0,0,0|0,0,2]=4 7829 B9R0.5 CCCCCC(O)CCO Amb22270100 [0,2,0,0,0,0|0,0,2]=4 7830 B9R0.5 CCCCCC(O)COC Amb24442432 [0,2,0,0,0,0|0,0,2]=4 7831 B9R0.5 CCCCCC(O)CSC Amb18798165 [0,2,0,0,0,0|0,0,2]=4 7832 B9R0.5 CCCCCC(S)CCO Amb24466226 [0,2,0,0,0,0|0,1,1]=4 7833 B9R0.5 CCCCCN(C)CC=C Amb24588145 [0,2,0,0,0,0|2,0,0]=4 7834 B9R0.5 CCCCCN(C)CC=O Amb24478014 [0,2,0,0,0,0|1,0,0]=3 7835 B9R0.5 CCCCCN(C)CCBr Amb24478090 [0,2,0,0,0,0|2,0,0]=4 7836 B9R0.5 CCCCCN(CCCl)C Amb17334595 [0,2,0,0,0,0|2,0,0]=4 7837 B9R0.5 CCCCCS(=O)CC#N Amb24623517 [0,2,0,0,0,0|1,0,0]=3 7838 B9R0.5 CCCCCS(=O)CCO Amb25071794 [0,2,0,0,0,0|1,0,0]=3 7839 B9R0.5 CCCCC[C@@H](C)CCO Amb25283200 [0,2,0,0,0,0|0,0,2]=4 7840 B9R0.5 CCCCC[C@@H](N)CCO Amb25147424 [0,2,0,0,0,0|1,0,1]=4 7841 B9R0.5 CCCCC[C@@H](O)CC#N Amb25357522 [0,2,0,0,0,0|0,0,2]=4 7842 B9R0.5 CCCCC[C@@H](O)CC=O Amb24680284 [0,2,0,0,0,0|0,0,2]=4 7843 B9R0.5 CCCCC[C@@H](O)COC Amb24379950 [0,2,0,0,0,0|0,0,2]=4 7844 B9R0.5 CCCCC[C@H](C)CCN Amb25147639 [0,2,0,0,0,0|1,0,1]=4 7845 B9R0.5 CCCCC[C@H](C)N=C=O Amb22053846 [0,2,0,0,0,0|0,0,1]=3 7846 B9R0.5 CCCCC[C@H](C)N=C=S Amb22045293 [0,2,0,0,0,0|0,1,1]=4 7847 B9R0.5 CCCCC[C@H](O)CC#C Amb25044619 [0,2,0,0,0,0|0,0,2]=4 7848 B9R0.5 CCCCC[C@H](O)CCO Amb25028003 [0,2,0,0,0,0|0,0,2]=4 7849 B9R0.5 CCCCC[C@H](O)COC Amb25801365 [0,2,0,0,0,0|0,0,2]=4 7850 B9R0.5 CCCCC\C(\C)=C/CBr Amb25290401 [0,2,0,0,0,0|1,0,0]=3 7851 B9R0.5 CCCCC\C(\C)=C\C#N Amb24428989 [0,2,0,0,0,0|1,0,0]=3 7852 B9R0.5 CCCCC\C(\C)=C\C=O Amb18643627 [0,2,0,0,0,0|0,0,0]=2 7853 B9R0.5 CCCCC\C(\O)=C\C=O Amb25326080 [0,2,0,0,0,0|1,0,0]=3 7854 B9R0.5 CCCCN=C(N)SCC Amb24660507 [0,2,0,0,0,0|2,0,0]=4 7855 B9R0.5 CCCCN=C(N)SCC Amb24660959 [0,2,0,0,0,0|2,0,0]=4 7856 B9R0.5 CCCCN=C(N)SCC Amb25852485 [0,2,0,0,0,0|2,0,0]=4 7857 B9R0.5 CCCCNC(=N)CC#N Amb18124552 [0,2,0,0,0,0|2,0,0]=4 7858 B9R0.5 CCCCNC(=N)NN=O Amb25378199 [0,2,0,0,0,0|2,0,0]=4 7859 B9R0.5 CCCCNC(=O)C#CCl Amb24435816 [0,2,0,0,0,0|1,0,1]=4 7860 B9R0.5 CCCCNC(=O)CC#N Amb1203319 [0,2,0,0,0,0|1,0,0]=3 7861 B9R0.5 CCCCNC(=O)CC=C Amb24472259 [0,2,0,0,0,0|1,0,0]=3 7862 B9R0.5 CCCCNC(=O)CCBr Amb17330970 [0,2,0,0,0,0|1,0,0]=3 7863 B9R0.5 CCCCNC(=O)CCN Amb21958196 [0,2,0,0,0,0|1,0,0]=3 7864 B9R0.5 CCCCNC(=O)CCO Amb17334238 [0,2,0,0,0,0|1,0,0]=3 7865 B9R0.5 CCCCNC(=O)CCS Amb24354823 [0,2,0,0,0,0|1,0,0]=3 7866 B9R0.5 CCCCNC(=O)COC Amb23247497 [0,2,0,0,0,0|1,0,0]=3 7867 B9R0.5 CCCCNC(=O)CON Amb25683647 [0,2,0,0,0,0|1,0,0]=3 7868 B9R0.5 CCCCNC(=O)N=[N+]=[N-] Amb25779401 [0,2,0,0,0,0|2,0,0]=4 7869 B9R0.5 CCCCNC(=O)OCC Amb10552892 [0,2,0,0,0,0|1,0,0]=3 7870 B9R0.5 CCCCNC(=O)OCCl Amb25703550 [0,2,0,0,0,0|1,0,0]=3 7871 B9R0.5 CCCCNC(=O)OCF Amb24681120 [0,2,0,0,0,0|1,0,0]=3 7872 B9R0.5 CCCCNC(=O)SCC Amb25131164 [0,2,0,0,0,0|1,0,0]=3 7873 B9R0.5 CCCCNC(=S)SCC Amb24381906 [0,2,0,0,0,0|1,1,0]=4 7874 B9R0.5 CCCCOC(=C)N=C=O Amb25054658 [0,2,0,0,0,0|1,0,1]=4 7875 B9R0.5 CCCCOC(=N)CCBr Amb24640981 [0,2,0,0,0,0|2,0,0]=4 7876 B9R0.5 CCCCOC(=O)/C=C/C Amb17940289 [0,2,0,0,0,0|1,0,0]=3 7877 B9R0.5 CCCCOC(=O)CC=O Amb24722099 [0,2,0,0,0,0|1,0,0]=3 7878 B9R0.5 CCCCOC(=O)CCBr Amb25301954 [0,2,0,0,0,0|1,0,0]=3 7879 B9R0.5 CCCCOC(=O)CON Amb25691107 [0,2,0,0,0,0|1,0,0]=3 7880 B9R0.5 CCCCOC(=O)CSC Amb18798147 [0,2,0,0,0,0|1,0,0]=3 7881 B9R0.5 CCCCOC(=O)NCCl Amb25831087 [0,2,0,0,0,0|1,0,0]=3 7882 B9R0.5 CCCCOC(=O)\C=C\N Amb24446980 [0,2,0,0,0,0|1,0,1]=4 7883 B9R0.5 CCCCOC(=S)SCCl Amb25363150 [0,2,0,0,0,0|1,1,0]=4 7884 B9R0.5 CCCCOC(C)N=C=O Amb24477302 [0,2,0,0,0,0|1,0,1]=4 7885 B9R0.5 CCCCOS(=O)CCCl Amb24415401 [0,2,0,0,0,0|2,0,0]=4 7886 B9R0.5 CCCCSC(=O)CNC Amb24679979 [0,2,0,0,0,0|1,0,0]=3 7887 B9R0.5 CCCCSC(=O)OCCl Amb24482256 [0,2,0,0,0,0|1,0,0]=3 7888 B9R0.5 CCCCSC(=S)NCC Amb25701646 [0,2,0,0,0,0|1,1,0]=4 7889 B9R0.5 CCCCSC(C)CC=O Amb25233529 [0,2,0,0,0,0|1,0,1]=4 7890 B9R0.5 CCCNCC(=C)CSC Amb25832416 [0,2,0,0,0,0|2,0,0]=4 7891 B9R0.5 CCCNCC(=O)CC#C Amb25843804 [0,2,0,0,0,0|1,0,0]=3 7892 B9R0.5 CCCNCC(=O)CCC Amb25041554 [0,2,0,0,0,0|1,0,0]=3 7893 B9R0.5 CCCNCC(=O)COC Amb25228409 [0,2,0,0,0,0|1,0,0]=3 7894 B9R0.5 CCCNCC(=O)NC#N Amb25102447 [0,2,0,0,0,0|1,0,1]=4 7895 B9R0.5 CCCOCC(=O)CC#C Amb24709854 [0,2,0,0,0,0|1,0,0]=3 7896 B9R0.5 CCCOCC(=O)CCC Amb25331735 [0,2,0,0,0,0|1,0,0]=3 7897 B9R0.5 CCCOCC(=O)N=C=O Amb24480861 [0,2,0,0,0,0|1,0,1]=4 7898 B9R0.5 CCCOCC(=O)NCC Amb25336196 [0,2,0,0,0,0|1,0,0]=3 7899 B9R0.5 CCCOCC(C)=CCN Amb24617278 [0,2,0,0,0,0|2,0,0]=4 7900 B9R0.5 CCCOC\C(\C)=C\CN Amb24739313 [0,2,0,0,0,0|2,0,0]=4 7901 B9R0.5 CCCONC(=O)CC#N Amb25031207 [0,2,0,0,0,0|2,0,0]=4 7902 B9R0.5 CCCONC(=O)CCBr Amb25707705 [0,2,0,0,0,0|2,0,0]=4 7903 B9R0.5 CCCONC(=O)CCC Amb25031185 [0,2,0,0,0,0|2,0,0]=4 7904 B9R0.5 CCCONC(=O)CCN Amb25784226 [0,2,0,0,0,0|2,0,0]=4 7905 B9R0.5 CCCONC(=O)OCC Amb25046316 [0,2,0,0,0,0|2,0,0]=4 7906 B9R0.5 CCCS(=O)CCCCN Amb25325886 [0,2,0,0,0,0|2,0,0]=4 7907 B9R0.5 CCCS(=O)CCCNC Amb25081219 [0,2,0,0,0,0|2,0,0]=4 7908 B9R0.5 CCCS(=O)CCNCC Amb24363698 [0,2,0,0,0,0|2,0,0]=4 7909 B9R0.5 CCCSCC(=O)CCC Amb18800477 [0,2,0,0,0,0|1,0,0]=3 7910 B9R0.5 CCCSCC(=O)COC Amb25145038 [0,2,0,0,0,0|1,0,0]=3 7911 B9R0.5 CCCSCC(=O)NOC Amb25355411 [0,2,0,0,0,0|1,0,0]=3 7912 B9R0.5 CCCSCC(C)N=C=O Amb25211782 [0,2,0,0,0,0|1,0,1]=4 7913 B9R0.5 CCC[C@H](N)CCCCC Amb25376691 [0,2,0,0,0,0|1,0,1]=4 7914 B9R0.5 CCC[C@H](O)CCCCC Amb24555119 [0,2,0,0,0,0|0,0,2]=4 7915 B9R0.5 CCC\C=C\C(=O)CC=C Amb25370749 [0,2,0,0,0,0|0,0,2]=4 7916 B9R0.5 CCC\C=C\C(=O)CCC Amb17593554 [0,2,0,0,0,0|0,0,2]=4 7917 B9R0.5 CCC\C=C\C(=O)COC Amb24432144 [0,2,0,0,0,0|0,0,2]=4 7918 B9R0.5 CCC\C=C\C(=O)NCC Amb24353919 [0,2,0,0,0,0|0,0,2]=4 7919 B9R0.5 CCC\C=C\C(=O)OCC Amb22001054 [0,2,0,0,0,0|0,0,2]=4 7920 B9R0.5 CCNC(=O)CCCC#C Amb24705433 [0,2,0,0,0,0|0,0,2]=4 7921 B9R0.5 CCNC(=O)CCCC=C Amb24352710 [0,2,0,0,0,0|0,0,2]=4 7922 B9R0.5 CCNC(=O)CCCCN Amb24657917 [0,2,0,0,0,0|1,0,0]=3 7923 B9R0.5 CCNC(=O)CCCSC Amb18411856 [0,2,0,0,0,0|1,0,0]=3 7924 B9R0.5 CCNC(=O)CCNCC Amb20171977 [0,2,0,0,0,0|1,0,0]=3 7925 B9R0.5 CCNC(=O)CCNOC Amb25663026 [0,2,0,0,0,0|2,0,0]=4 7926 B9R0.5 CCNC(=O)CNCCN Amb25314940 [0,2,0,0,0,0|2,0,0]=4 7927 B9R0.5 CCNC(=O)COCCCl Amb25228753 [0,2,0,0,0,0|2,0,0]=4 7928 B9R0.5 CCNC(=O)CSCCS Amb25839537 [0,2,0,0,0,0|2,0,0]=4 7929 B9R0.5 CCNC(=O)NCCCN Amb24478107 [0,2,0,0,0,0|2,0,0]=4 7930 B9R0.5 CCNC(=O)OCCCBr Amb24479498 [0,2,0,0,0,0|2,0,0]=4 7931 B9R0.5 CCNCCC(=O)NC#N Amb25121525 [0,2,0,0,0,0|1,0,1]=4 7932 B9R0.5 CCOC(=O)CC#CCC Amb25057125 [0,2,0,0,0,0|0,0,2]=4 7933 B9R0.5 CCOC(=O)CCC#CC Amb17939773 [0,2,0,0,0,0|0,0,2]=4 7934 B9R0.5 CCOC(=O)CCCC#C Amb18115788 [0,2,0,0,0,0|0,0,2]=4 7935 B9R0.5 CCOC(=O)CCCC#N Amb16233123 [0,2,0,0,0,0|1,0,1]=4 7936 B9R0.5 CCOC(=O)CCCC=O Amb22230665 [0,2,0,0,0,0|1,0,1]=4 7937 B9R0.5 CCOC(=O)CCCCCl Amb24445064 [0,2,0,0,0,0|1,0,0]=3 7938 B9R0.5 CCOC(=O)CCCCN Amb19957938 [0,2,0,0,0,0|1,0,0]=3 7939 B9R0.5 CCOC(=O)CCCCS Amb25246862 [0,2,0,0,0,0|1,0,0]=3 7940 B9R0.5 CCOC(=O)CCCSC Amb25058939 [0,2,0,0,0,0|1,0,0]=3 7941 B9R0.5 CCOC(=O)CCC[Zn]Br Amb22000359 [0,2,0,0,0,0|2,0,0]=4 7942 B9R0.5 CCOC(=O)CCSCCl Amb25109198 [0,2,0,0,0,0|2,0,0]=4 7943 B9R0.5 CCOC(=O)CNCCN Amb24090356 [0,2,0,0,0,0|2,0,0]=4 7944 B9R0.5 CCOC(=O)CNCCS Amb25032631 [0,2,0,0,0,0|2,0,0]=4 7945 B9R0.5 CCOC(=O)COCCCl Amb19958740 [0,2,0,0,0,0|2,0,0]=4 7946 B9R0.5 CCOC(=O)COCCN Amb25850783 [0,2,0,0,0,0|2,0,0]=4 7947 B9R0.5 CCOC(=O)COCCO Amb24113532 [0,2,0,0,0,0|2,0,0]=4 7948 B9R0.5 CCOC(=O)CSCCF Amb25220848 [0,2,0,0,0,0|2,0,0]=4 7949 B9R0.5 CCOC(=O)NCCCN Amb24546405 [0,2,0,0,0,0|2,0,0]=4 7950 B9R0.5 CCOC(=O)NCCOC Amb17792634 [0,2,0,0,0,0|2,0,0]=4 7951 B9R0.5 CCOC(=O)OCCCF Amb24088656 [0,2,0,0,0,0|2,0,0]=4 7952 B9R0.5 CCOC(=O)OCCCN Amb25840265 [0,2,0,0,0,0|2,0,0]=4 7953 B9R0.5 CCOC(=O)OCCNC Amb25742600 [0,2,0,0,0,0|2,0,0]=4 7954 B9R0.5 CCOCCC(=O)CC#C Amb25314014 [0,2,0,0,0,0|1,0,0]=3 7955 B9R0.5 CCOCCC(=O)CC=C Amb25092467 [0,2,0,0,0,0|1,0,0]=3 7956 B9R0.5 CCOCCC(=O)CSC Amb18798154 [0,2,0,0,0,0|1,0,0]=3 7957 B9R0.5 CCOCCC(=O)NC#N Amb25313946 [0,2,0,0,0,0|1,0,1]=4 7958 B9R0.5 CCOCCC(=O)\C=C\Cl Amb24383480 [0,2,0,0,0,0|1,0,1]=4 7959 B9R0.5 CCOCCC(C)=CCCl Amb24417738 [0,2,0,0,0,0|2,0,0]=4 7960 B9R0.5 CCOCCC(C)=CCO Amb25066662 [0,2,0,0,0,0|1,0,1]=4 7961 B9R0.5 CCOCCC(Cl)=CCCl Amb24634026 [0,2,0,0,0,0|2,0,0]=4 7962 B9R0.5 CCOCCS(=O)CCN Amb25055972 [0,2,0,0,0,0|2,0,0]=4 7963 B9R0.5 CCOCCS(=O)CCO Amb25315983 [0,2,0,0,0,0|2,0,0]=4 7964 B9R0.5 CCOCNC(=O)OCC Amb25117140 [0,2,0,0,0,0|2,0,0]=4 7965 B9R0.5 CCSC(=O)CCCCO Amb25806700 [0,2,0,0,0,0|1,0,0]=3 7966 B9R0.5 CCSC(=O)NCCCCl Amb24482473 [0,2,0,0,0,0|2,0,0]=4 7967 B9R0.5 CCSC(=O)NCCCO Amb25090706 [0,2,0,0,0,0|2,0,0]=4 7968 B9R0.5 CCSCCC(=O)NOC Amb24572118 [0,2,0,0,0,0|1,0,0]=3 7969 B9R0.5 CCSCCC(C)NC=O Amb24360891 [0,2,0,0,0,0|1,0,1]=4 7970 B9R0.5 CC\C=C(\C)/CCCCN Amb24684820 [0,2,0,0,0,0|2,0,0]=4 7971 B9R0.5 CC\C=C(\C)/CCCCO Amb25271959 [0,2,0,0,0,0|2,0,0]=4 7972 B9R0.5 CC\C=C\CC(=O)OCC Amb10071538 [0,2,0,0,0,0|0,0,2]=4 7973 B9R0.5 CNCC(=O)CCCC=C Amb24670935 [0,2,0,0,0,0|0,0,2]=4 7974 B9R0.5 CNCC(=O)NCCCC Amb21958174 [0,2,0,0,0,0|1,0,0]=3 7975 B9R0.5 CNCC(=O)NCCCO Amb21958818 [0,2,0,0,0,0|2,0,0]=4 7976 B9R0.5 CNCC(=O)NCCOC Amb21957446 [0,2,0,0,0,0|2,0,0]=4 7977 B9R0.5 CNCCCC(=O)NC#N Amb25046507 [0,2,0,0,0,0|1,0,1]=4 7978 B9R0.5 CNCCCC(=O)NOC Amb25684988 [0,2,0,0,0,0|1,0,0]=3 7979 B9R0.5 CNCCNC(=O)CSC Amb18798163 [0,2,0,0,0,0|2,0,0]=4 7980 B9R0.5 CNCCNC(=O)NCC Amb19027447 [0,2,0,0,0,0|2,0,0]=4 7981 B9R0.5 CNCCNC(=O)\C=C\C Amb18313285 [0,2,0,0,0,0|2,0,0]=4 7982 B9R0.5 COCC(=O)CCCCF Amb24475353 [0,2,0,0,0,0|1,0,0]=3 7983 B9R0.5 COCC(=O)CCCCO Amb25709925 [0,2,0,0,0,0|1,0,0]=3 7984 B9R0.5 COCC(=O)CCCSC Amb25060575 [0,2,0,0,0,0|1,0,0]=3 7985 B9R0.5 COCC(=O)COCCC Amb24482505 [0,2,0,0,0,0|1,0,0]=3 7986 B9R0.5 COCC(=O)NCCCF Amb25796686 [0,2,0,0,0,0|2,0,0]=4 7987 B9R0.5 COCC(=O)NCCCO Amb25786595 [0,2,0,0,0,0|2,0,0]=4 7988 B9R0.5 COCC(=O)NCCOC Amb23247502 [0,2,0,0,0,0|2,0,0]=4 7989 B9R0.5 COCC(=O)NCCSC Amb24458542 [0,2,0,0,0,0|2,0,0]=4 7990 B9R0.5 COCC(=O)OCCCBr Amb25072625 [0,2,0,0,0,0|2,0,0]=4 7991 B9R0.5 COCC(=O)OCCCC Amb20620642 [0,2,0,0,0,0|1,0,0]=3 7992 B9R0.5 COCC(=O)OCCCF Amb24482959 [0,2,0,0,0,0|2,0,0]=4 7993 B9R0.5 COCC(=O)OCCCI Amb24719300 [0,2,0,0,0,0|2,0,0]=4 7994 B9R0.5 COCC(=O)OCCOC Amb25845981 [0,2,0,0,0,0|2,0,0]=4 7995 B9R0.5 COCC(=O)OCCSC Amb25787825 [0,2,0,0,0,0|2,0,0]=4 7996 B9R0.5 COCCCC(=O)CSC Amb18798153 [0,2,0,0,0,0|1,0,0]=3 7997 B9R0.5 COCCCC(=O)N=C=O Amb25361935 [0,2,0,0,0,0|1,0,1]=4 7998 B9R0.5 COCCCC(C)=CC#N Amb24595189 [0,2,0,0,0,0|2,0,0]=4 7999 B9R0.5 COCCCN(C)CC=O Amb24372172 [0,2,0,0,0,0|2,0,0]=4 8000 B9R0.5 COCCCS(=O)CC#N Amb25846579 [0,2,0,0,0,0|2,0,0]=4 8001 B9R0.5 COCCNC(=O)CC#N Amb1103427 [0,2,0,0,0,0|2,0,0]=4 8002 B9R0.5 COCCNC(=O)CCBr Amb17325830 [0,2,0,0,0,0|2,0,0]=4 8003 B9R0.5 COCCNC(=O)CCCl Amb1141903 [0,2,0,0,0,0|2,0,0]=4 8004 B9R0.5 COCCNC(=O)CCN Amb1127290 [0,2,0,0,0,0|2,0,0]=4 8005 B9R0.5 COCCNC(=O)CCN Amb21958798 [0,2,0,0,0,0|2,0,0]=4 8006 B9R0.5 COCCNC(=O)CCO Amb17334264 [0,2,0,0,0,0|2,0,0]=4 8007 B9R0.5 COCCNC(=O)CSC Amb25832308 [0,2,0,0,0,0|2,0,0]=4 8008 B9R0.5 COCCOC(=O)CC=C Amb25228333 [0,2,0,0,0,0|2,0,0]=4 8009 B9R0.5 COCCOC(=O)CCC Amb24450506 [0,2,0,0,0,0|2,0,0]=4 8010 B9R0.5 COCCOC(=O)CCN Amb24468624 [0,2,0,0,0,0|2,0,0]=4 8011 B9R0.5 COCCOC(=O)CON Amb25691096 [0,2,0,0,0,0|2,0,0]=4 8012 B9R0.5 COCCOC(=O)\C=C\C Amb24404476 [0,2,0,0,0,0|2,0,0]=4 8013 B9R0.5 COCSCC(=O)OCC Amb24482667 [0,2,0,0,0,0|2,0,0]=4 8014 B9R0.5 CONC(=O)CCCC#C Amb24482717 [0,2,0,0,0,0|0,0,2]=4 8015 B9R0.5 CONC(=O)CCCC#N Amb25305914 [0,2,0,0,0,0|1,0,1]=4 8016 B9R0.5 CONC(=O)CCCC=C Amb25169382 [0,2,0,0,0,0|0,0,2]=4 8017 B9R0.5 CONC(=O)CCCCCl Amb25045987 [0,2,0,0,0,0|1,0,0]=3 8018 B9R0.5 CONC(=O)CCCCO Amb25851846 [0,2,0,0,0,0|1,0,0]=3 8019 B9R0.5 CONC(=O)COCCO Amb24482795 [0,2,0,0,0,0|2,0,0]=4 8020 B9R0.5 CONC(=O)NCCCF Amb24371097 [0,2,0,0,0,0|2,0,0]=4 8021 B9R0.5 CONC(=O)NCCSC Amb24482792 [0,2,0,0,0,0|2,0,0]=4 8022 B9R0.5 CSCC(=O)CCCCF Amb25705722 [0,2,0,0,0,0|1,0,0]=3 8023 B9R0.5 CSCC(=O)NCCCBr Amb25237189 [0,2,0,0,0,0|2,0,0]=4 8024 B9R0.5 CSCC(=O)NCCCI Amb24524415 [0,2,0,0,0,0|2,0,0]=4 8025 B9R0.5 CSCC(=O)NCCCN Amb18800674 [0,2,0,0,0,0|2,0,0]=4 8026 B9R0.5 CSCC(=O)OCCCF Amb24691802 [0,2,0,0,0,0|2,0,0]=4 8027 B9R0.5 CSCCNC(=O)CC#N Amb25844218 [0,2,0,0,0,0|2,0,0]=4 8028 B9R0.5 CSCCNC(=O)CCBr Amb17330723 [0,2,0,0,0,0|2,0,0]=4 8029 B9R0.5 C[C@@H](N=C=O)CCCCC Amb10807374 [0,2,0,0,0,0|0,0,1]=3 8030 B9R0.5 C[C@@H](N=C=S)CCCCC Amb10807444 [0,2,0,0,0,0|0,1,1]=4 8031 B9R0.5 C\C(\CCCC=C)=C/C=O Amb25707474 [0,2,0,0,0,0|0,0,2]=4 8032 B9R0.5 C\C(\CCCCO)=C/C=O Amb25262253 [0,2,0,0,0,0|1,0,0]=3 8033 B9R0.5 C\C=C/C(=O)CCCC=C Amb24422413 [0,2,0,0,0,0|0,0,2]=4 8034 B9R0.5 C\C=C/C(=O)CCCCC Amb25086296 [0,2,0,0,0,0|0,0,0]=2 8035 B9R0.5 C\C=C/C(=O)\C=C\CCC Amb24724045 [0,2,0,0,0,0|0,0,2]=4 8036 B9R0.5 C\C=C/CCC(=O)CCC Amb24698913 [0,2,0,0,0,0|0,0,2]=4 8037 B9R0.5 C\C=C\C(=O)CCCC=O Amb25743030 [0,2,0,0,0,0|1,0,1]=4 8038 B9R0.5 C\C=C\C(=O)CCCCBr Amb25381449 [0,2,0,0,0,0|1,0,0]=3 8039 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [0,2,0,0,0,0|0,0,0]=2 8040 B9R0.5 C\C=C\C(=O)CCCCCl Amb24548775 [0,2,0,0,0,0|1,0,0]=3 8041 B9R0.5 C\C=C\C(=O)CCCNO Amb25066429 [0,2,0,0,0,0|2,0,0]=4 8042 B9R0.5 C\C=C\C(=O)CCOCC Amb24676741 [0,2,0,0,0,0|1,0,0]=3 8043 B9R0.5 C\C=C\C(=O)NCCOC Amb25032281 [0,2,0,0,0,0|2,0,0]=4 8044 B9R0.5 C\C=C\C(=O)OCCCF Amb22289183 [0,2,0,0,0,0|2,0,0]=4 8045 B9R0.5 C\C=C\C(=O)OCCCO Amb24748584 [0,2,0,0,0,0|2,0,0]=4 8046 B9R0.5 C\C=C\C(=O)OCCSC Amb25849565 [0,2,0,0,0,0|2,0,0]=4 8047 B9R0.5 C\C=C\C(C)CCCCC Amb24639701 [0,2,0,0,0,0|1,0,1]=4 8048 B9R0.5 C\C=C\CCC(=O)NCC Amb25338258 [0,2,0,0,0,0|0,0,2]=4 8049 B9R0.5 C\C=C\CCC(=O)OCC Amb25242775 [0,2,0,0,0,0|0,0,2]=4 8050 B9R0.5 C\C=C\CC\C(\C)=C\C=O Amb18643316 [0,2,0,0,0,0|0,0,2]=4 8051 B9R0.5 ClCCCNC(=O)CCCl Amb2125612 [0,2,0,0,0,0|2,0,0]=4 8052 B9R0.5 N#CCC(=O)NCCCF Amb24447114 [0,2,0,0,0,0|2,0,0]=4 8053 B9R0.5 N#CNC(=O)CCCCCl Amb25799343 [0,2,0,0,0,0|1,0,1]=4 8054 B9R0.5 NCCC(=O)NCCCN Amb25853733 [0,2,0,0,0,0|2,0,0]=4 8055 B9R0.5 NCCC(=O)NCCCO Amb21958819 [0,2,0,0,0,0|2,0,0]=4 8056 B9R0.5 NCCCCC(=O)NCO Amb24715839 [0,2,0,0,0,0|1,0,0]=3 8057 B9R0.5 NCCCCC(=O)OCC Amb10807401 [0,2,0,0,0,0|1,0,0]=3 8058 B9R0.5 NCCCNC(=O)CCCl Amb18177806 [0,2,0,0,0,0|2,0,0]=4 8059 B9R0.5 NCCCNC(=O)CCO Amb24568840 [0,2,0,0,0,0|2,0,0]=4 8060 B9R0.5 NCCS(=O)CCCCF Amb25069235 [0,2,0,0,0,0|2,0,0]=4 8061 B9R0.5 O=C(CCBr)NCCCF Amb24613912 [0,2,0,0,0,0|2,0,0]=4 8062 B9R0.5 O=C(CCCCCl)OCCl Amb24692453 [0,2,0,0,0,0|1,0,0]=3 8063 B9R0.5 O=C(CCS)NCCCS Amb25311911 [0,2,0,0,0,0|2,0,0]=4 8064 B9R0.5 OCCCCC(=O)CCCl Amb25292236 [0,2,0,0,0,0|1,0,0]=3 8065 B9R0.5 OCCCCC(=O)NCC Amb17231999 [0,2,0,0,0,0|1,0,0]=3 8066 B9R0.5 OCCCCC(=O)OCC Amb17593658 [0,2,0,0,0,0|1,0,0]=3 8067 B9R0.5 OCCCNC(=O)CCBr Amb17331230 [0,2,0,0,0,0|2,0,0]=4 8068 B9R0.5 OCCCNC(=O)CCCl Amb17327508 [0,2,0,0,0,0|2,0,0]=4 8069 B9R0.5 [C-]#[N+]CC(=O)NCCCC Amb24678845 [0,2,0,0,0,0|1,0,0]=3 8070 B9R0.5 [C-]#[N+]CCCC(=O)OCC Amb2235706 [0,2,0,0,0,0|1,0,1]=4 8071 B9R0.8 CC#CCC(N)C(=O)OC Amb25076019 [0,2,0,0,0,0|0,0,2]=4 8072 B9R0.8 CC#CC[C@H](N)C(=O)OC Amb25141709 [0,2,0,0,0,0|0,0,2]=4 8073 B9R0.8 CC(=CC)C(=O)CCCC Amb25265828 [0,2,0,0,0,0|1,0,1]=4 8074 B9R0.8 CC(=NCCC)C(=O)CC Amb24553635 [0,2,0,0,0,0|1,0,1]=4 8075 B9R0.8 CC(C#C)C(O)CCCC Amb25071434 [0,2,0,0,0,0|1,0,1]=4 8076 B9R0.8 CC(C#N)C(Cl)CCCC Amb24391494 [0,2,0,0,0,0|1,0,1]=4 8077 B9R0.8 CC(C(CCCC)O)C=C Amb17593607 [0,2,0,0,0,0|1,0,1]=4 8078 B9R0.8 CC(C=C)C(N)CCCC Amb25217048 [0,2,0,0,0,0|1,0,1]=4 8079 B9R0.8 CC(C=O)C(O)CCCC Amb25713646 [0,2,0,0,0,0|0,0,1]=3 8080 B9R0.8 CC(CC)C(N)CCCC Amb24428005 [0,2,0,0,0,0|1,0,1]=4 8081 B9R0.8 CC(CCCC)C(Cl)C=O Amb24482248 [0,2,0,0,0,0|1,0,1]=4 8082 B9R0.8 CC(CCCC)C(F)C=O Amb24646581 [0,2,0,0,0,0|1,0,1]=4 8083 B9R0.8 CC(CCCC)C(O)CC Amb24529236 [0,2,0,0,0,0|0,0,2]=4 8084 B9R0.8 CC(CCCC)C(O)CN Amb25756288 [0,2,0,0,0,0|0,0,2]=4 8085 B9R0.8 CC(CCCC)C(O)CO Amb25787235 [0,2,0,0,0,0|0,0,2]=4 8086 B9R0.8 CC(CCCC)C(O)CS Amb24481288 [0,2,0,0,0,0|0,0,2]=4 8087 B9R0.8 CC(CCCN)C(=O)C=C Amb24379740 [0,2,0,0,0,0|1,0,1]=4 8088 B9R0.8 CC(CCCN)C(=O)NO Amb25230525 [0,2,0,0,0,0|2,0,0]=4 8089 B9R0.8 CC(CCCN)C(C)=NO Amb25277111 [0,2,0,0,0,0|1,0,1]=4 8090 B9R0.8 CC(CNCC)C(=O)CC Amb25843642 [0,2,0,0,0,0|1,0,0]=3 8091 B9R0.8 CC(CO)C(Cl)CCCC Amb25046785 [0,2,0,0,0,0|0,0,2]=4 8092 B9R0.8 CC(CO)C(O)CCCC Amb25856352 [0,2,0,0,0,0|0,0,2]=4 8093 B9R0.8 CC(CO)[C@@H](O)CCCC Amb24698674 [0,2,0,0,0,0|0,0,2]=4 8094 B9R0.8 CC(COCC)C(=O)CC Amb25323025 [0,2,0,0,0,0|1,0,0]=3 8095 B9R0.8 CCC(=C)C(=O)CCCC Amb25146831 [0,2,0,0,0,0|1,0,1]=4 8096 B9R0.8 CCC(=O)C(=O)CCCC Amb25723805 [0,2,0,0,0,0|0,0,1]=3 8097 B9R0.8 CCC(=O)C(=O)NCCC Amb25703151 [0,2,0,0,0,0|1,0,1]=4 8098 B9R0.8 CCC(=O)C(C)CCC#C Amb25797317 [0,2,0,0,0,0|0,0,2]=4 8099 B9R0.8 CCC(=O)C(C)CCC#N Amb18643441 [0,2,0,0,0,0|1,0,1]=4 8100 B9R0.8 CCC(=O)C(C)CCC=C Amb24668637 [0,2,0,0,0,0|0,0,2]=4 8101 B9R0.8 CCC(=O)C(C)CCC=O Amb18643954 [0,2,0,0,0,0|1,0,1]=4 8102 B9R0.8 CCC(=O)C(C)CCSC Amb25303660 [0,2,0,0,0,0|1,0,0]=3 8103 B9R0.8 CCC(=O)C(C)OCCC Amb24569608 [0,2,0,0,0,0|1,0,0]=3 8104 B9R0.8 CCC(=O)C(C)OCCCl Amb25111587 [0,2,0,0,0,0|2,0,0]=4 8105 B9R0.8 CCC(=O)C(C)SCCC Amb25141294 [0,2,0,0,0,0|1,0,0]=3 8106 B9R0.8 CCC(=O)C(C)SCCO Amb25052539 [0,2,0,0,0,0|2,0,0]=4 8107 B9R0.8 CCC(=O)C(C)SCCS Amb24364065 [0,2,0,0,0,0|2,0,0]=4 8108 B9R0.8 CCC(=O)C(N)CCC=C Amb25287718 [0,2,0,0,0,0|0,0,2]=4 8109 B9R0.8 CCC(=O)N(C)CCCO Amb24363845 [0,2,0,0,0,0|2,0,0]=4 8110 B9R0.8 CCC(=O)N(C)CCOC Amb25291328 [0,2,0,0,0,0|2,0,0]=4 8111 B9R0.8 CCC(=O)[C@@H](C)OCCC Amb25723352 [0,2,0,0,0,0|1,0,0]=3 8112 B9R0.8 CCC(=O)\C(\Cl)=C\CCC Amb24361276 [0,2,0,0,0,0|0,0,2]=4 8113 B9R0.8 CCC(N)C(O)CCCC Amb24609875 [0,2,0,0,0,0|1,0,1]=4 8114 B9R0.8 CCC(O)C(Cl)CCCC Amb25758728 [0,2,0,0,0,0|0,0,2]=4 8115 B9R0.8 CCCCC(=C)C(=O)CC Amb25334022 [0,2,0,0,0,0|0,0,1]=3 8116 B9R0.8 CCCCC(=C)C(C)C=O Amb18643640 [0,2,0,0,0,0|0,0,2]=4 8117 B9R0.8 CCCCC(=O)C(=O)OC Amb22755702 [0,2,0,0,0,0|0,0,1]=3 8118 B9R0.8 CCCCC(=O)C(=S)NC Amb24482026 [0,2,0,0,0,0|0,1,1]=4 8119 B9R0.8 CCCCC(=O)C(Cl)=CC Amb25328885 [0,2,0,0,0,0|1,0,1]=4 8120 B9R0.8 CCCCC(=O)\C(\Cl)=C\C Amb25713487 [0,2,0,0,0,0|1,0,1]=4 8121 B9R0.8 CCCCC(Br)C(=O)CC Amb24383150 [0,2,0,0,0,0|0,0,0]=2 8122 B9R0.8 CCCCC(Br)C(=O)NC Amb25112130 [0,2,0,0,0,0|0,0,0]=2 8123 B9R0.8 CCCCC(Br)C(=O)OC Amb19514695 [0,2,0,0,0,0|0,0,0]=2 8124 B9R0.8 CCCCC(C)=C(C)CO Amb24747676 [0,2,0,0,0,0|0,0,2]=4 8125 B9R0.8 CCCCC(C)C(=O)C#C Amb24481163 [0,2,0,0,0,0|0,0,1]=3 8126 B9R0.8 CCCCC(C)C(=O)CBr Amb25852950 [0,2,0,0,0,0|0,0,0]=2 8127 B9R0.8 CCCCC(C)C(=O)CC Amb25359211 [0,2,0,0,0,0|0,0,0]=2 8128 B9R0.8 CCCCC(C)C(=O)CCl Amb24479196 [0,2,0,0,0,0|0,0,0]=2 8129 B9R0.8 CCCCC(C)C(=O)CN Amb24481155 [0,2,0,0,0,0|0,0,0]=2 8130 B9R0.8 CCCCC(C)C(C)=NN Amb25319961 [0,2,0,0,0,0|1,0,0]=3 8131 B9R0.8 CCCCC(C)C(C)CN Amb24715368 [0,2,0,0,0,0|1,0,1]=4 8132 B9R0.8 CCCCC(C)C(C)CO Amb25782737 [0,2,0,0,0,0|0,0,2]=4 8133 B9R0.8 CCCCC(C)C(C)NN Amb24618945 [0,2,0,0,0,0|1,0,1]=4 8134 B9R0.8 CCCCC(C)N(C)C#N Amb25105105 [0,2,0,0,0,0|2,0,0]=4 8135 B9R0.8 CCCCC(C)N(C)CC Amb24588155 [0,2,0,0,0,0|2,0,0]=4 8136 B9R0.8 CCCCC(Cl)C(=O)NC Amb18800742 [0,2,0,0,0,0|0,0,0]=2 8137 B9R0.8 CCCCC(Cl)C(=O)OC Amb18800859 [0,2,0,0,0,0|0,0,0]=2 8138 B9R0.8 CCCCC(F)[C@@H](O)CO Amb24122595 [0,2,0,0,0,0|0,0,2]=4 8139 B9R0.8 CCCCC(N)C(=O)C#C Amb24697836 [0,2,0,0,0,0|0,0,1]=3 8140 B9R0.8 CCCCC(N)C(=O)CC Amb25757616 [0,2,0,0,0,0|0,0,0]=2 8141 B9R0.8 CCCCC(N)C(=O)CCl Amb25065023 [0,2,0,0,0,0|0,0,0]=2 8142 B9R0.8 CCCCC(N)C(=O)NC Amb18303660 [0,2,0,0,0,0|0,0,0]=2 8143 B9R0.8 CCCCC(N)C(=O)NO Amb22059372 [0,2,0,0,0,0|1,0,0]=3 8144 B9R0.8 CCCCC(N)C(C)=C=C Amb25340336 [0,2,0,0,0,0|1,0,0]=3 8145 B9R0.8 CCCCC(N)C(O)=NO Amb20669518 [0,2,0,0,0,0|1,0,1]=4 8146 B9R0.8 CCCCC(O)C(=C)C#N Amb18643442 [0,2,0,0,0,0|1,0,1]=4 8147 B9R0.8 CCCCC(O)C(=O)CC Amb25714343 [0,2,0,0,0,0|0,0,0]=2 8148 B9R0.8 CCCCC(O)C(=O)NN Amb25222246 [0,2,0,0,0,0|1,0,0]=3 8149 B9R0.8 CCCCC(O)C(=O)NO Amb24482809 [0,2,0,0,0,0|1,0,0]=3 8150 B9R0.8 CCCCC(O)C(=O)OC Amb23596568 [0,2,0,0,0,0|0,0,0]=2 8151 B9R0.8 CCCCC(O)C(=O)SC Amb24748546 [0,2,0,0,0,0|0,0,0]=2 8152 B9R0.8 CCCCC(O)C(C)=C=C Amb24481137 [0,2,0,0,0,0|1,0,0]=3 8153 B9R0.8 CCCCC(O)C(Cl)CC Amb24711915 [0,2,0,0,0,0|1,0,1]=4 8154 B9R0.8 CCCCC(O)C(Cl)CCl Amb25088315 [0,2,0,0,0,0|1,0,1]=4 8155 B9R0.8 CCCCC(O)C(F)=CC Amb25306120 [0,2,0,0,0,0|1,0,0]=3 8156 B9R0.8 CCCCC(O)C(O)CBr Amb24452745 [0,2,0,0,0,0|0,0,2]=4 8157 B9R0.8 CCCCC(O)C(O)CCl Amb24480473 [0,2,0,0,0,0|0,0,2]=4 8158 B9R0.8 CCCCC(S)C(=O)OC Amb24745120 [0,2,0,0,0,0|0,0,0]=2 8159 B9R0.8 CCCCN(C(=O)CBr)C Amb17325576 [0,2,0,0,0,0|1,0,0]=3 8160 B9R0.8 CCCCN(C(=O)CO)C Amb17334237 [0,2,0,0,0,0|1,0,0]=3 8161 B9R0.8 CCCCN(C)C(=O)CN Amb21957782 [0,2,0,0,0,0|1,0,0]=3 8162 B9R0.8 CCCCN(C)C(=O)CS Amb24482114 [0,2,0,0,0,0|1,0,0]=3 8163 B9R0.8 CCCCN(C)C(=O)NC Amb24632490 [0,2,0,0,0,0|1,0,0]=3 8164 B9R0.8 CCCCN(C)C(=O)OC Amb24721186 [0,2,0,0,0,0|1,0,0]=3 8165 B9R0.8 CCCCN(N)C(=O)NC Amb24400861 [0,2,0,0,0,0|1,0,0]=3 8166 B9R0.8 CCCCN(N)C(=S)NC Amb25068935 [0,2,0,0,0,0|1,1,0]=4 8167 B9R0.8 CCCCN(O)C(=O)CN Amb24640273 [0,2,0,0,0,0|1,0,0]=3 8168 B9R0.8 CCCC[C@@H](Br)C(=O)NC Amb25678518 [0,2,0,0,0,0|0,0,0]=2 8169 B9R0.8 CCCC[C@@H](Br)C(=O)OC Amb25119304 [0,2,0,0,0,0|0,0,0]=2 8170 B9R0.8 CCCC[C@@H](N)C(=O)OC Amb22745342 [0,2,0,0,0,0|0,0,0]=2 8171 B9R0.8 CCCC[C@@H](O)C(=C)CO Amb25687846 [0,2,0,0,0,0|1,0,0]=3 8172 B9R0.8 CCCC[C@@H](O)C(=O)OC Amb24430118 [0,2,0,0,0,0|0,0,0]=2 8173 B9R0.8 CCCC[C@@H](O)[C@@H](Cl)CC Amb24482152 [0,2,0,0,0,0|1,0,1]=4 8174 B9R0.8 CCCC[C@@H](O)[C@@H](O)CCl Amb25837344 [0,2,0,0,0,0|0,0,2]=4 8175 B9R0.8 CCCC[C@@H](O)[C@@H](O)CO Amb25796335 [0,2,0,0,0,0|0,0,2]=4 8176 B9R0.8 CCCC[C@@H](O)[C@H](Cl)CC Amb25279533 [0,2,0,0,0,0|1,0,1]=4 8177 B9R0.8 CCCC[C@H](Br)C(=O)NC Amb25755947 [0,2,0,0,0,0|0,0,0]=2 8178 B9R0.8 CCCC[C@H](C(=O)OC)N Amb16183949 [0,2,0,0,0,0|0,0,0]=2 8179 B9R0.8 CCCC[C@H](N)C(=O)CCl Amb25322512 [0,2,0,0,0,0|0,0,0]=2 8180 B9R0.8 CCCC[C@H](N)C(=O)OC Amb22169631 [0,2,0,0,0,0|0,0,0]=2 8181 B9R0.8 CCCC[C@H](O)C(=C)CO Amb24642396 [0,2,0,0,0,0|1,0,0]=3 8182 B9R0.8 CCCC[C@H](O)C(=O)CO Amb24524634 [0,2,0,0,0,0|0,0,0]=2 8183 B9R0.8 CCCC[C@H](O)C(C)=CC Amb25832667 [0,2,0,0,0,0|1,0,0]=3 8184 B9R0.8 CCCC[C@H](O)[C@@H](O)CCl Amb25707846 [0,2,0,0,0,0|0,0,2]=4 8185 B9R0.8 CCCC[C@H](O)[C@H](O)CCl Amb25837345 [0,2,0,0,0,0|0,0,2]=4 8186 B9R0.8 CCCNC(=O)C(=O)CBr Amb24477292 [0,2,0,0,0,0|1,0,1]=4 8187 B9R0.8 CCCNC(C)C(=O)OC Amb25350065 [0,2,0,0,0,0|1,0,0]=3 8188 B9R0.8 CCCOC(=O)C(=O)CBr Amb25090635 [0,2,0,0,0,0|1,0,1]=4 8189 B9R0.8 CCCOC(C)C(=O)NN Amb19960287 [0,2,0,0,0,0|2,0,0]=4 8190 B9R0.8 CCCSC(C)C(=O)NC Amb24420363 [0,2,0,0,0,0|1,0,0]=3 8191 B9R0.8 CCCSC(C)C(=O)NN Amb24420220 [0,2,0,0,0,0|2,0,0]=4 8192 B9R0.8 CCCSC(C)C(=O)OC Amb18798146 [0,2,0,0,0,0|1,0,0]=3 8193 B9R0.8 CCC\C=C(\N)/C(=O)OC Amb25361927 [0,2,0,0,0,0|0,0,2]=4 8194 B9R0.8 CCNCC(Br)C(=O)OC Amb25698350 [0,2,0,0,0,0|1,0,0]=3 8195 B9R0.8 CCNCC(C)C(=O)C=C Amb24376850 [0,2,0,0,0,0|1,0,1]=4 8196 B9R0.8 CCNCC(Cl)C(=O)OC Amb24524439 [0,2,0,0,0,0|1,0,0]=3 8197 B9R0.8 CCNCC(N)C(=O)OC Amb24354468 [0,2,0,0,0,0|1,0,0]=3 8198 B9R0.8 CCNCC(O)C(=O)OC Amb25326837 [0,2,0,0,0,0|1,0,0]=3 8199 B9R0.8 CCSCC(N)C(=O)OC Amb18788226 [0,2,0,0,0,0|1,0,0]=3 8200 B9R0.8 CCSC[C@@H](N)C(=O)OC Amb25326708 [0,2,0,0,0,0|1,0,0]=3 8201 B9R0.8 CCSC[C@H](N)C(=O)OC Amb24726239 [0,2,0,0,0,0|1,0,0]=3 8202 B9R0.8 CC[C@@H](Cl)[C@H](Cl)CCCC Amb25045113 [0,2,0,0,0,0|1,0,1]=4 8203 B9R0.8 CC[C@@H](O)[C@@H](O)CCCC Amb25077940 [0,2,0,0,0,0|0,0,2]=4 8204 B9R0.8 CC[C@@H](O)[C@H](Cl)CCCC Amb25232978 [0,2,0,0,0,0|0,0,2]=4 8205 B9R0.8 CC[C@@H](O)[C@H](O)CCCC Amb24509373 [0,2,0,0,0,0|0,0,2]=4 8206 B9R0.8 CC[C@H](Cl)[C@H](Cl)CCCC Amb25232571 [0,2,0,0,0,0|1,0,1]=4 8207 B9R0.8 CC[C@H](O)[C@@H](Cl)CCCC Amb25101617 [0,2,0,0,0,0|0,0,2]=4 8208 B9R0.8 CC[C@H](O)[C@H](Cl)CCCC Amb24482168 [0,2,0,0,0,0|0,0,2]=4 8209 B9R0.8 CN(C(=O)CCl)CCOC Amb17232571 [0,2,0,0,0,0|2,0,0]=4 8210 B9R0.8 CN(C(=O)CN)CCOC Amb17232010 [0,2,0,0,0,0|2,0,0]=4 8211 B9R0.8 CN(CCCN)C(=O)CN Amb24477993 [0,2,0,0,0,0|2,0,0]=4 8212 B9R0.8 CNC(=O)C(=O)CCSC Amb24523022 [0,2,0,0,0,0|1,0,1]=4 8213 B9R0.8 CNC(=O)C(C)CNCC Amb18523854 [0,2,0,0,0,0|1,0,0]=3 8214 B9R0.8 CNC(=O)C(C)NCCN Amb24478040 [0,2,0,0,0,0|2,0,0]=4 8215 B9R0.8 CNC(=O)C(C)NCCS Amb24532094 [0,2,0,0,0,0|2,0,0]=4 8216 B9R0.8 CNC(=O)C(C)OCCN Amb19020757 [0,2,0,0,0,0|2,0,0]=4 8217 B9R0.8 CNC(=O)C(Cl)CCSC Amb18187051 [0,2,0,0,0,0|1,0,0]=3 8218 B9R0.8 CNC(=O)C(N)CCC=C Amb25708722 [0,2,0,0,0,0|0,0,2]=4 8219 B9R0.8 CNC(=O)C(N)CCCN Amb24374793 [0,2,0,0,0,0|1,0,0]=3 8220 B9R0.8 CNC(=O)C(N)CCOC Amb18311406 [0,2,0,0,0,0|1,0,0]=3 8221 B9R0.8 CNC(=O)C(N)CCSC Amb23443538 [0,2,0,0,0,0|1,0,0]=3 8222 B9R0.8 CNC(=O)C(O)CCSC Amb24473701 [0,2,0,0,0,0|1,0,0]=3 8223 B9R0.8 CNC(=O)N(C)CCCN Amb18251291 [0,2,0,0,0,0|2,0,0]=4 8224 B9R0.8 CNC(=O)N(C)CCCO Amb24479013 [0,2,0,0,0,0|2,0,0]=4 8225 B9R0.8 CNC(=O)N(C)CCOC Amb24632839 [0,2,0,0,0,0|2,0,0]=4 8226 B9R0.8 CNC(=O)[C@@H](N)CCCN Amb24615613 [0,2,0,0,0,0|1,0,0]=3 8227 B9R0.8 CNC(=S)C(N)CCSC Amb25799332 [0,2,0,0,0,0|1,1,0]=4 8228 B9R0.8 CNCCN(C)C(=O)CBr Amb25147248 [0,2,0,0,0,0|2,0,0]=4 8229 B9R0.8 CNCCN(C)C(=O)CCl Amb25147249 [0,2,0,0,0,0|2,0,0]=4 8230 B9R0.8 CNCCN(C)C(=O)CN Amb25321612 [0,2,0,0,0,0|2,0,0]=4 8231 B9R0.8 CNCCN(C)C(=O)CS Amb24363344 [0,2,0,0,0,0|2,0,0]=4 8232 B9R0.8 CNCCN(C)C(=O)OC Amb25853559 [0,2,0,0,0,0|2,0,0]=4 8233 B9R0.8 COC(=O)C(=O)CCCBr Amb24440505 [0,2,0,0,0,0|1,0,1]=4 8234 B9R0.8 COC(=O)C(C)CCC#N Amb18643706 [0,2,0,0,0,0|1,0,1]=4 8235 B9R0.8 COC(=O)C(C)CCC=O Amb18644132 [0,2,0,0,0,0|1,0,1]=4 8236 B9R0.8 COC(=O)C(C)CCCBr Amb25249687 [0,2,0,0,0,0|1,0,0]=3 8237 B9R0.8 COC(=O)C(C)CCCO Amb24413656 [0,2,0,0,0,0|1,0,0]=3 8238 B9R0.8 COC(=O)C(C)CNOC Amb25830497 [0,2,0,0,0,0|2,0,0]=4 8239 B9R0.8 COC(=O)C(C)NCCBr Amb25802430 [0,2,0,0,0,0|2,0,0]=4 8240 B9R0.8 COC(=O)C(C)NCCF Amb25032140 [0,2,0,0,0,0|2,0,0]=4 8241 B9R0.8 COC(=O)C(C)OCCN Amb25135790 [0,2,0,0,0,0|2,0,0]=4 8242 B9R0.8 COC(=O)C(C)SCCF Amb25711934 [0,2,0,0,0,0|2,0,0]=4 8243 B9R0.8 COC(=O)C(C)SCCN Amb18798233 [0,2,0,0,0,0|2,0,0]=4 8244 B9R0.8 COC(=O)C(C)SCCO Amb18183513 [0,2,0,0,0,0|2,0,0]=4 8245 B9R0.8 COC(=O)C(CCCBr)Br Amb10071878 [0,2,0,0,0,0|1,0,0]=3 8246 B9R0.8 COC(=O)C(Cl)CCCCl Amb24711462 [0,2,0,0,0,0|1,0,0]=3 8247 B9R0.8 COC(=O)C(Cl)CCSC Amb18327893 [0,2,0,0,0,0|1,0,0]=3 8248 B9R0.8 COC(=O)C(F)CCCN Amb24558737 [0,2,0,0,0,0|1,0,0]=3 8249 B9R0.8 COC(=O)C(N)CCCO Amb18644325 [0,2,0,0,0,0|1,0,0]=3 8250 B9R0.8 COC(=O)C(O)CCC=O Amb25078499 [0,2,0,0,0,0|1,0,1]=4 8251 B9R0.8 COC(=O)C(O)CCCBr Amb24759864 [0,2,0,0,0,0|1,0,0]=3 8252 B9R0.8 COC(=O)C(O)CCCCl Amb24480606 [0,2,0,0,0,0|1,0,0]=3 8253 B9R0.8 COC(=O)C(O)CCCO Amb24404795 [0,2,0,0,0,0|1,0,0]=3 8254 B9R0.8 COC(=O)C(O)CCSC Amb18800831 [0,2,0,0,0,0|1,0,0]=3 8255 B9R0.8 COC(=O)C(O)CNOC Amb24453528 [0,2,0,0,0,0|2,0,0]=4 8256 B9R0.8 COC(=O)C(O)SCCN Amb24442366 [0,2,0,0,0,0|2,0,0]=4 8257 B9R0.8 COC(=O)N(C)CCCBr Amb25124904 [0,2,0,0,0,0|2,0,0]=4 8258 B9R0.8 COC(=O)N(C)CCCO Amb25261910 [0,2,0,0,0,0|2,0,0]=4 8259 B9R0.8 COC(=O)N(C)CCSC Amb25205283 [0,2,0,0,0,0|2,0,0]=4 8260 B9R0.8 COC(=O)[C@@H](C)CCCBr Amb24477377 [0,2,0,0,0,0|1,0,0]=3 8261 B9R0.8 COC(=O)[C@@H](C)NCOC Amb25333636 [0,2,0,0,0,0|2,0,0]=4 8262 B9R0.8 COC(=O)[C@@H](N)CCC#N Amb24479018 [0,2,0,0,0,0|1,0,1]=4 8263 B9R0.8 COC(=O)[C@H](C)NCCCl Amb24505287 [0,2,0,0,0,0|2,0,0]=4 8264 B9R0.8 COC(=O)[C@H](C)NCOC Amb24721830 [0,2,0,0,0,0|2,0,0]=4 8265 B9R0.8 COC(=O)[C@H](C)OCCC Amb25713201 [0,2,0,0,0,0|1,0,0]=3 8266 B9R0.8 COC(=O)[C@H](CCCN)N Amb16183971 [0,2,0,0,0,0|1,0,0]=3 8267 B9R0.8 COC(=O)[C@H](N)CCC#C Amb25367248 [0,2,0,0,0,0|0,0,2]=4 8268 B9R0.8 COC(=O)[C@H](N)CCCN Amb25823371 [0,2,0,0,0,0|1,0,0]=3 8269 B9R0.8 COC(=O)[C@H](N)COCC Amb24478281 [0,2,0,0,0,0|1,0,0]=3 8270 B9R0.8 COC(=O)[C@H](O)CCC=C Amb25749046 [0,2,0,0,0,0|0,0,2]=4 8271 B9R0.8 COCCC(C)C(=O)C#C Amb25294515 [0,2,0,0,0,0|1,0,1]=4 8272 B9R0.8 COCCC(C)C(=O)C=C Amb24622975 [0,2,0,0,0,0|1,0,1]=4 8273 B9R0.8 COCCC(C)C(=O)CN Amb25791410 [0,2,0,0,0,0|1,0,0]=3 8274 B9R0.8 COCCC(C)C(=O)NN Amb24542156 [0,2,0,0,0,0|2,0,0]=4 8275 B9R0.8 COCCC(N)C(=O)NN Amb25117326 [0,2,0,0,0,0|2,0,0]=4 8276 B9R0.8 COCCC(N)C(=O)NO Amb25146432 [0,2,0,0,0,0|2,0,0]=4 8277 B9R0.8 COCCC(N)C(=O)OC Amb24053179 [0,2,0,0,0,0|1,0,0]=3 8278 B9R0.8 COCCN(C)C(=O)CO Amb24509401 [0,2,0,0,0,0|2,0,0]=4 8279 B9R0.8 COCCN(C)C(=O)CS Amb25304849 [0,2,0,0,0,0|2,0,0]=4 8280 B9R0.8 COCCN(C)C(=O)OC Amb25847680 [0,2,0,0,0,0|2,0,0]=4 8281 B9R0.8 CSCCC(C(=O)OC)N Amb1152979 [0,2,0,0,0,0|1,0,0]=3 8282 B9R0.8 CSCCC(N)C(=O)NO Amb22349956 [0,2,0,0,0,0|2,0,0]=4 8283 B9R0.8 CSCCC(N)C(=O)SC Amb24650905 [0,2,0,0,0,0|1,0,0]=3 8284 B9R0.8 CSCCC(O)C(=O)CO Amb24706883 [0,2,0,0,0,0|1,0,0]=3 8285 B9R0.8 CSCCN(C)C(=O)CBr Amb24479467 [0,2,0,0,0,0|2,0,0]=4 8286 B9R0.8 CSCCN(C)C(=O)CCl Amb25087935 [0,2,0,0,0,0|2,0,0]=4 8287 B9R0.8 CSCCN(C)C(=O)CN Amb24407403 [0,2,0,0,0,0|2,0,0]=4 8288 B9R0.8 CSCCN(C)C(=O)CS Amb25129543 [0,2,0,0,0,0|2,0,0]=4 8289 B9R0.8 CSCC[C@@H](C(=O)NC)N Amb17232422 [0,2,0,0,0,0|1,0,0]=3 8290 B9R0.8 CSCC[C@@H](O)C(=O)CO Amb25059562 [0,2,0,0,0,0|1,0,0]=3 8291 B9R0.8 CSCC[C@H](N)C(=O)O[Zn+] Amb20241025 [0,2,0,0,0,0|2,0,0]=4 8292 B9R0.8 CSCC[C@H](O)C(=O)CO Amb25146839 [0,2,0,0,0,0|1,0,0]=3 8293 B9R0.8 C[C@@H](C#C)[C@H](O)CCCC Amb24733867 [0,2,0,0,0,0|1,0,1]=4 8294 B9R0.8 C[C@@H](C=C)[C@@H](N)CCCC Amb25147609 [0,2,0,0,0,0|1,0,1]=4 8295 B9R0.8 C[C@@H](CC)[C@@H](N)CCCC Amb24657197 [0,2,0,0,0,0|1,0,1]=4 8296 B9R0.8 C[C@@H](CC)[C@@H](O)CCCC Amb25316121 [0,2,0,0,0,0|1,0,1]=4 8297 B9R0.8 C[C@@H](CCCC)[C@H](O)CO Amb25058489 [0,2,0,0,0,0|0,0,2]=4 8298 B9R0.8 C[C@@H](CO)[C@H](Cl)CCCC Amb24373114 [0,2,0,0,0,0|0,0,2]=4 8299 B9R0.8 C[C@H](C=C)[C@H](N)CCCC Amb25142159 [0,2,0,0,0,0|1,0,1]=4 8300 B9R0.8 C[C@H](C=O)[C@@H](O)CCCC Amb25075641 [0,2,0,0,0,0|0,0,1]=3 8301 B9R0.8 C[C@H](CC)[C@@H](N)CCCC Amb25848922 [0,2,0,0,0,0|1,0,1]=4 8302 B9R0.8 C[C@H](CC)[C@@H](O)CCCC Amb24481271 [0,2,0,0,0,0|1,0,1]=4 8303 B9R0.8 C[C@H](CC)[C@H](O)CCCC Amb25681479 [0,2,0,0,0,0|1,0,1]=4 8304 B9R0.8 C[C@H](CCCC)[C@@H](O)CO Amb25848502 [0,2,0,0,0,0|0,0,2]=4 8305 B9R0.8 C[C@H](CCCC)[C@H](F)C=O Amb24361895 [0,2,0,0,0,0|1,0,1]=4 8306 B9R0.8 C[C@H](CCCC)[C@H](F)CO Amb24388891 [0,2,0,0,0,0|1,0,1]=4 8307 B9R0.8 C[C@H](CO)[C@@H](O)CCCC Amb25357919 [0,2,0,0,0,0|0,0,2]=4 8308 B9R0.8 C\C(=C/CCC)\C(=O)CC Amb25146872 [0,2,0,0,0,0|0,0,2]=4 8309 B9R0.8 C\C(=C/CCC)\C(=O)CO Amb25713633 [0,2,0,0,0,0|0,0,2]=4 8310 B9R0.8 C\C(=N/O)\C(=O)CCCC Amb25086460 [0,2,0,0,0,0|0,0,2]=4 8311 B9R0.8 C\C=C\CC(C)C(=O)CC Amb24529237 [0,2,0,0,0,0|0,0,2]=4 8312 B9R0.8 C\C=C\CC(F)C(=O)CC Amb24633533 [0,2,0,0,0,0|0,0,2]=4 8313 B9R0.8 NCCCC(O)C(=O)NO Amb24605796 [0,2,0,0,0,0|2,0,0]=4 8314 B9R0.8 NCCC[C@@H](C(=O)OC)N Amb16236222 [0,2,0,0,0,0|1,0,0]=3 8315 B9R0.8 OCCCC(O)C(=O)CO Amb24685446 [0,2,0,0,0,0|1,0,0]=3 8316 B9R0.8 OCCC[C@H](O)C(=O)CO Amb25687237 [0,2,0,0,0,0|1,0,0]=3 8317 B9R0.20 CC(C)(CCCCBr)C=O Amb25104302 [0,2,0,0,0,0|1,0,1]=4 8318 B9R0.20 CC(C)(CCCCCl)C=O Amb18126358 [0,2,0,0,0,0|1,0,1]=4 8319 B9R0.20 CC(C)(CCCCF)C=O Amb24424782 [0,2,0,0,0,0|1,0,1]=4 8320 B9R0.20 CCCCCC(Br)(Br)C=O Amb25103759 [0,2,0,0,0,0|1,0,1]=4 8321 B9R0.20 CCCCCC(C)(Br)C#N Amb25780449 [0,2,0,0,0,0|1,0,1]=4 8322 B9R0.20 CCCCCC(C)(C)CC Amb22052710 [0,2,0,0,0,0|1,0,1]=4 8323 B9R0.20 CCCCCC(C)(C)CCl Amb25804367 [0,2,0,0,0,0|1,0,1]=4 8324 B9R0.20 CCCCCC(C)(C)CN Amb20632202 [0,2,0,0,0,0|1,0,1]=4 8325 B9R0.20 CCCCCC(C)(Cl)C#N Amb24386163 [0,2,0,0,0,0|1,0,1]=4 8326 B9R0.20 CCCCCC(C)(Cl)C=O Amb25290277 [0,2,0,0,0,0|0,0,1]=3 8327 B9R0.20 CCCCCC(C)(Cl)CC Amb22229257 [0,2,0,0,0,0|1,0,1]=4 8328 B9R0.20 CCCCCC(C)(Cl)CO Amb24482527 [0,2,0,0,0,0|0,0,2]=4 8329 B9R0.20 CCCCCC(C)(F)CN Amb25261446 [0,2,0,0,0,0|1,0,1]=4 8330 B9R0.20 CCCCCC(C)(N)C#C Amb24602309 [0,2,0,0,0,0|1,0,1]=4 8331 B9R0.20 CCCCCC(C)(O)C=O Amb25763423 [0,2,0,0,0,0|0,0,1]=3 8332 B9R0.20 CCCCCC(C)(O)CCl Amb25084549 [0,2,0,0,0,0|0,0,2]=4 8333 B9R0.20 CCCCCC(C)(O)CN Amb24744522 [0,2,0,0,0,0|0,0,2]=4 8334 B9R0.20 CCCCCC(C)(O)CO Amb25719931 [0,2,0,0,0,0|0,0,2]=4 8335 B9R0.20 CCCCCC(F)(F)CBr Amb25117473 [0,2,0,0,0,0|1,0,1]=4 8336 B9R0.20 CCCCCP(C)(=O)CCl Amb25061295 [0,2,0,0,0,0|1,0,0]=3 8337 B9R0.20 CCCCCS(=O)(=O)C=C Amb25704162 [0,2,0,0,0,0|1,0,1]=4 8338 B9R0.20 CCCCC[C@@](C)(F)CO Amb25239659 [0,2,0,0,0,0|0,0,2]=4 8339 B9R0.20 CCCCC[C@@](C)(O)CO Amb24448062 [0,2,0,0,0,0|0,0,2]=4 8340 B9R0.20 CCCCC[C@](C)(O)CO Amb24389439 [0,2,0,0,0,0|0,0,2]=4 8341 B9R0.20 CCCCC[Si](C)(C)CCl Amb19883903 [0,2,0,0,0,0|1,1,0]=4 8342 B9R0.20 CCCCNS(=O)(=O)CBr Amb24648966 [0,2,0,0,0,0|2,0,0]=4 8343 B9R0.20 CCCCNS(=O)(=O)CC Amb17862033 [0,2,0,0,0,0|2,0,0]=4 8344 B9R0.20 CCCCNS(=O)(=O)CCl Amb25380649 [0,2,0,0,0,0|2,0,0]=4 8345 B9R0.20 CCCCNS(=O)(=O)NC Amb16948454 [0,2,0,0,0,0|2,0,0]=4 8346 B9R0.20 CCCCOS(=O)(=O)CCl Amb24334952 [0,2,0,0,0,0|2,0,0]=4 8347 B9R0.20 CCCCSC(C)(C)C=O Amb18645415 [0,2,0,0,0,0|1,0,1]=4 8348 B9R0.20 CCS(=O)(=O)CCCCO Amb23452896 [0,2,0,0,0,0|2,0,0]=4 8349 B9R0.20 CCS(=O)(=O)CCCNC Amb24407861 [0,2,0,0,0,0|2,0,0]=4 8350 B9R0.20 CCS(=O)(=O)CCCSC Amb24482522 [0,2,0,0,0,0|2,0,0]=4 8351 B9R0.20 CCS(=O)(=O)CCOCC Amb24523049 [0,2,0,0,0,0|2,0,0]=4 8352 B9R0.20 CCSCCC(C)(C)C=O Amb25362747 [0,2,0,0,0,0|1,0,1]=4 8353 B9R0.20 CCSCCS(=O)(=O)CC Amb10669631 [0,2,0,0,0,0|2,0,0]=4 8354 B9R0.20 CNS(=O)(=O)CCCCF Amb24446052 [0,2,0,0,0,0|2,0,0]=4 8355 B9R0.20 CNS(=O)(=O)CCCCN Amb18180111 [0,2,0,0,0,0|2,0,0]=4 8356 B9R0.20 CNS(=O)(=O)CCCOC Amb23450080 [0,2,0,0,0,0|2,0,0]=4 8357 B9R0.20 CNS(=O)(=O)CCCSC Amb24414727 [0,2,0,0,0,0|2,0,0]=4 8358 B9R0.20 CNS(=O)(=O)CCNCC Amb18792840 [0,2,0,0,0,0|2,0,0]=4 8359 B9R0.20 COCCCC(C)(C)C=O Amb25302343 [0,2,0,0,0,0|1,0,1]=4 8360 B9R0.20 COCCCC(C)(O)C=O Amb24671916 [0,2,0,0,0,0|1,0,1]=4 8361 B9R0.20 COS(=O)(=O)CCCCO Amb24592425 [0,2,0,0,0,0|2,0,0]=4 8362 B9R0.20 CSCCCC(C)(C)C=O Amb24711659 [0,2,0,0,0,0|1,0,1]=4 8363 B9R0.20 ClCCCCS(=O)(=O)CC Amb17139105 [0,2,0,0,0,0|2,0,0]=4 8364 B9R0.20 NCCCCS(=O)(=O)CC Amb17138599 [0,2,0,0,0,0|2,0,0]=4 8365 B9R0.20 NCCCCS(=O)(=O)CF Amb24596485 [0,2,0,0,0,0|2,0,0]=4 8366 B9R0.24 BrCC(=O)CCC(=O)OC Amb17403793 [0,2,0,0,0,0|1,0,1]=4 8367 B9R0.24 CC(CC)NCC(=C)CC Amb24718693 [0,2,0,0,0,0|2,0,0]=4 8368 B9R0.24 CC(CC)SCC(=O)CC Amb18800476 [0,2,0,0,0,0|1,0,0]=3 8369 B9R0.24 CC(CCC(=O)CBr)C#N Amb24477335 [0,2,0,0,0,0|1,0,1]=4 8370 B9R0.24 CC(CCC(=O)CC)=CCl Amb24671479 [0,2,0,0,0,0|1,0,1]=4 8371 B9R0.24 CC(CCC(=O)NN)CN Amb25287777 [0,2,0,0,0,0|2,0,0]=4 8372 B9R0.24 CC(CCC(Br)CC)CC Amb25737784 [0,2,0,0,0,0|1,0,1]=4 8373 B9R0.24 CC(CCC(Cl)CC)OC Amb25084861 [0,2,0,0,0,0|0,0,2]=4 8374 B9R0.24 CC(CCC(O)CC)C=C Amb25849613 [0,2,0,0,0,0|1,0,1]=4 8375 B9R0.24 CC(CCC(O)CC)CC Amb24388933 [0,2,0,0,0,0|0,0,2]=4 8376 B9R0.24 CC(CCC(O)CC)CO Amb25206034 [0,2,0,0,0,0|0,0,2]=4 8377 B9R0.24 CC(CCC(O)CC)OC Amb25147754 [0,2,0,0,0,0|0,0,2]=4 8378 B9R0.24 CC(CN)CCC(=O)C#C Amb25138223 [0,2,0,0,0,0|1,0,1]=4 8379 B9R0.24 CC(CN)CCC(=O)C=C Amb24601148 [0,2,0,0,0,0|1,0,1]=4 8380 B9R0.24 CC(CN)CCC(=O)NO Amb25145597 [0,2,0,0,0,0|2,0,0]=4 8381 B9R0.24 CC(CNC(=N)CC)CC Amb24476271 [0,2,0,0,0,0|2,0,0]=4 8382 B9R0.24 CC(CNC(=O)CC)CC Amb24628624 [0,2,0,0,0,0|1,0,0]=3 8383 B9R0.24 CC(CNC(=O)CN)CN Amb25806994 [0,2,0,0,0,0|2,0,0]=4 8384 B9R0.24 CC(CNC(=O)CO)CO Amb25127228 [0,2,0,0,0,0|2,0,0]=4 8385 B9R0.24 CC(CNC(=O)NC)NC Amb24379217 [0,2,0,0,0,0|2,0,0]=4 8386 B9R0.24 CC(CNC(=O)OC)OC Amb24333803 [0,2,0,0,0,0|2,0,0]=4 8387 B9R0.24 CC(COC(=O)CC)CC Amb24061296 [0,2,0,0,0,0|1,0,0]=3 8388 B9R0.24 CCC(=C)CCC(=O)C=C Amb25373310 [0,2,0,0,0,0|0,0,2]=4 8389 B9R0.24 CCC(=C)CCC(C)C=O Amb25740692 [0,2,0,0,0,0|0,0,2]=4 8390 B9R0.24 CCC(=C)CCC(C)CBr Amb24360356 [0,2,0,0,0,0|2,0,0]=4 8391 B9R0.24 CCC(=C)CCC(C)CCl Amb24455179 [0,2,0,0,0,0|2,0,0]=4 8392 B9R0.24 CCC(=C)CCC(C)CN Amb25135629 [0,2,0,0,0,0|2,0,0]=4 8393 B9R0.24 CCC(=C)CC[C@@H](C)C=O Amb25727919 [0,2,0,0,0,0|0,0,2]=4 8394 B9R0.24 CCC(=C)CC[C@@H](C)CO Amb25782256 [0,2,0,0,0,0|2,0,0]=4 8395 B9R0.24 CCC(=C)CNC(=O)CBr Amb24339384 [0,2,0,0,0,0|1,0,1]=4 8396 B9R0.24 CCC(=C)CNC(=O)CC Amb24339353 [0,2,0,0,0,0|1,0,1]=4 8397 B9R0.24 CCC(=C)CNC(=O)CCl Amb25300510 [0,2,0,0,0,0|1,0,1]=4 8398 B9R0.24 CCC(=C)CNC(=O)CS Amb25300511 [0,2,0,0,0,0|1,0,1]=4 8399 B9R0.24 CCC(=C)CNC(=O)OC Amb24339405 [0,2,0,0,0,0|1,0,1]=4 8400 B9R0.24 CCC(=O)CCC(=O)C=C Amb25146819 [0,2,0,0,0,0|0,0,2]=4 8401 B9R0.24 CCC(=O)CCC(=O)OC Amb24369355 [0,2,0,0,0,0|0,0,1]=3 8402 B9R0.24 CCC(=O)CCC(C)C#N Amb24648520 [0,2,0,0,0,0|1,0,1]=4 8403 B9R0.24 CCC(=O)CCC(C)CO Amb25146971 [0,2,0,0,0,0|1,0,0]=3 8404 B9R0.24 CCC(=O)CCC(C)OC Amb25147751 [0,2,0,0,0,0|1,0,0]=3 8405 B9R0.24 CCC(=O)CC[C@@H](C)C=O Amb24478247 [0,2,0,0,0,0|0,0,2]=4 8406 B9R0.24 CCC(=O)CNC(=O)CC Amb24505115 [0,2,0,0,0,0|1,0,1]=4 8407 B9R0.24 CCC(=O)CNC(=O)CCl Amb24725631 [0,2,0,0,0,0|1,0,1]=4 8408 B9R0.24 CCC(=O)CNC(=O)OC Amb25782037 [0,2,0,0,0,0|1,0,1]=4 8409 B9R0.24 CCC(=O)COC(C)CCl Amb25111994 [0,2,0,0,0,0|2,0,0]=4 8410 B9R0.24 CCC(=O)NCC(C)CN Amb19027064 [0,2,0,0,0,0|2,0,0]=4 8411 B9R0.24 CCC(=O)NCC(C)OC Amb25692806 [0,2,0,0,0,0|2,0,0]=4 8412 B9R0.24 CCC(=O)NCC(O)CN Amb25272632 [0,2,0,0,0,0|2,0,0]=4 8413 B9R0.24 CCC(=O)NCC(O)CO Amb24712225 [0,2,0,0,0,0|2,0,0]=4 8414 B9R0.24 CCC(=O)NC[C@@H](O)CC Amb24447062 [0,2,0,0,0,0|1,0,0]=3 8415 B9R0.24 CCC(=O)OCC(=O)NC Amb25355366 [0,2,0,0,0,0|1,0,1]=4 8416 B9R0.24 CCC(=O)OCC(C)CCl Amb25367344 [0,2,0,0,0,0|2,0,0]=4 8417 B9R0.24 CCC(=O)OCC(C)CO Amb24541857 [0,2,0,0,0,0|2,0,0]=4 8418 B9R0.24 CCC(=O)OCC(F)CC Amb25058063 [0,2,0,0,0,0|1,0,0]=3 8419 B9R0.24 CCC(=O)OCC(O)CBr Amb24477353 [0,2,0,0,0,0|2,0,0]=4 8420 B9R0.24 CCC(=O)OCC(O)CC Amb24449905 [0,2,0,0,0,0|1,0,0]=3 8421 B9R0.24 CCC(=O)OCC(O)CO Amb24740407 [0,2,0,0,0,0|2,0,0]=4 8422 B9R0.24 CCC(=O)OC[C@@H](O)CC Amb24481128 [0,2,0,0,0,0|1,0,0]=3 8423 B9R0.24 CCC(=O)OC[C@@H](O)CO Amb25047981 [0,2,0,0,0,0|2,0,0]=4 8424 B9R0.24 CCC(=O)OC[C@H](C)CO Amb25345171 [0,2,0,0,0,0|2,0,0]=4 8425 B9R0.24 CCC(=O)OC[C@H](O)CC Amb25259058 [0,2,0,0,0,0|1,0,0]=3 8426 B9R0.24 CCC(=O)OC[C@H](O)CCl Amb25794110 [0,2,0,0,0,0|2,0,0]=4 8427 B9R0.24 CCC(=O)OC[C@H](O)CO Amb24615355 [0,2,0,0,0,0|2,0,0]=4 8428 B9R0.24 CCC(=O)\C=C\C(O)CC Amb25372654 [0,2,0,0,0,0|0,0,2]=4 8429 B9R0.24 CCC(Br)\C=C\C(=O)OC Amb25277217 [0,2,0,0,0,0|0,0,2]=4 8430 B9R0.24 CCC(C)C#CC(=O)OC Amb25333980 [0,2,0,0,0,0|0,0,2]=4 8431 B9R0.24 CCC(C)CCC(=O)NC Amb24482921 [0,2,0,0,0,0|0,0,0]=2 8432 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,2,0,0,0,0|0,0,0]=2 8433 B9R0.24 CCC(C)CCC(C)CO Amb22641860 [0,2,0,0,0,0|0,0,2]=4 8434 B9R0.24 CCC(C)CNC(=O)C=C Amb25238655 [0,2,0,0,0,0|1,0,1]=4 8435 B9R0.24 CCC(C)CNC(=O)CBr Amb23512819 [0,2,0,0,0,0|1,0,0]=3 8436 B9R0.24 CCC(C)CNC(=O)CCl Amb18798260 [0,2,0,0,0,0|1,0,0]=3 8437 B9R0.24 CCC(C)CNC(=O)CN Amb19028765 [0,2,0,0,0,0|1,0,0]=3 8438 B9R0.24 CCC(C)CNC(=O)CS Amb24445028 [0,2,0,0,0,0|1,0,0]=3 8439 B9R0.24 CCC(C)CNC(=O)NN Amb24442838 [0,2,0,0,0,0|2,0,0]=4 8440 B9R0.24 CCC(C)CNC(=O)OC Amb25054721 [0,2,0,0,0,0|1,0,0]=3 8441 B9R0.24 CCC(C)COC(=O)C=C Amb17934097 [0,2,0,0,0,0|1,0,1]=4 8442 B9R0.24 CCC(C)COC(=O)CBr Amb25799480 [0,2,0,0,0,0|1,0,0]=3 8443 B9R0.24 CCC(C)CSC(N)=NC Amb25189655 [0,2,0,0,0,0|2,0,0]=4 8444 B9R0.24 CCC(C)C\C=C(/C)\C=O Amb24646940 [0,2,0,0,0,0|0,0,1]=3 8445 B9R0.24 CCC(C)NCC(=O)C#C Amb25679968 [0,2,0,0,0,0|1,0,1]=4 8446 B9R0.24 CCC(C)NCC(=O)C=C Amb24411222 [0,2,0,0,0,0|1,0,1]=4 8447 B9R0.24 CCC(C)NCC(=O)NN Amb25338630 [0,2,0,0,0,0|2,0,0]=4 8448 B9R0.24 CCC(C)NCC(=O)NO Amb24668363 [0,2,0,0,0,0|2,0,0]=4 8449 B9R0.24 CCC(C)OCC(=C)CCl Amb24703476 [0,2,0,0,0,0|2,0,0]=4 8450 B9R0.24 CCC(C)OCC(=C)CN Amb24748994 [0,2,0,0,0,0|2,0,0]=4 8451 B9R0.24 CCC(C)OCC(=C)CS Amb25136142 [0,2,0,0,0,0|2,0,0]=4 8452 B9R0.24 CCC(C)OCC(=O)NC Amb24482829 [0,2,0,0,0,0|1,0,0]=3 8453 B9R0.24 CCC(C)OCC(=O)NN Amb19960445 [0,2,0,0,0,0|2,0,0]=4 8454 B9R0.24 CCC(C)OCC(=O)NO Amb25220786 [0,2,0,0,0,0|2,0,0]=4 8455 B9R0.24 CCC(C)ONC(=O)CO Amb24705434 [0,2,0,0,0,0|2,0,0]=4 8456 B9R0.24 CCC(C)SCC(=C)CCl Amb25788394 [0,2,0,0,0,0|2,0,0]=4 8457 B9R0.24 CCC(C)SCC(=C)CN Amb24388772 [0,2,0,0,0,0|2,0,0]=4 8458 B9R0.24 CCC(C)SCC(=C)CS Amb24673391 [0,2,0,0,0,0|2,0,0]=4 8459 B9R0.24 CCC(C)SCC(=O)C#C Amb25809269 [0,2,0,0,0,0|1,0,1]=4 8460 B9R0.24 CCC(C)SCC(=O)NN Amb24658136 [0,2,0,0,0,0|2,0,0]=4 8461 B9R0.24 CCC(C)SCC(C)=CCl Amb24482757 [0,2,0,0,0,0|2,0,0]=4 8462 B9R0.24 CCC(C)\C=C\C(=O)CCl Amb24480648 [0,2,0,0,0,0|0,0,2]=4 8463 B9R0.24 CCC(CCC(CC)C)C Amb10069376 [0,2,0,0,0,0|1,0,1]=4 8464 B9R0.24 CCC(Cl)\C=C\C(=O)OC Amb25320866 [0,2,0,0,0,0|0,0,2]=4 8465 B9R0.24 CCC(N)CCC(=O)C=C Amb25201206 [0,2,0,0,0,0|0,0,1]=3 8466 B9R0.24 CCC(N)CCC(=O)NN Amb24726520 [0,2,0,0,0,0|1,0,0]=3 8467 B9R0.24 CCC(N)CCC(N)CF Amb25197615 [0,2,0,0,0,0|1,0,1]=4 8468 B9R0.24 CCC(N)CCN(C)OC Amb24687213 [0,2,0,0,0,0|1,0,1]=4 8469 B9R0.24 CCC(N)CNC(=O)C#C Amb24334161 [0,2,0,0,0,0|1,0,1]=4 8470 B9R0.24 CCC(N)CNC(=O)C=C Amb24476780 [0,2,0,0,0,0|1,0,1]=4 8471 B9R0.24 CCC(N)CNC(=O)OC Amb24427801 [0,2,0,0,0,0|1,0,0]=3 8472 B9R0.24 CCC(O)C#CC(=O)OC Amb22043388 [0,2,0,0,0,0|0,0,2]=4 8473 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [0,2,0,0,0,0|0,0,0]=2 8474 B9R0.24 CCC(O)CCC(C)=CCl Amb25122276 [0,2,0,0,0,0|1,0,0]=3 8475 B9R0.24 CCC(O)CCC(N)CO Amb25368410 [0,2,0,0,0,0|1,0,1]=4 8476 B9R0.24 CCC(O)CCC(O)CO Amb24364854 [0,2,0,0,0,0|0,0,2]=4 8477 B9R0.24 CCC(O)CNC(=O)C=C Amb24389176 [0,2,0,0,0,0|1,0,1]=4 8478 B9R0.24 CCC(O)CNC(=O)CCl Amb24480520 [0,2,0,0,0,0|1,0,0]=3 8479 B9R0.24 CCC(O)COC(=O)C=C Amb25381429 [0,2,0,0,0,0|1,0,1]=4 8480 B9R0.24 CCN(C)CCC(=O)NN Amb24549267 [0,2,0,0,0,0|2,0,0]=4 8481 B9R0.24 CCN(O)CCC(=O)OC Amb24763933 [0,2,0,0,0,0|1,0,0]=3 8482 B9R0.24 CCS(=O)CCC(=O)OC Amb18788300 [0,2,0,0,0,0|1,0,0]=3 8483 B9R0.24 CCS(=O)CCC(C)NC Amb25833015 [0,2,0,0,0,0|2,0,0]=4 8484 B9R0.24 CCS(=O)CCC(O)CN Amb24738164 [0,2,0,0,0,0|2,0,0]=4 8485 B9R0.24 CCS(=O)NCC(=O)OC Amb25273849 [0,2,0,0,0,0|2,0,0]=4 8486 B9R0.24 CC[C@@H](N)COC(=O)CN Amb25147512 [0,2,0,0,0,0|1,0,0]=3 8487 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [0,2,0,0,0,0|0,0,0]=2 8488 B9R0.24 CC[C@@H](O)COC(=O)C#C Amb24481173 [0,2,0,0,0,0|1,0,1]=4 8489 B9R0.24 CC[C@H](C)CCC(=C)C=O Amb25075582 [0,2,0,0,0,0|0,0,1]=3 8490 B9R0.24 CC[C@H](C)CCC(C)CO Amb25676351 [0,2,0,0,0,0|0,0,2]=4 8491 B9R0.24 CC[C@H](C)CNC(=O)OC Amb24549768 [0,2,0,0,0,0|1,0,0]=3 8492 B9R0.24 CC[C@H](C)COC(=O)CBr Amb24477461 [0,2,0,0,0,0|1,0,0]=3 8493 B9R0.24 CC[C@H](N)CC[C@@H](N)CC Amb25082022 [0,2,0,0,0,0|1,0,1]=4 8494 B9R0.24 CC[C@H](O)C#CC(=O)OC Amb25332399 [0,2,0,0,0,0|0,0,2]=4 8495 B9R0.24 CC[C@H](O)CCC(=O)OC Amb24377641 [0,2,0,0,0,0|0,0,0]=2 8496 B9R0.24 CC[C@H](O)COC(=O)C#C Amb24481174 [0,2,0,0,0,0|1,0,1]=4 8497 B9R0.24 CC[C@H](O)\C=C\C(=O)OC Amb25320330 [0,2,0,0,0,0|0,0,2]=4 8498 B9R0.24 CN(CCC(=O)CC)CC Amb25225879 [0,2,0,0,0,0|1,0,0]=3 8499 B9R0.24 CN(CCC(N)CC)CC Amb24756285 [0,2,0,0,0,0|2,0,0]=4 8500 B9R0.24 CNC(=O)CCC(=O)OC Amb17399893 [0,2,0,0,0,0|1,0,1]=4 8501 B9R0.24 CNC(=O)CCC(C)OC Amb25337100 [0,2,0,0,0,0|1,0,0]=3 8502 B9R0.24 CNC(=O)CCC(C)SC Amb25720834 [0,2,0,0,0,0|1,0,0]=3 8503 B9R0.24 CNC(=O)CNC(=N)CC Amb24477928 [0,2,0,0,0,0|1,0,1]=4 8504 B9R0.24 CNC(=O)CSC(C)CO Amb24623354 [0,2,0,0,0,0|2,0,0]=4 8505 B9R0.24 CNC(=O)NCC(=C)CC Amb24634562 [0,2,0,0,0,0|1,0,1]=4 8506 B9R0.24 CNC(=O)NCC(C)CN Amb18908393 [0,2,0,0,0,0|2,0,0]=4 8507 B9R0.24 CNC(=O)NCC(C)OC Amb25704552 [0,2,0,0,0,0|2,0,0]=4 8508 B9R0.24 CNC(=O)NCC(C)SC Amb25706035 [0,2,0,0,0,0|2,0,0]=4 8509 B9R0.24 CNC(=O)NCC(O)CC Amb25220048 [0,2,0,0,0,0|1,0,0]=3 8510 B9R0.24 CNC(=O)OCC(C)CBr Amb25680259 [0,2,0,0,0,0|2,0,0]=4 8511 B9R0.24 CNC(=O)OCC(N)CO Amb24734055 [0,2,0,0,0,0|2,0,0]=4 8512 B9R0.24 CNC(=S)NC[C@@H](O)CC Amb25069517 [0,2,0,0,0,0|1,1,0]=4 8513 B9R0.24 CNC(C)CNC(=O)CC Amb25047872 [0,2,0,0,0,0|2,0,0]=4 8514 B9R0.24 CNC(C)CNC(=O)OC Amb24601169 [0,2,0,0,0,0|2,0,0]=4 8515 B9R0.24 CNS(=O)CCC(=O)NC Amb24378122 [0,2,0,0,0,0|2,0,0]=4 8516 B9R0.24 COC(=N)CCC(=O)OC Amb17673181 [0,2,0,0,0,0|1,0,1]=4 8517 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,2,0,0,0,0|1,0,1]=4 8518 B9R0.24 COC(=O)CCC(Br)C=O Amb24680272 [0,2,0,0,0,0|1,0,1]=4 8519 B9R0.24 COC(=O)CCC(Br)CBr Amb25343381 [0,2,0,0,0,0|1,0,0]=3 8520 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [0,2,0,0,0,0|1,0,1]=4 8521 B9R0.24 COC(=O)CCC(C)CBr Amb25032347 [0,2,0,0,0,0|1,0,0]=3 8522 B9R0.24 COC(=O)CCC(C)SC Amb24709195 [0,2,0,0,0,0|1,0,0]=3 8523 B9R0.24 COC(=O)CCC(Cl)C#N Amb24650009 [0,2,0,0,0,0|1,0,1]=4 8524 B9R0.24 COC(=O)CCC(Cl)CCl Amb25241534 [0,2,0,0,0,0|1,0,0]=3 8525 B9R0.24 COC(=O)CCC(N)C#C Amb24433501 [0,2,0,0,0,0|0,0,2]=4 8526 B9R0.24 COC(=O)CCC(N)C=C Amb18124639 [0,2,0,0,0,0|0,0,2]=4 8527 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [0,2,0,0,0,0|1,0,0]=3 8528 B9R0.24 COC(=O)CCC(O)C=C Amb25127861 [0,2,0,0,0,0|0,0,2]=4 8529 B9R0.24 COC(=O)CCC(O)CBr Amb25044783 [0,2,0,0,0,0|1,0,0]=3 8530 B9R0.24 COC(=O)CCC(O)CN Amb25857935 [0,2,0,0,0,0|1,0,0]=3 8531 B9R0.24 COC(=O)CCC(O)CO Amb25204294 [0,2,0,0,0,0|1,0,0]=3 8532 B9R0.24 COC(=O)CC[C@@H](C)C=O Amb25104821 [0,2,0,0,0,0|1,0,1]=4 8533 B9R0.24 COC(=O)CC[C@@H](O)C#C Amb25343842 [0,2,0,0,0,0|0,0,2]=4 8534 B9R0.24 COC(=O)CC[C@@H](O)CN Amb24744697 [0,2,0,0,0,0|1,0,0]=3 8535 B9R0.24 COC(=O)CC[C@H](Cl)C=O Amb25100997 [0,2,0,0,0,0|1,0,1]=4 8536 B9R0.24 COC(=O)CC[C@H](N)C#C Amb25147453 [0,2,0,0,0,0|0,0,2]=4 8537 B9R0.24 COC(=O)CC[C@H](O)C=C Amb24481290 [0,2,0,0,0,0|0,0,2]=4 8538 B9R0.24 COC(=O)CNC(C)CN Amb25299776 [0,2,0,0,0,0|2,0,0]=4 8539 B9R0.24 COC(=O)COC(C)CN Amb24480966 [0,2,0,0,0,0|2,0,0]=4 8540 B9R0.24 COC(=O)CSC(C)CO Amb25070989 [0,2,0,0,0,0|2,0,0]=4 8541 B9R0.24 COC(=O)NCC(C)CN Amb18313166 [0,2,0,0,0,0|2,0,0]=4 8542 B9R0.24 COC(=O)NCC(C)SC Amb25206873 [0,2,0,0,0,0|2,0,0]=4 8543 B9R0.24 COC(=O)NCC(Cl)CCl Amb25106564 [0,2,0,0,0,0|2,0,0]=4 8544 B9R0.24 COC(=O)NCC(O)CN Amb24589991 [0,2,0,0,0,0|2,0,0]=4 8545 B9R0.24 COC(=O)NOC(C)CC Amb24524318 [0,2,0,0,0,0|2,0,0]=4 8546 B9R0.24 COC(=O)OCC(=O)CC Amb25059695 [0,2,0,0,0,0|1,0,1]=4 8547 B9R0.24 COC(=O)OCC(Cl)CF Amb25211615 [0,2,0,0,0,0|2,0,0]=4 8548 B9R0.24 COC(=O)OCC(F)CCl Amb25774919 [0,2,0,0,0,0|2,0,0]=4 8549 B9R0.24 COC(C)CNC(=O)CCl Amb24700874 [0,2,0,0,0,0|2,0,0]=4 8550 B9R0.24 COC(C)COC(=O)CO Amb24752113 [0,2,0,0,0,0|2,0,0]=4 8551 B9R0.24 COP(=O)CCC(=O)OC Amb25187314 [0,2,0,0,0,0|2,0,0]=4 8552 B9R0.24 COS(=O)CCC(=O)OC Amb22728623 [0,2,0,0,0,0|2,0,0]=4 8553 B9R0.24 CSC(=O)NCC(Cl)CCl Amb25828593 [0,2,0,0,0,0|2,0,0]=4 8554 B9R0.24 CSC(C)CCC(=O)NN Amb25340735 [0,2,0,0,0,0|2,0,0]=4 8555 B9R0.24 CSC(C)CCC(=O)NO Amb24538243 [0,2,0,0,0,0|2,0,0]=4 8556 B9R0.24 CSC(C)CNC(=O)CN Amb25360470 [0,2,0,0,0,0|2,0,0]=4 8557 B9R0.24 CSC(C)CNC(=O)CO Amb25322962 [0,2,0,0,0,0|2,0,0]=4 8558 B9R0.24 CSC(C)CNC(=O)CS Amb24738132 [0,2,0,0,0,0|2,0,0]=4 8559 B9R0.24 C[C@@H](CCC(=O)CC)CC Amb24645778 [0,2,0,0,0,0|0,0,0]=2 8560 B9R0.24 C[C@@H](CCC(O)CC)CC Amb25686198 [0,2,0,0,0,0|0,0,2]=4 8561 B9R0.24 C[C@H](CCC(=O)CC)CC Amb25094462 [0,2,0,0,0,0|0,0,0]=2 8562 B9R0.24 C[C@H](CCC(O)CO)CC Amb25332161 [0,2,0,0,0,0|0,0,2]=4 8563 B9R0.24 C[C@H](CC[C@@H](O)CO)CC Amb24592097 [0,2,0,0,0,0|0,0,2]=4 8564 B9R0.24 C\C=C(\C)/CCC(O)CO Amb24481244 [0,2,0,0,0,0|2,0,0]=4 8565 B9R0.24 NCC(=O)OCC(O)CO Amb24361035 [0,2,0,0,0,0|2,0,0]=4 8566 B9R0.24 O=C(CCl)OCC(Br)CBr Amb22359777 [0,2,0,0,0,0|2,0,0]=4 8567 B9R0.24 O=C(CCl)OCC(Cl)CCl Amb25313355 [0,2,0,0,0,0|2,0,0]=4 8568 B9R0.24 OC(COC(=O)CO)CO Amb25854328 [0,2,0,0,0,0|2,0,0]=4 8569 B9R0.24 OCC(=O)CCC(=O)CO Amb25358920 [0,2,0,0,0,0|1,0,1]=4 8570 B9R0.24 OCC(COC(=O)CS)O Amb16232257 [0,2,0,0,0,0|2,0,0]=4 8571 B9R0.24 OCC(O)CNC(=O)CCl Amb22754889 [0,2,0,0,0,0|2,0,0]=4 8572 B9R0.24 OCC(O)COC(=O)CBr Amb25287206 [0,2,0,0,0,0|2,0,0]=4 8573 B9R0.24 OC[C@H](O)CNC(=O)CCl Amb25839877 [0,2,0,0,0,0|2,0,0]=4 8574 B9R0.46 C#CC(=O)CCCCCN Amb25844685 [0,2,0,0,0,0|0,0,1]=3 8575 B9R0.46 C#CC(=O)OCCCCCl Amb24479172 [0,2,0,0,0,0|1,0,1]=4 8576 B9R0.46 C#CC(=O)OCCCCO Amb24473556 [0,2,0,0,0,0|1,0,1]=4 8577 B9R0.46 C#CCCCCC(=O)CBr Amb24477402 [0,2,0,0,0,0|0,0,1]=3 8578 B9R0.46 C#CCCCNC(=O)CBr Amb24481188 [0,2,0,0,0,0|0,0,2]=4 8579 B9R0.46 C#CCCCNC(=O)CCl Amb25332594 [0,2,0,0,0,0|0,0,2]=4 8580 B9R0.46 C#CCCCNC(=O)CO Amb25722848 [0,2,0,0,0,0|0,0,2]=4 8581 B9R0.46 C#CCCCNC(=O)CS Amb25358047 [0,2,0,0,0,0|0,0,2]=4 8582 B9R0.46 C=C(C=O)OCCCCBr Amb25685896 [0,2,0,0,0,0|1,0,1]=4 8583 B9R0.46 C=CC(=O)CCCCCCl Amb24477340 [0,2,0,0,0,0|0,0,1]=3 8584 B9R0.46 C=CC(=O)CCCCCN Amb24400947 [0,2,0,0,0,0|0,0,1]=3 8585 B9R0.46 C=CC(=O)NCCCCF Amb24393006 [0,2,0,0,0,0|1,0,1]=4 8586 B9R0.46 C=CCCCCC(=C)CO Amb25788970 [0,2,0,0,0,0|1,0,1]=4 8587 B9R0.46 C=CCCCCC(=O)C=C Amb25373427 [0,2,0,0,0,0|0,0,2]=4 8588 B9R0.46 C=CCCCCC(=O)CBr Amb25187234 [0,2,0,0,0,0|0,0,1]=3 8589 B9R0.46 C=CCCCCC(=O)CCl Amb24480553 [0,2,0,0,0,0|0,0,1]=3 8590 B9R0.46 C=CCCCCC(=O)CO Amb24708283 [0,2,0,0,0,0|0,0,1]=3 8591 B9R0.46 C=CCCCCC(=O)NN Amb24479057 [0,2,0,0,0,0|1,0,1]=4 8592 B9R0.46 C=CCCCNC(=O)CN Amb24675571 [0,2,0,0,0,0|0,0,2]=4 8593 B9R0.46 C=CCCCNC(=O)CO Amb25699293 [0,2,0,0,0,0|0,0,2]=4 8594 B9R0.46 C=CCCCNC(=O)CS Amb24475836 [0,2,0,0,0,0|0,0,2]=4 8595 B9R0.46 CC#CCCCC(=O)C=C Amb25830286 [0,2,0,0,0,0|0,0,2]=4 8596 B9R0.46 CC#CCCCC(=O)CC Amb25718978 [0,2,0,0,0,0|0,0,1]=3 8597 B9R0.46 CC#CCCCC(=O)NC Amb24473702 [0,2,0,0,0,0|0,0,1]=3 8598 B9R0.46 CC#CCCCC(C)C=O Amb25767125 [0,2,0,0,0,0|0,0,2]=4 8599 B9R0.46 CC#CCCC[C@H](C)C=O Amb25785557 [0,2,0,0,0,0|0,0,2]=4 8600 B9R0.46 CC#CCCNC(=O)CBr Amb25300217 [0,2,0,0,0,0|0,0,2]=4 8601 B9R0.46 CC#CCCNC(=O)CCl Amb24440598 [0,2,0,0,0,0|0,0,2]=4 8602 B9R0.46 CC#CCCNC(=O)CN Amb24692531 [0,2,0,0,0,0|0,0,2]=4 8603 B9R0.46 CC#CCCNC(=O)OC Amb24370345 [0,2,0,0,0,0|0,0,2]=4 8604 B9R0.46 CC#CCCOC(=O)CC Amb25345598 [0,2,0,0,0,0|0,0,2]=4 8605 B9R0.46 CC#CCNCC(=O)OC Amb24333064 [0,2,0,0,0,0|0,0,2]=4 8606 B9R0.46 CC#CCSCC(=O)OC Amb24408230 [0,2,0,0,0,0|0,0,2]=4 8607 B9R0.46 CC(C#N)NCCCCC Amb17044895 [0,2,0,0,0,0|1,0,1]=4 8608 B9R0.46 CC(C=O)=CCCCC#C Amb24582020 [0,2,0,0,0,0|0,0,2]=4 8609 B9R0.46 CC(CCCCC#C)C=O Amb25147694 [0,2,0,0,0,0|0,0,2]=4 8610 B9R0.46 CC(CCCCCCl)=NO Amb24674211 [0,2,0,0,0,0|0,0,1]=3 8611 B9R0.46 CC(CCCCCN)CN Amb24440497 [0,2,0,0,0,0|1,0,1]=4 8612 B9R0.46 CC(CCCNCC)CC Amb24452952 [0,2,0,0,0,0|1,0,1]=4 8613 B9R0.46 CC(CNCCCF)=CCl Amb24425930 [0,2,0,0,0,0|2,0,0]=4 8614 B9R0.46 CC(CNCCCI)=CCl Amb25049162 [0,2,0,0,0,0|2,0,0]=4 8615 B9R0.46 CC(CNCCCN)=CCl Amb24482536 [0,2,0,0,0,0|2,0,0]=4 8616 B9R0.46 CC(CNCCCO)=CCl Amb24482533 [0,2,0,0,0,0|2,0,0]=4 8617 B9R0.46 CC(CO)=CCCCCO Amb24719754 [0,2,0,0,0,0|0,0,2]=4 8618 B9R0.46 CC(COCCCO)C=O Amb25105169 [0,2,0,0,0,0|1,0,1]=4 8619 B9R0.46 CC(CS)=CCCCCO Amb24429400 [0,2,0,0,0,0|0,1,1]=4 8620 B9R0.46 CC(CSCCCF)=CCl Amb25730747 [0,2,0,0,0,0|2,0,0]=4 8621 B9R0.46 CC(CSCCCN)=CCl Amb25251098 [0,2,0,0,0,0|2,0,0]=4 8622 B9R0.46 CC(CSCCCO)=CCl Amb24482507 [0,2,0,0,0,0|2,0,0]=4 8623 B9R0.46 CC(CSCCCO)=NO Amb25725320 [0,2,0,0,0,0|1,0,1]=4 8624 B9R0.46 CCC(=C)CCCCNC Amb25032486 [0,2,0,0,0,0|1,0,0]=3 8625 B9R0.46 CCC(=C)CCCNCC Amb24731370 [0,2,0,0,0,0|1,0,0]=3 8626 B9R0.46 CCC(=C)CNCCCO Amb25729045 [0,2,0,0,0,0|2,0,0]=4 8627 B9R0.46 CCC(=C)CNCCSC Amb25097927 [0,2,0,0,0,0|2,0,0]=4 8628 B9R0.46 CCC(=C)CSCCOC Amb24414732 [0,2,0,0,0,0|2,0,0]=4 8629 B9R0.46 CCC(=N)NCCCCF Amb24670832 [0,2,0,0,0,0|2,0,0]=4 8630 B9R0.46 CCC(=N)NCCCSC Amb24728051 [0,2,0,0,0,0|2,0,0]=4 8631 B9R0.46 CCC(=N)NCCSCC Amb25851807 [0,2,0,0,0,0|2,0,0]=4 8632 B9R0.46 CCC(=O)CCCCC#C Amb24704178 [0,2,0,0,0,0|0,0,1]=3 8633 B9R0.46 CCC(=O)CCCCC=O Amb25243006 [0,2,0,0,0,0|0,0,1]=3 8634 B9R0.46 CCC(=O)CCCCCBr Amb25276919 [0,2,0,0,0,0|0,0,0]=2 8635 B9R0.46 CCC(=O)CCCCCCl Amb24538039 [0,2,0,0,0,0|0,0,0]=2 8636 B9R0.46 CCC(=O)CCCCCF Amb24596312 [0,2,0,0,0,0|0,0,0]=2 8637 B9R0.46 CCC(=O)CCCCOC Amb25797343 [0,2,0,0,0,0|0,0,0]=2 8638 B9R0.46 CCC(=O)CCCN=[N+]=[N-] Amb25239291 [0,2,0,0,0,0|2,0,0]=4 8639 B9R0.46 CCC(=O)CCSCC=C Amb25714184 [0,2,0,0,0,0|0,0,2]=4 8640 B9R0.46 CCC(=O)CNCCOC Amb24601446 [0,2,0,0,0,0|1,0,0]=3 8641 B9R0.46 CCC(=O)COCCC=C Amb25783572 [0,2,0,0,0,0|0,0,2]=4 8642 B9R0.46 CCC(=O)COCCSC Amb25776675 [0,2,0,0,0,0|1,0,0]=3 8643 B9R0.46 CCC(=O)CSCCOC Amb18800666 [0,2,0,0,0,0|1,0,0]=3 8644 B9R0.46 CCC(=O)NCCCC#C Amb25846514 [0,2,0,0,0,0|0,0,2]=4 8645 B9R0.46 CCC(=O)NCCCCBr Amb24627589 [0,2,0,0,0,0|1,0,0]=3 8646 B9R0.46 CCC(=O)NCCCOC Amb17775258 [0,2,0,0,0,0|1,0,0]=3 8647 B9R0.46 CCC(=O)NCCCON Amb17138412 [0,2,0,0,0,0|2,0,0]=4 8648 B9R0.46 CCC(=O)NN=CCCC Amb24747780 [0,2,0,0,0,0|1,0,1]=4 8649 B9R0.46 CCC(=O)NOCCSC Amb24482919 [0,2,0,0,0,0|2,0,0]=4 8650 B9R0.46 CCC(=O)OCCCC#C Amb25356857 [0,2,0,0,0,0|0,0,2]=4 8651 B9R0.46 CCC(=O)OCCCC#N Amb24688814 [0,2,0,0,0,0|1,0,1]=4 8652 B9R0.46 CCC(=O)OCCCC=C Amb24482885 [0,2,0,0,0,0|0,0,2]=4 8653 B9R0.46 CCC(=O)OCCCC=O Amb25270047 [0,2,0,0,0,0|1,0,1]=4 8654 B9R0.46 CCC(=O)OCCCCF Amb25769054 [0,2,0,0,0,0|1,0,0]=3 8655 B9R0.46 CCC(=O)\C=C\CCCC Amb24580499 [0,2,0,0,0,0|0,0,1]=3 8656 B9R0.46 CCC(=O)\C=C\NCCC Amb24690189 [0,2,0,0,0,0|0,0,2]=4 8657 B9R0.46 CCC(Br)CCCCOC Amb24478058 [0,2,0,0,0,0|1,0,1]=4 8658 B9R0.46 CCC(Br)CCCCSC Amb24378596 [0,2,0,0,0,0|1,0,1]=4 8659 B9R0.46 CCC(Br)CCCOCC Amb25306806 [0,2,0,0,0,0|1,0,1]=4 8660 B9R0.46 CCC(C)=CCCCCO Amb25257108 [0,2,0,0,0,0|1,0,1]=4 8661 B9R0.46 CCC(C)CCCCCO Amb21963913 [0,2,0,0,0,0|1,0,1]=4 8662 B9R0.46 CCC(C)CCCCNC Amb25112487 [0,2,0,0,0,0|1,0,1]=4 8663 B9R0.46 CCC(Cl)CCCCCCl Amb24447475 [0,2,0,0,0,0|1,0,1]=4 8664 B9R0.46 CCC(Cl)CCCCOC Amb18800866 [0,2,0,0,0,0|1,0,1]=4 8665 B9R0.46 CCC(Cl)CCCNCC Amb24585507 [0,2,0,0,0,0|1,0,1]=4 8666 B9R0.46 CCC(Cl)CCCOCC Amb18800867 [0,2,0,0,0,0|1,0,1]=4 8667 B9R0.46 CCC(N)CCCNCC Amb25299572 [0,2,0,0,0,0|1,0,1]=4 8668 B9R0.46 CCC(O)CCCCCF Amb25846271 [0,2,0,0,0,0|0,0,2]=4 8669 B9R0.46 CCC(O)CCCCCO Amb24403979 [0,2,0,0,0,0|0,0,2]=4 8670 B9R0.46 CCC(O)CCCCSC Amb25198133 [0,2,0,0,0,0|0,0,2]=4 8671 B9R0.46 CCC(O)CCCSCC Amb24450086 [0,2,0,0,0,0|0,0,2]=4 8672 B9R0.46 CCCC=C=CC(=O)CC Amb25768525 [0,2,0,0,0,0|0,0,2]=4 8673 B9R0.46 CCCC=NNC(=O)CO Amb24482808 [0,2,0,0,0,0|1,0,1]=4 8674 B9R0.46 CCCCC#CC(=C)C=O Amb25319160 [0,2,0,0,0,0|0,0,2]=4 8675 B9R0.46 CCCCC#CC(=C)CO Amb25042281 [0,2,0,0,0,0|1,0,1]=4 8676 B9R0.46 CCCCC#CC(=O)CCl Amb25824680 [0,2,0,0,0,0|0,0,1]=3 8677 B9R0.46 CCCCC#CC(=O)CF Amb25373052 [0,2,0,0,0,0|0,0,1]=3 8678 B9R0.46 CCCCC=C=C(C)CO Amb25823611 [0,2,0,0,0,0|0,0,2]=4 8679 B9R0.46 CCCCCCC(=C)CBr Amb25067914 [0,2,0,0,0,0|1,0,0]=3 8680 B9R0.46 CCCCCCC(=C)CCl Amb24350824 [0,2,0,0,0,0|1,0,0]=3 8681 B9R0.46 CCCCCCC(=C)CO Amb25145395 [0,2,0,0,0,0|1,0,0]=3 8682 B9R0.46 CCCCCCC(=N)NO Amb22733338 [0,2,0,0,0,0|1,0,1]=4 8683 B9R0.46 CCCCCCC(=O)C#C Amb25086546 [0,2,0,0,0,0|0,0,1]=3 8684 B9R0.46 CCCCCCC(=O)C#N Amb22734561 [0,2,0,0,0,0|0,0,1]=3 8685 B9R0.46 CCCCCCC(=O)CBr Amb24078361 [0,2,0,0,0,0|0,0,0]=2 8686 B9R0.46 CCCCCCC(=O)CCl Amb24078365 [0,2,0,0,0,0|0,0,0]=2 8687 B9R0.46 CCCCCCC(=O)CN Amb25731786 [0,2,0,0,0,0|0,0,0]=2 8688 B9R0.46 CCCCCCC(=O)CS Amb25146854 [0,2,0,0,0,0|0,0,0]=2 8689 B9R0.46 CCCCCCC(=O)NO Amb25146254 [0,2,0,0,0,0|1,0,0]=3 8690 B9R0.46 CCCCCCC(=S)NC Amb24724306 [0,2,0,0,0,0|0,1,0]=3 8691 B9R0.46 CCCCCCC(Br)CBr Amb17845325 [0,2,0,0,0,0|1,0,1]=4 8692 B9R0.46 CCCCCCC(Br)CC Amb24476891 [0,2,0,0,0,0|1,0,1]=4 8693 B9R0.46 CCCCCCC(Br)CF Amb25783737 [0,2,0,0,0,0|1,0,1]=4 8694 B9R0.46 CCCCCCC(C)=NO Amb24476810 [0,2,0,0,0,0|0,0,1]=3 8695 B9R0.46 CCCCCCC(C)C=C Amb25209348 [0,2,0,0,0,0|1,0,1]=4 8696 B9R0.46 CCCCCCC(C)CBr Amb20240804 [0,2,0,0,0,0|1,0,1]=4 8697 B9R0.46 CCCCCCC(C)CO Amb22728084 [0,2,0,0,0,0|0,0,2]=4 8698 B9R0.46 CCCCCCC(C)NN Amb20623338 [0,2,0,0,0,0|1,0,1]=4 8699 B9R0.46 CCCCCCC(C)NO Amb25048804 [0,2,0,0,0,0|0,0,2]=4 8700 B9R0.46 CCCCCCC(C)OC Amb24637476 [0,2,0,0,0,0|0,0,2]=4 8701 B9R0.46 CCCCCCC(C)[Mg]Br Amb22897345 [0,2,0,0,0,0|1,0,1]=4 8702 B9R0.46 CCCCCCC(C)[Zn]Br Amb22898146 [0,2,0,0,0,0|1,0,1]=4 8703 B9R0.46 CCCCCCC(C=O)C Amb10603627 [0,2,0,0,0,0|0,0,1]=3 8704 B9R0.46 CCCCCCC(CC)O Amb10068521 [0,2,0,0,0,0|0,0,2]=4 8705 B9R0.46 CCCCCCC(CS)S Amb16232249 [0,2,0,0,0,0|0,1,1]=4 8706 B9R0.46 CCCCCCC(Cl)CO Amb24684197 [0,2,0,0,0,0|1,0,1]=4 8707 B9R0.46 CCCCCCC(Cl)OC Amb24433943 [0,2,0,0,0,0|1,0,1]=4 8708 B9R0.46 CCCCCCC(F)C=O Amb25069121 [0,2,0,0,0,0|1,0,1]=4 8709 B9R0.46 CCCCCCC(F)CN Amb24714278 [0,2,0,0,0,0|1,0,1]=4 8710 B9R0.46 CCCCCCC(F)CO Amb24615387 [0,2,0,0,0,0|1,0,1]=4 8711 B9R0.46 CCCCCCC(N)CS Amb25760528 [0,2,0,0,0,0|1,0,1]=4 8712 B9R0.46 CCCCCCC(O)C=O Amb25820734 [0,2,0,0,0,0|1,0,1]=4 8713 B9R0.46 CCCCCCC(O)CBr Amb24477464 [0,2,0,0,0,0|0,0,2]=4 8714 B9R0.46 CCCCCCC(O)CF Amb22325236 [0,2,0,0,0,0|0,0,2]=4 8715 B9R0.46 CCCCCCC(O)OC Amb24482551 [0,2,0,0,0,0|0,0,2]=4 8716 B9R0.46 CCCCCCN(C)CC Amb24332468 [0,2,0,0,0,0|2,0,0]=4 8717 B9R0.46 CCCCCCN(C)N=O Amb24655838 [0,2,0,0,0,0|1,0,0]=3 8718 B9R0.46 CCCCCC[C@@H](C)CCl Amb25072753 [0,2,0,0,0,0|1,0,1]=4 8719 B9R0.46 CCCCCC[C@@H](C)CO Amb25332327 [0,2,0,0,0,0|0,0,2]=4 8720 B9R0.46 CCCCCC[C@@H](Cl)CO Amb24618972 [0,2,0,0,0,0|1,0,1]=4 8721 B9R0.46 CCCCCC[C@@H](O)CC Amb25076225 [0,2,0,0,0,0|0,0,2]=4 8722 B9R0.46 CCCCCC[C@@H](O)CF Amb22225126 [0,2,0,0,0,0|0,0,2]=4 8723 B9R0.46 CCCCCC[C@@H](O)CN Amb25147470 [0,2,0,0,0,0|0,0,2]=4 8724 B9R0.46 CCCCCC[C@@H](O)CO Amb22225132 [0,2,0,0,0,0|0,0,2]=4 8725 B9R0.46 CCCCCC[C@H](C)C=O Amb24374798 [0,2,0,0,0,0|0,0,1]=3 8726 B9R0.46 CCCCCC[C@H](C)CBr Amb24714619 [0,2,0,0,0,0|1,0,1]=4 8727 B9R0.46 CCCCCC[C@H](Cl)C=O Amb25109926 [0,2,0,0,0,0|1,0,1]=4 8728 B9R0.46 CCCCCC[C@H](Cl)CO Amb25113528 [0,2,0,0,0,0|1,0,1]=4 8729 B9R0.46 CCCCCC[C@H](F)C=O Amb24424433 [0,2,0,0,0,0|1,0,1]=4 8730 B9R0.46 CCCCCC[C@H](F)CBr Amb24495511 [0,2,0,0,0,0|1,0,1]=4 8731 B9R0.46 CCCCCC[C@H](O)C=O Amb25285757 [0,2,0,0,0,0|1,0,1]=4 8732 B9R0.46 CCCCCC[C@H](O)CBr Amb24453367 [0,2,0,0,0,0|0,0,2]=4 8733 B9R0.46 CCCCCC[C@H](O)CC Amb25083849 [0,2,0,0,0,0|0,0,2]=4 8734 B9R0.46 CCCCCC[C@H](O)CCl Amb25129523 [0,2,0,0,0,0|0,0,2]=4 8735 B9R0.46 CCCCCC[C@H](O)CO Amb22225460 [0,2,0,0,0,0|0,0,2]=4 8736 B9R0.46 CCCCCC[S+](C)CC Amb25799914 [0,2,0,0,0,0|2,0,0]=4 8737 B9R0.46 CCCCCNC(=N)NN Amb22499249 [0,2,0,0,0,0|2,0,0]=4 8738 B9R0.46 CCCCCNC(=O)C#C Amb25785124 [0,2,0,0,0,0|0,0,1]=3 8739 B9R0.46 CCCCCNC(=O)CBr Amb17331497 [0,2,0,0,0,0|0,0,0]=2 8740 B9R0.46 CCCCCNC(=O)CC Amb17736727 [0,2,0,0,0,0|0,0,0]=2 8741 B9R0.46 CCCCCNC(=O)CCl Amb1225540 [0,2,0,0,0,0|0,0,0]=2 8742 B9R0.46 CCCCCNC(=O)CF Amb25726850 [0,2,0,0,0,0|0,0,0]=2 8743 B9R0.46 CCCCCNC(=O)CO Amb17334236 [0,2,0,0,0,0|0,0,0]=2 8744 B9R0.46 CCCCCNC(=O)OC Amb17918558 [0,2,0,0,0,0|0,0,0]=2 8745 B9R0.46 CCCCCNC(=S)NN Amb1153021 [0,2,0,0,0,0|1,1,0]=4 8746 B9R0.46 CCCCCNC(C)CBr Amb25060825 [0,2,0,0,0,0|1,0,1]=4 8747 B9R0.46 CCCCCNC(C)CN Amb24661762 [0,2,0,0,0,0|1,0,1]=4 8748 B9R0.46 CCCCCNC(N)=NN Amb25251989 [0,2,0,0,0,0|2,0,0]=4 8749 B9R0.46 CCCCCNC(N)=NO Amb25041541 [0,2,0,0,0,0|1,0,1]=4 8750 B9R0.46 CCCCCNC(O)CC Amb24578736 [0,2,0,0,0,0|0,0,2]=4 8751 B9R0.46 CCCCCN[C@H](C)CN Amb24381277 [0,2,0,0,0,0|1,0,1]=4 8752 B9R0.46 CCCCCOC(=O)C=C Amb17933944 [0,2,0,0,0,0|0,0,1]=3 8753 B9R0.46 CCCCCOC(=O)CBr Amb22036620 [0,2,0,0,0,0|0,0,0]=2 8754 B9R0.46 CCCCCOC(=O)CN Amb22277108 [0,2,0,0,0,0|0,0,0]=2 8755 B9R0.46 CCCCCOC(=O)NC Amb24672684 [0,2,0,0,0,0|0,0,0]=2 8756 B9R0.46 CCCCCOC(=S)NN Amb25773228 [0,2,0,0,0,0|1,1,0]=4 8757 B9R0.46 CCCCCOC(C)C#N Amb25254648 [0,2,0,0,0,0|1,0,1]=4 8758 B9R0.46 CCCCCSC(=C)CO Amb25854022 [0,2,0,0,0,0|1,0,0]=3 8759 B9R0.46 CCCCCSC(C)C#N Amb24479646 [0,2,0,0,0,0|1,0,1]=4 8760 B9R0.46 CCCCCSC(C)CC Amb25120456 [0,2,0,0,0,0|1,0,1]=4 8761 B9R0.46 CCCCCSC(C)CCl Amb25788328 [0,2,0,0,0,0|1,0,1]=4 8762 B9R0.46 CCCCCSC(C)CN Amb25831615 [0,2,0,0,0,0|1,0,1]=4 8763 B9R0.46 CCCCCSC(C)CO Amb24456023 [0,2,0,0,0,0|0,0,2]=4 8764 B9R0.46 CCCCC\C=C(/C)\C=O Amb18643629 [0,2,0,0,0,0|0,0,0]=2 8765 B9R0.46 CCCCC\C=C(/C)\CBr Amb24597156 [0,2,0,0,0,0|1,0,0]=3 8766 B9R0.46 CCCCC\C=C(\C)/CBr Amb24583665 [0,2,0,0,0,0|1,0,0]=3 8767 B9R0.46 CCCCC\C=C(\F)/CCl Amb24480542 [0,2,0,0,0,0|1,0,0]=3 8768 B9R0.46 CCCCN=CC(=O)CC Amb24614282 [0,2,0,0,0,0|0,0,1]=3 8769 B9R0.46 CCCCNCC(=O)CC Amb24478874 [0,2,0,0,0,0|0,0,0]=2 8770 B9R0.46 CCCCNCC(Br)=CC Amb24682156 [0,2,0,0,0,0|1,0,0]=3 8771 B9R0.46 CCCCNCC(C)=CCl Amb25139804 [0,2,0,0,0,0|1,0,0]=3 8772 B9R0.46 CCCCNCC(C)CN Amb24382977 [0,2,0,0,0,0|1,0,1]=4 8773 B9R0.46 CCCCNCC(C)CO Amb25778162 [0,2,0,0,0,0|0,0,2]=4 8774 B9R0.46 CCCCNCC(C)OC Amb23570900 [0,2,0,0,0,0|0,0,2]=4 8775 B9R0.46 CCCCNCC(C)SC Amb18798067 [0,2,0,0,0,0|0,1,1]=4 8776 B9R0.46 CCCCNCC(CO)O Amb17308645 [0,2,0,0,0,0|0,0,2]=4 8777 B9R0.46 CCCCNCC(Cl)=CCl Amb24533904 [0,2,0,0,0,0|1,0,1]=4 8778 B9R0.46 CCCCNCC(N)=NO Amb25365486 [0,2,0,0,0,0|1,0,1]=4 8779 B9R0.46 CCCCNCC(O)CCl Amb24479197 [0,2,0,0,0,0|0,0,2]=4 8780 B9R0.46 CCCCNCC(O)CF Amb24578257 [0,2,0,0,0,0|0,0,2]=4 8781 B9R0.46 CCCCNC[C@@H](N)CC Amb25834994 [0,2,0,0,0,0|1,0,1]=4 8782 B9R0.46 CCCCNC[C@H](N)CC Amb25779083 [0,2,0,0,0,0|1,0,1]=4 8783 B9R0.46 CCCCNN=C(C)CC Amb25822101 [0,2,0,0,0,0|2,0,0]=4 8784 B9R0.46 CCCCOCC(=C)CCl Amb25066972 [0,2,0,0,0,0|1,0,0]=3 8785 B9R0.46 CCCCOCC(=C)CN Amb25769674 [0,2,0,0,0,0|1,0,0]=3 8786 B9R0.46 CCCCOCC(=O)C=C Amb24707067 [0,2,0,0,0,0|0,0,1]=3 8787 B9R0.46 CCCCOCC(=O)CO Amb25264319 [0,2,0,0,0,0|0,0,0]=2 8788 B9R0.46 CCCCOCC(=O)NC Amb24683967 [0,2,0,0,0,0|0,0,0]=2 8789 B9R0.46 CCCCOCC(=O)NN Amb19960250 [0,2,0,0,0,0|1,0,0]=3 8790 B9R0.46 CCCCOCC(=O)NO Amb24684124 [0,2,0,0,0,0|1,0,0]=3 8791 B9R0.46 CCCCOCC(C)CS Amb25788552 [0,2,0,0,0,0|0,1,1]=4 8792 B9R0.46 CCCCOCC(C)NC Amb25050097 [0,2,0,0,0,0|1,0,1]=4 8793 B9R0.46 CCCCOCC(CC)N Amb17485997 [0,2,0,0,0,0|1,0,1]=4 8794 B9R0.46 CCCCOCC(Cl)C=O Amb25138639 [0,2,0,0,0,0|1,0,1]=4 8795 B9R0.46 CCCCOCC(O)CBr Amb24388692 [0,2,0,0,0,0|0,0,2]=4 8796 B9R0.46 CCCCOCC(O)CI Amb24764143 [0,2,0,0,0,0|0,0,2]=4 8797 B9R0.46 CCCCOC[C@@H](O)CCl Amb24707805 [0,2,0,0,0,0|0,0,2]=4 8798 B9R0.46 CCCCOC[C@H](O)CCl Amb24406600 [0,2,0,0,0,0|0,0,2]=4 8799 B9R0.46 CCCCON=C(N)CC Amb24482859 [0,2,0,0,0,0|2,0,0]=4 8800 B9R0.46 CCCCO\C=C(\C)/C=O Amb24744737 [0,2,0,0,0,0|0,0,1]=3 8801 B9R0.46 CCCCSCC(=C)CCl Amb25234502 [0,2,0,0,0,0|1,0,0]=3 8802 B9R0.46 CCCCSCC(=C)CS Amb24404561 [0,2,0,0,0,0|1,0,0]=3 8803 B9R0.46 CCCCSCC(=O)CC Amb18800474 [0,2,0,0,0,0|0,0,0]=2 8804 B9R0.46 CCCCSCC(=O)NO Amb25845592 [0,2,0,0,0,0|1,0,0]=3 8805 B9R0.46 CCCCSCC(C)CBr Amb25177328 [0,2,0,0,0,0|1,0,1]=4 8806 B9R0.46 CCCCSCC(C)CC Amb25781749 [0,2,0,0,0,0|1,0,1]=4 8807 B9R0.46 CCCCSCC(C)CCl Amb24355523 [0,2,0,0,0,0|1,0,1]=4 8808 B9R0.46 CCCCSCC(C)CS Amb24407652 [0,2,0,0,0,0|0,1,1]=4 8809 B9R0.46 CCCCSCC(C)NC Amb24554949 [0,2,0,0,0,0|1,0,1]=4 8810 B9R0.46 CCCCSCC(C)OC Amb24464870 [0,2,0,0,0,0|0,0,2]=4 8811 B9R0.46 CCCCSCC(CO)O Amb10669577 [0,2,0,0,0,0|0,0,2]=4 8812 B9R0.46 CCCCSCC(N)CO Amb24480393 [0,2,0,0,0,0|1,0,1]=4 8813 B9R0.46 CCCCSCC(O)CC Amb18792454 [0,2,0,0,0,0|0,0,2]=4 8814 B9R0.46 CCCCSCC(O)CCl Amb25320949 [0,2,0,0,0,0|0,0,2]=4 8815 B9R0.46 CCCCSC[C@@H](O)CC Amb24584629 [0,2,0,0,0,0|0,0,2]=4 8816 B9R0.46 CCCCSC[C@@H](O)CN Amb24384739 [0,2,0,0,0,0|0,0,2]=4 8817 B9R0.46 CCCCSC[C@H](N)CO Amb24581523 [0,2,0,0,0,0|1,0,1]=4 8818 B9R0.46 CCCC\C=C\C(=O)CBr Amb25068266 [0,2,0,0,0,0|0,0,1]=3 8819 B9R0.46 CCCC\C=C\C(=O)OC Amb25339041 [0,2,0,0,0,0|0,0,1]=3 8820 B9R0.46 CCCC\C=C\C(C)C=O Amb24478317 [0,2,0,0,0,0|0,0,2]=4 8821 B9R0.46 CCCC\N=C\C(=O)CC Amb25807606 [0,2,0,0,0,0|0,0,1]=3 8822 B9R0.46 CCCNCCC(=O)CC Amb25366402 [0,2,0,0,0,0|0,0,0]=2 8823 B9R0.46 CCCNCCC(=O)NN Amb20171894 [0,2,0,0,0,0|1,0,0]=3 8824 B9R0.46 CCCNCCC(Br)CC Amb25130719 [0,2,0,0,0,0|1,0,1]=4 8825 B9R0.46 CCCNCCC(CN)C Amb17334225 [0,2,0,0,0,0|1,0,1]=4 8826 B9R0.46 CCCNCCC(O)CC Amb24340228 [0,2,0,0,0,0|0,0,2]=4 8827 B9R0.46 CCCNCCN(C)CC Amb25324885 [0,2,0,0,0,0|2,0,0]=4 8828 B9R0.46 CCCNCC\C(\N)=N/O Amb19981292 [0,2,0,0,0,0|1,0,1]=4 8829 B9R0.46 CCCNC\C=C(\C)/CO Amb18644033 [0,2,0,0,0,0|0,0,2]=4 8830 B9R0.46 CCCN\C=C\C(=O)OC Amb24413519 [0,2,0,0,0,0|0,0,2]=4 8831 B9R0.46 CCCOCCC(=O)NC Amb24410354 [0,2,0,0,0,0|0,0,0]=2 8832 B9R0.46 CCCOCCC(=O)NN Amb20076064 [0,2,0,0,0,0|1,0,0]=3 8833 B9R0.46 CCCOCCC(=O)NO Amb24524497 [0,2,0,0,0,0|1,0,0]=3 8834 B9R0.46 CCCOCCC(C)C=O Amb24581823 [0,2,0,0,0,0|0,0,1]=3 8835 B9R0.46 CCCOCCC(C)CN Amb24461190 [0,2,0,0,0,0|1,0,1]=4 8836 B9R0.46 CCCOCCC(C)CO Amb24529311 [0,2,0,0,0,0|0,0,2]=4 8837 B9R0.46 CCCOCCC(Cl)CC Amb25794364 [0,2,0,0,0,0|1,0,1]=4 8838 B9R0.46 CCCOCNC(=O)C=C Amb25697963 [0,2,0,0,0,0|1,0,1]=4 8839 B9R0.46 CCCONCC(=C)CC Amb25812810 [0,2,0,0,0,0|2,0,0]=4 8840 B9R0.46 CCCONCC(C)=CCl Amb25031194 [0,2,0,0,0,0|2,0,0]=4 8841 B9R0.46 CCCSCCC(O)CN Amb25849798 [0,2,0,0,0,0|0,0,2]=4 8842 B9R0.46 CCCSCCC(O)CO Amb25359745 [0,2,0,0,0,0|0,0,2]=4 8843 B9R0.46 CCC\C=C\CC(=O)CO Amb24708991 [0,2,0,0,0,0|0,0,1]=3 8844 B9R0.46 CCC\C=C\CC(C)C=O Amb24575415 [0,2,0,0,0,0|0,0,2]=4 8845 B9R0.46 CCC\C=C\NC(=O)OC Amb25128007 [0,2,0,0,0,0|0,0,2]=4 8846 B9R0.46 CCN(C)CCCCCBr Amb25728227 [0,2,0,0,0,0|2,0,0]=4 8847 B9R0.46 CCN(C)CCCCCCl Amb18788251 [0,2,0,0,0,0|2,0,0]=4 8848 B9R0.46 CCN(C)CCCCCN Amb24700898 [0,2,0,0,0,0|2,0,0]=4 8849 B9R0.46 CCN(C)CCCCCO Amb24677798 [0,2,0,0,0,0|2,0,0]=4 8850 B9R0.46 CCN(C)CCCCCS Amb25769217 [0,2,0,0,0,0|2,0,0]=4 8851 B9R0.46 CCNCCCC(=O)OC Amb22886193 [0,2,0,0,0,0|0,0,0]=2 8852 B9R0.46 CCNCCCC(C)CN Amb24724138 [0,2,0,0,0,0|1,0,1]=4 8853 B9R0.46 CCNCCCC(C)CO Amb25072913 [0,2,0,0,0,0|0,0,2]=4 8854 B9R0.46 CCNCCCC(C)OC Amb25738781 [0,2,0,0,0,0|0,0,2]=4 8855 B9R0.46 CCNCCCN(C)OC Amb24643436 [0,2,0,0,0,0|1,0,1]=4 8856 B9R0.46 CCNCCNC(=O)C#C Amb19027504 [0,2,0,0,0,0|1,0,1]=4 8857 B9R0.46 CCNCCNC(=O)C=C Amb24476888 [0,2,0,0,0,0|1,0,1]=4 8858 B9R0.46 CCNCCNC(=O)CN Amb25092424 [0,2,0,0,0,0|1,0,0]=3 8859 B9R0.46 CCNCCNC(=O)OC Amb24727935 [0,2,0,0,0,0|1,0,0]=3 8860 B9R0.46 CCNC\C=C\C(=O)OC Amb25266108 [0,2,0,0,0,0|0,0,2]=4 8861 B9R0.46 CCOCCCC(=N)NC Amb25211509 [0,2,0,0,0,0|1,0,0]=3 8862 B9R0.46 CCOCCCC(=O)CN Amb25333891 [0,2,0,0,0,0|0,0,0]=2 8863 B9R0.46 CCOCCCC(=O)NC Amb25736237 [0,2,0,0,0,0|0,0,0]=2 8864 B9R0.46 CCOCCCC(=O)NN Amb25337368 [0,2,0,0,0,0|1,0,0]=3 8865 B9R0.46 CCOCCCC(C)CO Amb25291426 [0,2,0,0,0,0|0,0,2]=4 8866 B9R0.46 CCOCCCC(C)NC Amb25778990 [0,2,0,0,0,0|1,0,1]=4 8867 B9R0.46 CCOCCCC(C)NN Amb24471904 [0,2,0,0,0,0|1,0,1]=4 8868 B9R0.46 CCOCCNC(=O)CBr Amb17325304 [0,2,0,0,0,0|1,0,0]=3 8869 B9R0.46 CCOCCNC(=O)CO Amb25372631 [0,2,0,0,0,0|1,0,0]=3 8870 B9R0.46 CCOCCOC(=C)C=O Amb25770095 [0,2,0,0,0,0|1,0,1]=4 8871 B9R0.46 CCOCCOC(=O)C=C Amb15692678 [0,2,0,0,0,0|1,0,1]=4 8872 B9R0.46 CCOCCOC(=O)CBr Amb25765727 [0,2,0,0,0,0|1,0,0]=3 8873 B9R0.46 CCOCCOC(=O)CCl Amb18602724 [0,2,0,0,0,0|1,0,0]=3 8874 B9R0.46 CCOCCO[C@@H](C)C=O Amb24441439 [0,2,0,0,0,0|1,0,1]=4 8875 B9R0.46 CCOCCSC(N)=NC Amb24448700 [0,2,0,0,0,0|2,0,0]=4 8876 B9R0.46 CCOCSCC(C)=CCl Amb24722483 [0,2,0,0,0,0|2,0,0]=4 8877 B9R0.46 CCS(=O)CCCCCCl Amb24740814 [0,2,0,0,0,0|1,0,0]=3 8878 B9R0.46 CCS(=O)CCCCCN Amb24573569 [0,2,0,0,0,0|1,0,0]=3 8879 B9R0.46 CCS(=O)CCCCCO Amb25246408 [0,2,0,0,0,0|1,0,0]=3 8880 B9R0.46 CCS(=O)CCNCCN Amb24369752 [0,2,0,0,0,0|2,0,0]=4 8881 B9R0.46 CCS(=O)CCNCCO Amb25222985 [0,2,0,0,0,0|2,0,0]=4 8882 B9R0.46 CCSCCCC(C)CBr Amb24509145 [0,2,0,0,0,0|1,0,1]=4 8883 B9R0.46 CCSCCCC(C)CN Amb25046097 [0,2,0,0,0,0|1,0,1]=4 8884 B9R0.46 CCSCCCN(C)OC Amb25842229 [0,2,0,0,0,0|1,0,1]=4 8885 B9R0.46 CCSCCNC(=O)CBr Amb17323884 [0,2,0,0,0,0|1,0,0]=3 8886 B9R0.46 CCSCCNC(=O)CCl Amb17331758 [0,2,0,0,0,0|1,0,0]=3 8887 B9R0.46 CCSCCNC(=O)OC Amb24747719 [0,2,0,0,0,0|1,0,0]=3 8888 B9R0.46 CCSCCOC(=O)NC Amb25247126 [0,2,0,0,0,0|1,0,0]=3 8889 B9R0.46 CCSCCSC(=O)CCl Amb25274004 [0,2,0,0,0,0|1,0,0]=3 8890 B9R0.46 CCSCCSC(=S)OC Amb25119826 [0,2,0,0,0,0|1,1,0]=4 8891 B9R0.46 CCSCSCC(=O)NC Amb24449478 [0,2,0,0,0,0|1,0,0]=3 8892 B9R0.46 CCSCSCC(=O)OC Amb24621540 [0,2,0,0,0,0|1,0,0]=3 8893 B9R0.46 CCSCSCC(C)=CCl Amb25768203 [0,2,0,0,0,0|2,0,0]=4 8894 B9R0.46 CC[C@@H](C)CCCCCBr Amb24651500 [0,2,0,0,0,0|1,0,1]=4 8895 B9R0.46 CC[C@@H](C)CCCCCO Amb22746927 [0,2,0,0,0,0|1,0,1]=4 8896 B9R0.46 CC[C@@H](O)CCCCCF Amb24448035 [0,2,0,0,0,0|0,0,2]=4 8897 B9R0.46 CC[C@H](C)CCCCCBr Amb24477236 [0,2,0,0,0,0|1,0,1]=4 8898 B9R0.46 CC[C@H](C)CCCCCO Amb19944689 [0,2,0,0,0,0|1,0,1]=4 8899 B9R0.46 CC\C(\C)=C\CCCCBr Amb25857987 [0,2,0,0,0,0|1,0,1]=4 8900 B9R0.46 CC\C=C\CCC(=O)OC Amb25350136 [0,2,0,0,0,0|0,0,1]=3 8901 B9R0.46 CC\C=C\CCC(=S)NC Amb25322216 [0,2,0,0,0,0|0,1,1]=4 8902 B9R0.46 CC\C=C\CCC(C)C=O Amb25729159 [0,2,0,0,0,0|0,0,2]=4 8903 B9R0.46 CC\C=C\CNC(=O)CCl Amb24584530 [0,2,0,0,0,0|0,0,2]=4 8904 B9R0.46 CC\C=C\CNC(=O)CN Amb24615022 [0,2,0,0,0,0|0,0,2]=4 8905 B9R0.46 CC\C=C\CNC(=O)OC Amb24577900 [0,2,0,0,0,0|0,0,2]=4 8906 B9R0.46 CN(CCCCC=O)C=O Amb24722873 [0,2,0,0,0,0|1,0,1]=4 8907 B9R0.46 CN(CCCNCC)CC Amb25742972 [0,2,0,0,0,0|2,0,0]=4 8908 B9R0.46 CN=C(N)SCCCOC Amb25829916 [0,2,0,0,0,0|2,0,0]=4 8909 B9R0.46 CNC(=N)NCCCCC Amb25783350 [0,2,0,0,0,0|1,0,0]=3 8910 B9R0.46 CNC(=N)NCCCCF Amb24681079 [0,2,0,0,0,0|2,0,0]=4 8911 B9R0.46 CNC(=N)NCCCCO Amb24760208 [0,2,0,0,0,0|2,0,0]=4 8912 B9R0.46 CNC(=N)NCCCOC Amb25112123 [0,2,0,0,0,0|2,0,0]=4 8913 B9R0.46 CNC(=N)NCCCSC Amb25064550 [0,2,0,0,0,0|2,0,0]=4 8914 B9R0.46 CNC(=O)CCCCC=C Amb25368070 [0,2,0,0,0,0|0,0,1]=3 8915 B9R0.46 CNC(=O)CCCCC=O Amb25339730 [0,2,0,0,0,0|0,0,1]=3 8916 B9R0.46 CNC(=O)CCCCOC Amb24457668 [0,2,0,0,0,0|0,0,0]=2 8917 B9R0.46 CNC(=O)CCCN=C=S Amb25132214 [0,2,0,0,0,0|1,0,1]=4 8918 B9R0.46 CNC(=O)CCCNCC Amb24691212 [0,2,0,0,0,0|0,0,0]=2 8919 B9R0.46 CNC(=O)CCNCC#C Amb25241003 [0,2,0,0,0,0|0,0,2]=4 8920 B9R0.46 CNC(=O)CCNCC=C Amb20171973 [0,2,0,0,0,0|0,0,2]=4 8921 B9R0.46 CNC(=O)CCNCCC Amb20171970 [0,2,0,0,0,0|0,0,0]=2 8922 B9R0.46 CNC(=O)CCNCCF Amb25032141 [0,2,0,0,0,0|1,0,0]=3 8923 B9R0.46 CNC(=O)CCNCCO Amb24478100 [0,2,0,0,0,0|1,0,0]=3 8924 B9R0.46 CNC(=O)CCSCC#C Amb25248285 [0,2,0,0,0,0|0,0,2]=4 8925 B9R0.46 CNC(=O)CCSCC=O Amb24657588 [0,2,0,0,0,0|1,0,1]=4 8926 B9R0.46 CNC(=O)CCSCCN Amb18798161 [0,2,0,0,0,0|1,0,0]=3 8927 B9R0.46 CNC(=O)CCSCCO Amb18798234 [0,2,0,0,0,0|1,0,0]=3 8928 B9R0.46 CNC(=O)CNCCC=C Amb24476198 [0,2,0,0,0,0|0,0,2]=4 8929 B9R0.46 CNC(=O)CNOCCC Amb25031188 [0,2,0,0,0,0|1,0,0]=3 8930 B9R0.46 CNC(=O)CSCCCS Amb25728156 [0,2,0,0,0,0|1,0,0]=3 8931 B9R0.46 CNC(=O)CSCCOC Amb25315975 [0,2,0,0,0,0|1,0,0]=3 8932 B9R0.46 CNC(=O)CSCCON Amb25233985 [0,2,0,0,0,0|2,0,0]=4 8933 B9R0.46 CNC(=O)NCCC#CC Amb24709923 [0,2,0,0,0,0|0,0,2]=4 8934 B9R0.46 CNC(=O)NCCCC#C Amb25792392 [0,2,0,0,0,0|0,0,2]=4 8935 B9R0.46 CNC(=O)NCCCC=C Amb24700967 [0,2,0,0,0,0|0,0,2]=4 8936 B9R0.46 CNC(=O)NCCCCF Amb24333126 [0,2,0,0,0,0|1,0,0]=3 8937 B9R0.46 CNC(=O)NCCCCN Amb24502161 [0,2,0,0,0,0|1,0,0]=3 8938 B9R0.46 CNC(=O)NCCCCO Amb24480832 [0,2,0,0,0,0|1,0,0]=3 8939 B9R0.46 CNC(=O)NCCNCC Amb24555774 [0,2,0,0,0,0|1,0,0]=3 8940 B9R0.46 CNC(=O)NCCSCC Amb25185191 [0,2,0,0,0,0|1,0,0]=3 8941 B9R0.46 CNC(=O)NC\C=C\CC Amb24578067 [0,2,0,0,0,0|0,0,2]=4 8942 B9R0.46 CNC(=O)OCCCCN Amb24551298 [0,2,0,0,0,0|1,0,0]=3 8943 B9R0.46 CNC(=S)NCCCCF Amb25182666 [0,2,0,0,0,0|1,1,0]=4 8944 B9R0.46 CNC(=S)NCCOCC Amb24458741 [0,2,0,0,0,0|1,1,0]=4 8945 B9R0.46 CNC(C)CCCCCO Amb25680151 [0,2,0,0,0,0|1,0,1]=4 8946 B9R0.46 CNC(C)CNCCCC Amb24477898 [0,2,0,0,0,0|1,0,1]=4 8947 B9R0.46 CNCCCCC(=O)OC Amb25725637 [0,2,0,0,0,0|0,0,0]=2 8948 B9R0.46 CNCCCCC(C)=NO Amb24671218 [0,2,0,0,0,0|0,0,1]=3 8949 B9R0.46 CNCCCCC(N)CO Amb25217030 [0,2,0,0,0,0|1,0,1]=4 8950 B9R0.46 CNCCCCC(OC)C Amb17569968 [0,2,0,0,0,0|0,0,2]=4 8951 B9R0.46 CNCCCCN(C)OC Amb24464694 [0,2,0,0,0,0|1,0,1]=4 8952 B9R0.46 CNCCCC\C(\C)=N/O Amb25118116 [0,2,0,0,0,0|0,0,1]=3 8953 B9R0.46 CNCCCNC(=O)CN Amb24450821 [0,2,0,0,0,0|1,0,0]=3 8954 B9R0.46 CNCCCNC(=O)CS Amb24482115 [0,2,0,0,0,0|1,0,0]=3 8955 B9R0.46 CNCCOCC(=O)NC Amb19374954 [0,2,0,0,0,0|1,0,0]=3 8956 B9R0.46 CNCCOCC(C)=CCl Amb25721534 [0,2,0,0,0,0|2,0,0]=4 8957 B9R0.46 CNCCSCC(=O)NN Amb25180208 [0,2,0,0,0,0|2,0,0]=4 8958 B9R0.46 CNCCSCC(=O)OC Amb18798231 [0,2,0,0,0,0|1,0,0]=3 8959 B9R0.46 COC(=N)CCCOCC Amb24597184 [0,2,0,0,0,0|1,0,0]=3 8960 B9R0.46 COC(=O)C#CCCCO Amb22230916 [0,2,0,0,0,0|0,0,2]=4 8961 B9R0.46 COC(=O)CCC#CCBr Amb25139754 [0,2,0,0,0,0|0,0,2]=4 8962 B9R0.46 COC(=O)CCC#CCN Amb25074286 [0,2,0,0,0,0|0,0,2]=4 8963 B9R0.46 COC(=O)CCC#CCO Amb25854158 [0,2,0,0,0,0|0,0,2]=4 8964 B9R0.46 COC(=O)CCCCC#C Amb18636156 [0,2,0,0,0,0|0,0,1]=3 8965 B9R0.46 COC(=O)CCCCC#N Amb18643702 [0,2,0,0,0,0|0,0,1]=3 8966 B9R0.46 COC(=O)CCCCCCl Amb25703167 [0,2,0,0,0,0|0,0,0]=2 8967 B9R0.46 COC(=O)CCCCCI Amb24429888 [0,2,0,0,0,0|0,0,0]=2 8968 B9R0.46 COC(=O)CCCCCO Amb22002577 [0,2,0,0,0,0|0,0,0]=2 8969 B9R0.46 COC(=O)CCCC[Zn]Br Amb22898092 [0,2,0,0,0,0|1,0,0]=3 8970 B9R0.46 COC(=O)CCCN=[N+]=[N-] Amb22586627 [0,2,0,0,0,0|2,0,0]=4 8971 B9R0.46 COC(=O)CCCSC#N Amb22230905 [0,2,0,0,0,0|1,0,1]=4 8972 B9R0.46 COC(=O)CCNCCF Amb24468568 [0,2,0,0,0,0|1,0,0]=3 8973 B9R0.46 COC(=O)CCNCCN Amb24478041 [0,2,0,0,0,0|1,0,0]=3 8974 B9R0.46 COC(=O)CCNOCC Amb24739231 [0,2,0,0,0,0|1,0,0]=3 8975 B9R0.46 COC(=O)CCSCC#C Amb18183274 [0,2,0,0,0,0|0,0,2]=4 8976 B9R0.46 COC(=O)CCSCC=O Amb18183492 [0,2,0,0,0,0|1,0,1]=4 8977 B9R0.46 COC(=O)CCSCCN Amb20623046 [0,2,0,0,0,0|1,0,0]=3 8978 B9R0.46 COC(=O)CCSCCN Amb20668423 [0,2,0,0,0,0|1,0,0]=3 8979 B9R0.46 COC(=O)CC\C=C\CBr Amb25076169 [0,2,0,0,0,0|0,0,2]=4 8980 B9R0.46 COC(=O)CNCCCF Amb24675706 [0,2,0,0,0,0|1,0,0]=3 8981 B9R0.46 COC(=O)CNCCCN Amb25128054 [0,2,0,0,0,0|1,0,0]=3 8982 B9R0.46 COC(=O)CNOCCC Amb25755786 [0,2,0,0,0,0|1,0,0]=3 8983 B9R0.46 COC(=O)COCCCBr Amb24477190 [0,2,0,0,0,0|1,0,0]=3 8984 B9R0.46 COC(=O)COC\C=C\C Amb25321206 [0,2,0,0,0,0|0,0,2]=4 8985 B9R0.46 COC(=O)CSCCC#C Amb24476761 [0,2,0,0,0,0|0,0,2]=4 8986 B9R0.46 COC(=O)CSCCC=C Amb25143714 [0,2,0,0,0,0|0,0,2]=4 8987 B9R0.46 COC(=O)CSCCC=O Amb18788129 [0,2,0,0,0,0|1,0,1]=4 8988 B9R0.46 COC(=O)CSCCCCl Amb22524768 [0,2,0,0,0,0|1,0,0]=3 8989 B9R0.46 COC(=O)CSCCCS Amb24733758 [0,2,0,0,0,0|1,0,0]=3 8990 B9R0.46 COC(=O)NCCCC#N Amb24477915 [0,2,0,0,0,0|1,0,1]=4 8991 B9R0.46 COC(=O)NCCCNN Amb24670479 [0,2,0,0,0,0|2,0,0]=4 8992 B9R0.46 COC(=O)NCCOCC Amb25851319 [0,2,0,0,0,0|1,0,0]=3 8993 B9R0.46 COC(=O)NOCCSC Amb24569709 [0,2,0,0,0,0|2,0,0]=4 8994 B9R0.46 COC(=O)OCCCCN Amb24570668 [0,2,0,0,0,0|1,0,0]=3 8995 B9R0.46 COC(=O)OCCCCO Amb25056213 [0,2,0,0,0,0|1,0,0]=3 8996 B9R0.46 COC(=O)\C=C\CCCBr Amb24505064 [0,2,0,0,0,0|0,0,2]=4 8997 B9R0.46 COC(=O)\C=C\CCCCl Amb24574594 [0,2,0,0,0,0|0,0,2]=4 8998 B9R0.46 COC(=O)\C=C\CCCO Amb25724784 [0,2,0,0,0,0|0,0,2]=4 8999 B9R0.46 COC(=O)\C=C\COCC Amb24655529 [0,2,0,0,0,0|0,0,2]=4 9000 B9R0.46 COC(=S)NCCCSC Amb24427368 [0,2,0,0,0,0|1,1,0]=4 9001 B9R0.46 COC(=S)SCCCCF Amb25681598 [0,2,0,0,0,0|1,1,0]=4 9002 B9R0.46 COC(=S)SCCCCO Amb25169422 [0,2,0,0,0,0|1,1,0]=4 9003 B9R0.46 COC(C)CCCCCCl Amb25809507 [0,2,0,0,0,0|0,0,2]=4 9004 B9R0.46 COC(C)CCCCCO Amb25756223 [0,2,0,0,0,0|0,0,2]=4 9005 B9R0.46 COCCCCC(=O)C=C Amb24460942 [0,2,0,0,0,0|0,0,1]=3 9006 B9R0.46 COCCCCC(=O)CCl Amb24738510 [0,2,0,0,0,0|0,0,0]=2 9007 B9R0.46 COCCCCC(=O)NN Amb24505213 [0,2,0,0,0,0|1,0,0]=3 9008 B9R0.46 COCCCCC(=O)NO Amb24431421 [0,2,0,0,0,0|1,0,0]=3 9009 B9R0.46 COCCCCC(=O)OC Amb25136902 [0,2,0,0,0,0|0,0,0]=2 9010 B9R0.46 COCCCCC(C)C=O Amb24356335 [0,2,0,0,0,0|0,0,1]=3 9011 B9R0.46 COCCCCC(C)CN Amb24644918 [0,2,0,0,0,0|1,0,1]=4 9012 B9R0.46 COCCCCC(Cl)CCl Amb25233418 [0,2,0,0,0,0|1,0,1]=4 9013 B9R0.46 COCCCCC(N)=NO Amb24558035 [0,2,0,0,0,0|1,0,1]=4 9014 B9R0.46 COCCCCC(NC)C Amb17569972 [0,2,0,0,0,0|1,0,1]=4 9015 B9R0.46 COCCCNC(=O)CBr Amb17323752 [0,2,0,0,0,0|1,0,0]=3 9016 B9R0.46 COCCCNC(=O)CCl Amb1150989 [0,2,0,0,0,0|1,0,0]=3 9017 B9R0.46 COCCCNC(=O)CN Amb21958876 [0,2,0,0,0,0|1,0,0]=3 9018 B9R0.46 COCCCNC(=O)NC Amb2132785 [0,2,0,0,0,0|1,0,0]=3 9019 B9R0.46 COCCCNC(=O)NN Amb21618956 [0,2,0,0,0,0|2,0,0]=4 9020 B9R0.46 COCCCNC(=O)OC Amb17737911 [0,2,0,0,0,0|1,0,0]=3 9021 B9R0.46 COCCCOC(=O)CC Amb24350143 [0,2,0,0,0,0|1,0,0]=3 9022 B9R0.46 COCCCSC(=S)OC Amb24446235 [0,2,0,0,0,0|1,1,0]=4 9023 B9R0.46 COCCC\C=C(\C)/C=O Amb25308818 [0,2,0,0,0,0|0,0,1]=3 9024 B9R0.46 COCCC\C=C(\C)/CO Amb24513532 [0,2,0,0,0,0|0,0,2]=4 9025 B9R0.46 COCCNCC(=O)C#C Amb25113048 [0,2,0,0,0,0|1,0,1]=4 9026 B9R0.46 COCCOCC(=C)CCl Amb25114691 [0,2,0,0,0,0|2,0,0]=4 9027 B9R0.46 COCCOCC(=C)CS Amb25091771 [0,2,0,0,0,0|2,0,0]=4 9028 B9R0.46 COCCOCC(=N)NC Amb24595133 [0,2,0,0,0,0|2,0,0]=4 9029 B9R0.46 COCCOCC(=N)OC Amb25240882 [0,2,0,0,0,0|2,0,0]=4 9030 B9R0.46 COCCOCC(=O)CCl Amb25704798 [0,2,0,0,0,0|1,0,0]=3 9031 B9R0.46 COCCOCC(=O)NC Amb24476338 [0,2,0,0,0,0|1,0,0]=3 9032 B9R0.46 COCCOCC(=O)NO Amb24593158 [0,2,0,0,0,0|2,0,0]=4 9033 B9R0.46 COCCONC(=O)CBr Amb24433670 [0,2,0,0,0,0|2,0,0]=4 9034 B9R0.46 COCCONC(=O)CC Amb25066775 [0,2,0,0,0,0|2,0,0]=4 9035 B9R0.46 COCCONC(=O)CCl Amb24563281 [0,2,0,0,0,0|2,0,0]=4 9036 B9R0.46 COCCONC(=O)CN Amb24442732 [0,2,0,0,0,0|2,0,0]=4 9037 B9R0.46 COCCONC(=O)CO Amb25345661 [0,2,0,0,0,0|2,0,0]=4 9038 B9R0.46 COCCONC(=O)OC Amb25206929 [0,2,0,0,0,0|2,0,0]=4 9039 B9R0.46 COCCSCC(=C)CN Amb25221588 [0,2,0,0,0,0|2,0,0]=4 9040 B9R0.46 COCCSCC(=O)NO Amb24482790 [0,2,0,0,0,0|2,0,0]=4 9041 B9R0.46 COCCSCC(C)=CCl Amb24509402 [0,2,0,0,0,0|2,0,0]=4 9042 B9R0.46 COCOCCC(=C)C=O Amb24682570 [0,2,0,0,0,0|1,0,1]=4 9043 B9R0.46 CON(C)CCCCCF Amb24482811 [0,2,0,0,0,0|1,0,1]=4 9044 B9R0.46 CON(C)CCCCCO Amb25763782 [0,2,0,0,0,0|1,0,1]=4 9045 B9R0.46 CON(C)CCCOCC Amb25052879 [0,2,0,0,0,0|1,0,1]=4 9046 B9R0.46 CSCCCC\C(\N)=N\O Amb18792449 [0,2,0,0,0,0|1,0,1]=4 9047 B9R0.46 CSCCCNC(=N)SC Amb25784613 [0,2,0,0,0,0|2,0,0]=4 9048 B9R0.46 CSCCCNC(=O)C#C Amb25214048 [0,2,0,0,0,0|1,0,1]=4 9049 B9R0.46 CSCCCNC(=O)C=C Amb24679711 [0,2,0,0,0,0|1,0,1]=4 9050 B9R0.46 CSCCCNC(=O)CN Amb25088013 [0,2,0,0,0,0|1,0,0]=3 9051 B9R0.46 CSCCCNC(=O)NN Amb25146381 [0,2,0,0,0,0|2,0,0]=4 9052 B9R0.46 CSCCCOC(=O)CS Amb25252055 [0,2,0,0,0,0|1,0,0]=3 9053 B9R0.46 CSCCOCC(=C)CCl Amb25132750 [0,2,0,0,0,0|2,0,0]=4 9054 B9R0.46 CSCCOCC(=C)CN Amb24474446 [0,2,0,0,0,0|2,0,0]=4 9055 B9R0.46 CSCCONC(=O)CO Amb25704529 [0,2,0,0,0,0|2,0,0]=4 9056 B9R0.46 CSCCSCC(=C)CC Amb25806315 [0,2,0,0,0,0|2,0,0]=4 9057 B9R0.46 CSCCSCC(=C)CCl Amb24470370 [0,2,0,0,0,0|2,0,0]=4 9058 B9R0.46 CSCCSCC(=C)CN Amb25834705 [0,2,0,0,0,0|2,0,0]=4 9059 B9R0.46 CSCCSCC(=O)CC Amb25773276 [0,2,0,0,0,0|1,0,0]=3 9060 B9R0.46 CSSCCNC(=O)CBr Amb25230758 [0,2,0,0,0,0|2,0,0]=4 9061 B9R0.46 CSSCCNC(=O)CC Amb24354241 [0,2,0,0,0,0|2,0,0]=4 9062 B9R0.46 CSSCCNC(=O)CCl Amb24657366 [0,2,0,0,0,0|2,0,0]=4 9063 B9R0.46 CSSCCNC(=O)CO Amb25169410 [0,2,0,0,0,0|2,0,0]=4 9064 B9R0.46 CSSCCNC(=O)CS Amb24680380 [0,2,0,0,0,0|2,0,0]=4 9065 B9R0.46 CSSCCNC(=O)NC Amb24524469 [0,2,0,0,0,0|2,0,0]=4 9066 B9R0.46 CSSCCNC(=O)OC Amb24404332 [0,2,0,0,0,0|2,0,0]=4 9067 B9R0.46 C[C@H](CCCCCO)CO Amb24363587 [0,2,0,0,0,0|0,0,2]=4 9068 B9R0.46 C\C(\C=O)=C/CCCC#C Amb24478336 [0,2,0,0,0,0|0,0,2]=4 9069 B9R0.46 C\C(\CC)=C\CCNCC Amb25737459 [0,2,0,0,0,0|1,0,1]=4 9070 B9R0.46 C\C(\CCl)=C/CCCCCl Amb25857951 [0,2,0,0,0,0|1,0,1]=4 9071 B9R0.46 C\C(\CO)=C/CCCCN Amb25314967 [0,2,0,0,0,0|0,0,2]=4 9072 B9R0.46 C\C=C(/C)\CCCCC=O Amb25101803 [0,2,0,0,0,0|1,0,1]=4 9073 B9R0.46 C\C=C(\C)/CCCCC=O Amb25366484 [0,2,0,0,0,0|1,0,1]=4 9074 B9R0.46 C\C=C\CCCC(=O)OC Amb24356360 [0,2,0,0,0,0|0,0,1]=3 9075 B9R0.46 C\C=C\CCCC(C)C=O Amb18643631 [0,2,0,0,0,0|0,0,2]=4 9076 B9R0.46 C\C=C\CCNC(=O)CBr Amb24525267 [0,2,0,0,0,0|0,0,2]=4 9077 B9R0.46 C\C=C\CCNC(=O)CN Amb24524383 [0,2,0,0,0,0|0,0,2]=4 9078 B9R0.46 C\C=C\CCNC(=O)OC Amb24333403 [0,2,0,0,0,0|0,0,2]=4 9079 B9R0.46 C\C=C\COCC(=O)CC Amb24505221 [0,2,0,0,0,0|0,0,2]=4 9080 B9R0.46 C\C=C\CSCC(=O)OC Amb25297114 [0,2,0,0,0,0|0,0,2]=4 9081 B9R0.46 N#CCCCNC(=O)CBr Amb25783231 [0,2,0,0,0,0|1,0,1]=4 9082 B9R0.46 N#CCCCNC(=O)CCl Amb18797926 [0,2,0,0,0,0|1,0,1]=4 9083 B9R0.46 N#CCCCOC(=O)CO Amb24703415 [0,2,0,0,0,0|1,0,1]=4 9084 B9R0.46 N#CCCSCC(=O)NC Amb17502404 [0,2,0,0,0,0|1,0,1]=4 9085 B9R0.46 NC(CCCCCO)CO Amb25323751 [0,2,0,0,0,0|1,0,1]=4 9086 B9R0.46 NC(CCCCCS)=NO Amb24512304 [0,2,0,0,0,0|1,0,1]=4 9087 B9R0.46 NC(CO)CCCCCF Amb24704903 [0,2,0,0,0,0|1,0,1]=4 9088 B9R0.46 NCC(=O)NCCCC#N Amb19026979 [0,2,0,0,0,0|1,0,1]=4 9089 B9R0.46 NCC(=O)NCCCCO Amb25823399 [0,2,0,0,0,0|1,0,0]=3 9090 B9R0.46 NCC(=O)OCCCCCl Amb25200017 [0,2,0,0,0,0|1,0,0]=3 9091 B9R0.46 NCC(O)CCCCCBr Amb25290968 [0,2,0,0,0,0|0,0,2]=4 9092 B9R0.46 NCCCCCC(=O)NN Amb18061863 [0,2,0,0,0,0|1,0,0]=3 9093 B9R0.46 NCCCCCC(=O)NO Amb25146421 [0,2,0,0,0,0|1,0,0]=3 9094 B9R0.46 NCCCCCC(=O)OC Amb1152885 [0,2,0,0,0,0|0,0,0]=2 9095 B9R0.46 NCCCCCC(=O)OC Amb16203805 [0,2,0,0,0,0|0,0,0]=2 9096 B9R0.46 NCCCCCC(=O)OC Amb1935045 [0,2,0,0,0,0|0,0,0]=2 9097 B9R0.46 NCCCCCC(N)CBr Amb25857899 [0,2,0,0,0,0|1,0,1]=4 9098 B9R0.46 NCCCCNC(=N)CF Amb24501740 [0,2,0,0,0,0|2,0,0]=4 9099 B9R0.46 NCCCCNC(=O)CC Amb17053701 [0,2,0,0,0,0|1,0,0]=3 9100 B9R0.46 NCCCCNC(=O)CCl Amb18177807 [0,2,0,0,0,0|1,0,0]=3 9101 B9R0.46 NCCCCNC(=O)CN Amb25085458 [0,2,0,0,0,0|1,0,0]=3 9102 B9R0.46 NCCCSCC(=O)NC Amb17500712 [0,2,0,0,0,0|1,0,0]=3 9103 B9R0.46 NCCSCCC(=O)NN Amb24402665 [0,2,0,0,0,0|2,0,0]=4 9104 B9R0.46 NNC(=O)CCCCCS Amb24390942 [0,2,0,0,0,0|1,0,0]=3 9105 B9R0.46 NNC(=O)CCOCCO Amb25769029 [0,2,0,0,0,0|2,0,0]=4 9106 B9R0.46 NNC(=O)CCSCCS Amb25109489 [0,2,0,0,0,0|2,0,0]=4 9107 B9R0.46 O=C(CBr)NCCCCF Amb24682855 [0,2,0,0,0,0|1,0,0]=3 9108 B9R0.46 O=C(CBr)OCCCCBr Amb24598197 [0,2,0,0,0,0|1,0,0]=3 9109 B9R0.46 O=C(CCl)NCCCCF Amb25118252 [0,2,0,0,0,0|1,0,0]=3 9110 B9R0.46 O=C(CCl)OCCCCCl Amb24355856 [0,2,0,0,0,0|1,0,0]=3 9111 B9R0.46 O=C(CF)NCOCCCl Amb25140748 [0,2,0,0,0,0|2,0,0]=4 9112 B9R0.46 O=C(CF)OCCCCBr Amb24477290 [0,2,0,0,0,0|1,0,0]=3 9113 B9R0.46 O=C(CF)OCCCCCl Amb25709579 [0,2,0,0,0,0|1,0,0]=3 9114 B9R0.46 O=C(CS)NCCCCS Amb24410091 [0,2,0,0,0,0|1,0,0]=3 9115 B9R0.46 O=CCCCCC(=O)OC Amb16233585 [0,2,0,0,0,0|0,0,1]=3 9116 B9R0.46 OCC(=O)NCCCCF Amb25731398 [0,2,0,0,0,0|1,0,0]=3 9117 B9R0.46 OCCCCCC(=O)C=O Amb24478225 [0,2,0,0,0,0|0,0,1]=3 9118 B9R0.46 OCCCCCC(O)CO Amb22731576 [0,2,0,0,0,0|0,0,2]=4 9119 B9R0.46 OCCCCNC(=O)CC Amb17102978 [0,2,0,0,0,0|1,0,0]=3 9120 B9R0.46 OCCCCNC(=O)CCl Amb24378067 [0,2,0,0,0,0|1,0,0]=3 9121 B9R0.46 OCCCCOC(=O)CCl Amb24406599 [0,2,0,0,0,0|1,0,0]=3 9122 B9R0.46 OCCCSCC(=O)NC Amb17502854 [0,2,0,0,0,0|1,0,0]=3 9123 B9R0.46 ONC(=O)CCCCC=O Amb24382910 [0,2,0,0,0,0|1,0,1]=4 9124 B9R0.46 S=C=NCCCC(=O)OC Amb2371146 [0,2,0,0,0,0|1,0,1]=4 9125 B9R0.47 BrCCCCC(=O)N(C)C Amb17239685 [0,2,0,0,0,0|1,0,0]=3 9126 B9R0.47 C#CCCCC(=O)C(F)F Amb24748884 [0,2,0,0,0,0|0,0,2]=4 9127 B9R0.47 C#CCCCC(O)C(O)=O Amb25221599 [0,2,0,0,0,0|1,0,1]=4 9128 B9R0.47 C#CCCC[C@@H](N)C(O)=O Amb24077358 [0,2,0,0,0,0|1,0,1]=4 9129 B9R0.47 C#CCCC[C@H](N)C(O)=O Amb24088878 [0,2,0,0,0,0|1,0,1]=4 9130 B9R0.47 C=C(CCCCO)C(O)=O Amb24479220 [0,2,0,0,0,0|1,0,1]=4 9131 B9R0.47 C=CCCCC(=O)C(F)F Amb24470642 [0,2,0,0,0,0|0,0,2]=4 9132 B9R0.47 C=CCCCC(Cl)C(=O)Cl Amb24509720 [0,2,0,0,0,0|1,0,1]=4 9133 B9R0.47 C=CCCCC(Cl)C(O)=O Amb18645742 [0,2,0,0,0,0|1,0,1]=4 9134 B9R0.47 C=CCCCC(N)C(O)=O Amb22002149 [0,2,0,0,0,0|1,0,1]=4 9135 B9R0.47 C=CCCC[C@@H](N)C(N)=O Amb25824644 [0,2,0,0,0,0|1,0,1]=4 9136 B9R0.47 C=CCCC[C@@H](N)C(O)=O Amb22831130 [0,2,0,0,0,0|1,0,1]=4 9137 B9R0.47 C=CCCC[C@@H](O)C(O)=O Amb24714998 [0,2,0,0,0,0|1,0,1]=4 9138 B9R0.47 C=CCCC[C@H](O)C(O)=O Amb24763769 [0,2,0,0,0,0|1,0,1]=4 9139 B9R0.47 CC#CCCC(=O)C(C)N Amb24401207 [0,2,0,0,0,0|0,0,2]=4 9140 B9R0.47 CC#CCCC(C)C(C)=O Amb25242345 [0,2,0,0,0,0|0,0,1]=3 9141 B9R0.47 CC#CCCC(O)C(C)=C Amb25285699 [0,2,0,0,0,0|1,0,1]=4 9142 B9R0.47 CC#CCC[C@@H](N)C(N)=O Amb25789997 [0,2,0,0,0,0|1,0,1]=4 9143 B9R0.47 CC#CCC[C@@H](N)C(O)=O Amb25835847 [0,2,0,0,0,0|1,0,1]=4 9144 B9R0.47 CC(=C)C(=C)CNCCC Amb24546977 [0,2,0,0,0,0|1,0,1]=4 9145 B9R0.47 CC(=C)C(=O)CCCC#C Amb25788808 [0,2,0,0,0,0|0,0,2]=4 9146 B9R0.47 CC(=C)C(=O)CCCC=C Amb25146865 [0,2,0,0,0,0|0,0,2]=4 9147 B9R0.47 CC(=C)C(=O)CCCCC Amb25146665 [0,2,0,0,0,0|0,0,0]=2 9148 B9R0.47 CC(=C)C(=O)CCCCN Amb24621760 [0,2,0,0,0,0|1,0,0]=3 9149 B9R0.47 CC(=C)C(=O)CCNCC Amb25662602 [0,2,0,0,0,0|1,0,0]=3 9150 B9R0.47 CC(=C)C(=O)CNCCC Amb24670945 [0,2,0,0,0,0|1,0,0]=3 9151 B9R0.47 CC(=C)C(=O)COCCC Amb25306742 [0,2,0,0,0,0|1,0,0]=3 9152 B9R0.47 CC(=C)C(=O)NCCCC Amb17933970 [0,2,0,0,0,0|1,0,0]=3 9153 B9R0.47 CC(=C)C(=O)NCCCN Amb17933170 [0,2,0,0,0,0|2,0,0]=4 9154 B9R0.47 CC(=C)C(=O)NCCCN Amb22284541 [0,2,0,0,0,0|2,0,0]=4 9155 B9R0.47 CC(=C)C(=O)NCCCO Amb25147303 [0,2,0,0,0,0|2,0,0]=4 9156 B9R0.47 CC(=C)C(=O)NCCNC Amb24617767 [0,2,0,0,0,0|2,0,0]=4 9157 B9R0.47 CC(=C)C(=O)OCCCF Amb22008273 [0,2,0,0,0,0|2,0,0]=4 9158 B9R0.47 CC(=C)C(=O)OCCCN Amb24480700 [0,2,0,0,0,0|2,0,0]=4 9159 B9R0.47 CC(=C)C(=O)OCCCO Amb22338752 [0,2,0,0,0,0|2,0,0]=4 9160 B9R0.47 CC(=C)C(=O)OCCOC Amb22228871 [0,2,0,0,0,0|2,0,0]=4 9161 B9R0.47 CC(=C)C(=O)OCCSC Amb22228171 [0,2,0,0,0,0|2,0,0]=4 9162 B9R0.47 CC(=C)C(=O)SCCCO Amb25356345 [0,2,0,0,0,0|2,0,0]=4 9163 B9R0.47 CC(=C)C(O)CCCC#C Amb24544456 [0,2,0,0,0,0|1,0,1]=4 9164 B9R0.47 CC(=C)C(O)CCCC=C Amb24555527 [0,2,0,0,0,0|1,0,1]=4 9165 B9R0.47 CC(=C=CCCC)C(O)=O Amb24409524 [0,2,0,0,0,0|0,0,2]=4 9166 B9R0.47 CC(=CCCCCl)C(=O)Cl Amb25263393 [0,2,0,0,0,0|1,0,1]=4 9167 B9R0.47 CC(=NOCCC)C(O)=O Amb24757594 [0,2,0,0,0,0|2,0,0]=4 9168 B9R0.47 CC(=O)C(=C)CCCC=C Amb25286074 [0,2,0,0,0,0|0,0,2]=4 9169 B9R0.47 CC(=O)C(=C)CCCCC Amb24708779 [0,2,0,0,0,0|0,0,0]=2 9170 B9R0.47 CC(=O)C(=C)CC\C=C\C Amb24518459 [0,2,0,0,0,0|0,0,2]=4 9171 B9R0.47 CC(=O)C(=C)COCCC Amb25226745 [0,2,0,0,0,0|0,0,1]=3 9172 B9R0.47 CC(=O)C(=O)CCCCCl Amb24480576 [0,2,0,0,0,0|0,0,1]=3 9173 B9R0.47 CC(=O)C(=O)CCCCO Amb24524628 [0,2,0,0,0,0|0,0,1]=3 9174 B9R0.47 CC(=O)C(=O)OCCCCl Amb24480577 [0,2,0,0,0,0|1,0,1]=4 9175 B9R0.47 CC(=O)C(=O)OCCSC Amb24690798 [0,2,0,0,0,0|1,0,1]=4 9176 B9R0.47 CC(=O)C(=O)OCOCC Amb24676830 [0,2,0,0,0,0|1,0,1]=4 9177 B9R0.47 CC(=O)C(=O)SCCCS Amb24509333 [0,2,0,0,0,0|1,0,1]=4 9178 B9R0.47 CC(=O)C(=O)\C=C\CCC Amb25255453 [0,2,0,0,0,0|0,0,2]=4 9179 B9R0.47 CC(=O)C(Cl)=NCCCC Amb24512403 [0,2,0,0,0,0|0,0,1]=3 9180 B9R0.47 CC(=O)C(Cl)CNCCCl Amb25295461 [0,2,0,0,0,0|1,0,0]=3 9181 B9R0.47 CC(=O)C(N)CCCCN Amb18644167 [0,2,0,0,0,0|0,0,0]=2 9182 B9R0.47 CC(=O)C(O)CCCC=C Amb24577858 [0,2,0,0,0,0|0,0,1]=3 9183 B9R0.47 CC(=O)N(C)CCCC=C Amb24627578 [0,2,0,0,0,0|0,0,2]=4 9184 B9R0.47 CC(=O)N(C)CCCCCl Amb24571275 [0,2,0,0,0,0|1,0,0]=3 9185 B9R0.47 CC(=O)N(C)CCCCN Amb22490951 [0,2,0,0,0,0|1,0,0]=3 9186 B9R0.47 CC(=O)N(C)CCCCO Amb24618666 [0,2,0,0,0,0|1,0,0]=3 9187 B9R0.47 CC(=O)N(C)COCCBr Amb25843188 [0,2,0,0,0,0|2,0,0]=4 9188 B9R0.47 CC(=O)N(O)CCCCN Amb24445386 [0,2,0,0,0,0|1,0,0]=3 9189 B9R0.47 CC(=O)[C@@H](N)CCCCN Amb25251380 [0,2,0,0,0,0|0,0,0]=2 9190 B9R0.47 CC(=O)\C(\Cl)=C/CCCC Amb24598892 [0,2,0,0,0,0|0,0,1]=3 9191 B9R0.47 CC(=O)\C(\O)=C/NCCC Amb24670646 [0,2,0,0,0,0|0,0,2]=4 9192 B9R0.47 CC(Br)C(=O)NCCCF Amb25092310 [0,2,0,0,0,0|2,0,0]=4 9193 B9R0.47 CC(Br)C(=O)NCCCN Amb24420346 [0,2,0,0,0,0|2,0,0]=4 9194 B9R0.47 CC(Br)C(O)CCCCC Amb24567150 [0,2,0,0,0,0|0,0,2]=4 9195 B9R0.47 CC(C(=O)NCCCO)Br Amb17333283 [0,2,0,0,0,0|2,0,0]=4 9196 B9R0.47 CC(C(=O)NCCCO)Cl Amb17600137 [0,2,0,0,0,0|2,0,0]=4 9197 B9R0.47 CC(C(=O)O)SCCCN Amb17500677 [0,2,0,0,0,0|2,0,0]=4 9198 B9R0.47 CC(C)=C(C)CCCCC Amb22228299 [0,2,0,0,0,0|1,0,0]=3 9199 B9R0.47 CC(C)=C(C)CCCCN Amb25781308 [0,2,0,0,0,0|1,0,1]=4 9200 B9R0.47 CC(C)C(=O)CCCC=C Amb25108070 [0,2,0,0,0,0|0,0,2]=4 9201 B9R0.47 CC(C)C(=O)CCCC=O Amb18643953 [0,2,0,0,0,0|1,0,1]=4 9202 B9R0.47 CC(C)C(=O)CCCCBr Amb24477365 [0,2,0,0,0,0|1,0,0]=3 9203 B9R0.47 CC(C)C(=O)CCCCCl Amb25064335 [0,2,0,0,0,0|1,0,0]=3 9204 B9R0.47 CC(C)C(=O)CSCCN Amb24525413 [0,2,0,0,0,0|2,0,0]=4 9205 B9R0.47 CC(C)C(=O)NCCCI Amb25356829 [0,2,0,0,0,0|2,0,0]=4 9206 B9R0.47 CC(C)C(=O)OCCCBr Amb24651630 [0,2,0,0,0,0|2,0,0]=4 9207 B9R0.47 CC(C)C(=O)OCCCCl Amb24546392 [0,2,0,0,0,0|2,0,0]=4 9208 B9R0.47 CC(C)C(=O)OCCCF Amb25306078 [0,2,0,0,0,0|2,0,0]=4 9209 B9R0.47 CC(C)C(=O)OCCCO Amb24396987 [0,2,0,0,0,0|2,0,0]=4 9210 B9R0.47 CC(C)C(C)CCCCN Amb24389393 [0,2,0,0,0,0|1,0,1]=4 9211 B9R0.47 CC(C)C(C)CCCCO Amb24513833 [0,2,0,0,0,0|1,0,1]=4 9212 B9R0.47 CC(C)C(C)CCCNC Amb24374135 [0,2,0,0,0,0|1,0,1]=4 9213 B9R0.47 CC(C)C(C)CNCCC Amb24477937 [0,2,0,0,0,0|1,0,1]=4 9214 B9R0.47 CC(C)C(C)SCCCC Amb24588156 [0,2,0,0,0,0|1,0,1]=4 9215 B9R0.47 CC(C)C(Cl)CCCCC Amb25842560 [0,2,0,0,0,0|1,0,1]=4 9216 B9R0.47 CC(C)C(Cl)CCCOC Amb18800868 [0,2,0,0,0,0|1,0,1]=4 9217 B9R0.47 CC(C)C(Cl)CCCSC Amb25121851 [0,2,0,0,0,0|1,0,1]=4 9218 B9R0.47 CC(C)C(Cl)CCOCC Amb25293523 [0,2,0,0,0,0|1,0,1]=4 9219 B9R0.47 CC(C)C(N)CCNCC Amb25094874 [0,2,0,0,0,0|1,0,1]=4 9220 B9R0.47 CC(C)C(N)CCSCC Amb24644010 [0,2,0,0,0,0|1,0,1]=4 9221 B9R0.47 CC(C)C(N)COCCC Amb21953834 [0,2,0,0,0,0|1,0,1]=4 9222 B9R0.47 CC(C)C(N)COCCC Amb22009215 [0,2,0,0,0,0|1,0,1]=4 9223 B9R0.47 CC(C)C(O)CCCCCl Amb25788308 [0,2,0,0,0,0|1,0,1]=4 9224 B9R0.47 CC(C)C(O)CCCCO Amb24529316 [0,2,0,0,0,0|1,0,1]=4 9225 B9R0.47 CC(C)C(O)CCCNC Amb24514464 [0,2,0,0,0,0|1,0,1]=4 9226 B9R0.47 CC(C)C(O)COCCC Amb25331736 [0,2,0,0,0,0|1,0,1]=4 9227 B9R0.47 CC(C)[C@@H](N)CSCCC Amb24743487 [0,2,0,0,0,0|1,0,1]=4 9228 B9R0.47 CC(C)[C@H](C)NCCCC Amb24680021 [0,2,0,0,0,0|1,0,1]=4 9229 B9R0.47 CC(C)[C@H](N)CNCCC Amb24753655 [0,2,0,0,0,0|1,0,1]=4 9230 B9R0.47 CC(C)[C@H](O)CCCCC Amb25129291 [0,2,0,0,0,0|0,0,2]=4 9231 B9R0.47 CC(CCCC#C)C(O)=O Amb25824201 [0,2,0,0,0,0|1,0,1]=4 9232 B9R0.47 CC(CCCC=C)C(O)=O Amb18643893 [0,2,0,0,0,0|1,0,1]=4 9233 B9R0.47 CC(CCCC=O)C(=O)Cl Amb24448943 [0,2,0,0,0,0|1,0,1]=4 9234 B9R0.47 CC(CCCC=O)C(C)=O Amb24478226 [0,2,0,0,0,0|0,0,1]=3 9235 B9R0.47 CC(CCCCF)C(O)=O Amb24370978 [0,2,0,0,0,0|1,0,0]=3 9236 B9R0.47 CC(CCCCN)C(O)=O Amb18644200 [0,2,0,0,0,0|1,0,0]=3 9237 B9R0.47 CC(CCCCN)N(C)C Amb18202387 [0,2,0,0,0,0|2,0,0]=4 9238 B9R0.47 CC(CCCOC)C(C)Br Amb24660575 [0,2,0,0,0,0|1,0,1]=4 9239 B9R0.47 CC(CCCOC)C(C)Cl Amb18800869 [0,2,0,0,0,0|1,0,1]=4 9240 B9R0.47 CC(CCCOC)C(C)O Amb24478010 [0,2,0,0,0,0|0,0,2]=4 9241 B9R0.47 CC(CCCSC)C(C)Cl Amb24652053 [0,2,0,0,0,0|1,0,1]=4 9242 B9R0.47 CC(CCCSC)C(C)O Amb24361756 [0,2,0,0,0,0|0,0,2]=4 9243 B9R0.47 CC(CNCCF)C(N)=O Amb24365709 [0,2,0,0,0,0|2,0,0]=4 9244 B9R0.47 CC(CNCCF)C(O)=O Amb25061129 [0,2,0,0,0,0|2,0,0]=4 9245 B9R0.47 CC(CNCCF)S(C)=O Amb24708978 [0,2,0,0,0,0|2,0,0]=4 9246 B9R0.47 CC(CSCCF)C(O)=O Amb25696347 [0,2,0,0,0,0|2,0,0]=4 9247 B9R0.47 CC(CSCCN)C(O)=O Amb18788221 [0,2,0,0,0,0|2,0,0]=4 9248 B9R0.47 CC(C\C=C/CO)C(C)=O Amb25712974 [0,2,0,0,0,0|0,0,2]=4 9249 B9R0.47 CC(C\C=C\CO)C(C)=O Amb25264776 [0,2,0,0,0,0|0,0,2]=4 9250 B9R0.47 CC(Cl)C(=O)NCCCN Amb19011212 [0,2,0,0,0,0|2,0,0]=4 9251 B9R0.47 CC(Cl)C(O)CCCCC Amb24692698 [0,2,0,0,0,0|0,0,2]=4 9252 B9R0.47 CC(N)C(=O)CCCC#C Amb25041556 [0,2,0,0,0,0|0,0,2]=4 9253 B9R0.47 CC(N)C(=O)NCCCN Amb18305816 [0,2,0,0,0,0|2,0,0]=4 9254 B9R0.47 CC(N)C(=O)NCCCO Amb21958817 [0,2,0,0,0,0|2,0,0]=4 9255 B9R0.47 CC(N)C(=O)NCCCS Amb24741609 [0,2,0,0,0,0|2,0,0]=4 9256 B9R0.47 CC(N)C(=O)OCCCO Amb24642552 [0,2,0,0,0,0|2,0,0]=4 9257 B9R0.47 CC(N)C(N)CCCCC Amb25147529 [0,2,0,0,0,0|1,0,1]=4 9258 B9R0.47 CC(N)C(O)CCCCC Amb18124761 [0,2,0,0,0,0|0,0,2]=4 9259 B9R0.47 CC(N)C(O)CCCSC Amb24386332 [0,2,0,0,0,0|1,0,1]=4 9260 B9R0.47 CC(NCCCF)C(O)=O Amb24407596 [0,2,0,0,0,0|2,0,0]=4 9261 B9R0.47 CC(NCCCN)C(N)=O Amb24761337 [0,2,0,0,0,0|2,0,0]=4 9262 B9R0.47 CC(O)C(=O)NCCCN Amb24477180 [0,2,0,0,0,0|2,0,0]=4 9263 B9R0.47 CC(O)C(=O)OCCCF Amb25716095 [0,2,0,0,0,0|2,0,0]=4 9264 B9R0.47 CC(O)C(C)CCCCO Amb25854852 [0,2,0,0,0,0|0,0,2]=4 9265 B9R0.47 CC(O)C(N)CCCCC Amb18644212 [0,2,0,0,0,0|0,0,2]=4 9266 B9R0.47 CC(O)C(O)CCCCF Amb24747720 [0,2,0,0,0,0|0,0,2]=4 9267 B9R0.47 CC(OCCCF)C(O)=O Amb24602795 [0,2,0,0,0,0|2,0,0]=4 9268 B9R0.47 CC(OCCCN)C(C)=O Amb18111504 [0,2,0,0,0,0|1,0,0]=3 9269 B9R0.47 CC(OCCCN)C(N)=O Amb25191408 [0,2,0,0,0,0|2,0,0]=4 9270 B9R0.47 CC(OCCCN)C(O)=O Amb18111477 [0,2,0,0,0,0|2,0,0]=4 9271 B9R0.47 CC(OCCCO)C(O)=O Amb25132795 [0,2,0,0,0,0|2,0,0]=4 9272 B9R0.47 CC(S)C(=O)NCCCO Amb25028017 [0,2,0,0,0,0|2,0,0]=4 9273 B9R0.47 CC(S)C(=O)NCCCS Amb24535350 [0,2,0,0,0,0|2,0,0]=4 9274 B9R0.47 CC(S)C(=O)OCCCO Amb24352402 [0,2,0,0,0,0|2,0,0]=4 9275 B9R0.47 CC(SCCC#N)C(C)=O Amb18927758 [0,2,0,0,0,0|1,0,1]=4 9276 B9R0.47 CC(SCCC=C)C(C)=O Amb24482848 [0,2,0,0,0,0|0,0,2]=4 9277 B9R0.47 CC(SCCCF)C(N)=O Amb24482849 [0,2,0,0,0,0|2,0,0]=4 9278 B9R0.47 CC(SCCCN)C(N)=O Amb25794386 [0,2,0,0,0,0|2,0,0]=4 9279 B9R0.47 CC(SCCCO)C(C)=O Amb24724359 [0,2,0,0,0,0|1,0,0]=3 9280 B9R0.47 CC(SCCCS)C(O)=O Amb18648366 [0,2,0,0,0,0|2,0,0]=4 9281 B9R0.47 CC(\C=C/CCF)C(C)=O Amb25707485 [0,2,0,0,0,0|0,0,2]=4 9282 B9R0.47 CC(\C=C\CCF)C(C)=O Amb24694366 [0,2,0,0,0,0|0,0,2]=4 9283 B9R0.47 CCC#CCC(C)C(O)=O Amb24392620 [0,2,0,0,0,0|1,0,1]=4 9284 B9R0.47 CCC#CC[C@H](C)C(O)=O Amb25843119 [0,2,0,0,0,0|1,0,1]=4 9285 B9R0.47 CCCC#CC(O)C(O)=O Amb24480403 [0,2,0,0,0,0|1,0,1]=4 9286 B9R0.47 CCCCCC(=C)C(C)O Amb25828956 [0,2,0,0,0,0|1,0,0]=3 9287 B9R0.47 CCCCCC(=C)C(N)=O Amb25774332 [0,2,0,0,0,0|0,0,1]=3 9288 B9R0.47 CCCCCC(=C)C(O)=O Amb18643927 [0,2,0,0,0,0|0,0,1]=3 9289 B9R0.47 CCCCCC(=C)[C@@H](C)O Amb24625124 [0,2,0,0,0,0|1,0,0]=3 9290 B9R0.47 CCCCCC(=O)C(=C)F Amb24736420 [0,2,0,0,0,0|0,0,1]=3 9291 B9R0.47 CCCCCC(=O)C(=O)C Amb15693393 [0,2,0,0,0,0|0,0,0]=2 9292 B9R0.47 CCCCCC(=O)C(=O)Cl Amb24647840 [0,2,0,0,0,0|0,0,1]=3 9293 B9R0.47 CCCCCC(=O)C(C)Br Amb25277019 [0,2,0,0,0,0|0,0,0]=2 9294 B9R0.47 CCCCCC(=O)C(C)N Amb24651748 [0,2,0,0,0,0|0,0,0]=2 9295 B9R0.47 CCCCCC(=O)C(C)O Amb25146485 [0,2,0,0,0,0|0,0,0]=2 9296 B9R0.47 CCCCCC(=O)C(O)=O Amb18644122 [0,2,0,0,0,0|0,0,1]=3 9297 B9R0.47 CCCCCC(=O)[C@@H](C)O Amb25729179 [0,2,0,0,0,0|0,0,0]=2 9298 B9R0.47 CCCCCC(Br)C(C)=C Amb25338082 [0,2,0,0,0,0|1,0,0]=3 9299 B9R0.47 CCCCCC(Br)C(N)=O Amb25857400 [0,2,0,0,0,0|1,0,0]=3 9300 B9R0.47 CCCCCC(Br)C(O)=O Amb18130346 [0,2,0,0,0,0|1,0,0]=3 9301 B9R0.47 CCCCCC(C(=O)O)F Amb17593693 [0,2,0,0,0,0|1,0,0]=3 9302 B9R0.47 CCCCCC(C(C)C)C Amb10069375 [0,2,0,0,0,0|1,0,1]=4 9303 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [0,2,0,0,0,0|0,0,1]=3 9304 B9R0.47 CCCCCC(C)C(C)O Amb24478011 [0,2,0,0,0,0|0,0,2]=4 9305 B9R0.47 CCCCCC(C)C(N)=N Amb24477154 [0,2,0,0,0,0|1,0,1]=4 9306 B9R0.47 CCCCCC(C)C(N)=O Amb24568260 [0,2,0,0,0,0|0,0,1]=3 9307 B9R0.47 CCCCCC(C)P(O)=O Amb25287382 [0,2,0,0,0,0|0,0,1]=3 9308 B9R0.47 CCCCCC(C)[N+]([O-])=O Amb25059956 [0,2,0,0,0,0|0,0,1]=3 9309 B9R0.47 CCCCCC(Cl)C(C)=C Amb24509526 [0,2,0,0,0,0|1,0,0]=3 9310 B9R0.47 CCCCCC(Cl)C(Cl)Cl Amb24444835 [0,2,0,0,0,0|1,0,1]=4 9311 B9R0.47 CCCCCC(Cl)C(N)=O Amb18800736 [0,2,0,0,0,0|1,0,0]=3 9312 B9R0.47 CCCCCC(Cl)C(O)=O Amb18646187 [0,2,0,0,0,0|1,0,0]=3 9313 B9R0.47 CCCCCC(F)C(C)=O Amb25763258 [0,2,0,0,0,0|0,0,0]=2 9314 B9R0.47 CCCCCC(F)C(N)=O Amb25147451 [0,2,0,0,0,0|1,0,0]=3 9315 B9R0.47 CCCCCC(N)C(C)=C Amb24431216 [0,2,0,0,0,0|1,0,0]=3 9316 B9R0.47 CCCCCC(N)C(C)=O Amb24446263 [0,2,0,0,0,0|0,0,0]=2 9317 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [0,2,0,0,0,0|1,0,0]=3 9318 B9R0.47 CCCCCC(O)C(C)=C Amb24350676 [0,2,0,0,0,0|1,0,0]=3 9319 B9R0.47 CCCCCC(O)C(F)F Amb25185272 [0,2,0,0,0,0|0,0,2]=4 9320 B9R0.47 CCCCCC(O)C(N)=O Amb24478096 [0,2,0,0,0,0|1,0,0]=3 9321 B9R0.47 CCCCCC(O)C(O)=O Amb17778103 [0,2,0,0,0,0|1,0,0]=3 9322 B9R0.47 CCCCCC(O)N(C)C Amb25760341 [0,2,0,0,0,0|0,0,2]=4 9323 B9R0.47 CCCCCN(C)C(=O)Cl Amb25032287 [0,2,0,0,0,0|1,0,0]=3 9324 B9R0.47 CCCCCN(C)C(C)=N Amb25848010 [0,2,0,0,0,0|1,0,0]=3 9325 B9R0.47 CCCCCN(C)C(C)=O Amb24621351 [0,2,0,0,0,0|0,0,0]=2 9326 B9R0.47 CCCCCN(N)C(N)=N Amb24542721 [0,2,0,0,0,0|2,0,0]=4 9327 B9R0.47 CCCCC[C@@H](C(=O)O)C Amb10844510 [0,2,0,0,0,0|0,0,1]=3 9328 B9R0.47 CCCCC[C@@H](N)C(O)=O Amb22745982 [0,2,0,0,0,0|1,0,0]=3 9329 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [0,2,0,0,0,0|0,0,0]=2 9330 B9R0.47 CCCCC[C@H](Br)C(C)=O Amb25187962 [0,2,0,0,0,0|0,0,0]=2 9331 B9R0.47 CCCCC[C@H](C(=O)O)C Amb10844515 [0,2,0,0,0,0|0,0,1]=3 9332 B9R0.47 CCCCC[C@H](C)C(C)=O Amb25134138 [0,2,0,0,0,0|0,0,0]=2 9333 B9R0.47 CCCCC[C@H](N)C(N)=O Amb24502148 [0,2,0,0,0,0|1,0,0]=3 9334 B9R0.47 CCCCC[C@H](N)C(O)=O Amb17943098 [0,2,0,0,0,0|1,0,0]=3 9335 B9R0.47 CCCCC[C@H](O)C(O)=O Amb25728353 [0,2,0,0,0,0|1,0,0]=3 9336 B9R0.47 CCCCN=C(F)C(F)Cl Amb24512068 [0,2,0,0,0,0|2,0,0]=4 9337 B9R0.47 CCCCN=C(N)N(C)C Amb24504723 [0,2,0,0,0,0|2,0,0]=4 9338 B9R0.47 CCCCNC(=N)C(C)C Amb24458943 [0,2,0,0,0,0|2,0,0]=4 9339 B9R0.47 CCCCNC(=N)C(C)Cl Amb24096497 [0,2,0,0,0,0|2,0,0]=4 9340 B9R0.47 CCCCNC(=N)C(O)=O Amb24746786 [0,2,0,0,0,0|1,0,1]=4 9341 B9R0.47 CCCCNC(=O)C(=O)C Amb17399878 [0,2,0,0,0,0|0,0,1]=3 9342 B9R0.47 CCCCNC(=O)C(Br)C Amb17333014 [0,2,0,0,0,0|1,0,0]=3 9343 B9R0.47 CCCCNC(=O)C(C)N Amb21958689 [0,2,0,0,0,0|1,0,0]=3 9344 B9R0.47 CCCCNC(=O)C(C)S Amb25806494 [0,2,0,0,0,0|1,0,0]=3 9345 B9R0.47 CCCCNC(=O)N(C)O Amb25366865 [0,2,0,0,0,0|1,0,0]=3 9346 B9R0.47 CCCCNC(=O)[C@@H](C)N Amb18014636 [0,2,0,0,0,0|1,0,0]=3 9347 B9R0.47 CCCCNC(=O)[C@@H](C)O Amb25740293 [0,2,0,0,0,0|1,0,0]=3 9348 B9R0.47 CCCCNC(=O)[C@H](C)Cl Amb24482335 [0,2,0,0,0,0|1,0,0]=3 9349 B9R0.47 CCCCNC(=S)C(C)C Amb25312007 [0,2,0,0,0,0|1,1,0]=4 9350 B9R0.47 CCCCNC(=S)N(N)C Amb1150085 [0,2,0,0,0,0|1,1,0]=4 9351 B9R0.47 CCCCNC(=S)N(O)C Amb10574311 [0,2,0,0,0,0|1,1,0]=4 9352 B9R0.47 CCCCNC(C)C(C)=O Amb25294138 [0,2,0,0,0,0|0,0,0]=2 9353 B9R0.47 CCCCNC(C)C(C)S Amb18126308 [0,2,0,0,0,0|0,1,1]=4 9354 B9R0.47 CCCCOC(=N)C(N)=O Amb24470659 [0,2,0,0,0,0|1,0,1]=4 9355 B9R0.47 CCCCOC(=O)C(=O)C Amb15692541 [0,2,0,0,0,0|0,0,1]=3 9356 B9R0.47 CCCCOC(=O)C(=O)Cl Amb25316230 [0,2,0,0,0,0|1,0,1]=4 9357 B9R0.47 CCCCOC(=O)C(C)=C Amb22338478 [0,2,0,0,0,0|1,0,0]=3 9358 B9R0.47 CCCCOC(=O)C(C)=C Amb22363339 [0,2,0,0,0,0|1,0,0]=3 9359 B9R0.47 CCCCOC(=O)C(C)S Amb25098485 [0,2,0,0,0,0|1,0,0]=3 9360 B9R0.47 CCCCOC(=O)C(Cl)Cl Amb17940051 [0,2,0,0,0,0|1,0,0]=3 9361 B9R0.47 CCCCOC(=O)C(Cl)F Amb10840262 [0,2,0,0,0,0|1,0,0]=3 9362 B9R0.47 CCCCOC(=O)C(F)F Amb10838765 [0,2,0,0,0,0|1,0,0]=3 9363 B9R0.47 CCCCOC(=O)C(N)=N Amb25238449 [0,2,0,0,0,0|1,0,1]=4 9364 B9R0.47 CCCCOC(=O)C(N)=O Amb22734019 [0,2,0,0,0,0|1,0,1]=4 9365 B9R0.47 CCCCOC(=O)N(C)C Amb10552893 [0,2,0,0,0,0|1,0,0]=3 9366 B9R0.47 CCCCOC(=O)[C@@H](C)Cl Amb25101546 [0,2,0,0,0,0|1,0,0]=3 9367 B9R0.47 CCCCOC(=O)[C@@H](C)N Amb22744849 [0,2,0,0,0,0|1,0,0]=3 9368 B9R0.47 CCCCOC(=O)[C@@H](C)O Amb22800542 [0,2,0,0,0,0|1,0,0]=3 9369 B9R0.47 CCCCOC(=S)C(F)Cl Amb25765762 [0,2,0,0,0,0|1,1,0]=4 9370 B9R0.47 CCCCOC(C)C(C)Br Amb25105290 [0,2,0,0,0,0|1,0,1]=4 9371 B9R0.47 CCCCOC(C)C(N)=S Amb18798045 [0,2,0,0,0,0|1,1,0]=4 9372 B9R0.47 CCCCOC(C)[C@H](C)N Amb25066338 [0,2,0,0,0,0|1,0,1]=4 9373 B9R0.47 CCCCOC(C)[C@H](C)O Amb24373040 [0,2,0,0,0,0|0,0,2]=4 9374 B9R0.47 CCCCOC(Cl)C(=O)Cl Amb24626835 [0,2,0,0,0,0|1,0,0]=3 9375 B9R0.47 CCCCOP(=O)C(C)O Amb25357308 [0,2,0,0,0,0|2,0,0]=4 9376 B9R0.47 CCCCO[C@H](C)C(O)=O Amb24480807 [0,2,0,0,0,0|1,0,0]=3 9377 B9R0.47 CCCCO[C@H](C)[C@@H](C)O Amb24749770 [0,2,0,0,0,0|0,0,2]=4 9378 B9R0.47 CCCCSC(=O)C(F)Cl Amb24334717 [0,2,0,0,0,0|1,0,0]=3 9379 B9R0.47 CCCCSC(C)C(C)N Amb24439757 [0,2,0,0,0,0|1,0,1]=4 9380 B9R0.47 CCCCSC(C)C(C)O Amb24467934 [0,2,0,0,0,0|0,0,2]=4 9381 B9R0.47 CCCCSC(C)C(N)=N Amb18797920 [0,2,0,0,0,0|2,0,0]=4 9382 B9R0.47 CCCCSC(C)C(N)=O Amb18183483 [0,2,0,0,0,0|1,0,0]=3 9383 B9R0.47 CCCCS[C@@H](C)[C@H](C)O Amb25070650 [0,2,0,0,0,0|0,0,2]=4 9384 B9R0.47 CCCCS[C@H](C)C(O)=O Amb24725214 [0,2,0,0,0,0|1,0,0]=3 9385 B9R0.47 CCCC\C=C(/C)\C(C)=O Amb24378444 [0,2,0,0,0,0|0,0,1]=3 9386 B9R0.47 CCCC\C=C(/C)\[N+]([O-])=O Amb25824021 [0,2,0,0,0,0|0,0,1]=3 9387 B9R0.47 CCCC\C=C(/N)\C(N)=O Amb24640945 [0,2,0,0,0,0|1,0,1]=4 9388 B9R0.47 CCCC\C=C(\C)/B(O)O Amb24558321 [0,2,0,0,0,0|0,0,2]=4 9389 B9R0.47 CCCC\C=C(\C)/C(C)O Amb25769451 [0,2,0,0,0,0|0,0,2]=4 9390 B9R0.47 CCCC\C=C(\C)/[N+]([O-])=O Amb25247778 [0,2,0,0,0,0|0,0,1]=3 9391 B9R0.47 CCCC\C=C(\Cl)/C(O)=O Amb25299436 [0,2,0,0,0,0|1,0,1]=4 9392 B9R0.47 CCCC\N=C(/C)\C(C)=O Amb25073215 [0,2,0,0,0,0|0,0,1]=3 9393 B9R0.47 CCCNCC(=C)C(O)=O Amb24479657 [0,2,0,0,0,0|1,0,1]=4 9394 B9R0.47 CCCNCC(=O)C(C)C Amb24401195 [0,2,0,0,0,0|1,0,0]=3 9395 B9R0.47 CCCNCC(C)C(C)N Amb24679869 [0,2,0,0,0,0|1,0,1]=4 9396 B9R0.47 CCCNCC(C)S(C)=O Amb25170525 [0,2,0,0,0,0|1,0,0]=3 9397 B9R0.47 CCCNCC(O)C(=C)Cl Amb24482400 [0,2,0,0,0,0|1,0,1]=4 9398 B9R0.47 CCCNCC(O)C(O)=O Amb24734975 [0,2,0,0,0,0|1,0,0]=3 9399 B9R0.47 CCCN\C=C(/C)\C(C)=O Amb25146791 [0,2,0,0,0,0|0,0,2]=4 9400 B9R0.47 CCCN\C=C(\C)/C(C)=O Amb25244710 [0,2,0,0,0,0|0,0,2]=4 9401 B9R0.47 CCCOCC(=C)C(N)=O Amb25836866 [0,2,0,0,0,0|1,0,1]=4 9402 B9R0.47 CCCOCC(=O)C(C)C Amb24478082 [0,2,0,0,0,0|1,0,0]=3 9403 B9R0.47 CCCOCC(=O)C(C)O Amb25762309 [0,2,0,0,0,0|1,0,0]=3 9404 B9R0.47 CCCOCC(C)C(C)=O Amb24725662 [0,2,0,0,0,0|0,0,0]=2 9405 B9R0.47 CCCOCC(C)C(C)N Amb24553879 [0,2,0,0,0,0|1,0,1]=4 9406 B9R0.47 CCCOCC(C)C(C)O Amb25273307 [0,2,0,0,0,0|0,0,2]=4 9407 B9R0.47 CCCOCC(Cl)C(C)=C Amb24482380 [0,2,0,0,0,0|1,0,0]=3 9408 B9R0.47 CCCOCC(Cl)C(O)=O Amb25713951 [0,2,0,0,0,0|1,0,0]=3 9409 B9R0.47 CCCOCC(N)C(C)=C Amb24375016 [0,2,0,0,0,0|1,0,0]=3 9410 B9R0.47 CCCOCC(N)C(O)=O Amb24621740 [0,2,0,0,0,0|1,0,0]=3 9411 B9R0.47 CCCOCC(O)C(C)=C Amb25136372 [0,2,0,0,0,0|1,0,0]=3 9412 B9R0.47 CCCOCC(O)C(O)=O Amb25098725 [0,2,0,0,0,0|1,0,0]=3 9413 B9R0.47 CCCONC(=O)C(C)C Amb25031186 [0,2,0,0,0,0|2,0,0]=4 9414 B9R0.47 CCCONC(=O)C(C)Cl Amb25813405 [0,2,0,0,0,0|2,0,0]=4 9415 B9R0.47 CCCONC(=O)C(F)F Amb25139660 [0,2,0,0,0,0|2,0,0]=4 9416 B9R0.47 CCCONC(=O)[C@@H](C)N Amb25031192 [0,2,0,0,0,0|2,0,0]=4 9417 B9R0.47 CCCONC(=O)[C@H](C)N Amb25701893 [0,2,0,0,0,0|2,0,0]=4 9418 B9R0.47 CCCONC(C)C(N)=O Amb25803680 [0,2,0,0,0,0|2,0,0]=4 9419 B9R0.47 CCCONC(C)C(O)=O Amb25664130 [0,2,0,0,0,0|2,0,0]=4 9420 B9R0.47 CCCSCC(N)C(N)=O Amb18788146 [0,2,0,0,0,0|1,0,0]=3 9421 B9R0.47 CCCSCC(O)C(=C)Cl Amb25333395 [0,2,0,0,0,0|1,0,1]=4 9422 B9R0.47 CCCSC[C@@H](N)C(O)=O Amb18792511 [0,2,0,0,0,0|1,0,0]=3 9423 B9R0.47 CCCSC[C@H](O)C(O)=O Amb24482234 [0,2,0,0,0,0|1,0,0]=3 9424 B9R0.47 CCC\C=C\C(=O)C(C)C Amb24512557 [0,2,0,0,0,0|0,0,2]=4 9425 B9R0.47 CCC\C=C\C(=O)C(C)O Amb24502165 [0,2,0,0,0,0|0,0,2]=4 9426 B9R0.47 CCC\C=C\C(=O)C(Cl)Cl Amb25321918 [0,2,0,0,0,0|0,0,2]=4 9427 B9R0.47 CCC\C=C\C(C)C(O)=O Amb25687429 [0,2,0,0,0,0|1,0,1]=4 9428 B9R0.47 CCC\C=C\C(N)C(O)=O Amb24656860 [0,2,0,0,0,0|1,0,1]=4 9429 B9R0.47 CCC\C=C\C(O)C(O)=O Amb25113481 [0,2,0,0,0,0|1,0,1]=4 9430 B9R0.47 CCC\C=C\[C@@H](O)C(C)=O Amb24633335 [0,2,0,0,0,0|0,0,1]=3 9431 B9R0.47 CCC\C=C\[C@H](N)C(O)=O Amb24547580 [0,2,0,0,0,0|1,0,1]=4 9432 B9R0.47 CCC\C=N\[C@@H](C)C(O)=O Amb24401135 [0,2,0,0,0,0|1,0,1]=4 9433 B9R0.47 CCC\N=C\C(=O)C(C)C Amb24584514 [0,2,0,0,0,0|1,0,1]=4 9434 B9R0.47 CCNCCC(=O)N(C)C Amb18304232 [0,2,0,0,0,0|1,0,0]=3 9435 B9R0.47 CCNCCC(C)N(C)C Amb25059997 [0,2,0,0,0,0|2,0,0]=4 9436 B9R0.47 CCNCCN(C)C(C)=O Amb24073117 [0,2,0,0,0,0|1,0,0]=3 9437 B9R0.47 CCOCCC(=O)C(=O)Cl Amb24649864 [0,2,0,0,0,0|1,0,1]=4 9438 B9R0.47 CCOCCC(C)C(C)Cl Amb18800870 [0,2,0,0,0,0|1,0,1]=4 9439 B9R0.47 CCOCCC(C)C(C)O Amb25057048 [0,2,0,0,0,0|0,0,2]=4 9440 B9R0.47 CCOCCC(Cl)C(C)=O Amb24407317 [0,2,0,0,0,0|0,0,0]=2 9441 B9R0.47 CCOCCC(N)C(C)=C Amb25836049 [0,2,0,0,0,0|1,0,0]=3 9442 B9R0.47 CCOCCC(N)C(N)=O Amb25354003 [0,2,0,0,0,0|1,0,0]=3 9443 B9R0.47 CCOCCC(O)C(C)=C Amb25720026 [0,2,0,0,0,0|1,0,0]=3 9444 B9R0.47 CCOCCN(C)C(C)=N Amb25690020 [0,2,0,0,0,0|2,0,0]=4 9445 B9R0.47 CCOCC[C@H](C)C(O)=O Amb25791629 [0,2,0,0,0,0|1,0,0]=3 9446 B9R0.47 CCOCNC(=O)C(C)C Amb10562771 [0,2,0,0,0,0|2,0,0]=4 9447 B9R0.47 CCOCSC(C)C(C)=O Amb25286257 [0,2,0,0,0,0|1,0,0]=3 9448 B9R0.47 CCOCSC(C)C(O)=O Amb24456124 [0,2,0,0,0,0|2,0,0]=4 9449 B9R0.47 CCONCC(N)C(O)=O Amb25350611 [0,2,0,0,0,0|2,0,0]=4 9450 B9R0.47 CCSCCC(=O)N(C)C Amb24475690 [0,2,0,0,0,0|1,0,0]=3 9451 B9R0.47 CCSCCC(C(=O)O)C Amb10844082 [0,2,0,0,0,0|1,0,0]=3 9452 B9R0.47 CCSCCC(C(=O)O)N Amb2137050 [0,2,0,0,0,0|1,0,0]=3 9453 B9R0.47 CCSCCC(C)C(C)Br Amb24525347 [0,2,0,0,0,0|1,0,1]=4 9454 B9R0.47 CCSCCC(N)C(N)=O Amb18177774 [0,2,0,0,0,0|1,0,0]=3 9455 B9R0.47 CCSCCC(N)C(O)=O Amb22904200 [0,2,0,0,0,0|1,0,0]=3 9456 B9R0.47 CCSCCC(O)C(O)=O Amb24482157 [0,2,0,0,0,0|1,0,0]=3 9457 B9R0.47 CCSCC[C@@H](C(=O)O)N Amb17613844 [0,2,0,0,0,0|1,0,0]=3 9458 B9R0.47 CCSCC[C@H](C(=O)O)N Amb17613843 [0,2,0,0,0,0|1,0,0]=3 9459 B9R0.47 CCSC\C=C(/C)\C(C)=O Amb25689133 [0,2,0,0,0,0|0,0,2]=4 9460 B9R0.47 CC[Se]CCC(C(=O)O)N Amb17620056 [0,2,0,0,0,0|1,0,0]=3 9461 B9R0.47 CC\C=C\CC(N)C(O)=O Amb25255710 [0,2,0,0,0,0|1,0,1]=4 9462 B9R0.47 CC\C=C\CC(O)C(O)=O Amb24480470 [0,2,0,0,0,0|1,0,1]=4 9463 B9R0.47 CC\C=C\C[C@H](N)C(O)=O Amb24617272 [0,2,0,0,0,0|1,0,1]=4 9464 B9R0.47 CN(C)C(=O)CCCC#N Amb25762474 [0,2,0,0,0,0|1,0,1]=4 9465 B9R0.47 CN(C)C(=O)CCCCN Amb25146454 [0,2,0,0,0,0|1,0,0]=3 9466 B9R0.47 CN(C)C(=O)CCCON Amb25783696 [0,2,0,0,0,0|2,0,0]=4 9467 B9R0.47 CN(C)C(=O)COCCCl Amb24479223 [0,2,0,0,0,0|2,0,0]=4 9468 B9R0.47 CN(C)C(=O)COCCN Amb18308413 [0,2,0,0,0,0|2,0,0]=4 9469 B9R0.47 CN(C)C(=O)COCCO Amb24577058 [0,2,0,0,0,0|2,0,0]=4 9470 B9R0.47 CN(C)C(=O)CSCCBr Amb25359510 [0,2,0,0,0,0|2,0,0]=4 9471 B9R0.47 CN(C)C(=O)CSCCCl Amb25684083 [0,2,0,0,0,0|2,0,0]=4 9472 B9R0.47 CN(C)C(=O)NCCCF Amb24334944 [0,2,0,0,0,0|2,0,0]=4 9473 B9R0.47 CN(C)C(=O)NCCCN Amb18251288 [0,2,0,0,0,0|2,0,0]=4 9474 B9R0.47 CN(C)C(=O)OCCCO Amb25806649 [0,2,0,0,0,0|2,0,0]=4 9475 B9R0.47 CN(C)C(=O)SCCCCl Amb25745968 [0,2,0,0,0,0|2,0,0]=4 9476 B9R0.47 CN(CCCCCl)C(=O)Cl Amb22338609 [0,2,0,0,0,0|2,0,0]=4 9477 B9R0.47 CN(CCCCN)C(N)=O Amb24635990 [0,2,0,0,0,0|2,0,0]=4 9478 B9R0.47 CNCCCC(=O)C(C)C Amb24401153 [0,2,0,0,0,0|1,0,0]=3 9479 B9R0.47 CNCCCC(=O)N(C)C Amb19003180 [0,2,0,0,0,0|1,0,0]=3 9480 B9R0.47 CNCCCC(=O)N(C)O Amb24606000 [0,2,0,0,0,0|1,0,0]=3 9481 B9R0.47 CNCCCC(C)C(O)=O Amb25313872 [0,2,0,0,0,0|1,0,0]=3 9482 B9R0.47 CNCCCC(C)N(C)C Amb24590581 [0,2,0,0,0,0|2,0,0]=4 9483 B9R0.47 CNCCCC(N)C(O)=O Amb18644279 [0,2,0,0,0,0|1,0,0]=3 9484 B9R0.47 CNCCCN(C)C(=O)S Amb24365378 [0,2,0,0,0,0|2,0,0]=4 9485 B9R0.47 CNCCCN(C)C(C)=O Amb24096777 [0,2,0,0,0,0|1,0,0]=3 9486 B9R0.47 CNCCCN(C)S(C)=O Amb24725127 [0,2,0,0,0,0|2,0,0]=4 9487 B9R0.47 CNCCCS(=O)C(C)C Amb24751691 [0,2,0,0,0,0|2,0,0]=4 9488 B9R0.47 CNCCC[C@H](N)C(O)=O Amb24377155 [0,2,0,0,0,0|1,0,0]=3 9489 B9R0.47 CNCCNC(=O)C(C)C Amb19036002 [0,2,0,0,0,0|2,0,0]=4 9490 B9R0.47 CNCCNC(=O)C(C)C Amb24271128 [0,2,0,0,0,0|2,0,0]=4 9491 B9R0.47 CNCCNC(=O)C(C)N Amb25066134 [0,2,0,0,0,0|2,0,0]=4 9492 B9R0.47 CNCCNC(=O)N(C)C Amb22157186 [0,2,0,0,0,0|2,0,0]=4 9493 B9R0.47 CNCCNC(=O)[C@H](C)N Amb25837617 [0,2,0,0,0,0|2,0,0]=4 9494 B9R0.47 CNCCOC(=O)C(C)C Amb24480733 [0,2,0,0,0,0|2,0,0]=4 9495 B9R0.47 CNCCOC(=O)N(C)C Amb24357109 [0,2,0,0,0,0|2,0,0]=4 9496 B9R0.47 CNCCOC(C)C(C)=O Amb18111841 [0,2,0,0,0,0|1,0,0]=3 9497 B9R0.47 CNCCOC(C)C(N)=O Amb24727850 [0,2,0,0,0,0|2,0,0]=4 9498 B9R0.47 CNCCOC(C)C(O)=O Amb18630742 [0,2,0,0,0,0|2,0,0]=4 9499 B9R0.47 CNCCSC(F)C(O)=O Amb24601985 [0,2,0,0,0,0|2,0,0]=4 9500 B9R0.47 CNOCCC(N)C(O)=O Amb24477008 [0,2,0,0,0,0|2,0,0]=4 9501 B9R0.47 COCCCC(=O)C(C)O Amb25180729 [0,2,0,0,0,0|1,0,0]=3 9502 B9R0.47 COCCCC(=O)C(F)F Amb25284664 [0,2,0,0,0,0|1,0,0]=3 9503 B9R0.47 COCCCC(Cl)C(C)=O Amb25708322 [0,2,0,0,0,0|0,0,0]=2 9504 B9R0.47 COCCCC(N)C(C)=O Amb24628741 [0,2,0,0,0,0|0,0,0]=2 9505 B9R0.47 COCCCC(N)C(O)=O Amb20628315 [0,2,0,0,0,0|1,0,0]=3 9506 B9R0.47 COCCCC(N)C(O)=O Amb22058809 [0,2,0,0,0,0|1,0,0]=3 9507 B9R0.47 COCCCC(O)C(C)=C Amb24704938 [0,2,0,0,0,0|1,0,0]=3 9508 B9R0.47 COCCCN(C)C(C)=O Amb25767211 [0,2,0,0,0,0|1,0,0]=3 9509 B9R0.47 COCCCN(C)C(N)=O Amb25683020 [0,2,0,0,0,0|2,0,0]=4 9510 B9R0.47 COCCC[C@@H](N)C(O)=O Amb25081508 [0,2,0,0,0,0|1,0,0]=3 9511 B9R0.47 COCCC[C@H](N)C(O)=O Amb25378737 [0,2,0,0,0,0|1,0,0]=3 9512 B9R0.47 COCCNC(=O)C(=O)C Amb17399892 [0,2,0,0,0,0|1,0,1]=4 9513 B9R0.47 COCCNC(=O)C(Br)C Amb17327900 [0,2,0,0,0,0|2,0,0]=4 9514 B9R0.47 COCCNC(=O)C(C)N Amb21957270 [0,2,0,0,0,0|2,0,0]=4 9515 B9R0.47 COCCNC(=O)C(Cl)C Amb1676845 [0,2,0,0,0,0|2,0,0]=4 9516 B9R0.47 COCCNC(=O)N(C)C Amb24619405 [0,2,0,0,0,0|2,0,0]=4 9517 B9R0.47 COCCNC(=O)[C@@H](C)N Amb18014645 [0,2,0,0,0,0|2,0,0]=4 9518 B9R0.47 COCCNC(=O)[C@H](C)O Amb25108318 [0,2,0,0,0,0|2,0,0]=4 9519 B9R0.47 COCCNC(C)C(N)=O Amb19222868 [0,2,0,0,0,0|2,0,0]=4 9520 B9R0.47 COCCOC(=O)C(C)Br Amb18090823 [0,2,0,0,0,0|2,0,0]=4 9521 B9R0.47 COCCOC(=O)C(C)N Amb24694899 [0,2,0,0,0,0|2,0,0]=4 9522 B9R0.47 COCCOC(=O)C(C)O Amb25781141 [0,2,0,0,0,0|2,0,0]=4 9523 B9R0.47 COCCOC(=O)C(F)F Amb24363269 [0,2,0,0,0,0|2,0,0]=4 9524 B9R0.47 COCCOC(=O)[C@@H](C)N Amb24478115 [0,2,0,0,0,0|2,0,0]=4 9525 B9R0.47 COCCOC(=O)[C@@H](C)O Amb24482714 [0,2,0,0,0,0|2,0,0]=4 9526 B9R0.47 COCCOC(C)C(N)=O Amb24471883 [0,2,0,0,0,0|2,0,0]=4 9527 B9R0.47 COCCSC(C)C(N)=O Amb18792461 [0,2,0,0,0,0|2,0,0]=4 9528 B9R0.47 COCCSC(F)C(O)=O Amb25342930 [0,2,0,0,0,0|2,0,0]=4 9529 B9R0.47 COCOCC(=O)N(C)C Amb24101330 [0,2,0,0,0,0|2,0,0]=4 9530 B9R0.47 COCOCC(C)C(C)=O Amb25146475 [0,2,0,0,0,0|1,0,0]=3 9531 B9R0.47 COCOC[C@@H](C)C(O)=O Amb24505310 [0,2,0,0,0,0|2,0,0]=4 9532 B9R0.47 COCSCC(N)C(O)=O Amb25287934 [0,2,0,0,0,0|2,0,0]=4 9533 B9R0.47 COCSC[C@@H](N)C(O)=O Amb25225221 [0,2,0,0,0,0|2,0,0]=4 9534 B9R0.47 COCSC[C@H](N)C(O)=O Amb25275942 [0,2,0,0,0,0|2,0,0]=4 9535 B9R0.47 CONCCC(N)C(O)=O Amb25311314 [0,2,0,0,0,0|2,0,0]=4 9536 B9R0.47 CSCCCC(=O)N(C)C Amb18413480 [0,2,0,0,0,0|1,0,0]=3 9537 B9R0.47 CSCCCC(C(=O)O)N Amb17594057 [0,2,0,0,0,0|1,0,0]=3 9538 B9R0.47 CSCCCC(O)C(O)=O Amb25169340 [0,2,0,0,0,0|1,0,0]=3 9539 B9R0.47 CSCCCN(C)C(=O)Cl Amb25281512 [0,2,0,0,0,0|2,0,0]=4 9540 B9R0.47 CSCCCN(C)C(C)=N Amb25165117 [0,2,0,0,0,0|2,0,0]=4 9541 B9R0.47 CSCCCN(C)C(C)=O Amb24645869 [0,2,0,0,0,0|1,0,0]=3 9542 B9R0.47 CSCCCN(C)C(N)=O Amb24458707 [0,2,0,0,0,0|2,0,0]=4 9543 B9R0.47 CSCCNC(=O)C(Br)C Amb17332774 [0,2,0,0,0,0|2,0,0]=4 9544 B9R0.47 CSCCNC(=O)C(C)C Amb24573793 [0,2,0,0,0,0|2,0,0]=4 9545 B9R0.47 CSCCNC(=O)C(C)N Amb25146385 [0,2,0,0,0,0|2,0,0]=4 9546 B9R0.47 CSCCNC(=O)C(C)S Amb25231681 [0,2,0,0,0,0|2,0,0]=4 9547 B9R0.47 CSCCNC(=O)[C@@H](C)N Amb24443986 [0,2,0,0,0,0|2,0,0]=4 9548 B9R0.47 CSCCNC(=O)[C@H](C)O Amb24351052 [0,2,0,0,0,0|2,0,0]=4 9549 B9R0.47 CSCCNC(C)C(O)=O Amb25805024 [0,2,0,0,0,0|2,0,0]=4 9550 B9R0.47 CSCCN[C@@H](C)C(O)=O Amb24554487 [0,2,0,0,0,0|2,0,0]=4 9551 B9R0.47 CSCCN[C@H](C)C(O)=O Amb25027967 [0,2,0,0,0,0|2,0,0]=4 9552 B9R0.47 CSCCOC(=O)C(C)C Amb25085373 [0,2,0,0,0,0|2,0,0]=4 9553 B9R0.47 CSCCOC(=O)C(C)N Amb24400522 [0,2,0,0,0,0|2,0,0]=4 9554 B9R0.47 CSCCOC(=O)N(C)C Amb25805789 [0,2,0,0,0,0|2,0,0]=4 9555 B9R0.47 CSCCOC(=O)[C@@H](C)O Amb25169432 [0,2,0,0,0,0|2,0,0]=4 9556 B9R0.47 CSCCOC(=O)[C@H](C)O Amb24730180 [0,2,0,0,0,0|2,0,0]=4 9557 B9R0.47 CSCCOC(C)C(N)=O Amb24730449 [0,2,0,0,0,0|2,0,0]=4 9558 B9R0.47 CSCCOC(C)C(O)=O Amb24482366 [0,2,0,0,0,0|2,0,0]=4 9559 B9R0.47 CSCCOC(F)C(O)=O Amb25683225 [0,2,0,0,0,0|2,0,0]=4 9560 B9R0.47 CSCCO[C@@H](C)C(O)=O Amb25146944 [0,2,0,0,0,0|2,0,0]=4 9561 B9R0.47 CSCSC[C@@H](N)C(O)=O Amb25360905 [0,2,0,0,0,0|2,0,0]=4 9562 B9R0.47 CSSCC[C@H](N)C(O)=O Amb25111241 [0,2,0,0,0,0|2,0,0]=4 9563 B9R0.47 C[C@@H](N)C(=O)NCCCF Amb25345861 [0,2,0,0,0,0|2,0,0]=4 9564 B9R0.47 C[C@@H](N)C(=O)NCCCO Amb25139243 [0,2,0,0,0,0|2,0,0]=4 9565 B9R0.47 C[C@@H](NCCCF)C(O)=O Amb25049576 [0,2,0,0,0,0|2,0,0]=4 9566 B9R0.47 C[C@@H](NCCCN)C(O)=O Amb25710680 [0,2,0,0,0,0|2,0,0]=4 9567 B9R0.47 C[C@@H](O)C(=O)NCCCN Amb25840795 [0,2,0,0,0,0|2,0,0]=4 9568 B9R0.47 C[C@@H](O)C(=O)OCCCF Amb25358441 [0,2,0,0,0,0|2,0,0]=4 9569 B9R0.47 C[C@@H](O)[C@H](F)CCCCC Amb25788166 [0,2,0,0,0,0|0,0,2]=4 9570 B9R0.47 C[C@@H](O)[C@H](N)CCCCC Amb24679627 [0,2,0,0,0,0|0,0,2]=4 9571 B9R0.47 C[C@@H](O)[C@H](O)CCCCC Amb25842141 [0,2,0,0,0,0|0,0,2]=4 9572 B9R0.47 C[C@@H](OCCCF)C(O)=O Amb25146943 [0,2,0,0,0,0|2,0,0]=4 9573 B9R0.47 C[C@@H](OCCCO)C(O)=O Amb24692362 [0,2,0,0,0,0|2,0,0]=4 9574 B9R0.47 C[C@H](Br)C(=O)NCCCN Amb25123878 [0,2,0,0,0,0|2,0,0]=4 9575 B9R0.47 C[C@H](Cl)C(=O)NCCCN Amb25300285 [0,2,0,0,0,0|2,0,0]=4 9576 B9R0.47 C[C@H](N)C(=O)OCCCO Amb24479694 [0,2,0,0,0,0|2,0,0]=4 9577 B9R0.47 C[C@H](N)[C@H](O)CCCCC Amb24524514 [0,2,0,0,0,0|0,0,2]=4 9578 B9R0.47 C[C@H](NCCCF)C(O)=O Amb25300818 [0,2,0,0,0,0|2,0,0]=4 9579 B9R0.47 C[C@H](NCCCN)C(O)=O Amb24653332 [0,2,0,0,0,0|2,0,0]=4 9580 B9R0.47 C[C@H](O)C(=O)NCCCO Amb25115521 [0,2,0,0,0,0|2,0,0]=4 9581 B9R0.47 C[C@H](O)C(=O)OCCCF Amb25099335 [0,2,0,0,0,0|2,0,0]=4 9582 B9R0.47 C[C@H](O)[C@@H](O)CCCCC Amb25115950 [0,2,0,0,0,0|0,0,2]=4 9583 B9R0.47 C[C@H](OCCCN)C(O)=O Amb25146951 [0,2,0,0,0,0|2,0,0]=4 9584 B9R0.47 C[C@H](OCCCO)C(O)=O Amb25720488 [0,2,0,0,0,0|2,0,0]=4 9585 B9R0.47 C\C(=C/CCCC)\C(O)=O Amb18643947 [0,2,0,0,0,0|0,0,1]=3 9586 B9R0.47 C\C(=C/CCCCl)\C(O)=O Amb24462748 [0,2,0,0,0,0|1,0,1]=4 9587 B9R0.47 C\C(=C\CCCC)\C(N)=O Amb25174960 [0,2,0,0,0,0|0,0,1]=3 9588 B9R0.47 C\C=C/CCC(C)C(C)=O Amb24570857 [0,2,0,0,0,0|0,0,1]=3 9589 B9R0.47 C\C=C\COC(C)C(C)=O Amb24409503 [0,2,0,0,0,0|0,0,2]=4 9590 B9R0.47 N#CCCCC(C(=O)O)Cl Amb17594023 [0,2,0,0,0,0|1,0,1]=4 9591 B9R0.47 NC(CCCC#N)C(O)=O Amb25242567 [0,2,0,0,0,0|1,0,1]=4 9592 B9R0.47 NC(CCCCBr)P(O)=O Amb25706143 [0,2,0,0,0,0|2,0,0]=4 9593 B9R0.47 NC(CCCCCl)C(O)=O Amb25141944 [0,2,0,0,0,0|1,0,0]=3 9594 B9R0.47 NC(CCCCS)C(O)=O Amb25363159 [0,2,0,0,0,0|1,0,0]=3 9595 B9R0.47 NC(CCCNO)C(O)=O Amb24722710 [0,2,0,0,0,0|2,0,0]=4 9596 B9R0.47 NC(CCC[13CH2][15NH2])C(O)=O Amb22351283 [0,2,0,0,0,0|1,0,0]=3 9597 B9R0.47 NC(CCNCO)C(O)=O Amb25701616 [0,2,0,0,0,0|2,0,0]=4 9598 B9R0.47 NC(CCSCF)C(O)=O Amb24610565 [0,2,0,0,0,0|2,0,0]=4 9599 B9R0.47 NC(CNCCF)C(N)=O Amb25132328 [0,2,0,0,0,0|2,0,0]=4 9600 B9R0.47 NC(CNCCO)C(O)=O Amb25073329 [0,2,0,0,0,0|2,0,0]=4 9601 B9R0.47 NC(COCCCl)C(O)=O Amb18126477 [0,2,0,0,0,0|2,0,0]=4 9602 B9R0.47 NC(CSCCCl)C(O)=O Amb18129288 [0,2,0,0,0,0|2,0,0]=4 9603 B9R0.47 NC(CSCCF)C(O)=O Amb25054114 [0,2,0,0,0,0|2,0,0]=4 9604 B9R0.47 NC(CSCCO)C(N)=O Amb18788315 [0,2,0,0,0,0|2,0,0]=4 9605 B9R0.47 NCCCCC(=O)C(O)=O Amb25703573 [0,2,0,0,0,0|1,0,1]=4 9606 B9R0.47 NCCCCC(=O)N(C)C Amb13883045 [0,2,0,0,0,0|1,0,0]=3 9607 B9R0.47 NCCCCC(C(=O)N)N Amb17593646 [0,2,0,0,0,0|1,0,0]=3 9608 B9R0.47 NCCCCC(Cl)C(O)=O Amb24540314 [0,2,0,0,0,0|1,0,0]=3 9609 B9R0.47 NCCCCC(F)C(O)=O Amb25147460 [0,2,0,0,0,0|1,0,0]=3 9610 B9R0.47 NCCCCC(N)C(=O)Cl Amb24678769 [0,2,0,0,0,0|1,0,0]=3 9611 B9R0.47 NCCCCC(N)C(O)=O Amb22349470 [0,2,0,0,0,0|1,0,0]=3 9612 B9R0.47 NCCCCC(N)C(O)=O Amb22489521 [0,2,0,0,0,0|1,0,0]=3 9613 B9R0.47 NCCCCC(N)P(O)=O Amb25337348 [0,2,0,0,0,0|2,0,0]=4 9614 B9R0.47 NCCCCC(N)[13C](O)=O Amb22338743 [0,2,0,0,0,0|1,0,0]=3 9615 B9R0.47 NCCCCC(O)C(O)=O Amb18644320 [0,2,0,0,0,0|1,0,0]=3 9616 B9R0.47 NCCCCC(S)C(O)=O Amb24652524 [0,2,0,0,0,0|1,0,0]=3 9617 B9R0.47 NCCCCC([15NH2])C(O)=O Amb22351358 [0,2,0,0,0,0|1,0,0]=3 9618 B9R0.47 NCCCC[13CH](N)C(O)=O Amb22351886 [0,2,0,0,0,0|1,0,0]=3 9619 B9R0.47 NCCCC[13CH](N)[13C](O)=O Amb22336528 [0,2,0,0,0,0|1,0,0]=3 9620 B9R0.47 NCCCC[C@@H](C(=O)O)C Amb10844513 [0,2,0,0,0,0|1,0,0]=3 9621 B9R0.47 NCCCC[C@@H](N)C(N)=O Amb22800869 [0,2,0,0,0,0|1,0,0]=3 9622 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22744766 [0,2,0,0,0,0|1,0,0]=3 9623 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22746247 [0,2,0,0,0,0|1,0,0]=3 9624 B9R0.47 NCCCC[C@@H](N)C(O)=O Amb22750565 [0,2,0,0,0,0|1,0,0]=3 9625 B9R0.47 NCCCC[C@H](C(=O)O)N Amb10072417 [0,2,0,0,0,0|1,0,0]=3 9626 B9R0.47 NCCCC[C@H](N)C(N)=O Amb25738519 [0,2,0,0,0,0|1,0,0]=3 9627 B9R0.47 NCCCC[C@H](O)C(O)=O Amb25303562 [0,2,0,0,0,0|1,0,0]=3 9628 B9R0.47 NCCCC[C@H]([15NH2])C(O)=O Amb22354049 [0,2,0,0,0,0|1,0,0]=3 9629 B9R0.47 NCCCNC(=O)C(F)F Amb24531323 [0,2,0,0,0,0|2,0,0]=4 9630 B9R0.47 NCCCO[C@H](N)C(O)=O Amb25111856 [0,2,0,0,0,0|2,0,0]=4 9631 B9R0.47 NCCCSC(F)C(O)=O Amb24717365 [0,2,0,0,0,0|2,0,0]=4 9632 B9R0.47 NCCCSC(N)C(O)=O Amb24443705 [0,2,0,0,0,0|2,0,0]=4 9633 B9R0.47 NCCNCC(N)C(O)=O Amb25032175 [0,2,0,0,0,0|2,0,0]=4 9634 B9R0.47 NCCNCC(O)C(N)=O Amb25307230 [0,2,0,0,0,0|2,0,0]=4 9635 B9R0.47 NCCNCC(O)C(O)=O Amb25135297 [0,2,0,0,0,0|2,0,0]=4 9636 B9R0.47 NCCNC[C@@H](N)C(O)=O Amb25147420 [0,2,0,0,0,0|2,0,0]=4 9637 B9R0.47 NCCNC[C@H](N)C(O)=O Amb24580529 [0,2,0,0,0,0|2,0,0]=4 9638 B9R0.47 NCCOC[C@@H](N)C(O)=O Amb22799590 [0,2,0,0,0,0|2,0,0]=4 9639 B9R0.47 NCCOC[C@@H](N)C(O)=O Amb25679129 [0,2,0,0,0,0|2,0,0]=4 9640 B9R0.47 NCCOC[C@H](N)C(O)=O Amb22231353 [0,2,0,0,0,0|2,0,0]=4 9641 B9R0.47 NCCSCC(N)C(N)=O Amb24368331 [0,2,0,0,0,0|2,0,0]=4 9642 B9R0.47 NCCSCC(N)C(O)=O Amb18126410 [0,2,0,0,0,0|2,0,0]=4 9643 B9R0.47 NCCSC[C@@H](N)C(O)=O Amb22800706 [0,2,0,0,0,0|2,0,0]=4 9644 B9R0.47 NCCSC[C@H](N)C(O)=O Amb22362775 [0,2,0,0,0,0|2,0,0]=4 9645 B9R0.47 NNCCCC(N)C(O)=O Amb24378076 [0,2,0,0,0,0|2,0,0]=4 9646 B9R0.47 NNCCC[C@H](N)C(O)=O Amb24623157 [0,2,0,0,0,0|2,0,0]=4 9647 B9R0.47 NOCCCC(N)C(O)=O Amb24117962 [0,2,0,0,0,0|2,0,0]=4 9648 B9R0.47 N[13CH2]CCCC(N)C(O)=O Amb22367560 [0,2,0,0,0,0|1,0,0]=3 9649 B9R0.47 N[13CH2][13CH2][13CH2][13CH2][13C@H](N)[13C](O)=O Amb22337497 [0,2,0,0,0,0|1,0,0]=3 9650 B9R0.47 N[14CH2][14CH2][14CH2][14CH2][14CH](N)[14C](O)=O Amb22349598 [0,2,0,0,0,0|1,0,0]=3 9651 B9R0.47 N[C@@H](CCCCO)C(O)=O Amb22900800 [0,2,0,0,0,0|1,0,0]=3 9652 B9R0.47 N[C@@H](CCCCS)C(O)=O Amb25729289 [0,2,0,0,0,0|1,0,0]=3 9653 B9R0.47 N[C@@H](CCCC[NH3+])C(O)=O Amb22801419 [0,2,0,0,0,0|1,0,0]=3 9654 B9R0.47 N[C@@H](CCCNO)C(O)=O Amb25075377 [0,2,0,0,0,0|2,0,0]=4 9655 B9R0.47 N[C@@H](CCNCO)C(O)=O Amb24760325 [0,2,0,0,0,0|2,0,0]=4 9656 B9R0.47 N[C@@H](CNCCO)C(O)=O Amb25146307 [0,2,0,0,0,0|2,0,0]=4 9657 B9R0.47 N[C@@H](COCCO)C(O)=O Amb24479093 [0,2,0,0,0,0|2,0,0]=4 9658 B9R0.47 N[C@H](CNCCO)C(O)=O Amb24617539 [0,2,0,0,0,0|2,0,0]=4 9659 B9R0.47 N[C@H](COCCCl)C(O)=O Amb24426914 [0,2,0,0,0,0|2,0,0]=4 9660 B9R0.47 O=C(CCCCCl)N(Cl)Cl Amb24754002 [0,2,0,0,0,0|2,0,0]=4 9661 B9R0.47 O=C(CCCCF)C(F)F Amb25846400 [0,2,0,0,0,0|1,0,0]=3 9662 B9R0.47 O=C(Cl)C(Br)CCCCCl Amb24716966 [0,2,0,0,0,0|1,0,0]=3 9663 B9R0.47 O=C(NCCCBr)C(F)F Amb25315706 [0,2,0,0,0,0|2,0,0]=4 9664 B9R0.47 O=C(NCCCCl)C(F)F Amb24524442 [0,2,0,0,0,0|2,0,0]=4 9665 B9R0.47 O=C(OCCCCl)C(F)F Amb25238278 [0,2,0,0,0,0|2,0,0]=4 9666 B9R0.47 O=C(OCCCF)C(F)F Amb22008201 [0,2,0,0,0,0|2,0,0]=4 9667 B9R0.47 O=CCCCC(C(=O)O)N Amb17619026 [0,2,0,0,0,0|1,0,1]=4 9668 B9R0.47 OC(=O)C(=O)CCCCF Amb25259949 [0,2,0,0,0,0|1,0,1]=4 9669 B9R0.47 OC(=O)C(Br)CCCCBr Amb21964537 [0,2,0,0,0,0|1,0,0]=3 9670 B9R0.47 OC(=O)C(Cl)CCCCCl Amb24442431 [0,2,0,0,0,0|1,0,0]=3 9671 B9R0.47 OC(=O)C(F)CCCCF Amb24482414 [0,2,0,0,0,0|1,0,0]=3 9672 B9R0.47 OCCCCC(=O)N(C)C Amb17232000 [0,2,0,0,0,0|1,0,0]=3 9673 B9R0.47 OCCCCC(O)C(O)=O Amb18644356 [0,2,0,0,0,0|1,0,0]=3 9674 B9R0.47 OCCCC[C@H](O)C(O)=O Amb24480682 [0,2,0,0,0,0|1,0,0]=3 9675 B9R0.47 OCCCNC(=O)C(Cl)Cl Amb17665128 [0,2,0,0,0,0|2,0,0]=4 9676 B9R0.47 OCCCSC(F)C(O)=O Amb24659088 [0,2,0,0,0,0|2,0,0]=4 9677 B9R0.47 OCCNC[C@H](O)C(O)=O Amb25316160 [0,2,0,0,0,0|2,0,0]=4 9678 B9R0.47 OCCSCC(O)C(O)=O Amb25211640 [0,2,0,0,0,0|2,0,0]=4 9679 B9R0.47 [15NH2]CCCCC([15NH2])C(O)=O Amb22363194 [0,2,0,0,0,0|1,0,0]=3 9680 B9R0.47 [15NH2]CCCC[C@H]([15NH2])C(O)=O Amb22353587 [0,2,0,0,0,0|1,0,0]=3 9681 B9R0.47 [2H][13CH2]SCC[C@H](N)C(O)=O Amb22337395 [0,2,0,0,0,0|2,0,0]=4 9682 B9R0.50 CCC(CCCCCl)C=O Amb25213058 [0,2,0,0,0,0|1,0,1]=4 9683 B9R0.50 CCCCC=C(C=O)C=O Amb18643579 [0,2,0,0,0,0|0,0,2]=4 9684 B9R0.50 CCCCC=C(CC)CC Amb22229299 [0,2,0,0,0,0|1,0,1]=4 9685 B9R0.50 CCCCCC(=CN)C#N Amb24514895 [0,2,0,0,0,0|1,0,1]=4 9686 B9R0.50 CCCCCC(C=C)C=O Amb24383091 [0,2,0,0,0,0|0,0,2]=4 9687 B9R0.50 CCCCCC(C=O)=CCl Amb24635030 [0,2,0,0,0,0|0,0,1]=3 9688 B9R0.50 CCCCCC(C=O)C#N Amb24333051 [0,2,0,0,0,0|0,0,2]=4 9689 B9R0.50 CCCCCC(C=O)C=O Amb25119282 [0,2,0,0,0,0|0,0,2]=4 9690 B9R0.50 CCCCCC(C=O)OC Amb25195889 [0,2,0,0,0,0|0,0,1]=3 9691 B9R0.50 CCCCCC(CBr)C=C Amb25766539 [0,2,0,0,0,0|1,0,1]=4 9692 B9R0.50 CCCCCC(CBr)CBr Amb24570078 [0,2,0,0,0,0|1,0,1]=4 9693 B9R0.50 CCCCCC(CBr)OC Amb25139566 [0,2,0,0,0,0|0,0,2]=4 9694 B9R0.50 CCCCCC(CC)CC Amb22229275 [0,2,0,0,0,0|1,0,1]=4 9695 B9R0.50 CCCCCC(CC)NC Amb24598729 [0,2,0,0,0,0|1,0,1]=4 9696 B9R0.50 CCCCCC(CC)[Mg]Br Amb22897346 [0,2,0,0,0,0|1,0,1]=4 9697 B9R0.50 CCCCCC(CC)[Zn]Br Amb22897858 [0,2,0,0,0,0|1,0,1]=4 9698 B9R0.50 CCCCCC(CCl)CCl Amb24429090 [0,2,0,0,0,0|1,0,1]=4 9699 B9R0.50 CCCCCC(CCl)OC Amb25373853 [0,2,0,0,0,0|0,0,2]=4 9700 B9R0.50 CCCCCC(CN)CC Amb25090204 [0,2,0,0,0,0|1,0,1]=4 9701 B9R0.50 CCCCCC(CO)=C=C Amb25027810 [0,2,0,0,0,0|1,0,0]=3 9702 B9R0.50 CCCCCC(CO)C#N Amb24477943 [0,2,0,0,0,0|1,0,1]=4 9703 B9R0.50 CCCCCC(CO)NC Amb24444104 [0,2,0,0,0,0|0,0,2]=4 9704 B9R0.50 CCCCCC(NC)=NN Amb25719651 [0,2,0,0,0,0|1,0,0]=3 9705 B9R0.50 CCCCCP(CO)CO Amb24642930 [0,2,0,0,0,0|1,0,1]=4 9706 B9R0.50 CCCCC[C@@H](CC)C=O Amb24559168 [0,2,0,0,0,0|0,0,1]=3 9707 B9R0.50 CCCCC[C@@H](CO)CC Amb25763987 [0,2,0,0,0,0|0,0,2]=4 9708 B9R0.50 CCCCC\C(=C\N)\C=O Amb25117739 [0,2,0,0,0,0|0,0,1]=3 9709 B9R0.50 CCCCC\C(=C\O)\C=O Amb24434885 [0,2,0,0,0,0|0,0,1]=3 9710 B9R0.50 CCCCSC(CO)=CC Amb25796330 [0,2,0,0,0,0|1,0,1]=4 9711 B9R0.50 CCCCSC(NC)=NC Amb24727010 [0,2,0,0,0,0|2,0,0]=4 9712 B9R0.50 CCCCS\C(=N\C)\NC Amb10552903 [0,2,0,0,0,0|2,0,0]=4 9713 B9R0.50 CCCC\C=C(/C=O)\SC Amb25324111 [0,2,0,0,0,0|0,0,1]=3 9714 B9R0.50 CCCC\C=C(/CBr)\CC Amb24477337 [0,2,0,0,0,0|1,0,1]=4 9715 B9R0.50 CCCC\C=C(/CO)\CC Amb25327448 [0,2,0,0,0,0|0,0,2]=4 9716 B9R0.50 CCN(CCCCO)N=O Amb22732229 [0,2,0,0,0,0|2,0,0]=4 9717 B9R0.50 CCN(CCNCC)C=O Amb18124697 [0,2,0,0,0,0|2,0,0]=4 9718 B9R0.50 CCSCCC(C=O)OC Amb25321425 [0,2,0,0,0,0|1,0,1]=4 9719 B9R0.50 CC\C(\C=O)=C/CCCC Amb24117957 [0,2,0,0,0,0|0,0,1]=3 9720 B9R0.50 CNC(NCCCC)=NC Amb25211484 [0,2,0,0,0,0|2,0,0]=4 9721 B9R0.50 CNC(NCCCC)=NN Amb25107927 [0,2,0,0,0,0|2,0,0]=4 9722 B9R0.50 COC(CCCSC)C=O Amb25074754 [0,2,0,0,0,0|1,0,1]=4 9723 B9R0.50 C\C=C(/CCCCC)\C=O Amb18643630 [0,2,0,0,0,0|0,0,0]=2 9724 B9R0.50 C\C=C(\C=O)/SCCCC Amb18645105 [0,2,0,0,0,0|1,0,0]=3 9725 B9R0.2 BrCCCCCCC(=O)O Amb10071514 [0,2,0,0,0,0|1,0,0]=3 9726 B9R0.2 C#CCCCCCC(O)=O Amb22232010 [0,2,0,0,0,0|1,0,0]=3 9727 B9R0.2 C#CCCCNCC(N)=O Amb24674781 [0,2,0,0,0,0|1,0,1]=4 9728 B9R0.2 C#CCCCNCC(O)=O Amb25284826 [0,2,0,0,0,0|1,0,1]=4 9729 B9R0.2 C#CCCNCCC(N)=O Amb25048747 [0,2,0,0,0,0|1,0,1]=4 9730 B9R0.2 C#CCNCCCC(N)=O Amb24666395 [0,2,0,0,0,0|1,0,1]=4 9731 B9R0.2 C#CCSCCCC(=O)O Amb17503626 [0,2,0,0,0,0|1,0,1]=4 9732 B9R0.2 C=C(Br)CSCCCCF Amb25191260 [0,2,0,0,0,0|1,0,1]=4 9733 B9R0.2 C=C(Cl)CNCCCCO Amb25839321 [0,2,0,0,0,0|1,0,1]=4 9734 B9R0.2 C=CCCCCCC(N)=O Amb25113258 [0,2,0,0,0,0|1,0,0]=3 9735 B9R0.2 C=CCCCCNC(N)=O Amb25309766 [0,2,0,0,0,0|1,0,1]=4 9736 B9R0.2 C=CCCCCOC(=O)C Amb10842183 [0,2,0,0,0,0|0,0,1]=3 9737 B9R0.2 C=CCCCOCC(N)=O Amb25825853 [0,2,0,0,0,0|1,0,1]=4 9738 B9R0.2 C=CCCNCCC(N)=O Amb25672230 [0,2,0,0,0,0|1,0,1]=4 9739 B9R0.2 C=CCNCCCC(N)=O Amb25224261 [0,2,0,0,0,0|1,0,1]=4 9740 B9R0.2 C=NCCCCCC(O)=O Amb25111950 [0,2,0,0,0,0|1,0,0]=3 9741 B9R0.2 CC#CCCCCC(C)Cl Amb25146926 [0,2,0,0,0,0|1,0,1]=4 9742 B9R0.2 CC#CCCCCC(C)O Amb25146924 [0,2,0,0,0,0|0,0,2]=4 9743 B9R0.2 CC#CCCNCC(C)=C Amb24709922 [0,2,0,0,0,0|1,0,1]=4 9744 B9R0.2 CC#CCCNCC(N)=O Amb25088588 [0,2,0,0,0,0|1,0,1]=4 9745 B9R0.2 CC#CCCNCC(O)=O Amb25138292 [0,2,0,0,0,0|1,0,1]=4 9746 B9R0.2 CC#CCCSCC(C)=O Amb25727388 [0,2,0,0,0,0|0,0,1]=3 9747 B9R0.2 CC#CCNCCS(C)=O Amb25057856 [0,2,0,0,0,0|1,0,1]=4 9748 B9R0.2 CC#CCOCCC(O)=O Amb24393140 [0,2,0,0,0,0|1,0,1]=4 9749 B9R0.2 CC#CCSCCC(C)=C Amb24482648 [0,2,0,0,0,0|1,0,1]=4 9750 B9R0.2 CC#CCSCCC(O)=O Amb18797356 [0,2,0,0,0,0|1,0,1]=4 9751 B9R0.2 CC(=C)CC#CCCCN Amb24409956 [0,2,0,0,0,0|1,0,1]=4 9752 B9R0.2 CC(=C)CCC#CCCBr Amb24477163 [0,2,0,0,0,0|1,0,1]=4 9753 B9R0.2 CC(=C)CCCC#CCCl Amb24480429 [0,2,0,0,0,0|1,0,1]=4 9754 B9R0.2 CC(=C)CCCC#CCO Amb25848587 [0,2,0,0,0,0|1,0,1]=4 9755 B9R0.2 CC(=C)CCC\C=C\CCl Amb25077233 [0,2,0,0,0,0|1,0,1]=4 9756 B9R0.2 CC(=C)CCC\C=C\CO Amb24464660 [0,2,0,0,0,0|1,0,1]=4 9757 B9R0.2 CC(=C)CCNCCC=C Amb24444754 [0,2,0,0,0,0|1,0,1]=4 9758 B9R0.2 CC(=C)CCNCCCF Amb24372680 [0,2,0,0,0,0|1,0,0]=3 9759 B9R0.2 CC(=C)CCOCCC#N Amb24524414 [0,2,0,0,0,0|1,0,1]=4 9760 B9R0.2 CC(=C)CCOCCC=O Amb24354701 [0,2,0,0,0,0|1,0,1]=4 9761 B9R0.2 CC(=C)CCOCCCBr Amb25098731 [0,2,0,0,0,0|1,0,0]=3 9762 B9R0.2 CC(=C)CCOCCCCl Amb25822519 [0,2,0,0,0,0|1,0,0]=3 9763 B9R0.2 CC(=C)CCOCCCS Amb25058112 [0,2,0,0,0,0|1,0,0]=3 9764 B9R0.2 CC(=C)CCSCCC=C Amb24377830 [0,2,0,0,0,0|1,0,1]=4 9765 B9R0.2 CC(=C)CCSCCCF Amb24446790 [0,2,0,0,0,0|1,0,0]=3 9766 B9R0.2 CC(=C)CC\C=C\CCBr Amb25102671 [0,2,0,0,0,0|1,0,1]=4 9767 B9R0.2 CC(=C)CC\C=C\CCO Amb24422820 [0,2,0,0,0,0|1,0,1]=4 9768 B9R0.2 CC(=C)CNCCCC#N Amb25828726 [0,2,0,0,0,0|1,0,1]=4 9769 B9R0.2 CC(=C)CNCCCC=C Amb25055350 [0,2,0,0,0,0|1,0,1]=4 9770 B9R0.2 CC(=C)CNCCCCO Amb24377753 [0,2,0,0,0,0|1,0,0]=3 9771 B9R0.2 CC(=C)CONCCCF Amb25025498 [0,2,0,0,0,0|2,0,0]=4 9772 B9R0.2 CC(=C)CSCCCCF Amb24524486 [0,2,0,0,0,0|1,0,0]=3 9773 B9R0.2 CC(=C)CSSCCCO Amb24644766 [0,2,0,0,0,0|2,0,0]=4 9774 B9R0.2 CC(=O)C#CCCCC#C Amb25146764 [0,2,0,0,0,0|0,0,2]=4 9775 B9R0.2 CC(=O)CCC#CCC=C Amb25820775 [0,2,0,0,0,0|0,0,2]=4 9776 B9R0.2 CC(=O)CCC#CCCO Amb25096345 [0,2,0,0,0,0|0,0,1]=3 9777 B9R0.2 CC(=O)CCCC#CC=O Amb24480487 [0,2,0,0,0,0|0,0,2]=4 9778 B9R0.2 CC(=O)CCCC#CCBr Amb25032077 [0,2,0,0,0,0|0,0,1]=3 9779 B9R0.2 CC(=O)CCCCC=C=C Amb25296928 [0,2,0,0,0,0|0,0,1]=3 9780 B9R0.2 CC(=O)CCCCCC#N Amb24570407 [0,2,0,0,0,0|0,0,0]=2 9781 B9R0.2 CC(=O)CCCCCC=C Amb24117120 [0,2,0,0,0,0|0,0,0]=2 9782 B9R0.2 CC(=O)CCCCCC=O Amb25290329 [0,2,0,0,0,0|0,0,0]=2 9783 B9R0.2 CC(=O)CCCCCCBr Amb24436166 [0,2,0,0,0,0|0,0,0]=2 9784 B9R0.2 CC(=O)CCCCCCF Amb25050277 [0,2,0,0,0,0|0,0,0]=2 9785 B9R0.2 CC(=O)CCCCCCN Amb25147578 [0,2,0,0,0,0|0,0,0]=2 9786 B9R0.2 CC(=O)CCCCCCO Amb25728037 [0,2,0,0,0,0|0,0,0]=2 9787 B9R0.2 CC(=O)CCCCSC#N Amb24467545 [0,2,0,0,0,0|0,0,1]=3 9788 B9R0.2 CC(=O)CCCC\C=C\Cl Amb24380821 [0,2,0,0,0,0|0,0,1]=3 9789 B9R0.2 CC(=O)CCCOCC#C Amb25146553 [0,2,0,0,0,0|0,0,1]=3 9790 B9R0.2 CC(=O)CCCOCCO Amb25265612 [0,2,0,0,0,0|0,0,0]=2 9791 B9R0.2 CC(=O)CCC\C=C/CO Amb25146607 [0,2,0,0,0,0|0,0,1]=3 9792 B9R0.2 CC(=O)CCC\C=C\C#N Amb24553086 [0,2,0,0,0,0|0,0,2]=4 9793 B9R0.2 CC(=O)CCC\C=C\C=C Amb25713959 [0,2,0,0,0,0|0,0,2]=4 9794 B9R0.2 CC(=O)CCC\C=C\C=O Amb18124580 [0,2,0,0,0,0|0,0,2]=4 9795 B9R0.2 CC(=O)CCC\C=C\CO Amb25297110 [0,2,0,0,0,0|0,0,1]=3 9796 B9R0.2 CC(=O)CCNCCCO Amb24704454 [0,2,0,0,0,0|0,0,0]=2 9797 B9R0.2 CC(=O)CCOCCCBr Amb25274435 [0,2,0,0,0,0|0,0,0]=2 9798 B9R0.2 CC(=O)CCOCCCN Amb18111574 [0,2,0,0,0,0|0,0,0]=2 9799 B9R0.2 CC(=O)CCOCCCO Amb25094277 [0,2,0,0,0,0|0,0,0]=2 9800 B9R0.2 CC(=O)CCONCCC Amb22369235 [0,2,0,0,0,0|0,0,0]=2 9801 B9R0.2 CC(=O)CCSCCC#N Amb18265316 [0,2,0,0,0,0|0,0,1]=3 9802 B9R0.2 CC(=O)CC\C=C\CC#C Amb24621936 [0,2,0,0,0,0|0,0,2]=4 9803 B9R0.2 CC(=O)CC\C=C\CC=C Amb25245400 [0,2,0,0,0,0|0,0,2]=4 9804 B9R0.2 CC(=O)CC\C=C\CCO Amb24587265 [0,2,0,0,0,0|0,0,1]=3 9805 B9R0.2 CC(=O)CNCCCC=O Amb24664343 [0,2,0,0,0,0|0,0,1]=3 9806 B9R0.2 CC(=O)CSCCCC=C Amb25256553 [0,2,0,0,0,0|0,0,1]=3 9807 B9R0.2 CC(=O)CSCCCCO Amb24504843 [0,2,0,0,0,0|0,0,0]=2 9808 B9R0.2 CC(=O)NCCCC=C=C Amb25067189 [0,2,0,0,0,0|0,0,2]=4 9809 B9R0.2 CC(=O)NCCCCC#C Amb25185221 [0,2,0,0,0,0|0,0,1]=3 9810 B9R0.2 CC(=O)NCCCCC#N Amb24350216 [0,2,0,0,0,0|0,0,1]=3 9811 B9R0.2 CC(=O)NCCCCC=O Amb24524516 [0,2,0,0,0,0|0,0,1]=3 9812 B9R0.2 CC(=O)NCCCCCBr Amb24477078 [0,2,0,0,0,0|0,0,0]=2 9813 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [0,2,0,0,0,0|0,0,0]=2 9814 B9R0.2 CC(=O)NCCCCCN Amb18102716 [0,2,0,0,0,0|0,0,0]=2 9815 B9R0.2 CC(=O)NCCCN=[N+]=[N-] Amb25842583 [0,2,0,0,0,0|2,0,0]=4 9816 B9R0.2 CC(=O)NCCCNC#N Amb25308540 [0,2,0,0,0,0|1,0,1]=4 9817 B9R0.2 CC(=O)NCCCOC=O Amb25340400 [0,2,0,0,0,0|1,0,1]=4 9818 B9R0.2 CC(=O)NCCNCC#C Amb24382609 [0,2,0,0,0,0|0,0,2]=4 9819 B9R0.2 CC(=O)NCCNCCF Amb25696348 [0,2,0,0,0,0|1,0,0]=3 9820 B9R0.2 CC(=O)NCCOCC=C Amb25284274 [0,2,0,0,0,0|0,0,2]=4 9821 B9R0.2 CC(=O)NCCOCCN Amb16233780 [0,2,0,0,0,0|1,0,0]=3 9822 B9R0.2 CC(=O)NCCOCCO Amb24477952 [0,2,0,0,0,0|1,0,0]=3 9823 B9R0.2 CC(=O)NCCSCC#C Amb24481278 [0,2,0,0,0,0|0,0,2]=4 9824 B9R0.2 CC(=O)NOCCCC#C Amb25285254 [0,2,0,0,0,0|0,0,2]=4 9825 B9R0.2 CC(=O)NOCCCC=C Amb24706086 [0,2,0,0,0,0|0,0,2]=4 9826 B9R0.2 CC(=O)NOCCCCF Amb24577255 [0,2,0,0,0,0|1,0,0]=3 9827 B9R0.2 CC(=O)OCCC#CCBr Amb25108290 [0,2,0,0,0,0|0,0,2]=4 9828 B9R0.2 CC(=O)OCCCCC#N Amb18643727 [0,2,0,0,0,0|0,0,1]=3 9829 B9R0.2 CC(=O)OCCCCCF Amb25346117 [0,2,0,0,0,0|0,0,0]=2 9830 B9R0.2 CC(=O)OCCCCCI Amb25304053 [0,2,0,0,0,0|0,0,0]=2 9831 B9R0.2 CC(=O)OCCCCCN Amb25228426 [0,2,0,0,0,0|0,0,0]=2 9832 B9R0.2 CC(=O)OCCCC[Zn]Br Amb22000480 [0,2,0,0,0,0|1,0,0]=3 9833 B9R0.2 CC(=O)OCCCOCCl Amb25306711 [0,2,0,0,0,0|1,0,0]=3 9834 B9R0.2 CC(=O)OCCC\C=C\Cl Amb24720035 [0,2,0,0,0,0|0,0,2]=4 9835 B9R0.2 CC(=O)OCCOCCO Amb22728942 [0,2,0,0,0,0|1,0,0]=3 9836 B9R0.2 CC(=O)OCC\C=C\CBr Amb24558178 [0,2,0,0,0,0|0,0,2]=4 9837 B9R0.2 CC(=O)OC\C=C\CCBr Amb25731902 [0,2,0,0,0,0|0,0,2]=4 9838 B9R0.2 CC(=O)OC\C=C\CCCl Amb25791630 [0,2,0,0,0,0|0,0,2]=4 9839 B9R0.2 CC(=O)O\C=C/CCCBr Amb25068275 [0,2,0,0,0,0|0,0,2]=4 9840 B9R0.2 CC(=O)O\C=C\CCCBr Amb24567866 [0,2,0,0,0,0|0,0,2]=4 9841 B9R0.2 CC(=O)SCCCCCCl Amb24443095 [0,2,0,0,0,0|0,0,0]=2 9842 B9R0.2 CC(=O)SCCSCCCl Amb25139329 [0,2,0,0,0,0|1,0,0]=3 9843 B9R0.2 CC(=O)\C=C\CCCC#C Amb25205680 [0,2,0,0,0,0|0,0,2]=4 9844 B9R0.2 CC(=O)\C=C\CCCC#N Amb24612117 [0,2,0,0,0,0|0,0,2]=4 9845 B9R0.2 CC(=O)\C=C\CCCC=O Amb24476998 [0,2,0,0,0,0|0,0,2]=4 9846 B9R0.2 CC(=O)\C=C\CCCCBr Amb24477141 [0,2,0,0,0,0|0,0,1]=3 9847 B9R0.2 CC(=O)\C=C\CCCCO Amb24518640 [0,2,0,0,0,0|0,0,1]=3 9848 B9R0.2 CC(Br)CCCCCC#C Amb25136440 [0,2,0,0,0,0|1,0,1]=4 9849 B9R0.2 CC(C)=C=CCCCCO Amb25332292 [0,2,0,0,0,0|1,0,1]=4 9850 B9R0.2 CC(C)=CCCCCC=O Amb18643636 [0,2,0,0,0,0|1,0,1]=4 9851 B9R0.2 CC(C)=CCCCCCBr Amb24524614 [0,2,0,0,0,0|1,0,0]=3 9852 B9R0.2 CC(C)=CCCNCCF Amb24581536 [0,2,0,0,0,0|1,0,1]=4 9853 B9R0.2 CC(C)=CCCNCCN Amb24585356 [0,2,0,0,0,0|1,0,1]=4 9854 B9R0.2 CC(C)=CCCNCCO Amb24547984 [0,2,0,0,0,0|1,0,1]=4 9855 B9R0.2 CC(C)=CCNCCCCl Amb24670767 [0,2,0,0,0,0|1,0,1]=4 9856 B9R0.2 CC(C)=CCNCCCF Amb25101379 [0,2,0,0,0,0|1,0,1]=4 9857 B9R0.2 CC(C)=CCNCCCI Amb24739148 [0,2,0,0,0,0|1,0,1]=4 9858 B9R0.2 CC(C)=CCNCCCN Amb18622357 [0,2,0,0,0,0|1,0,1]=4 9859 B9R0.2 CC(C)=CCOCCCO Amb25697595 [0,2,0,0,0,0|1,0,1]=4 9860 B9R0.2 CC(C)=CCSCCCN Amb24702175 [0,2,0,0,0,0|1,0,1]=4 9861 B9R0.2 CC(C)=CCSCCCO Amb24758012 [0,2,0,0,0,0|1,0,1]=4 9862 B9R0.2 CC(C)CCCCCC#N Amb18643473 [0,2,0,0,0,0|1,0,1]=4 9863 B9R0.2 CC(C)CCCCCC=O Amb22233123 [0,2,0,0,0,0|1,0,1]=4 9864 B9R0.2 CC(C)CCCCCCBr Amb20240805 [0,2,0,0,0,0|1,0,1]=4 9865 B9R0.2 CC(C)CCCCCCCl Amb24425622 [0,2,0,0,0,0|1,0,1]=4 9866 B9R0.2 CC(C)CCCNCCCl Amb25112681 [0,2,0,0,0,0|1,0,1]=4 9867 B9R0.2 CC(C)CCCNCCI Amb24400137 [0,2,0,0,0,0|1,0,1]=4 9868 B9R0.2 CC(C)CCCNCCO Amb24476742 [0,2,0,0,0,0|1,0,1]=4 9869 B9R0.2 CC(C)CCCOCCO Amb25349307 [0,2,0,0,0,0|1,0,1]=4 9870 B9R0.2 CC(C)CCCSCCCl Amb25776374 [0,2,0,0,0,0|1,0,1]=4 9871 B9R0.2 CC(C)CCNCCCBr Amb24340144 [0,2,0,0,0,0|1,0,1]=4 9872 B9R0.2 CC(C)CCNCCCF Amb24760970 [0,2,0,0,0,0|1,0,1]=4 9873 B9R0.2 CC(C)CCSCCCBr Amb25358052 [0,2,0,0,0,0|1,0,1]=4 9874 B9R0.2 CC(C)CCSCCCS Amb25055353 [0,2,0,0,0,0|1,0,1]=4 9875 B9R0.2 CC(C)CNCCCCF Amb25256367 [0,2,0,0,0,0|1,0,1]=4 9876 B9R0.2 CC(C)CNCCCCI Amb24570093 [0,2,0,0,0,0|1,0,1]=4 9877 B9R0.2 CC(C)COCCCCCl Amb18798375 [0,2,0,0,0,0|1,0,1]=4 9878 B9R0.2 CC(C)COCCCCS Amb25058327 [0,2,0,0,0,0|1,0,1]=4 9879 B9R0.2 CC(C)CSCCCCCl Amb18184970 [0,2,0,0,0,0|1,0,1]=4 9880 B9R0.2 CC(C)CSCCCCS Amb24748171 [0,2,0,0,0,0|1,0,1]=4 9881 B9R0.2 CC(C)NCCCCCBr Amb24694234 [0,2,0,0,0,0|1,0,1]=4 9882 B9R0.2 CC(C)NCCCCCN Amb21953734 [0,2,0,0,0,0|1,0,1]=4 9883 B9R0.2 CC(C)OCCCCCBr Amb25060878 [0,2,0,0,0,0|1,0,1]=4 9884 B9R0.2 CC(C)OCCCCCN Amb25049832 [0,2,0,0,0,0|1,0,1]=4 9885 B9R0.2 CC(C)OCCCCCS Amb25788551 [0,2,0,0,0,0|1,0,1]=4 9886 B9R0.2 CC(C)SCCCCCCl Amb18796389 [0,2,0,0,0,0|1,0,1]=4 9887 B9R0.2 CC(C)SCCCCCF Amb24393727 [0,2,0,0,0,0|1,0,1]=4 9888 B9R0.2 CC(C)SCCCCCN Amb18792402 [0,2,0,0,0,0|1,0,1]=4 9889 B9R0.2 CC(C)SCCCCCO Amb18800676 [0,2,0,0,0,0|1,0,1]=4 9890 B9R0.2 CC(Cl)CCCCCCO Amb25210096 [0,2,0,0,0,0|1,0,1]=4 9891 B9R0.2 CC(Cl)CCCNCCF Amb25053831 [0,2,0,0,0,0|1,0,1]=4 9892 B9R0.2 CC(N)=NCCCCC#C Amb25750969 [0,2,0,0,0,0|1,0,1]=4 9893 B9R0.2 CC(N)=NCCCCC#N Amb25699271 [0,2,0,0,0,0|1,0,1]=4 9894 B9R0.2 CC(N)=NCCCCCO Amb25761933 [0,2,0,0,0,0|1,0,0]=3 9895 B9R0.2 CC(N)=NCCOCCO Amb24396802 [0,2,0,0,0,0|2,0,0]=4 9896 B9R0.2 CC(N)CCCCCC#C Amb25060631 [0,2,0,0,0,0|1,0,1]=4 9897 B9R0.2 CC(N)CCCNCCF Amb24448171 [0,2,0,0,0,0|1,0,1]=4 9898 B9R0.2 CC(N)CCSCCCF Amb24617430 [0,2,0,0,0,0|1,0,1]=4 9899 B9R0.2 CC(N)CCSCCCO Amb25074083 [0,2,0,0,0,0|1,0,1]=4 9900 B9R0.2 CC(N)CNCCCCF Amb24364143 [0,2,0,0,0,0|1,0,1]=4 9901 B9R0.2 CC(N)CSCCCCF Amb24660427 [0,2,0,0,0,0|1,0,1]=4 9902 B9R0.2 CC(O)CCCCCC#C Amb25147698 [0,2,0,0,0,0|0,0,2]=4 9903 B9R0.2 CC(O)CCCCCC=O Amb24611207 [0,2,0,0,0,0|0,0,2]=4 9904 B9R0.2 CC(O)CCCCCCF Amb24685025 [0,2,0,0,0,0|0,0,2]=4 9905 B9R0.2 CC(O)CCCNCCF Amb24481149 [0,2,0,0,0,0|0,0,2]=4 9906 B9R0.2 CC(O)CCCOCCO Amb25682125 [0,2,0,0,0,0|0,0,2]=4 9907 B9R0.2 CC(O)CCCSCCN Amb25676264 [0,2,0,0,0,0|0,0,2]=4 9908 B9R0.2 CC(O)CCCSCCO Amb25848714 [0,2,0,0,0,0|0,0,2]=4 9909 B9R0.2 CC(O)CCNCCCN Amb25111706 [0,2,0,0,0,0|0,0,2]=4 9910 B9R0.2 CC(O)CCNCCCO Amb25201402 [0,2,0,0,0,0|0,0,2]=4 9911 B9R0.2 CC(O)CCOCCCN Amb24630914 [0,2,0,0,0,0|0,0,2]=4 9912 B9R0.2 CC(O)CCSCCCN Amb25108386 [0,2,0,0,0,0|0,0,2]=4 9913 B9R0.2 CC(O)CNCCCCF Amb25705721 [0,2,0,0,0,0|0,0,2]=4 9914 B9R0.2 CC(O)CNCCCCS Amb25805139 [0,2,0,0,0,0|0,0,2]=4 9915 B9R0.2 CC=C=CCCCC(C)=O Amb24364249 [0,2,0,0,0,0|0,0,1]=3 9916 B9R0.2 CC=C=CCCCC(N)=O Amb24479054 [0,2,0,0,0,0|1,0,1]=4 9917 B9R0.2 CCC#CCCOC(C)=O Amb22641578 [0,2,0,0,0,0|0,0,1]=3 9918 B9R0.2 CCC=CCC=CC(C)=O Amb24061730 [0,2,0,0,0,0|0,0,2]=4 9919 B9R0.2 CCCC#CC#CC(=O)C Amb17593414 [0,2,0,0,0,0|0,0,2]=4 9920 B9R0.2 CCCC#CCCC(C)=O Amb24480490 [0,2,0,0,0,0|0,0,0]=2 9921 B9R0.2 CCCC#CCCC(C)O Amb25099377 [0,2,0,0,0,0|0,0,2]=4 9922 B9R0.2 CCCC=C\C=C\C(C)=O Amb25274464 [0,2,0,0,0,0|0,0,2]=4 9923 B9R0.2 CCCC=NNCC(C)=C Amb25135830 [0,2,0,0,0,0|1,0,1]=4 9924 B9R0.2 CCCCC#CCC(C)=O Amb24479204 [0,2,0,0,0,0|0,0,0]=2 9925 B9R0.2 CCCCC#CCC(N)=O Amb25105357 [0,2,0,0,0,0|1,0,0]=3 9926 B9R0.2 CCCCC=C=CC(=O)O Amb17593544 [0,2,0,0,0,0|1,0,1]=4 9927 B9R0.2 CCCCC=C=CC(C)=O Amb24061644 [0,2,0,0,0,0|0,0,1]=3 9928 B9R0.2 CCCCC=NNC(C)=O Amb25206196 [0,2,0,0,0,0|0,0,1]=3 9929 B9R0.2 CCCCCC#CC(C)=O Amb25146663 [0,2,0,0,0,0|0,0,0]=2 9930 B9R0.2 CCCCCC#CC(C)Br Amb25743386 [0,2,0,0,0,0|1,0,1]=4 9931 B9R0.2 CCCCCC#CC(N)=O Amb25363776 [0,2,0,0,0,0|1,0,0]=3 9932 B9R0.2 CCCCCC#C[C@H](C)O Amb25762969 [0,2,0,0,0,0|0,0,2]=4 9933 B9R0.2 CCCCCCC=C(C)C Amb24539575 [0,2,0,0,0,0|1,0,0]=3 9934 B9R0.2 CCCCCCCC(=O)S Amb10561702 [0,2,0,0,0,0|1,0,0]=3 9935 B9R0.2 CCCCCCCC(O)=O Amb22352272 [0,2,0,0,0,0|1,0,0]=3 9936 B9R0.2 CCCCCCCC(O)=O Amb22353407 [0,2,0,0,0,0|1,0,0]=3 9937 B9R0.2 CCCCCCCC([O-])=O Amb22045472 [0,2,0,0,0,0|1,0,0]=3 9938 B9R0.2 CCCCCCCC([O-])=O Amb22731641 [0,2,0,0,0,0|1,0,0]=3 9939 B9R0.2 CCCCCCCC([O-])=O Amb22732291 [0,2,0,0,0,0|1,0,0]=3 9940 B9R0.2 CCCCCCCC([O-])=O Amb22732747 [0,2,0,0,0,0|1,0,0]=3 9941 B9R0.2 CCCCCCC[13C](O)=O Amb20243497 [0,2,0,0,0,0|1,0,0]=3 9942 B9R0.2 CCCCCCC[13C]([O-])=O Amb22366893 [0,2,0,0,0,0|1,0,0]=3 9943 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [0,2,0,0,0,0|1,0,1]=4 9944 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,2,0,0,0,0|0,0,2]=4 9945 B9R0.2 CCCCCCC[C@H](C)Br Amb25277237 [0,2,0,0,0,0|1,0,1]=4 9946 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [0,2,0,0,0,0|1,0,1]=4 9947 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,2,0,0,0,0|0,0,2]=4 9948 B9R0.2 CCCCCCC[N+]([O-])=O Amb17672611 [0,2,0,0,0,0|2,0,0]=4 9949 B9R0.2 CCCCCCNC(=S)N Amb1152526 [0,2,0,0,0,0|1,1,0]=4 9950 B9R0.2 CCCCCCNC(C)=N Amb25288761 [0,2,0,0,0,0|1,0,0]=3 9951 B9R0.2 CCCCCCNC(N)=N Amb25292193 [0,2,0,0,0,0|2,0,0]=4 9952 B9R0.2 CCCCCCNC(N)=O Amb23569596 [0,2,0,0,0,0|1,0,0]=3 9953 B9R0.2 CCCCCCNC(O)=S Amb24375451 [0,2,0,0,0,0|1,0,1]=4 9954 B9R0.2 CCCCCCNC(S)=S Amb24702211 [0,2,0,0,0,0|1,1,0]=4 9955 B9R0.2 CCCCCCNN(C)C Amb25227754 [0,2,0,0,0,0|2,0,0]=4 9956 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [0,2,0,0,0,0|1,0,0]=3 9957 B9R0.2 CCCCCCOC(C)Cl Amb25662692 [0,2,0,0,0,0|1,0,1]=4 9958 B9R0.2 CCCCCCOC(N)=O Amb22495526 [0,2,0,0,0,0|1,0,0]=3 9959 B9R0.2 CCCCCCOC([S-])=S Amb19849157 [0,2,0,0,0,0|1,1,0]=4 9960 B9R0.2 CCCCCCSC(N)=N Amb20676030 [0,2,0,0,0,0|2,0,0]=4 9961 B9R0.2 CCCCCCSC(N)=N Amb22487386 [0,2,0,0,0,0|2,0,0]=4 9962 B9R0.2 CCCCCCSC(N)=O Amb25765687 [0,2,0,0,0,0|1,0,0]=3 9963 B9R0.2 CCCCCC[13CH2]C(O)=O Amb22367410 [0,2,0,0,0,0|1,0,0]=3 9964 B9R0.2 CCCCCC[13CH2][13C](O)=O Amb22367490 [0,2,0,0,0,0|1,0,0]=3 9965 B9R0.2 CCCCCN=CN(C)C Amb24430694 [0,2,0,0,0,0|2,0,0]=4 9966 B9R0.2 CCCCCNCC(=C)C Amb17308711 [0,2,0,0,0,0|1,0,0]=3 9967 B9R0.2 CCCCCNCC(=C)Cl Amb18800599 [0,2,0,0,0,0|1,0,1]=4 9968 B9R0.2 CCCCCNCC(=O)Cl Amb25248398 [0,2,0,0,0,0|1,0,0]=3 9969 B9R0.2 CCCCCNN=C(C)C Amb24732722 [0,2,0,0,0,0|1,0,0]=3 9970 B9R0.2 CCCCCNOC(C)C Amb24437727 [0,2,0,0,0,0|1,0,1]=4 9971 B9R0.2 CCCCCOCC(=C)Br Amb25261580 [0,2,0,0,0,0|1,0,1]=4 9972 B9R0.2 CCCCCOCC(N)=O Amb25770302 [0,2,0,0,0,0|1,0,0]=3 9973 B9R0.2 CCCCCONC(N)=N Amb25147362 [0,2,0,0,0,0|2,0,0]=4 9974 B9R0.2 CCCCCSCC(=C)Cl Amb25220149 [0,2,0,0,0,0|1,0,1]=4 9975 B9R0.2 CCCCCSCC(C)N Amb25857333 [0,2,0,0,0,0|1,0,1]=4 9976 B9R0.2 CCCCCSCC(C)O Amb24675808 [0,2,0,0,0,0|0,0,2]=4 9977 B9R0.2 CCCCCSCC(N)=N Amb24382920 [0,2,0,0,0,0|2,0,0]=4 9978 B9R0.2 CCCCCSCC(N)=O Amb24524402 [0,2,0,0,0,0|1,0,0]=3 9979 B9R0.2 CCCCCSC[C@@H](C)N Amb24479642 [0,2,0,0,0,0|1,0,1]=4 9980 B9R0.2 CCCCCSC[C@@H](C)O Amb24581873 [0,2,0,0,0,0|0,0,2]=4 9981 B9R0.2 CCCCCSC[C@H](C)O Amb25796591 [0,2,0,0,0,0|0,0,2]=4 9982 B9R0.2 CCCCC\C=C/C(C)=O Amb25783438 [0,2,0,0,0,0|0,0,0]=2 9983 B9R0.2 CCCCC\C=C/C(C)C Amb22546691 [0,2,0,0,0,0|1,0,1]=4 9984 B9R0.2 CCCCC\C=C\C(=O)Cl Amb24754105 [0,2,0,0,0,0|1,0,0]=3 9985 B9R0.2 CCCCC\C=C\C(C)=O Amb22052624 [0,2,0,0,0,0|0,0,0]=2 9986 B9R0.2 CCCCC\C=C\C(C)C Amb22546757 [0,2,0,0,0,0|1,0,1]=4 9987 B9R0.2 CCCCC\C=C\C(N)=N Amb25260868 [0,2,0,0,0,0|2,0,0]=4 9988 B9R0.2 CCCCC\C=C\[C@@H](C)O Amb25795409 [0,2,0,0,0,0|0,0,2]=4 9989 B9R0.2 CCCCN=CCC(C)=O Amb25276853 [0,2,0,0,0,0|0,0,0]=2 9990 B9R0.2 CCCCNCC=C(C)C Amb18643772 [0,2,0,0,0,0|1,0,0]=3 9991 B9R0.2 CCCCNCCC(C)=C Amb24652080 [0,2,0,0,0,0|1,0,0]=3 9992 B9R0.2 CCCCNCCC(C)N Amb24477984 [0,2,0,0,0,0|1,0,1]=4 9993 B9R0.2 CCCCNCCN(C)C Amb1124804 [0,2,0,0,0,0|2,0,0]=4 9994 B9R0.2 CCCCNCCS(C)=O Amb24397424 [0,2,0,0,0,0|1,0,0]=3 9995 B9R0.2 CCCCNCC[C@@H](C)O Amb24568301 [0,2,0,0,0,0|0,0,2]=4 9996 B9R0.2 CCCCNOCC(C)C Amb24717271 [0,2,0,0,0,0|1,0,1]=4 9997 B9R0.2 CCCCNOCC(N)=O Amb24561497 [0,2,0,0,0,0|1,0,0]=3 9998 B9R0.2 CCCCN\C=C/C(C)=O Amb25348567 [0,2,0,0,0,0|0,0,1]=3 9999 B9R0.2 CCCCN\C=C\C(C)=O Amb25147404 [0,2,0,0,0,0|0,0,1]=3 10000 B9R0.2 CCCCN\C=C\C(O)=O Amb25703721 [0,2,0,0,0,0|1,0,1]=4 10001 B9R0.2 CCCCOCCC(C)Br Amb25103284 [0,2,0,0,0,0|1,0,1]=4 10002 B9R0.2 CCCCOCCC(C)O Amb24455174 [0,2,0,0,0,0|0,0,2]=4 10003 B9R0.2 CCCCOCSC(N)=N Amb24635825 [0,2,0,0,0,0|2,0,0]=4 10004 B9R0.2 CCCCO\C=C\C(C)=O Amb25146855 [0,2,0,0,0,0|0,0,1]=3 10005 B9R0.2 CCCCO\C=C\C(O)=O Amb18644130 [0,2,0,0,0,0|1,0,1]=4 10006 B9R0.2 CCCCSCC=C(C)C Amb24464957 [0,2,0,0,0,0|1,0,0]=3 10007 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,2,0,0,0,0|1,0,0]=3 10008 B9R0.2 CCCCSCCC(=S)N Amb17503251 [0,2,0,0,0,0|1,1,0]=4 10009 B9R0.2 CCCCSCCC(C)O Amb25108387 [0,2,0,0,0,0|0,0,2]=4 10010 B9R0.2 CCCCSCCC(N)=O Amb18798040 [0,2,0,0,0,0|1,0,0]=3 10011 B9R0.2 CCCCSCCN(C)C Amb24482729 [0,2,0,0,0,0|2,0,0]=4 10012 B9R0.2 CCCCSCC[C@@H](C)O Amb25092039 [0,2,0,0,0,0|0,0,2]=4 10013 B9R0.2 CCCCSCC[C@H](C)O Amb24355162 [0,2,0,0,0,0|0,0,2]=4 10014 B9R0.2 CCCCSCC[N+]([O-])=O Amb24482730 [0,2,0,0,0,0|2,0,0]=4 10015 B9R0.2 CCCCS\C=C/C(O)=O Amb18645412 [0,2,0,0,0,0|1,0,1]=4 10016 B9R0.2 CCCCS\C=C\C(O)=O Amb24380477 [0,2,0,0,0,0|1,0,1]=4 10017 B9R0.2 CCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22351826 [0,2,0,0,0,0|1,0,0]=3 10018 B9R0.2 CCCC\C=C\CC(=O)N Amb1815461 [0,2,0,0,0,0|1,0,0]=3 10019 B9R0.2 CCCC\C=C\CC(C)N Amb24744361 [0,2,0,0,0,0|1,0,1]=4 10020 B9R0.2 CCCC\C=C\C[C@@H](C)O Amb25041963 [0,2,0,0,0,0|0,0,2]=4 10021 B9R0.2 CCCC\C=C\NC(C)=O Amb24674131 [0,2,0,0,0,0|0,0,1]=3 10022 B9R0.2 CCCC\C=C\OC(C)=O Amb25293926 [0,2,0,0,0,0|0,0,1]=3 10023 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,2,0,0,0,0|1,0,0]=3 10024 B9R0.2 CCCNCCCC(C)=C Amb25724747 [0,2,0,0,0,0|1,0,0]=3 10025 B9R0.2 CCCNCCCC(C)Br Amb24639117 [0,2,0,0,0,0|1,0,1]=4 10026 B9R0.2 CCCNCCCC(C)Cl Amb24481144 [0,2,0,0,0,0|1,0,1]=4 10027 B9R0.2 CCCNCCCC(C)O Amb24478896 [0,2,0,0,0,0|0,0,2]=4 10028 B9R0.2 CCCNCCCC(N)=O Amb24513695 [0,2,0,0,0,0|1,0,0]=3 10029 B9R0.2 CCCNCCNC(C)C Amb20077354 [0,2,0,0,0,0|1,0,1]=4 10030 B9R0.2 CCCNCCOC(C)=O Amb18928593 [0,2,0,0,0,0|0,0,0]=2 10031 B9R0.2 CCCNCCOC(C)C Amb24419645 [0,2,0,0,0,0|1,0,1]=4 10032 B9R0.2 CCCNCCSC(C)C Amb18177759 [0,2,0,0,0,0|1,0,1]=4 10033 B9R0.2 CCCNOCCC(C)=O Amb24580378 [0,2,0,0,0,0|0,0,0]=2 10034 B9R0.2 CCCOCCCC(C)N Amb25776191 [0,2,0,0,0,0|1,0,1]=4 10035 B9R0.2 CCCOCCNC(C)C Amb24476713 [0,2,0,0,0,0|1,0,1]=4 10036 B9R0.2 CCCOCCOC(C)=O Amb25354004 [0,2,0,0,0,0|0,0,0]=2 10037 B9R0.2 CCCONCCC(C)=C Amb25376802 [0,2,0,0,0,0|1,0,0]=3 10038 B9R0.2 CCCSCCCC(C)C Amb25761075 [0,2,0,0,0,0|1,0,1]=4 10039 B9R0.2 CCCSCCCC(C)O Amb24430166 [0,2,0,0,0,0|0,0,2]=4 10040 B9R0.2 CCCSCCNC(C)=O Amb24548362 [0,2,0,0,0,0|0,0,0]=2 10041 B9R0.2 CCCSCCNC(C)C Amb18177755 [0,2,0,0,0,0|1,0,1]=4 10042 B9R0.2 CCCSCCNC(N)=S Amb25368583 [0,2,0,0,0,0|1,1,0]=4 10043 B9R0.2 CCCSCCOC(C)C Amb25783108 [0,2,0,0,0,0|1,0,1]=4 10044 B9R0.2 CCCSCCSC(C)C Amb24719190 [0,2,0,0,0,0|1,0,1]=4 10045 B9R0.2 CCC\C=C/CCC(N)=O Amb24400971 [0,2,0,0,0,0|1,0,0]=3 10046 B9R0.2 CCC\C=C\C#CC(=O)C Amb17593455 [0,2,0,0,0,0|0,0,2]=4 10047 B9R0.2 CCC\C=C\C=CC(C)=O Amb24722296 [0,2,0,0,0,0|0,0,2]=4 10048 B9R0.2 CCC\C=C\C=C\C(C)=O Amb25050290 [0,2,0,0,0,0|0,0,2]=4 10049 B9R0.2 CCC\C=C\CCC(O)=O Amb25378821 [0,2,0,0,0,0|1,0,0]=3 10050 B9R0.2 CCC\C=C\OCC(C)=O Amb24467180 [0,2,0,0,0,0|0,0,1]=3 10051 B9R0.2 CCN=NCCCN(C)C Amb24542856 [0,2,0,0,0,0|2,0,0]=4 10052 B9R0.2 CCNCCCCC(C)C Amb25185215 [0,2,0,0,0,0|1,0,1]=4 10053 B9R0.2 CCNCCCCC(O)=O Amb24385094 [0,2,0,0,0,0|1,0,0]=3 10054 B9R0.2 CCNCCCNC(C)C Amb20171817 [0,2,0,0,0,0|1,0,1]=4 10055 B9R0.2 CCNCCCSC(C)C Amb18177750 [0,2,0,0,0,0|1,0,1]=4 10056 B9R0.2 CCNCCNCC(O)=O Amb24568313 [0,2,0,0,0,0|1,0,0]=3 10057 B9R0.2 CCNCCOCC(=C)Cl Amb18798259 [0,2,0,0,0,0|1,0,1]=4 10058 B9R0.2 CCNCCOCC(C)=O Amb18111808 [0,2,0,0,0,0|0,0,0]=2 10059 B9R0.2 CCNCCOCC(O)=O Amb18111801 [0,2,0,0,0,0|1,0,0]=3 10060 B9R0.2 CCNCCSCC(C)C Amb18177751 [0,2,0,0,0,0|1,0,1]=4 10061 B9R0.2 CCOCCCCC(C)N Amb25304977 [0,2,0,0,0,0|1,0,1]=4 10062 B9R0.2 CCOCCCCC(N)=S Amb18180039 [0,2,0,0,0,0|1,1,0]=4 10063 B9R0.2 CCOCCCOC(C)=O Amb22733319 [0,2,0,0,0,0|0,0,0]=2 10064 B9R0.2 CCOCCCSC(C)C Amb25143800 [0,2,0,0,0,0|1,0,1]=4 10065 B9R0.2 CCOCCNCC(=C)Br Amb25096907 [0,2,0,0,0,0|1,0,1]=4 10066 B9R0.2 CCOCCNCC(=C)Cl Amb18792528 [0,2,0,0,0,0|1,0,1]=4 10067 B9R0.2 CCOCCNC[C@@H](C)O Amb25127396 [0,2,0,0,0,0|0,0,2]=4 10068 B9R0.2 CCOCCNC[C@H](C)O Amb25703768 [0,2,0,0,0,0|0,0,2]=4 10069 B9R0.2 CCOCCOCC(=C)Br Amb25822824 [0,2,0,0,0,0|1,0,1]=4 10070 B9R0.2 CCOCCOC[C@H](C)N Amb25088047 [0,2,0,0,0,0|1,0,1]=4 10071 B9R0.2 CCOCCSCC(=C)Cl Amb24388654 [0,2,0,0,0,0|1,0,1]=4 10072 B9R0.2 CCOCCSCC(N)=O Amb25837642 [0,2,0,0,0,0|1,0,0]=3 10073 B9R0.2 CCOCOCCC(C)O Amb24475090 [0,2,0,0,0,0|0,0,2]=4 10074 B9R0.2 CCOCSCCN(C)C Amb25128660 [0,2,0,0,0,0|2,0,0]=4 10075 B9R0.2 CCONCCCC(C)C Amb24479255 [0,2,0,0,0,0|1,0,1]=4 10076 B9R0.2 CCONCCCC(C)O Amb25762384 [0,2,0,0,0,0|0,0,2]=4 10077 B9R0.2 CCONCCNC(C)=O Amb24454108 [0,2,0,0,0,0|1,0,0]=3 10078 B9R0.2 CCO\C=C/CCC(C)=O Amb25369742 [0,2,0,0,0,0|0,0,1]=3 10079 B9R0.2 CCSCC=NNC(C)=O Amb24456357 [0,2,0,0,0,0|1,0,1]=4 10080 B9R0.2 CCSCCCCC(C)Cl Amb24683400 [0,2,0,0,0,0|1,0,1]=4 10081 B9R0.2 CCSCCCCC(C)N Amb24685694 [0,2,0,0,0,0|1,0,1]=4 10082 B9R0.2 CCSCCCCC(N)=N Amb18792305 [0,2,0,0,0,0|2,0,0]=4 10083 B9R0.2 CCSCCCNC(C)=N Amb25121495 [0,2,0,0,0,0|1,0,0]=3 10084 B9R0.2 CCSCCCNC(C)C Amb18177747 [0,2,0,0,0,0|1,0,1]=4 10085 B9R0.2 CCSCCCNC(N)=N Amb25120351 [0,2,0,0,0,0|2,0,0]=4 10086 B9R0.2 CCSCCCNC(N)=O Amb25791875 [0,2,0,0,0,0|1,0,0]=3 10087 B9R0.2 CCSCCCNN(C)C Amb24361606 [0,2,0,0,0,0|2,0,0]=4 10088 B9R0.2 CCSCCCOC(C)C Amb25256491 [0,2,0,0,0,0|1,0,1]=4 10089 B9R0.2 CCSCCNCC(=C)Br Amb24554517 [0,2,0,0,0,0|1,0,1]=4 10090 B9R0.2 CCSCCNCC(=C)Cl Amb24396455 [0,2,0,0,0,0|1,0,1]=4 10091 B9R0.2 CCSCCNCC(C)C Amb18798056 [0,2,0,0,0,0|1,0,1]=4 10092 B9R0.2 CCSCCNCC(C)O Amb25829716 [0,2,0,0,0,0|0,0,2]=4 10093 B9R0.2 CCSCCNCC(O)=O Amb24652163 [0,2,0,0,0,0|1,0,0]=3 10094 B9R0.2 CCSCCNC[C@@H](C)O Amb24516507 [0,2,0,0,0,0|0,0,2]=4 10095 B9R0.2 CCSCCOCC(C)=O Amb25693909 [0,2,0,0,0,0|0,0,0]=2 10096 B9R0.2 CCSCCOCC(C)C Amb24482936 [0,2,0,0,0,0|1,0,1]=4 10097 B9R0.2 CCSCCOCC(O)=O Amb24716269 [0,2,0,0,0,0|1,0,0]=3 10098 B9R0.2 CCSCCSCC(=C)Br Amb24509405 [0,2,0,0,0,0|1,0,1]=4 10099 B9R0.2 CCSCCSCC(C)=O Amb24522838 [0,2,0,0,0,0|0,0,0]=2 10100 B9R0.2 CCSCCSCC(C)C Amb24446033 [0,2,0,0,0,0|1,0,1]=4 10101 B9R0.2 CCSCCSCC(C)N Amb24389919 [0,2,0,0,0,0|1,0,1]=4 10102 B9R0.2 CCSCCSCC(C)O Amb24450768 [0,2,0,0,0,0|0,0,2]=4 10103 B9R0.2 CCSCC\C=C\C(O)=O Amb25200813 [0,2,0,0,0,0|1,0,1]=4 10104 B9R0.2 CCSCSCC=C(C)C Amb25162638 [0,2,0,0,0,0|1,0,1]=4 10105 B9R0.2 CCSC\C=C/CC(O)=O Amb18645410 [0,2,0,0,0,0|1,0,1]=4 10106 B9R0.2 CCSC\C=C\CC(O)=O Amb25322061 [0,2,0,0,0,0|1,0,1]=4 10107 B9R0.2 CC\C=C/CC#CC(C)=O Amb24068744 [0,2,0,0,0,0|0,0,2]=4 10108 B9R0.2 CC\C=C/CCOC(=O)C Amb10807379 [0,2,0,0,0,0|0,0,1]=3 10109 B9R0.2 CC\C=C\CC#CC(C)=O Amb24646668 [0,2,0,0,0,0|0,0,2]=4 10110 B9R0.2 CC\C=C\CCCC(C)=O Amb24697143 [0,2,0,0,0,0|0,0,0]=2 10111 B9R0.2 CC\C=C\CCCC(C)O Amb24472555 [0,2,0,0,0,0|0,0,2]=4 10112 B9R0.2 CC\C=C\CCCC(O)=O Amb18643886 [0,2,0,0,0,0|1,0,0]=3 10113 B9R0.2 CC\C=C\CCC[C@H](C)O Amb25855838 [0,2,0,0,0,0|0,0,2]=4 10114 B9R0.2 CC\C=C\CCOC(C)=O Amb24706335 [0,2,0,0,0,0|0,0,1]=3 10115 B9R0.2 CC\C=C\CCOC(N)=O Amb25291608 [0,2,0,0,0,0|1,0,1]=4 10116 B9R0.2 CC\N=N\CCCN(C)C Amb20242731 [0,2,0,0,0,0|2,0,0]=4 10117 B9R0.2 CC\N=N\CCCN(C)C Amb25290143 [0,2,0,0,0,0|2,0,0]=4 10118 B9R0.2 CN(C)CCCCCC=O Amb25743404 [0,2,0,0,0,0|2,0,0]=4 10119 B9R0.2 CN(C)CCCCCCCl Amb18800750 [0,2,0,0,0,0|2,0,0]=4 10120 B9R0.2 CN(C)CCCNCCBr Amb24376299 [0,2,0,0,0,0|2,0,0]=4 10121 B9R0.2 CN(C)CCCNCCF Amb24744137 [0,2,0,0,0,0|2,0,0]=4 10122 B9R0.2 CN(C)CCCNCCI Amb25117086 [0,2,0,0,0,0|2,0,0]=4 10123 B9R0.2 CN(C)CCCOCCO Amb25244990 [0,2,0,0,0,0|2,0,0]=4 10124 B9R0.2 CN(C)CCCSCCBr Amb25024315 [0,2,0,0,0,0|2,0,0]=4 10125 B9R0.2 CN(C)CCCSCCCl Amb25771568 [0,2,0,0,0,0|2,0,0]=4 10126 B9R0.2 CN(C)CCCSCCS Amb24539048 [0,2,0,0,0,0|2,0,0]=4 10127 B9R0.2 CN(C)CCNCCCBr Amb24659183 [0,2,0,0,0,0|2,0,0]=4 10128 B9R0.2 CN(C)CCNCCCCl Amb24440015 [0,2,0,0,0,0|2,0,0]=4 10129 B9R0.2 CN(C)CCNCCCI Amb25796620 [0,2,0,0,0,0|2,0,0]=4 10130 B9R0.2 CN(C)CCOCCCN Amb23308391 [0,2,0,0,0,0|2,0,0]=4 10131 B9R0.2 CN(C)CCSCCCO Amb24628477 [0,2,0,0,0,0|2,0,0]=4 10132 B9R0.2 CN(C)NCCCCCO Amb24504968 [0,2,0,0,0,0|2,0,0]=4 10133 B9R0.2 CNCCCCCC(C)=O Amb25728176 [0,2,0,0,0,0|0,0,0]=2 10134 B9R0.2 CNCCCCCC(C)C Amb24505305 [0,2,0,0,0,0|1,0,1]=4 10135 B9R0.2 CNCCCCCC(O)=O Amb25704769 [0,2,0,0,0,0|1,0,0]=3 10136 B9R0.2 CNCCCCCN(C)C Amb24425916 [0,2,0,0,0,0|2,0,0]=4 10137 B9R0.2 CNCCCCCS(C)=O Amb24538468 [0,2,0,0,0,0|1,0,0]=3 10138 B9R0.2 CNCCCCNC(C)C Amb24477986 [0,2,0,0,0,0|1,0,1]=4 10139 B9R0.2 CNCCCCSC(C)C Amb18798064 [0,2,0,0,0,0|1,0,1]=4 10140 B9R0.2 CNCCCNCC(O)=O Amb25292252 [0,2,0,0,0,0|1,0,0]=3 10141 B9R0.2 CNCCCOCC(C)C Amb20076075 [0,2,0,0,0,0|1,0,1]=4 10142 B9R0.2 CNCCCSCC(C)C Amb18177742 [0,2,0,0,0,0|1,0,1]=4 10143 B9R0.2 CNCCNCCC(C)C Amb25187362 [0,2,0,0,0,0|1,0,1]=4 10144 B9R0.2 CNCCOCCC(C)=C Amb25805038 [0,2,0,0,0,0|1,0,0]=3 10145 B9R0.2 CNCCOCCC(C)=O Amb18630756 [0,2,0,0,0,0|0,0,0]=2 10146 B9R0.2 CNCCOCCC(C)C Amb25696260 [0,2,0,0,0,0|1,0,1]=4 10147 B9R0.2 CNCCOCCC(C)O Amb24703694 [0,2,0,0,0,0|0,0,2]=4 10148 B9R0.2 CNCCOCCC(O)=O Amb18111840 [0,2,0,0,0,0|1,0,0]=3 10149 B9R0.2 CNCCOCCN(C)C Amb24406265 [0,2,0,0,0,0|2,0,0]=4 10150 B9R0.2 CNCCSCCC(N)=O Amb25024456 [0,2,0,0,0,0|1,0,0]=3 10151 B9R0.2 COCCCCCC(=O)O Amb10607872 [0,2,0,0,0,0|1,0,0]=3 10152 B9R0.2 COCCCCCC(C)O Amb24669996 [0,2,0,0,0,0|0,0,2]=4 10153 B9R0.2 COCCCCNC(C)=N Amb25334905 [0,2,0,0,0,0|1,0,0]=3 10154 B9R0.2 COCCCCNC(C)C Amb25363772 [0,2,0,0,0,0|1,0,1]=4 10155 B9R0.2 COCCCCNC(N)=O Amb24478015 [0,2,0,0,0,0|1,0,0]=3 10156 B9R0.2 COCCCCNC(N)=S Amb18800671 [0,2,0,0,0,0|1,1,0]=4 10157 B9R0.2 COCCCCOC(C)=O Amb24325176 [0,2,0,0,0,0|0,0,0]=2 10158 B9R0.2 COCCCCSC(C)C Amb24509206 [0,2,0,0,0,0|1,0,1]=4 10159 B9R0.2 COCCCCSC(N)=N Amb24419842 [0,2,0,0,0,0|2,0,0]=4 10160 B9R0.2 COCCCNCC(=C)Br Amb24680536 [0,2,0,0,0,0|1,0,1]=4 10161 B9R0.2 COCCCNCC(=C)C Amb17308605 [0,2,0,0,0,0|1,0,0]=3 10162 B9R0.2 COCCCNCC(=C)Cl Amb18800731 [0,2,0,0,0,0|1,0,1]=4 10163 B9R0.2 COCCCNCC(O)C Amb17138417 [0,2,0,0,0,0|0,0,2]=4 10164 B9R0.2 COCCCNN=C(C)C Amb24594076 [0,2,0,0,0,0|2,0,0]=4 10165 B9R0.2 COCCCOCC(C)=O Amb25056055 [0,2,0,0,0,0|0,0,0]=2 10166 B9R0.2 COCCCOCC(N)=S Amb18792509 [0,2,0,0,0,0|1,1,0]=4 10167 B9R0.2 COCCCOCC(O)=O Amb25304314 [0,2,0,0,0,0|1,0,0]=3 10168 B9R0.2 COCCCOC[C@@H](C)O Amb25145652 [0,2,0,0,0,0|0,0,2]=4 10169 B9R0.2 COCCCON=C(C)C Amb24592311 [0,2,0,0,0,0|2,0,0]=4 10170 B9R0.2 COCCCONC(N)=O Amb24673253 [0,2,0,0,0,0|2,0,0]=4 10171 B9R0.2 COCCCSCC(C)=C Amb25296011 [0,2,0,0,0,0|1,0,0]=3 10172 B9R0.2 COCCCSCC(C)=O Amb25289706 [0,2,0,0,0,0|0,0,0]=2 10173 B9R0.2 COCCCSCC(C)C Amb25135967 [0,2,0,0,0,0|1,0,1]=4 10174 B9R0.2 COCCCSCC(C)N Amb25762953 [0,2,0,0,0,0|1,0,1]=4 10175 B9R0.2 COCCCSCC(C)O Amb25146302 [0,2,0,0,0,0|0,0,2]=4 10176 B9R0.2 COCCCSCC(N)=N Amb25732763 [0,2,0,0,0,0|2,0,0]=4 10177 B9R0.2 COCCCSCC(N)=O Amb25096665 [0,2,0,0,0,0|1,0,0]=3 10178 B9R0.2 COCCCSCC(O)=O Amb18798347 [0,2,0,0,0,0|1,0,0]=3 10179 B9R0.2 COCCCSC[C@@H](C)N Amb25027991 [0,2,0,0,0,0|1,0,1]=4 10180 B9R0.2 COCCCSC[C@@H](C)O Amb24663658 [0,2,0,0,0,0|0,0,2]=4 10181 B9R0.2 COCCC\C=C\C(C)=O Amb25125817 [0,2,0,0,0,0|0,0,1]=3 10182 B9R0.2 COCCNCC=C(C)C Amb25117619 [0,2,0,0,0,0|1,0,1]=4 10183 B9R0.2 COCCNCCC(=S)N Amb17232420 [0,2,0,0,0,0|1,1,0]=4 10184 B9R0.2 COCCNCCC(C)=C Amb25760884 [0,2,0,0,0,0|1,0,0]=3 10185 B9R0.2 COCCNCCC(C)=O Amb24473587 [0,2,0,0,0,0|0,0,0]=2 10186 B9R0.2 COCCNCCC(C)O Amb24361046 [0,2,0,0,0,0|0,0,2]=4 10187 B9R0.2 COCCNCCC(N)=N Amb24482495 [0,2,0,0,0,0|2,0,0]=4 10188 B9R0.2 COCCNCCC(N)=O Amb19960056 [0,2,0,0,0,0|1,0,0]=3 10189 B9R0.2 COCCNCC[C@H](C)N Amb24609848 [0,2,0,0,0,0|1,0,1]=4 10190 B9R0.2 COCCNOCC(N)=O Amb25726213 [0,2,0,0,0,0|2,0,0]=4 10191 B9R0.2 COCCOCCN(C)N Amb25703621 [0,2,0,0,0,0|2,0,0]=4 10192 B9R0.2 COCCOCC[C@@H](C)N Amb25340758 [0,2,0,0,0,0|1,0,1]=4 10193 B9R0.2 COCCOCC[C@H](C)N Amb24411878 [0,2,0,0,0,0|1,0,1]=4 10194 B9R0.2 COCCONCC(C)=C Amb24707536 [0,2,0,0,0,0|2,0,0]=4 10195 B9R0.2 COCCONCC(N)=O Amb24390668 [0,2,0,0,0,0|2,0,0]=4 10196 B9R0.2 COCCSCC=C(C)C Amb24465990 [0,2,0,0,0,0|1,0,1]=4 10197 B9R0.2 COCCSCCC(C)=C Amb24413530 [0,2,0,0,0,0|1,0,0]=3 10198 B9R0.2 COCCSCCC(C)C Amb25028048 [0,2,0,0,0,0|1,0,1]=4 10199 B9R0.2 COCCSCCC(N)=O Amb18788219 [0,2,0,0,0,0|1,0,0]=3 10200 B9R0.2 COCCSCCN(C)C Amb25135436 [0,2,0,0,0,0|2,0,0]=4 10201 B9R0.2 COCOCCCC(C)=O Amb25724503 [0,2,0,0,0,0|0,0,0]=2 10202 B9R0.2 COCSCCCC(C)C Amb25078936 [0,2,0,0,0,0|1,0,1]=4 10203 B9R0.2 CONCCCCC(N)=O Amb24414497 [0,2,0,0,0,0|1,0,0]=3 10204 B9R0.2 CONCCCCC(O)=O Amb25694999 [0,2,0,0,0,0|1,0,0]=3 10205 B9R0.2 CONCCCNC(C)=O Amb24482765 [0,2,0,0,0,0|1,0,0]=3 10206 B9R0.2 CO\C=C\CCCC(O)=O Amb25083414 [0,2,0,0,0,0|1,0,1]=4 10207 B9R0.2 CO\N=C\CCCC(C)=O Amb24690565 [0,2,0,0,0,0|0,0,1]=3 10208 B9R0.2 CS(=O)CCCCCC#N Amb24326343 [0,2,0,0,0,0|1,0,0]=3 10209 B9R0.2 CS(=O)CCCCCCCl Amb24365969 [0,2,0,0,0,0|1,0,0]=3 10210 B9R0.2 CS(=O)CCCCN=[N+]=[N-] Amb22054364 [0,2,0,0,0,0|2,0,0]=4 10211 B9R0.2 CS(=O)CCCC\C=N\O Amb22055821 [0,2,0,0,0,0|1,0,1]=4 10212 B9R0.2 CS(=O)CCCNCC#N Amb24433765 [0,2,0,0,0,0|1,0,1]=4 10213 B9R0.2 CS(=O)CCCNCCN Amb25788907 [0,2,0,0,0,0|1,0,0]=3 10214 B9R0.2 CS(=O)CCCNCCO Amb25147738 [0,2,0,0,0,0|1,0,0]=3 10215 B9R0.2 CS(=O)CCNCCC#C Amb24397423 [0,2,0,0,0,0|1,0,1]=4 10216 B9R0.2 CS(=O)CCNCCCI Amb24681610 [0,2,0,0,0,0|1,0,0]=3 10217 B9R0.2 CS(=O)CCNCCCO Amb24701015 [0,2,0,0,0,0|1,0,0]=3 10218 B9R0.2 CS(=O)CCOCCCN Amb25346823 [0,2,0,0,0,0|1,0,0]=3 10219 B9R0.2 CS(=O)CCSCCCO Amb24538900 [0,2,0,0,0,0|1,0,0]=3 10220 B9R0.2 CS(=O)NCCCCC#C Amb25177217 [0,2,0,0,0,0|1,0,1]=4 10221 B9R0.2 CS(=O)NCCOCCO Amb25177301 [0,2,0,0,0,0|2,0,0]=4 10222 B9R0.2 CSCCC=NNC(C)=O Amb24643306 [0,2,0,0,0,0|1,0,1]=4 10223 B9R0.2 CSCCCCCC(C)Br Amb24674793 [0,2,0,0,0,0|1,0,1]=4 10224 B9R0.2 CSCCCCCC(C)Cl Amb25229910 [0,2,0,0,0,0|1,0,1]=4 10225 B9R0.2 CSCCCCCC(C)N Amb24387980 [0,2,0,0,0,0|1,0,1]=4 10226 B9R0.2 CSCCCCNC(C)=N Amb25075050 [0,2,0,0,0,0|1,0,0]=3 10227 B9R0.2 CSCCCCNC(C)C Amb18798069 [0,2,0,0,0,0|1,0,1]=4 10228 B9R0.2 CSCCCCNC(N)=S Amb24679096 [0,2,0,0,0,0|1,1,0]=4 10229 B9R0.2 CSCCCNC[C@H](C)O Amb25091074 [0,2,0,0,0,0|0,0,2]=4 10230 B9R0.2 CSCCCONC(C)=O Amb25702616 [0,2,0,0,0,0|1,0,0]=3 10231 B9R0.2 CSCCCONC(N)=O Amb25675874 [0,2,0,0,0,0|2,0,0]=4 10232 B9R0.2 CSCCCSCC(C)=C Amb25213826 [0,2,0,0,0,0|1,0,0]=3 10233 B9R0.2 CSCCCSCC(C)O Amb24425891 [0,2,0,0,0,0|0,0,2]=4 10234 B9R0.2 CSCCNCCC(C)C Amb18800588 [0,2,0,0,0,0|1,0,1]=4 10235 B9R0.2 CSCCNCCC(C)Cl Amb24738945 [0,2,0,0,0,0|1,0,1]=4 10236 B9R0.2 CSCCNCCC(C)O Amb25304485 [0,2,0,0,0,0|0,0,2]=4 10237 B9R0.2 CSCCNCCC(O)=O Amb25055507 [0,2,0,0,0,0|1,0,0]=3 10238 B9R0.2 CSCCNCCN(C)C Amb18800678 [0,2,0,0,0,0|2,0,0]=4 10239 B9R0.2 CSCCOCCC(C)=O Amb25810170 [0,2,0,0,0,0|0,0,0]=2 10240 B9R0.2 CSCCOCCC(O)=O Amb25173504 [0,2,0,0,0,0|1,0,0]=3 10241 B9R0.2 CSCCSCC=C(C)C Amb25297217 [0,2,0,0,0,0|1,0,1]=4 10242 B9R0.2 CSCCSCCC(C)=C Amb24448113 [0,2,0,0,0,0|1,0,0]=3 10243 B9R0.2 CSCCSCCC(C)=O Amb24381035 [0,2,0,0,0,0|0,0,0]=2 10244 B9R0.2 CSCCSCCC(N)=N Amb25139647 [0,2,0,0,0,0|2,0,0]=4 10245 B9R0.2 CSCCSCCC(N)=O Amb24504409 [0,2,0,0,0,0|1,0,0]=3 10246 B9R0.2 CSCCSCCC(O)=O Amb25798868 [0,2,0,0,0,0|1,0,0]=3 10247 B9R0.2 CSCCSCCN(C)C Amb25825536 [0,2,0,0,0,0|2,0,0]=4 10248 B9R0.2 CSCSCCCC(C)C Amb25161978 [0,2,0,0,0,0|1,0,1]=4 10249 B9R0.2 CSSCCCCC(O)=O Amb24429106 [0,2,0,0,0,0|1,0,0]=3 10250 B9R0.2 CSSCCNCC(C)=C Amb24538610 [0,2,0,0,0,0|2,0,0]=4 10251 B9R0.2 CSSCCNCC(O)=O Amb24538756 [0,2,0,0,0,0|2,0,0]=4 10252 B9R0.2 CS\C=C\CCCC(O)=O Amb25848561 [0,2,0,0,0,0|1,0,1]=4 10253 B9R0.2 C[13CH2]CCCCCC(O)=O Amb22367488 [0,2,0,0,0,0|1,0,0]=3 10254 B9R0.2 C[C@@H](N)CCCCCC#C Amb24427659 [0,2,0,0,0,0|1,0,1]=4 10255 B9R0.2 C[C@@H](N)CNCCCCF Amb25789392 [0,2,0,0,0,0|1,0,1]=4 10256 B9R0.2 C[C@@H](O)CCCCCCF Amb24448007 [0,2,0,0,0,0|0,0,2]=4 10257 B9R0.2 C[C@@H](O)CNCCCCF Amb25172363 [0,2,0,0,0,0|0,0,2]=4 10258 B9R0.2 C[C@H](N)CCCCCCN Amb24738393 [0,2,0,0,0,0|1,0,1]=4 10259 B9R0.2 C[C@H](N)CNCCCCF Amb25076887 [0,2,0,0,0,0|1,0,1]=4 10260 B9R0.2 C[C@H](O)CCCCCC=C Amb24384728 [0,2,0,0,0,0|0,0,2]=4 10261 B9R0.2 C[C@H](O)CCCCCCN Amb25045097 [0,2,0,0,0,0|0,0,2]=4 10262 B9R0.2 C[C@H](O)CNCCCCF Amb25287098 [0,2,0,0,0,0|0,0,2]=4 10263 B9R0.2 C[C@H](O)CNCCCCO Amb25070079 [0,2,0,0,0,0|0,0,2]=4 10264 B9R0.2 C\C(\N)=N\CCCCC=C Amb25381286 [0,2,0,0,0,0|1,0,1]=4 10265 B9R0.2 C\C=C/CCCCC(C)=O Amb25129045 [0,2,0,0,0,0|0,0,0]=2 10266 B9R0.2 C\C=C/COCCC(O)=O Amb24377336 [0,2,0,0,0,0|1,0,1]=4 10267 B9R0.2 C\C=C\C=C\CCC(C)=O Amb24478389 [0,2,0,0,0,0|0,0,2]=4 10268 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [0,2,0,0,0,0|0,0,0]=2 10269 B9R0.2 C\C=C\CCCCC(O)=O Amb18643887 [0,2,0,0,0,0|1,0,0]=3 10270 B9R0.2 C\C=C\CCCNC(C)=O Amb24668710 [0,2,0,0,0,0|0,0,1]=3 10271 B9R0.2 C\C=C\CCNCC(C)=C Amb24524385 [0,2,0,0,0,0|1,0,1]=4 10272 B9R0.2 C\C=C\CC\C=C\C(C)=O Amb24402185 [0,2,0,0,0,0|0,0,2]=4 10273 B9R0.2 C\C=C\CNCCC(C)=C Amb24645701 [0,2,0,0,0,0|1,0,1]=4 10274 B9R0.2 C\C=C\CNCCS(C)=O Amb24480814 [0,2,0,0,0,0|1,0,1]=4 10275 B9R0.2 C\C=C\COCCC(C)=O Amb25059570 [0,2,0,0,0,0|0,0,1]=3 10276 B9R0.2 C\C=C\COCCC(N)=O Amb24505222 [0,2,0,0,0,0|1,0,1]=4 10277 B9R0.2 C\C=C\COCCC(O)=O Amb24478110 [0,2,0,0,0,0|1,0,1]=4 10278 B9R0.2 C\C=C\CSCCC(C)=C Amb25204865 [0,2,0,0,0,0|1,0,1]=4 10279 B9R0.2 ClCCCCCC=C(Cl)Cl Amb25836265 [0,2,0,0,0,0|2,0,0]=4 10280 B9R0.2 ClCCCCCCC(=O)O Amb17594087 [0,2,0,0,0,0|1,0,0]=3 10281 B9R0.2 ClCCNCCCN(C)C Amb17334624 [0,2,0,0,0,0|2,0,0]=4 10282 B9R0.2 FC(F)=CCCCCCCl Amb25129470 [0,2,0,0,0,0|2,0,0]=4 10283 B9R0.2 N#CCCCCCC(O)=O Amb18643705 [0,2,0,0,0,0|1,0,0]=3 10284 B9R0.2 N#CCCCSCC(=C)C Amb17504243 [0,2,0,0,0,0|1,0,1]=4 10285 B9R0.2 N#CCCCSCC(=O)C Amb17504235 [0,2,0,0,0,0|0,0,1]=3 10286 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [0,2,0,0,0,0|1,0,1]=4 10287 B9R0.2 N#CCCNCCC(=O)O Amb17315318 [0,2,0,0,0,0|1,0,1]=4 10288 B9R0.2 N#CCCOCCC(O)=O Amb24409319 [0,2,0,0,0,0|1,0,1]=4 10289 B9R0.2 N#CCCSCCC(O)=O Amb18927741 [0,2,0,0,0,0|1,0,1]=4 10290 B9R0.2 N#CCSCCCC(=O)O Amb17501766 [0,2,0,0,0,0|1,0,1]=4 10291 B9R0.2 NC(=N)CCCCCCCl Amb24417141 [0,2,0,0,0,0|2,0,0]=4 10292 B9R0.2 NC(=N)NCCCCCO Amb19823705 [0,2,0,0,0,0|2,0,0]=4 10293 B9R0.2 NC(=O)CCCCC=NO Amb24624690 [0,2,0,0,0,0|1,0,1]=4 10294 B9R0.2 NC(=O)CCCCCC#N Amb24568680 [0,2,0,0,0,0|1,0,0]=3 10295 B9R0.2 NC(=O)CCCCN=C=S Amb25192150 [0,2,0,0,0,0|1,0,1]=4 10296 B9R0.2 NC(=O)CCCCNC#N Amb25828250 [0,2,0,0,0,0|1,0,1]=4 10297 B9R0.2 NC(=O)CCCC\C=C\Br Amb24760295 [0,2,0,0,0,0|1,0,1]=4 10298 B9R0.2 NC(=O)CCCC\C=C\Cl Amb24523165 [0,2,0,0,0,0|1,0,1]=4 10299 B9R0.2 NC(=O)CCCNCCF Amb25772120 [0,2,0,0,0,0|1,0,0]=3 10300 B9R0.2 NC(=O)CCCNCCO Amb24432464 [0,2,0,0,0,0|1,0,0]=3 10301 B9R0.2 NC(=O)CCNCCCO Amb19959936 [0,2,0,0,0,0|1,0,0]=3 10302 B9R0.2 NC(=O)CNCCCCF Amb25694790 [0,2,0,0,0,0|1,0,0]=3 10303 B9R0.2 NC(=O)CNCCCCO Amb25140635 [0,2,0,0,0,0|1,0,0]=3 10304 B9R0.2 NC(=O)CSCCCC#N Amb18927688 [0,2,0,0,0,0|1,0,1]=4 10305 B9R0.2 NC(=O)CSCCCCBr Amb25853094 [0,2,0,0,0,0|1,0,0]=3 10306 B9R0.2 NC(=O)NCCCCN=O Amb22231336 [0,2,0,0,0,0|2,0,0]=4 10307 B9R0.2 NC(=O)OCCCCCBr Amb24479497 [0,2,0,0,0,0|1,0,0]=3 10308 B9R0.2 NC(=O)OCCCCCCl Amb25378803 [0,2,0,0,0,0|1,0,0]=3 10309 B9R0.2 NC(=O)OCCNCCF Amb25825520 [0,2,0,0,0,0|2,0,0]=4 10310 B9R0.2 NC(=O)OCCOCCCl Amb25219350 [0,2,0,0,0,0|2,0,0]=4 10311 B9R0.2 NC(=S)CCCCCCO Amb25330374 [0,2,0,0,0,0|1,1,0]=4 10312 B9R0.2 NCCCCCC=C(Cl)Cl Amb25299275 [0,2,0,0,0,0|2,0,0]=4 10313 B9R0.2 NCCCCCCC(=O)O Amb1151254 [0,2,0,0,0,0|1,0,0]=3 10314 B9R0.2 NCCCCCCC(=O)O Amb16232099 [0,2,0,0,0,0|1,0,0]=3 10315 B9R0.2 NCCCCNCC(C)C Amb17334222 [0,2,0,0,0,0|1,0,1]=4 10316 B9R0.2 NCCCCNCC(N)=O Amb25840017 [0,2,0,0,0,0|1,0,0]=3 10317 B9R0.2 NCCCCOCC(N)=O Amb24515943 [0,2,0,0,0,0|1,0,0]=3 10318 B9R0.2 NCCCCSCC(=C)C Amb17500961 [0,2,0,0,0,0|1,0,0]=3 10319 B9R0.2 NCCCCSCC(=O)C Amb17500952 [0,2,0,0,0,0|0,0,0]=2 10320 B9R0.2 NCCCCSCC(=O)N Amb17500917 [0,2,0,0,0,0|1,0,0]=3 10321 B9R0.2 NCCCCSCC(=O)O Amb17500919 [0,2,0,0,0,0|1,0,0]=3 10322 B9R0.2 NCCCC\C=C\C(O)=O Amb24502157 [0,2,0,0,0,0|1,0,1]=4 10323 B9R0.2 NCCCNCCC(C)C Amb17315309 [0,2,0,0,0,0|1,0,1]=4 10324 B9R0.2 NCCCNCCC(N)=O Amb24360847 [0,2,0,0,0,0|1,0,0]=3 10325 B9R0.2 NCCCNCCN(C)C Amb17315303 [0,2,0,0,0,0|2,0,0]=4 10326 B9R0.2 NCCCNOCC(N)=O Amb25678871 [0,2,0,0,0,0|2,0,0]=4 10327 B9R0.2 NCCCOCCC(O)=O Amb18111494 [0,2,0,0,0,0|1,0,0]=3 10328 B9R0.2 NCCCSCCC(C)C Amb17500699 [0,2,0,0,0,0|1,0,1]=4 10329 B9R0.2 NCCCSCCC(O)=O Amb24496605 [0,2,0,0,0,0|1,0,0]=3 10330 B9R0.2 NCCNCCCC(N)=O Amb25216041 [0,2,0,0,0,0|1,0,0]=3 10331 B9R0.2 NCCNCCNC(O)=O Amb24069145 [0,2,0,0,0,0|2,0,0]=4 10332 B9R0.2 NCCOCCCC(N)=O Amb24554840 [0,2,0,0,0,0|1,0,0]=3 10333 B9R0.2 NCCOCCCC(O)=O Amb18111467 [0,2,0,0,0,0|1,0,0]=3 10334 B9R0.2 NCCSCCCC(=O)O Amb17500468 [0,2,0,0,0,0|1,0,0]=3 10335 B9R0.2 NCCSSCCC(=O)O Amb17608062 [0,2,0,0,0,0|2,0,0]=4 10336 B9R0.2 NOCCCCCC(=O)O Amb10975958 [0,2,0,0,0,0|1,0,0]=3 10337 B9R0.2 O=C(Cl)CCCCCCCl Amb24703296 [0,2,0,0,0,0|1,0,0]=3 10338 B9R0.2 O=C(Cl)CCSCCCCl Amb24477286 [0,2,0,0,0,0|1,0,0]=3 10339 B9R0.2 O=C(Cl)OCCOCCCl Amb25322249 [0,2,0,0,0,0|2,0,0]=4 10340 B9R0.2 O=C(Cl)\C=C\CCCCCl Amb25074569 [0,2,0,0,0,0|1,0,1]=4 10341 B9R0.2 O=C=NCCCCC(=O)Cl Amb25695423 [0,2,0,0,0,0|1,0,1]=4 10342 B9R0.2 OC(=O)CCCC#CCBr Amb24477271 [0,2,0,0,0,0|1,0,1]=4 10343 B9R0.2 OC(=O)CCCCC#CBr Amb25758884 [0,2,0,0,0,0|1,0,1]=4 10344 B9R0.2 OC(=O)CCCCCCF Amb25132501 [0,2,0,0,0,0|1,0,0]=3 10345 B9R0.2 OC(=O)CCCCCCS Amb24710334 [0,2,0,0,0,0|1,0,0]=3 10346 B9R0.2 OC(=O)CCCCN=C=O Amb24505309 [0,2,0,0,0,0|1,0,1]=4 10347 B9R0.2 OC(=O)CCCCN=C=S Amb25685363 [0,2,0,0,0,0|1,0,1]=4 10348 B9R0.2 OC(=O)CCCNCCF Amb25312142 [0,2,0,0,0,0|1,0,0]=3 10349 B9R0.2 OC(=O)CCOCCCBr Amb25207601 [0,2,0,0,0,0|1,0,0]=3 10350 B9R0.2 OC(=O)CCOCCCF Amb25794478 [0,2,0,0,0,0|1,0,0]=3 10351 B9R0.2 OC(=O)CNCCCCCl Amb24505281 [0,2,0,0,0,0|1,0,0]=3 10352 B9R0.2 OC(=O)CNCCCCF Amb24588093 [0,2,0,0,0,0|1,0,0]=3 10353 B9R0.2 OC(=O)\C=C\CCCCBr Amb18130981 [0,2,0,0,0,0|1,0,1]=4 10354 B9R0.2 OC(=O)\C=C\CCCCCl Amb18645743 [0,2,0,0,0,0|1,0,1]=4 10355 B9R0.2 OCCC#CCCC(O)=O Amb25716100 [0,2,0,0,0,0|1,0,1]=4 10356 B9R0.2 OCCCCCCC(C)C Amb17617666 [0,2,0,0,0,0|1,0,1]=4 10357 B9R0.2 OCCCCCCN(C)C Amb17613201 [0,2,0,0,0,0|2,0,0]=4 10358 B9R0.2 OCCCCCNC(=N)N Amb2234594 [0,2,0,0,0,0|2,0,0]=4 10359 B9R0.2 OCCCCCNC(=O)C Amb15769972 [0,2,0,0,0,0|0,0,0]=2 10360 B9R0.2 OCCCCCNC(C)C Amb17334255 [0,2,0,0,0,0|1,0,1]=4 10361 B9R0.2 OCCCCCNC(S)=S Amb24728153 [0,2,0,0,0,0|1,1,0]=4 10362 B9R0.2 OCCCCNCC(C)C Amb17334252 [0,2,0,0,0,0|1,0,1]=4 10363 B9R0.2 OCCCCSCC(O)=O Amb18798269 [0,2,0,0,0,0|1,0,0]=3 10364 B9R0.2 OCCCC\C=C\C(O)=O Amb18644146 [0,2,0,0,0,0|1,0,1]=4 10365 B9R0.2 OCCCOCCC(O)=O Amb24476864 [0,2,0,0,0,0|1,0,0]=3 10366 B9R0.2 OCCCSCCC(=S)N Amb17503263 [0,2,0,0,0,0|1,1,0]=4 10367 B9R0.2 OCCCSCCC(C)C Amb17502843 [0,2,0,0,0,0|1,0,1]=4 10368 B9R0.2 OCCCSSCC(O)=O Amb25053922 [0,2,0,0,0,0|2,0,0]=4 10369 B9R0.2 OCCSSCCC(=O)O Amb17615366 [0,2,0,0,0,0|2,0,0]=4 10370 B9R0.2 OC\C=C\CCCC(O)=O Amb24568323 [0,2,0,0,0,0|1,0,1]=4 10371 B9R0.2 ON=CCCCCC(O)=O Amb24480769 [0,2,0,0,0,0|1,0,1]=4 10372 B9R0.2 ONCCCCCC(O)=O Amb25354224 [0,2,0,0,0,0|1,0,0]=3 10373 B9R0.2 [13CH3]CCCCCCC(O)=O Amb22367137 [0,2,0,0,0,0|1,0,0]=3 10374 B9R0.2 [13CH3][13CH2]CCCCCC(O)=O Amb22367489 [0,2,0,0,0,0|1,0,0]=3 10375 B9R0.2 [N-]=[N+]=NCCCCC(O)=O Amb19516609 [0,2,0,0,0,0|2,0,0]=4 10376 B9R0.38 BrCCCCC[N+](C)(C)C Amb17610059 [0,2,0,0,0,0|2,0,0]=4 10377 B9R0.38 CC(C)(F)CCCCCBr Amb25774434 [0,2,0,0,0,0|1,0,1]=4 10378 B9R0.38 CC(C)(F)CCCCCO Amb24454675 [0,2,0,0,0,0|1,0,1]=4 10379 B9R0.38 CC(C)(N)CCCCCF Amb25686440 [0,2,0,0,0,0|1,0,1]=4 10380 B9R0.38 CC(C)(N)CCCCCN Amb25147427 [0,2,0,0,0,0|1,0,1]=4 10381 B9R0.38 CC(C)(O)CCCCCBr Amb25737898 [0,2,0,0,0,0|0,0,2]=4 10382 B9R0.38 CC(C)(O)CCCCCS Amb25692387 [0,2,0,0,0,0|0,0,2]=4 10383 B9R0.38 CC(F)(F)CCCCCBr Amb25309673 [0,2,0,0,0,0|1,0,1]=4 10384 B9R0.38 CCCCCCC(C)(C)C Amb10069374 [0,2,0,0,0,0|1,0,1]=4 10385 B9R0.38 CCCCCCC(C)(C)Cl Amb22228729 [0,2,0,0,0,0|1,0,1]=4 10386 B9R0.38 CCCCCCC(C)(C)O Amb21520374 [0,2,0,0,0,0|0,0,2]=4 10387 B9R0.38 CCCCCCS(=O)(=O)N Amb16191920 [0,2,0,0,0,0|2,0,0]=4 10388 B9R0.38 CCCCCCS(O)(=O)=O Amb25138206 [0,2,0,0,0,0|2,0,0]=4 10389 B9R0.38 CCCCCC[N+](C)(C)C Amb22045198 [0,2,0,0,0,0|2,0,0]=4 10390 B9R0.38 CCCCCC[Si](C)(Cl)Cl Amb19893899 [0,2,0,0,0,0|1,1,0]=4 10391 B9R0.38 CCCCCNS(=O)(=O)Cl Amb17193921 [0,2,0,0,0,0|2,0,0]=4 10392 B9R0.38 CCCCCNS(O)(=O)=O Amb24535979 [0,2,0,0,0,0|2,0,0]=4 10393 B9R0.38 CCCCCOP(O)(O)=O Amb22168445 [0,2,0,0,0,0|2,0,0]=4 10394 B9R0.38 CCCCCOS(=O)(=O)Cl Amb24374827 [0,2,0,0,0,0|2,0,0]=4 10395 B9R0.38 CCCCCOS(C)(=O)=O Amb22388766 [0,2,0,0,0,0|1,0,0]=3 10396 B9R0.38 CCCCCOS(N)(=O)=O Amb22056031 [0,2,0,0,0,0|2,0,0]=4 10397 B9R0.38 CCCCCSS(=O)(=O)C Amb17619183 [0,2,0,0,0,0|1,0,0]=3 10398 B9R0.38 CCCCNCC(C)(C)C Amb17231975 [0,2,0,0,0,0|1,0,1]=4 10399 B9R0.38 CCCCNCC(C)(C)Cl Amb25059090 [0,2,0,0,0,0|1,0,1]=4 10400 B9R0.38 CCCCNCC(C)(C)N Amb24074597 [0,2,0,0,0,0|1,0,1]=4 10401 B9R0.38 CCCCNCC(C)(F)F Amb24701940 [0,2,0,0,0,0|1,0,1]=4 10402 B9R0.38 CCCCNCC(O)(C)C Amb17138402 [0,2,0,0,0,0|0,0,2]=4 10403 B9R0.38 CCCCNCP(=O)(O)C Amb1776475 [0,2,0,0,0,0|1,0,0]=3 10404 B9R0.38 CCCCNCS(O)(=O)=O Amb25784458 [0,2,0,0,0,0|2,0,0]=4 10405 B9R0.38 CCCCNC[Si](C)(C)C Amb10560918 [0,2,0,0,0,0|1,1,0]=4 10406 B9R0.38 CCCCOCC(N)(C)C Amb17485999 [0,2,0,0,0,0|1,0,1]=4 10407 B9R0.38 CCCCOCP(O)(O)=O Amb25349493 [0,2,0,0,0,0|2,0,0]=4 10408 B9R0.38 CCCCSCC(C)(C)O Amb18792455 [0,2,0,0,0,0|0,0,2]=4 10409 B9R0.38 CCCNCCC(C)(F)F Amb25688657 [0,2,0,0,0,0|1,0,1]=4 10410 B9R0.38 CCCNCCP(O)(O)=O Amb25288004 [0,2,0,0,0,0|2,0,0]=4 10411 B9R0.38 CCCNCCS(C)(=O)=O Amb18800965 [0,2,0,0,0,0|1,0,0]=3 10412 B9R0.38 CCCNCC[Si](C)(C)C Amb25048037 [0,2,0,0,0,0|1,1,0]=4 10413 B9R0.38 CCCOCCC(C)(C)N Amb25341882 [0,2,0,0,0,0|1,0,1]=4 10414 B9R0.38 CCCOCCS(N)(=O)=O Amb25318135 [0,2,0,0,0,0|2,0,0]=4 10415 B9R0.38 CCCSCCC(C)(C)C Amb25225909 [0,2,0,0,0,0|1,0,1]=4 10416 B9R0.38 CCCSCCS(C)(=O)=O Amb25739487 [0,2,0,0,0,0|1,0,0]=3 10417 B9R0.38 CCNCCCC(C)(C)C Amb24552971 [0,2,0,0,0,0|1,0,1]=4 10418 B9R0.38 CCNCCCC(C)(C)N Amb25146419 [0,2,0,0,0,0|1,0,1]=4 10419 B9R0.38 CCNCCCS(C)(=O)=O Amb18792707 [0,2,0,0,0,0|1,0,0]=3 10420 B9R0.38 CCNCCCS(N)(=O)=O Amb18801125 [0,2,0,0,0,0|2,0,0]=4 10421 B9R0.38 CCOCCCC(C)(C)N Amb25147426 [0,2,0,0,0,0|1,0,1]=4 10422 B9R0.38 CCOCCCS(=O)(=O)Cl Amb25756682 [0,2,0,0,0,0|2,0,0]=4 10423 B9R0.38 CCOCCCS(N)(=O)=O Amb24617117 [0,2,0,0,0,0|2,0,0]=4 10424 B9R0.38 CCOCCCS(O)(=O)=O Amb25174240 [0,2,0,0,0,0|2,0,0]=4 10425 B9R0.38 CCOCCOS(C)(=O)=O Amb24288665 [0,2,0,0,0,0|2,0,0]=4 10426 B9R0.38 CCSCCCS(=O)(=O)Cl Amb25683628 [0,2,0,0,0,0|2,0,0]=4 10427 B9R0.38 CCSCCCS(C)(=O)=O Amb25344623 [0,2,0,0,0,0|1,0,0]=3 10428 B9R0.38 CCSCCCS(N)(=O)=O Amb24434269 [0,2,0,0,0,0|2,0,0]=4 10429 B9R0.38 CNCCCCC(O)(C)C Amb17569963 [0,2,0,0,0,0|0,0,2]=4 10430 B9R0.38 CNCCCCS(C)(=O)=O Amb18800968 [0,2,0,0,0,0|1,0,0]=3 10431 B9R0.38 COCCCCC(N)(C)C Amb17569981 [0,2,0,0,0,0|1,0,1]=4 10432 B9R0.38 COCCCCS(N)(=O)=O Amb25810707 [0,2,0,0,0,0|2,0,0]=4 10433 B9R0.38 COCCCN=S(C)(C)=O Amb24646758 [0,2,0,0,0,0|2,0,0]=4 10434 B9R0.38 COCCNCP(C)(C)=O Amb24482416 [0,2,0,0,0,0|2,0,0]=4 10435 B9R0.38 CP(C)(=O)COCCCN Amb25059249 [0,2,0,0,0,0|2,0,0]=4 10436 B9R0.38 CS(=O)(=O)CCCCC=C Amb25114533 [0,2,0,0,0,0|1,0,1]=4 10437 B9R0.38 CS(=O)(=O)CCCCC=O Amb24447263 [0,2,0,0,0,0|1,0,1]=4 10438 B9R0.38 CS(=O)(=O)CCCCCBr Amb25091397 [0,2,0,0,0,0|1,0,0]=3 10439 B9R0.38 CS(=O)(=O)CCCCCCl Amb18319620 [0,2,0,0,0,0|1,0,0]=3 10440 B9R0.38 CS(=O)(=O)CCCCCN Amb18828014 [0,2,0,0,0,0|1,0,0]=3 10441 B9R0.38 CS(=O)(=O)CCCCCO Amb25098992 [0,2,0,0,0,0|1,0,0]=3 10442 B9R0.38 CS(=O)(=O)CCCCNN Amb25704713 [0,2,0,0,0,0|2,0,0]=4 10443 B9R0.38 CS(=O)(=O)CCNCCI Amb25738411 [0,2,0,0,0,0|2,0,0]=4 10444 B9R0.38 CS(=O)(=O)CCNCCN Amb18792841 [0,2,0,0,0,0|2,0,0]=4 10445 B9R0.38 CS(=O)(=O)CCNCCO Amb18798863 [0,2,0,0,0,0|2,0,0]=4 10446 B9R0.38 CS(=O)(=O)CCOCCCl Amb23452895 [0,2,0,0,0,0|2,0,0]=4 10447 B9R0.38 CS(=O)(=O)CCOCCN Amb19352281 [0,2,0,0,0,0|2,0,0]=4 10448 B9R0.38 CS(=O)(=O)CCSCCN Amb19057259 [0,2,0,0,0,0|2,0,0]=4 10449 B9R0.38 CS(=O)(=O)CCSCCO Amb18324344 [0,2,0,0,0,0|2,0,0]=4 10450 B9R0.38 CS(=O)(=O)CCSCCS Amb24513868 [0,2,0,0,0,0|2,0,0]=4 10451 B9R0.38 CS(=O)(=O)NCCCCI Amb25830091 [0,2,0,0,0,0|2,0,0]=4 10452 B9R0.38 CS(=O)(=O)OCCCCBr Amb24653972 [0,2,0,0,0,0|2,0,0]=4 10453 B9R0.38 CS(=O)(=O)OCCCCCl Amb21964961 [0,2,0,0,0,0|2,0,0]=4 10454 B9R0.38 CS(=O)(=O)OCCCCO Amb24524699 [0,2,0,0,0,0|2,0,0]=4 10455 B9R0.38 CSCCCOS(C)(=O)=O Amb24074532 [0,2,0,0,0,0|2,0,0]=4 10456 B9R0.38 C[Si](C)(Cl)CCCCCCl Amb25363270 [0,2,0,0,0,0|1,1,0]=4 10457 B9R0.38 NCCCCCP(O)(O)=O Amb24729548 [0,2,0,0,0,0|2,0,0]=4 10458 B9R0.38 NCCCCNS(=O)(=O)C Amb17053760 [0,2,0,0,0,0|2,0,0]=4 10459 B9R0.38 NCCOCCS(=O)(=O)C Amb17502064 [0,2,0,0,0,0|2,0,0]=4 10460 B9R0.38 NS(=O)(=O)CCCCCF Amb24593996 [0,2,0,0,0,0|2,0,0]=4 10461 B9R0.38 O=S(=O)(Cl)CCCCCBr Amb24505264 [0,2,0,0,0,0|2,0,0]=4 10462 B9R0.38 O=S(=O)(Cl)CCCCCCl Amb18062652 [0,2,0,0,0,0|2,0,0]=4 10463 B9R0.38 OCCCCCS(O)(=O)=O Amb25127860 [0,2,0,0,0,0|2,0,0]=4 10464 B9R0.38 OCCCCNS(=O)(=O)C Amb17103035 [0,2,0,0,0,0|2,0,0]=4 10465 B9R0.38 OS(=O)(=O)CCCCCBr Amb19130974 [0,2,0,0,0,0|2,0,0]=4 10466 B9R0.38 [O-]S(=O)(=O)CCCCCBr Amb24426955 [0,2,0,0,0,0|2,0,0]=4 10467 B9R0.48 C#CCC(O)CCC(O)=O Amb25077171 [0,2,0,0,0,0|1,0,1]=4 10468 B9R0.48 C=CCC(N)CCC(O)=O Amb25132628 [0,2,0,0,0,0|1,0,1]=4 10469 B9R0.48 C=CC[C@@H](N)CCC(O)=O Amb25308063 [0,2,0,0,0,0|1,0,1]=4 10470 B9R0.48 CC#CC(O)CCC(C)=C Amb24675353 [0,2,0,0,0,0|1,0,1]=4 10471 B9R0.48 CC(=C)CCC(=O)COC Amb24371466 [0,2,0,0,0,0|1,0,1]=4 10472 B9R0.48 CC(=C)CCC(=O)OCC Amb22270105 [0,2,0,0,0,0|1,0,1]=4 10473 B9R0.48 CC(=C)CCC(O)CCO Amb24475141 [0,2,0,0,0,0|1,0,0]=3 10474 B9R0.48 CC(=C)CC[C@H](O)CC=C Amb25769343 [0,2,0,0,0,0|1,0,1]=4 10475 B9R0.48 CC(=O)CCC(=C)CCC Amb24432180 [0,2,0,0,0,0|0,0,0]=2 10476 B9R0.48 CC(=O)CCC(=O)CC#N Amb24721780 [0,2,0,0,0,0|0,0,2]=4 10477 B9R0.48 CC(=O)CCC(=O)CCBr Amb24381453 [0,2,0,0,0,0|0,0,1]=3 10478 B9R0.48 CC(=O)CCC(=O)COC Amb24724049 [0,2,0,0,0,0|0,0,1]=3 10479 B9R0.48 CC(=O)CCC(=O)NOC Amb24478126 [0,2,0,0,0,0|1,0,1]=4 10480 B9R0.48 CC(=O)CCC(=O)\C=C\C Amb24691794 [0,2,0,0,0,0|0,0,2]=4 10481 B9R0.48 CC(=O)CCC(O)CC#N Amb18643714 [0,2,0,0,0,0|0,0,1]=3 10482 B9R0.48 CC(=O)CCN(C)CC#N Amb25026489 [0,2,0,0,0,0|1,0,1]=4 10483 B9R0.48 CC(=O)CNC(=O)CCCl Amb24462717 [0,2,0,0,0,0|1,0,1]=4 10484 B9R0.48 CC(=O)CNC(=O)COC Amb25369821 [0,2,0,0,0,0|1,0,1]=4 10485 B9R0.48 CC(=O)CNC(=O)CSC Amb25738341 [0,2,0,0,0,0|1,0,1]=4 10486 B9R0.48 CC(=O)COC(=O)COC Amb24387702 [0,2,0,0,0,0|1,0,1]=4 10487 B9R0.48 CC(=O)COC(=O)CSC Amb25724297 [0,2,0,0,0,0|1,0,1]=4 10488 B9R0.48 CC(=O)COC(=O)OCC Amb25682129 [0,2,0,0,0,0|1,0,1]=4 10489 B9R0.48 CC(=O)NCC(=N)OCC Amb25809883 [0,2,0,0,0,0|1,0,1]=4 10490 B9R0.48 CC(=O)NCC(=O)CCC Amb25367834 [0,2,0,0,0,0|0,0,1]=3 10491 B9R0.48 CC(=O)NCC(=O)SCC Amb25146289 [0,2,0,0,0,0|1,0,1]=4 10492 B9R0.48 CC(=O)NCC(=S)SCC Amb25857079 [0,2,0,0,0,0|1,0,1]=4 10493 B9R0.48 CC(=O)NCC(O)CC#N Amb24585604 [0,2,0,0,0,0|1,0,1]=4 10494 B9R0.48 CC(=O)OCC(=O)NCC Amb24747778 [0,2,0,0,0,0|1,0,1]=4 10495 B9R0.48 CC(=O)OCC(=O)OCC Amb24482663 [0,2,0,0,0,0|1,0,1]=4 10496 B9R0.48 CC(=O)OCC(Cl)CCCl Amb25274075 [0,2,0,0,0,0|1,0,0]=3 10497 B9R0.48 CC(=O)OCC(O)CC=O Amb24736983 [0,2,0,0,0,0|1,0,1]=4 10498 B9R0.48 CC(=O)OCC(O)CCO Amb24371331 [0,2,0,0,0,0|1,0,0]=3 10499 B9R0.48 CC(=O)OC[C@H](O)CC=O Amb24758802 [0,2,0,0,0,0|1,0,1]=4 10500 B9R0.48 CC(=O)ON=C(N)CCC Amb24532437 [0,2,0,0,0,0|1,0,1]=4 10501 B9R0.48 CC(=O)SCC(O)CC=C Amb25676686 [0,2,0,0,0,0|0,0,2]=4 10502 B9R0.48 CC(=O)\C=C\C(=O)CCC Amb24512208 [0,2,0,0,0,0|0,0,2]=4 10503 B9R0.48 CC(C)CCC(Br)CCBr Amb23456166 [0,2,0,0,0,0|1,0,1]=4 10504 B9R0.48 CC(C)CCC(C)CCN Amb24477979 [0,2,0,0,0,0|1,0,1]=4 10505 B9R0.48 CC(C)CCC(C)CNC Amb25305191 [0,2,0,0,0,0|1,0,1]=4 10506 B9R0.48 CC(C)CCC(Cl)CCC Amb25080274 [0,2,0,0,0,0|1,0,1]=4 10507 B9R0.48 CC(C)CCC(Cl)COC Amb18798380 [0,2,0,0,0,0|1,0,1]=4 10508 B9R0.48 CC(C)CCC(N)CCO Amb18831259 [0,2,0,0,0,0|1,0,1]=4 10509 B9R0.48 CC(C)CCC(N)CSC Amb18798071 [0,2,0,0,0,0|1,0,1]=4 10510 B9R0.48 CC(C)CCC(O)CCN Amb25254667 [0,2,0,0,0,0|1,0,1]=4 10511 B9R0.48 CC(C)CCC(O)CCO Amb23456160 [0,2,0,0,0,0|1,0,1]=4 10512 B9R0.48 CC(C)CCC(O)CNC Amb25141272 [0,2,0,0,0,0|1,0,1]=4 10513 B9R0.48 CC(C)CCC(O)CSC Amb18798166 [0,2,0,0,0,0|1,0,1]=4 10514 B9R0.48 CC(C)CC[C@H](C)CCO Amb24719731 [0,2,0,0,0,0|1,0,1]=4 10515 B9R0.48 CC(C)NCC(N)CCC Amb24513651 [0,2,0,0,0,0|1,0,1]=4 10516 B9R0.48 CC(C)NCC(O)CCC Amb25065833 [0,2,0,0,0,0|1,0,1]=4 10517 B9R0.48 CC(C)NC[C@@H](N)CCC Amb25252759 [0,2,0,0,0,0|1,0,1]=4 10518 B9R0.48 CC(C)NC[C@H](N)CCC Amb25821858 [0,2,0,0,0,0|1,0,1]=4 10519 B9R0.48 CC(C)OCC(Cl)CCC Amb24482566 [0,2,0,0,0,0|1,0,1]=4 10520 B9R0.48 CC(C)SCC(N)CCC Amb25683293 [0,2,0,0,0,0|1,0,1]=4 10521 B9R0.48 CC(C)SC[C@@H](N)CCC Amb24696214 [0,2,0,0,0,0|1,0,1]=4 10522 B9R0.48 CC(C)SC[C@H](N)CCC Amb24385598 [0,2,0,0,0,0|1,0,1]=4 10523 B9R0.48 CC(CC#C)CCC(O)=O Amb25331115 [0,2,0,0,0,0|1,0,1]=4 10524 B9R0.48 CC(CC#N)CCC(C)=O Amb18124541 [0,2,0,0,0,0|0,0,1]=3 10525 B9R0.48 CC(CC#N)CCC(O)=O Amb25826195 [0,2,0,0,0,0|1,0,1]=4 10526 B9R0.48 CC(CC=C)CNC(C)=O Amb24351217 [0,2,0,0,0,0|0,0,2]=4 10527 B9R0.48 CC(CC=O)COC(C)=O Amb18644137 [0,2,0,0,0,0|1,0,1]=4 10528 B9R0.48 CC(CCBr)COC(C)=O Amb24759472 [0,2,0,0,0,0|1,0,0]=3 10529 B9R0.48 CC(CCC(C)=O)=CCO Amb24656003 [0,2,0,0,0,0|0,0,2]=4 10530 B9R0.48 CC(CCC(C)=O)=NOC Amb24583507 [0,2,0,0,0,0|1,0,1]=4 10531 B9R0.48 CC(CCC(C)Br)COC Amb25841089 [0,2,0,0,0,0|1,0,1]=4 10532 B9R0.48 CC(CCC(C)O)COC Amb25378257 [0,2,0,0,0,0|0,0,2]=4 10533 B9R0.48 CC(CCCl)COC(C)=O Amb25757525 [0,2,0,0,0,0|1,0,0]=3 10534 B9R0.48 CC(CCN)CCC(C)=C Amb25067186 [0,2,0,0,0,0|1,0,0]=3 10535 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,2,0,0,0,0|1,0,0]=3 10536 B9R0.48 CC(CCN)CCC(O)=O Amb18124749 [0,2,0,0,0,0|1,0,0]=3 10537 B9R0.48 CC(CCN)CCS(C)=O Amb24585879 [0,2,0,0,0,0|1,0,0]=3 10538 B9R0.48 CC(CCN)SCC(C)=C Amb24366862 [0,2,0,0,0,0|2,0,0]=4 10539 B9R0.48 CC(CCO)CC=C(C)C Amb24397049 [0,2,0,0,0,0|1,0,1]=4 10540 B9R0.48 CC(CCO)COC(C)=O Amb24524456 [0,2,0,0,0,0|1,0,0]=3 10541 B9R0.48 CC(CCO)NCC(C)=C Amb25138314 [0,2,0,0,0,0|2,0,0]=4 10542 B9R0.48 CC(CCO)SCC(N)=O Amb25122527 [0,2,0,0,0,0|2,0,0]=4 10543 B9R0.48 CC(CCO)SCC(O)=O Amb25056289 [0,2,0,0,0,0|2,0,0]=4 10544 B9R0.48 CC(COC(C)=O)OCCl Amb24746780 [0,2,0,0,0,0|2,0,0]=4 10545 B9R0.48 CC(O)CCC(O)COC Amb24529314 [0,2,0,0,0,0|0,0,2]=4 10546 B9R0.48 CCCC(=N)NCC(N)=O Amb24722000 [0,2,0,0,0,0|1,0,1]=4 10547 B9R0.48 CCCC(=O)NCC(=O)N Amb17231980 [0,2,0,0,0,0|1,0,1]=4 10548 B9R0.48 CCCC(=S)NCC(N)=O Amb25071575 [0,2,0,0,0,0|1,0,1]=4 10549 B9R0.48 CCCC(Br)CCC(O)=O Amb24469305 [0,2,0,0,0,0|1,0,0]=3 10550 B9R0.48 CCCC(C)=NNC(C)=O Amb24505079 [0,2,0,0,0,0|1,0,1]=4 10551 B9R0.48 CCCC(C)CCC(C)Br Amb25805955 [0,2,0,0,0,0|1,0,1]=4 10552 B9R0.48 CCCC(C)CCC(C)N Amb25775537 [0,2,0,0,0,0|1,0,1]=4 10553 B9R0.48 CCCC(C)CNN(C)C Amb24479514 [0,2,0,0,0,0|2,0,0]=4 10554 B9R0.48 CCCC(C)COC(=O)Cl Amb25783542 [0,2,0,0,0,0|1,0,0]=3 10555 B9R0.48 CCCC(C)COC(C)=O Amb22735194 [0,2,0,0,0,0|0,0,0]=2 10556 B9R0.48 CCCC(C)CSC(N)=N Amb25246067 [0,2,0,0,0,0|2,0,0]=4 10557 B9R0.48 CCCC(C)NCC(=C)Cl Amb18183485 [0,2,0,0,0,0|1,0,1]=4 10558 B9R0.48 CCCC(C)NCC(C)=C Amb25704086 [0,2,0,0,0,0|1,0,0]=3 10559 B9R0.48 CCCC(C)NCC(C)Cl Amb25341725 [0,2,0,0,0,0|1,0,1]=4 10560 B9R0.48 CCCC(C)OCC(=C)Br Amb25698155 [0,2,0,0,0,0|1,0,1]=4 10561 B9R0.48 CCCC(C)OCC(C)O Amb24504646 [0,2,0,0,0,0|0,0,2]=4 10562 B9R0.48 CCCC(C)OCC(N)=N Amb24481038 [0,2,0,0,0,0|2,0,0]=4 10563 B9R0.48 CCCC(C)OCC(N)=O Amb25227310 [0,2,0,0,0,0|1,0,0]=3 10564 B9R0.48 CCCC(C)OCC(O)=O Amb18124782 [0,2,0,0,0,0|1,0,0]=3 10565 B9R0.48 CCCC(C)OC[C@@H](C)O Amb24441315 [0,2,0,0,0,0|0,0,2]=4 10566 B9R0.48 CCCC(C)SCC(C)N Amb24703352 [0,2,0,0,0,0|1,0,1]=4 10567 B9R0.48 CCCC(C)\C=C\C(C)=O Amb24686480 [0,2,0,0,0,0|0,0,1]=3 10568 B9R0.48 CCCC(CCC(=O)C)C Amb10807385 [0,2,0,0,0,0|0,0,0]=2 10569 B9R0.48 CCCC(CCC(=O)N)O Amb17593642 [0,2,0,0,0,0|1,0,0]=3 10570 B9R0.48 CCCC(CCC(=O)O)N Amb1014101 [0,2,0,0,0,0|1,0,0]=3 10571 B9R0.48 CCCC(CCC(=O)[O-])O Amb2386295 [0,2,0,0,0,0|1,0,0]=3 10572 B9R0.48 CCCC(Cl)CCC(O)=O Amb23590328 [0,2,0,0,0,0|1,0,0]=3 10573 B9R0.48 CCCC(Cl)COC(C)=O Amb25088458 [0,2,0,0,0,0|0,0,0]=2 10574 B9R0.48 CCCC(F)CCC(C)=O Amb25723377 [0,2,0,0,0,0|0,0,0]=2 10575 B9R0.48 CCCC(N)CCN(C)C Amb18202388 [0,2,0,0,0,0|2,0,0]=4 10576 B9R0.48 CCCC(N)CCS(C)=O Amb24538948 [0,2,0,0,0,0|1,0,0]=3 10577 B9R0.48 CCCC(N)CNC(N)=O Amb24443520 [0,2,0,0,0,0|1,0,0]=3 10578 B9R0.48 CCCC(O)C#CC(C)=C Amb25221062 [0,2,0,0,0,0|1,0,1]=4 10579 B9R0.48 CCCC(O)C#CC(O)=O Amb25823661 [0,2,0,0,0,0|1,0,1]=4 10580 B9R0.48 CCCC(O)C=C=C(C)C Amb25049915 [0,2,0,0,0,0|1,0,1]=4 10581 B9R0.48 CCCC(O)CCC(O)=O Amb17689110 [0,2,0,0,0,0|1,0,0]=3 10582 B9R0.48 CCCC(O)CCC([O-])=O Amb17778117 [0,2,0,0,0,0|1,0,0]=3 10583 B9R0.48 CCCC(O)CCN(C)C Amb25182887 [0,2,0,0,0,0|2,0,0]=4 10584 B9R0.48 CCCC(O)CNC(C)=O Amb24333057 [0,2,0,0,0,0|0,0,0]=2 10585 B9R0.48 CCCC(O)CNC(N)=N Amb24392299 [0,2,0,0,0,0|2,0,0]=4 10586 B9R0.48 CCCC(O)\C=C\C(C)=O Amb25293157 [0,2,0,0,0,0|0,0,1]=3 10587 B9R0.48 CCCC(O)\C=C\S(C)=O Amb24471430 [0,2,0,0,0,0|1,0,1]=4 10588 B9R0.48 CCCN(C)CC=C(C)C Amb24689062 [0,2,0,0,0,0|1,0,1]=4 10589 B9R0.48 CCCN(C)CCC(C)=C Amb24748001 [0,2,0,0,0,0|1,0,0]=3 10590 B9R0.48 CCCN(C)CCC(C)O Amb25304938 [0,2,0,0,0,0|0,0,2]=4 10591 B9R0.48 CCCN(C)CCC(O)=O Amb19280988 [0,2,0,0,0,0|1,0,0]=3 10592 B9R0.48 CCCS(=O)CCC(C)=O Amb25196510 [0,2,0,0,0,0|0,0,0]=2 10593 B9R0.48 CCCS(=O)CCC(O)=O Amb18792575 [0,2,0,0,0,0|1,0,0]=3 10594 B9R0.48 CCCS(=O)NCC(C)=O Amb25195253 [0,2,0,0,0,0|1,0,0]=3 10595 B9R0.48 CCC[C@@H](Br)COC(C)=O Amb25733071 [0,2,0,0,0,0|0,0,0]=2 10596 B9R0.48 CCC[C@@H](C)CCC(C)O Amb25806670 [0,2,0,0,0,0|0,0,2]=4 10597 B9R0.48 CCC[C@@H](C)CCC(O)=O Amb24548514 [0,2,0,0,0,0|1,0,0]=3 10598 B9R0.48 CCC[C@@H](N)CCN(C)C Amb24529134 [0,2,0,0,0,0|2,0,0]=4 10599 B9R0.48 CCC[C@H](C)CCC(O)=O Amb24446759 [0,2,0,0,0,0|1,0,0]=3 10600 B9R0.48 CCC[C@H](N)CCC(O)=O Amb25211817 [0,2,0,0,0,0|1,0,0]=3 10601 B9R0.48 CCC[C@H](N)CCN(C)C Amb25255847 [0,2,0,0,0,0|2,0,0]=4 10602 B9R0.48 CCNC(=O)CCC(=O)C Amb17334212 [0,2,0,0,0,0|0,0,1]=3 10603 B9R0.48 CCNC(=O)CCC(=O)Cl Amb17142903 [0,2,0,0,0,0|1,0,1]=4 10604 B9R0.48 CCNC(=O)CCC(=O)N Amb17142864 [0,2,0,0,0,0|1,0,1]=4 10605 B9R0.48 CCNC(=O)CCS(C)=O Amb24674872 [0,2,0,0,0,0|1,0,1]=4 10606 B9R0.48 CCNC(C)CCC(O)=O Amb24394614 [0,2,0,0,0,0|1,0,0]=3 10607 B9R0.48 CCN[C@@H](C)CNC(N)=O Amb25811109 [0,2,0,0,0,0|2,0,0]=4 10608 B9R0.48 CCN[C@H](C)CNC(N)=O Amb24570937 [0,2,0,0,0,0|2,0,0]=4 10609 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,2,0,0,0,0|1,0,1]=4 10610 B9R0.48 CCOC(=O)CCS(C)=O Amb18788306 [0,2,0,0,0,0|1,0,1]=4 10611 B9R0.48 CCOC(=O)CNC(=O)C Amb1195867 [0,2,0,0,0,0|1,0,1]=4 10612 B9R0.48 CCOC(=S)SCC(C)=O Amb17872265 [0,2,0,0,0,0|1,0,1]=4 10613 B9R0.48 CCOC(C)CCC(O)=O Amb24690847 [0,2,0,0,0,0|1,0,0]=3 10614 B9R0.48 CCOC(C)CNC(C)=N Amb24359991 [0,2,0,0,0,0|2,0,0]=4 10615 B9R0.48 CCOC(C)OCC(C)=O Amb24752470 [0,2,0,0,0,0|1,0,0]=3 10616 B9R0.48 CCOC(C)SCC(O)=O Amb24443054 [0,2,0,0,0,0|2,0,0]=4 10617 B9R0.48 CCOC(Cl)CSC(C)=O Amb24429156 [0,2,0,0,0,0|1,0,0]=3 10618 B9R0.48 CCOP(=O)CNC(C)=O Amb25260439 [0,2,0,0,0,0|2,0,0]=4 10619 B9R0.48 CCO\C(\C)=C/CC(C)=O Amb25713031 [0,2,0,0,0,0|0,0,2]=4 10620 B9R0.48 CCSC(=O)CCC(O)=O Amb24482232 [0,2,0,0,0,0|1,0,1]=4 10621 B9R0.48 CCSC(C)CCC(O)=O Amb18800669 [0,2,0,0,0,0|1,0,0]=3 10622 B9R0.48 CC\C=C(\C)/CCC(C)=O Amb24511429 [0,2,0,0,0,0|0,0,1]=3 10623 B9R0.48 CN(CCBr)CCS(C)=O Amb24541635 [0,2,0,0,0,0|2,0,0]=4 10624 B9R0.48 CN(CCCl)CCS(C)=O Amb25198530 [0,2,0,0,0,0|2,0,0]=4 10625 B9R0.48 CN(CCF)CCC(N)=O Amb25681499 [0,2,0,0,0,0|2,0,0]=4 10626 B9R0.48 CN(CCF)CCC(O)=O Amb25054517 [0,2,0,0,0,0|2,0,0]=4 10627 B9R0.48 CN(CCN)CCC(N)=O Amb24355517 [0,2,0,0,0,0|2,0,0]=4 10628 B9R0.48 CN(CCO)CCS(C)=O Amb24548435 [0,2,0,0,0,0|2,0,0]=4 10629 B9R0.48 CNCC(C)CCC(C)=C Amb24353317 [0,2,0,0,0,0|1,0,0]=3 10630 B9R0.48 CNCC(C)CCS(C)=O Amb24538764 [0,2,0,0,0,0|1,0,0]=3 10631 B9R0.48 CNCC(C)OCC(C)=C Amb25083727 [0,2,0,0,0,0|2,0,0]=4 10632 B9R0.48 CNCC(O)CCC(O)=O Amb24745159 [0,2,0,0,0,0|1,0,0]=3 10633 B9R0.48 CNCC(O)CNC(C)=O Amb24577191 [0,2,0,0,0,0|1,0,0]=3 10634 B9R0.48 COCC(Br)CNC(C)=O Amb25707089 [0,2,0,0,0,0|1,0,0]=3 10635 B9R0.48 COCC(C)CCC(O)=O Amb25340432 [0,2,0,0,0,0|1,0,0]=3 10636 B9R0.48 COCC(C)CNC(C)=N Amb24721998 [0,2,0,0,0,0|2,0,0]=4 10637 B9R0.48 COCC(C)CNC(C)=O Amb25099602 [0,2,0,0,0,0|1,0,0]=3 10638 B9R0.48 COCC(C)CNC(N)=O Amb25809151 [0,2,0,0,0,0|2,0,0]=4 10639 B9R0.48 COCC(C)NCC(O)=O Amb19408155 [0,2,0,0,0,0|2,0,0]=4 10640 B9R0.48 COCC(C)OCC(N)=O Amb25146467 [0,2,0,0,0,0|2,0,0]=4 10641 B9R0.48 COCC(C)ONC(C)=O Amb25681602 [0,2,0,0,0,0|2,0,0]=4 10642 B9R0.48 COCC(C)SCC(C)=C Amb24474742 [0,2,0,0,0,0|2,0,0]=4 10643 B9R0.48 COCC(Cl)COC(C)=O Amb24710120 [0,2,0,0,0,0|1,0,0]=3 10644 B9R0.48 COCC(O)CCC(C)=O Amb24438108 [0,2,0,0,0,0|0,0,0]=2 10645 B9R0.48 COCC(O)CNC(C)=O Amb24731685 [0,2,0,0,0,0|1,0,0]=3 10646 B9R0.48 COCC(O)CNS(C)=O Amb25177252 [0,2,0,0,0,0|2,0,0]=4 10647 B9R0.48 COCC(O)COC(C)=O Amb25346275 [0,2,0,0,0,0|1,0,0]=3 10648 B9R0.48 COC[C@@H](O)CNC(N)=O Amb25681169 [0,2,0,0,0,0|2,0,0]=4 10649 B9R0.48 COC[C@H](O)CNC(C)=O Amb24447557 [0,2,0,0,0,0|1,0,0]=3 10650 B9R0.48 COC[C@H](O)CNC(N)=O Amb24482761 [0,2,0,0,0,0|2,0,0]=4 10651 B9R0.48 COC[C@H](O)COC(C)=O Amb24687445 [0,2,0,0,0,0|1,0,0]=3 10652 B9R0.48 CSCC(C)CNC(C)=N Amb24744260 [0,2,0,0,0,0|2,0,0]=4 10653 B9R0.48 CSCC(C)COC(=O)Cl Amb25370807 [0,2,0,0,0,0|2,0,0]=4 10654 B9R0.48 CSCC(C)NCC(C)=C Amb25297875 [0,2,0,0,0,0|2,0,0]=4 10655 B9R0.48 CSCC(C)NCC(O)=O Amb25701279 [0,2,0,0,0,0|2,0,0]=4 10656 B9R0.48 CSCC(O)CCC(C)=C Amb25057883 [0,2,0,0,0,0|1,0,0]=3 10657 B9R0.48 CSS[C@@H](C)CCC(O)=O Amb25798967 [0,2,0,0,0,0|2,0,0]=4 10658 B9R0.48 CSS[C@H](C)CCC(O)=O Amb24652619 [0,2,0,0,0,0|2,0,0]=4 10659 B9R0.48 C[C@@H](CC=O)CCC(O)=O Amb24505022 [0,2,0,0,0,0|1,0,1]=4 10660 B9R0.48 C[C@@H](CCS)CCC(O)=O Amb24693959 [0,2,0,0,0,0|1,0,0]=3 10661 B9R0.48 C[C@H](CCBr)CCC(O)=O Amb24585993 [0,2,0,0,0,0|1,0,0]=3 10662 B9R0.48 C[C@H](CCO)CCC(C)=O Amb25319945 [0,2,0,0,0,0|0,0,0]=2 10663 B9R0.48 C[C@H](CCO)OCC(C)=C Amb25848415 [0,2,0,0,0,0|2,0,0]=4 10664 B9R0.48 C\C(\CCC(C)=O)=C/CO Amb25142674 [0,2,0,0,0,0|0,0,2]=4 10665 B9R0.48 C\C(\CCC(C)=O)=C\CO Amb25172142 [0,2,0,0,0,0|0,0,2]=4 10666 B9R0.48 C\C=C/[C@@H](O)CCC(C)=O Amb25146706 [0,2,0,0,0,0|0,0,1]=3 10667 B9R0.48 C\C=C\C(O)CCC(C)=O Amb25142677 [0,2,0,0,0,0|0,0,1]=3 10668 B9R0.48 C\C=C\C(O)CCC(O)=O Amb25275755 [0,2,0,0,0,0|1,0,1]=4 10669 B9R0.48 C\C=C\C(O)CNC(C)=O Amb24480779 [0,2,0,0,0,0|0,0,2]=4 10670 B9R0.48 C\C=C\[C@H](O)CCC(C)=O Amb24749626 [0,2,0,0,0,0|0,0,1]=3 10671 B9R0.48 C\C=C\[C@H](O)CCC(O)=O Amb24538051 [0,2,0,0,0,0|1,0,1]=4 10672 B9R0.48 NC(CC#N)CCC(O)=O Amb24595715 [0,2,0,0,0,0|1,0,1]=4 10673 B9R0.48 NC(CCS)CCC(O)=O Amb24453471 [0,2,0,0,0,0|1,0,0]=3 10674 B9R0.48 NCCC(=O)CCC(O)=O Amb25790735 [0,2,0,0,0,0|1,0,1]=4 10675 B9R0.48 NCCS(=O)CCC(N)=O Amb25737235 [0,2,0,0,0,0|2,0,0]=4 10676 B9R0.48 NN(CCO)CCC(O)=O Amb25259231 [0,2,0,0,0,0|2,0,0]=4 10677 B9R0.48 N[C@@H](CCO)CCC(O)=O Amb25756968 [0,2,0,0,0,0|1,0,0]=3 10678 B9R0.48 N[C@H](CC#N)CCC(O)=O Amb24541852 [0,2,0,0,0,0|1,0,1]=4 10679 B9R0.48 OC(=O)CCC(=O)CCO Amb25265246 [0,2,0,0,0,0|1,0,1]=4 10680 B9R0.48 OC(=O)CCS(=O)CCF Amb25040432 [0,2,0,0,0,0|2,0,0]=4 10681 B9R0.48 OC(CCS)CCC(O)=O Amb25320980 [0,2,0,0,0,0|1,0,0]=3 10682 B9R0.48 OCCN(CCC(=O)Cl)C Amb17142907 [0,2,0,0,0,0|2,0,0]=4 10683 B9R0.48 OCCN(CCC(=O)N)C Amb17142868 [0,2,0,0,0,0|2,0,0]=4 10684 B9R0.48 OCC[C@H](O)CCC(O)=O Amb25843738 [0,2,0,0,0,0|1,0,0]=3 10685 B9R0.55 C=C(Cl)CCCCC(N)=O Amb24358043 [0,2,0,0,0,0|1,0,1]=4 10686 B9R0.55 CC(=C)CCCCC(N)=O Amb24695037 [0,2,0,0,0,0|1,0,0]=3 10687 B9R0.55 CC(=C)CCOCC(O)=O Amb18644114 [0,2,0,0,0,0|1,0,1]=4 10688 B9R0.55 CC(=C)CNCCC(C)=C Amb24679605 [0,2,0,0,0,0|1,0,1]=4 10689 B9R0.55 CC(=C)CNCCC(N)=O Amb24442603 [0,2,0,0,0,0|1,0,1]=4 10690 B9R0.55 CC(=C)CSCCC(C)=C Amb24524477 [0,2,0,0,0,0|1,0,1]=4 10691 B9R0.55 CC(=C)CSCCN(C)C Amb21983415 [0,2,0,0,0,0|2,0,0]=4 10692 B9R0.55 CC(=N)NCCCC(N)=O Amb25729267 [0,2,0,0,0,0|1,0,1]=4 10693 B9R0.55 CC(=O)CCC#CC(C)=C Amb25728115 [0,2,0,0,0,0|0,0,2]=4 10694 B9R0.55 CC(=O)CCCC=C(C)O Amb24627452 [0,2,0,0,0,0|0,0,1]=3 10695 B9R0.55 CC(=O)CCCCC(=O)C Amb17593600 [0,2,0,0,0,0|0,0,0]=2 10696 B9R0.55 CC(=O)CCCCC(C)=C Amb24553457 [0,2,0,0,0,0|0,0,0]=2 10697 B9R0.55 CC(=O)CCCCC(N)=O Amb24505160 [0,2,0,0,0,0|0,0,1]=3 10698 B9R0.55 CC(=O)CCCNC(N)=O Amb24333544 [0,2,0,0,0,0|1,0,1]=4 10699 B9R0.55 CC(=O)CCCOC(=O)C Amb1033031 [0,2,0,0,0,0|0,0,1]=3 10700 B9R0.55 CC(=O)CCCOC(=O)Cl Amb25146796 [0,2,0,0,0,0|1,0,1]=4 10701 B9R0.55 CC(=O)CCCSC(C)=O Amb24662493 [0,2,0,0,0,0|0,0,1]=3 10702 B9R0.55 CC(=O)CCC\C=C(\C)/O Amb24546380 [0,2,0,0,0,0|0,0,1]=3 10703 B9R0.55 CC(=O)CCOCC(C)=C Amb25146699 [0,2,0,0,0,0|0,0,1]=3 10704 B9R0.55 CC(=O)CCSCC(C)=C Amb24340243 [0,2,0,0,0,0|0,0,1]=3 10705 B9R0.55 CC(=O)CCSCC(N)=O Amb24733496 [0,2,0,0,0,0|1,0,1]=4 10706 B9R0.55 CC(=O)CCSCC(O)=O Amb24443138 [0,2,0,0,0,0|1,0,1]=4 10707 B9R0.55 CC(=O)CC\C=C\C(Cl)Cl Amb25212311 [0,2,0,0,0,0|0,0,2]=4 10708 B9R0.55 CC(=O)CC\C=N\N(C)C Amb25320156 [0,2,0,0,0,0|1,0,1]=4 10709 B9R0.55 CC(=O)COCCC(F)F Amb24708448 [0,2,0,0,0,0|1,0,0]=3 10710 B9R0.55 CC(=O)CSCCC(=S)N Amb17503258 [0,2,0,0,0,0|1,0,1]=4 10711 B9R0.55 CC(=O)CSCCC(C)=O Amb24361719 [0,2,0,0,0,0|0,0,1]=3 10712 B9R0.55 CC(=O)CSSCC(C)=O Amb24509319 [0,2,0,0,0,0|1,0,1]=4 10713 B9R0.55 CC(=O)C\C=C\CC(C)=O Amb25227383 [0,2,0,0,0,0|0,0,2]=4 10714 B9R0.55 CC(=O)NCCCC(=C)Cl Amb24477328 [0,2,0,0,0,0|0,0,2]=4 10715 B9R0.55 CC(=O)NCCCC(N)=S Amb18182547 [0,2,0,0,0,0|1,0,1]=4 10716 B9R0.55 CC(=O)NCCNC(=O)C Amb2522644 [0,2,0,0,0,0|1,0,1]=4 10717 B9R0.55 CC(=O)NCCNC(C)=N Amb25778539 [0,2,0,0,0,0|1,0,1]=4 10718 B9R0.55 CC(=O)NCCNN(C)C Amb25720722 [0,2,0,0,0,0|2,0,0]=4 10719 B9R0.55 CC(=O)NCCOC(F)F Amb25228241 [0,2,0,0,0,0|2,0,0]=4 10720 B9R0.55 CC(=O)NNCCN(C)C Amb24073114 [0,2,0,0,0,0|2,0,0]=4 10721 B9R0.55 CC(=O)OCCCC(=C)F Amb22641472 [0,2,0,0,0,0|0,0,2]=4 10722 B9R0.55 CC(=O)OCCCC(=O)Cl Amb25174238 [0,2,0,0,0,0|1,0,1]=4 10723 B9R0.55 CC(=O)OCCCC(N)=O Amb25333292 [0,2,0,0,0,0|1,0,1]=4 10724 B9R0.55 CC(=O)OCCCC(O)=O Amb24480808 [0,2,0,0,0,0|1,0,1]=4 10725 B9R0.55 CC(=O)OCCCN(C)C Amb24541474 [0,2,0,0,0,0|1,0,0]=3 10726 B9R0.55 CC(=O)OCCCS(C)=O Amb24387513 [0,2,0,0,0,0|1,0,0]=3 10727 B9R0.55 CC(=O)SCCCN(C)C Amb25288482 [0,2,0,0,0,0|1,0,0]=3 10728 B9R0.55 CC(Br)=CCCCC(O)=O Amb25289201 [0,2,0,0,0,0|1,0,1]=4 10729 B9R0.55 CC(Br)CCCCC(O)=O Amb25309392 [0,2,0,0,0,0|1,0,0]=3 10730 B9R0.55 CC(Br)CCCCS(C)=O Amb24538952 [0,2,0,0,0,0|1,0,0]=3 10731 B9R0.55 CC(Br)CCCNC(C)=O Amb25784406 [0,2,0,0,0,0|0,0,0]=2 10732 B9R0.55 CC(C)=CCCCC(O)=O Amb18643939 [0,2,0,0,0,0|1,0,1]=4 10733 B9R0.55 CC(C)=COCCC(C)=O Amb25718461 [0,2,0,0,0,0|0,0,2]=4 10734 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [0,2,0,0,0,0|1,0,0]=3 10735 B9R0.55 CC(C)CCCCC(C)C Amb22043289 [0,2,0,0,0,0|1,0,1]=4 10736 B9R0.55 CC(C)CCCCC(C)O Amb24334713 [0,2,0,0,0,0|0,0,2]=4 10737 B9R0.55 CC(C)CCCCC([O-])=O Amb22732968 [0,2,0,0,0,0|1,0,0]=3 10738 B9R0.55 CC(C)CCCNC(C)=O Amb25756283 [0,2,0,0,0,0|0,0,0]=2 10739 B9R0.55 CC(C)CCCNC(N)=S Amb18788022 [0,2,0,0,0,0|1,1,0]=4 10740 B9R0.55 CC(C)CCCNC(S)=S Amb25238686 [0,2,0,0,0,0|1,1,0]=4 10741 B9R0.55 CC(C)CCCNN(C)C Amb24355489 [0,2,0,0,0,0|2,0,0]=4 10742 B9R0.55 CC(C)CCCOC(C)=O Amb24401009 [0,2,0,0,0,0|0,0,0]=2 10743 B9R0.55 CC(C)CCNCC(=C)Br Amb25079702 [0,2,0,0,0,0|1,0,1]=4 10744 B9R0.55 CC(C)CCNCC(=C)Cl Amb18800600 [0,2,0,0,0,0|1,0,1]=4 10745 B9R0.55 CC(C)CCNCC(C)Cl Amb25305127 [0,2,0,0,0,0|1,0,1]=4 10746 B9R0.55 CC(C)CCNCC(C)N Amb24544512 [0,2,0,0,0,0|1,0,1]=4 10747 B9R0.55 CC(C)CCNC[C@H](C)O Amb25125982 [0,2,0,0,0,0|0,0,2]=4 10748 B9R0.55 CC(C)CCOCC(=C)Br Amb25829671 [0,2,0,0,0,0|1,0,1]=4 10749 B9R0.55 CC(C)CCOCC(C)O Amb24478035 [0,2,0,0,0,0|0,0,2]=4 10750 B9R0.55 CC(C)CCOCC(N)=O Amb25055946 [0,2,0,0,0,0|1,0,0]=3 10751 B9R0.55 CC(C)CCOC[C@@H](C)N Amb25831001 [0,2,0,0,0,0|1,0,1]=4 10752 B9R0.55 CC(C)CCOC[C@H](C)O Amb25295154 [0,2,0,0,0,0|0,0,2]=4 10753 B9R0.55 CC(C)CCONC(C)=O Amb25822328 [0,2,0,0,0,0|1,0,0]=3 10754 B9R0.55 CC(C)CCSCC(=C)Cl Amb25130313 [0,2,0,0,0,0|1,0,1]=4 10755 B9R0.55 CC(C)CCSC[C@H](C)N Amb24613670 [0,2,0,0,0,0|1,0,1]=4 10756 B9R0.55 CC(C)CC\C=C\C(C)=O Amb25111718 [0,2,0,0,0,0|0,0,1]=3 10757 B9R0.55 CC(C)CNCCC(C)=C Amb24477971 [0,2,0,0,0,0|1,0,0]=3 10758 B9R0.55 CC(C)CNCCC(C)N Amb25677564 [0,2,0,0,0,0|1,0,1]=4 10759 B9R0.55 CC(C)CNCCC(N)=N Amb25088996 [0,2,0,0,0,0|2,0,0]=4 10760 B9R0.55 CC(C)CNCCS(C)=O Amb24717669 [0,2,0,0,0,0|1,0,0]=3 10761 B9R0.55 CC(C)CNCC[C@H](C)O Amb25730715 [0,2,0,0,0,0|0,0,2]=4 10762 B9R0.55 CC(C)CNOCC(C)=O Amb24478134 [0,2,0,0,0,0|1,0,0]=3 10763 B9R0.55 CC(C)CNOCC(N)=O Amb24667538 [0,2,0,0,0,0|2,0,0]=4 10764 B9R0.55 CC(C)COCCC(C)O Amb24478037 [0,2,0,0,0,0|0,0,2]=4 10765 B9R0.55 CC(C)CONCC(O)=O Amb24740299 [0,2,0,0,0,0|2,0,0]=4 10766 B9R0.55 CC(C)CO\C=C\C(C)=O Amb24569665 [0,2,0,0,0,0|0,0,2]=4 10767 B9R0.55 CC(C)CSCC=C(C)C Amb25235968 [0,2,0,0,0,0|1,0,1]=4 10768 B9R0.55 CC(C)CSCCC(C)=C Amb24660945 [0,2,0,0,0,0|1,0,0]=3 10769 B9R0.55 CC(C)CSCCC(C)O Amb25353802 [0,2,0,0,0,0|0,0,2]=4 10770 B9R0.55 CC(C)CSCCC(N)=O Amb18798041 [0,2,0,0,0,0|1,0,0]=3 10771 B9R0.55 CC(C)CSCCN(C)C Amb24380608 [0,2,0,0,0,0|2,0,0]=4 10772 B9R0.55 CC(C)CSCC[N+]([O-])=O Amb25256909 [0,2,0,0,0,0|2,0,0]=4 10773 B9R0.55 CC(C)C\C=C\CC(O)=O Amb24681011 [0,2,0,0,0,0|1,0,1]=4 10774 B9R0.55 CC(C)NCCC=C(C)C Amb19025197 [0,2,0,0,0,0|1,0,1]=4 10775 B9R0.55 CC(C)NCCCC(C)Br Amb24451526 [0,2,0,0,0,0|1,0,1]=4 10776 B9R0.55 CC(C)NCCCC(C)N Amb25147247 [0,2,0,0,0,0|1,0,1]=4 10777 B9R0.55 CC(C)NCCCC(C)O Amb24478897 [0,2,0,0,0,0|0,0,2]=4 10778 B9R0.55 CC(C)NCCCC(N)=O Amb25138205 [0,2,0,0,0,0|1,0,0]=3 10779 B9R0.55 CC(C)NCCCS(C)=O Amb25236669 [0,2,0,0,0,0|1,0,0]=3 10780 B9R0.55 CC(C)NCCNC(N)=O Amb19026215 [0,2,0,0,0,0|2,0,0]=4 10781 B9R0.55 CC(C)NCCNS(C)=O Amb24588854 [0,2,0,0,0,0|2,0,0]=4 10782 B9R0.55 CC(C)OCCCC(C)Cl Amb18800871 [0,2,0,0,0,0|1,0,1]=4 10783 B9R0.55 CC(C)OCCCC(C)O Amb24450979 [0,2,0,0,0,0|0,0,2]=4 10784 B9R0.55 CC(C)OCCCC(N)=O Amb25221235 [0,2,0,0,0,0|1,0,0]=3 10785 B9R0.55 CC(C)OCCCN(C)N Amb24545749 [0,2,0,0,0,0|2,0,0]=4 10786 B9R0.55 CC(C)OCCNC(C)=N Amb25064986 [0,2,0,0,0,0|2,0,0]=4 10787 B9R0.55 CC(C)OCCNC(C)=O Amb25719823 [0,2,0,0,0,0|1,0,0]=3 10788 B9R0.55 CC(C)OCCNC(N)=O Amb24432984 [0,2,0,0,0,0|2,0,0]=4 10789 B9R0.55 CC(C)OCCOC(=O)Cl Amb24465716 [0,2,0,0,0,0|2,0,0]=4 10790 B9R0.55 CC(C)OCCOC(C)=O Amb25662885 [0,2,0,0,0,0|1,0,0]=3 10791 B9R0.55 CC(C)OCCOC(N)=O Amb24436664 [0,2,0,0,0,0|2,0,0]=4 10792 B9R0.55 CC(C)ONCCC(O)=O Amb24619964 [0,2,0,0,0,0|2,0,0]=4 10793 B9R0.55 CC(C)SCCCC(C)=O Amb18792293 [0,2,0,0,0,0|0,0,0]=2 10794 B9R0.55 CC(C)SCCCC(C)Br Amb24704145 [0,2,0,0,0,0|1,0,1]=4 10795 B9R0.55 CC(C)SCCCC(N)=N Amb18792297 [0,2,0,0,0,0|2,0,0]=4 10796 B9R0.55 CC(C)SCCNC(C)=O Amb25306690 [0,2,0,0,0,0|1,0,0]=3 10797 B9R0.55 CC(C)SCCOC(C)=O Amb24482200 [0,2,0,0,0,0|1,0,0]=3 10798 B9R0.55 CC(C)\C=C\CCC(O)=O Amb25082805 [0,2,0,0,0,0|1,0,1]=4 10799 B9R0.55 CC(C)\C=C\OCC(C)=O Amb24736419 [0,2,0,0,0,0|0,0,2]=4 10800 B9R0.55 CC(CCCCC(=O)O)C Amb10576144 [0,2,0,0,0,0|1,0,0]=3 10801 B9R0.55 CC(CCNCC(=C)C)C Amb17317917 [0,2,0,0,0,0|1,0,0]=3 10802 B9R0.55 CC(CCNCC(=O)N)C Amb1112311 [0,2,0,0,0,0|1,0,0]=3 10803 B9R0.55 CC(CCNCC(=O)O)C Amb1111021 [0,2,0,0,0,0|1,0,0]=3 10804 B9R0.55 CC(CCSCC(=O)O)C Amb1137397 [0,2,0,0,0,0|1,0,0]=3 10805 B9R0.55 CC(CC\C=C\C(=O)O)C Amb17593603 [0,2,0,0,0,0|1,0,1]=4 10806 B9R0.55 CC(CNCCC(=O)O)C Amb10609230 [0,2,0,0,0,0|1,0,0]=3 10807 B9R0.55 CC(CNCCC(=O)O)C Amb2372367 [0,2,0,0,0,0|1,0,0]=3 10808 B9R0.55 CC(CNCCC(=S)N)C Amb17232337 [0,2,0,0,0,0|1,1,0]=4 10809 B9R0.55 CC(CNCCN(C)C)C Amb1114677 [0,2,0,0,0,0|2,0,0]=4 10810 B9R0.55 CC(CSCCC(=S)N)C Amb17503256 [0,2,0,0,0,0|1,1,0]=4 10811 B9R0.55 CC(Cl)C#CCOC(C)=O Amb25322069 [0,2,0,0,0,0|0,0,2]=4 10812 B9R0.55 CC(Cl)CCCCC(=O)Cl Amb24633993 [0,2,0,0,0,0|1,0,0]=3 10813 B9R0.55 CC(Cl)CCCCC(Cl)Cl Amb24741814 [0,2,0,0,0,0|1,0,1]=4 10814 B9R0.55 CC(Cl)CCCCC(O)=O Amb18646185 [0,2,0,0,0,0|1,0,0]=3 10815 B9R0.55 CC(Cl)CCCCN(C)C Amb25724889 [0,2,0,0,0,0|1,0,1]=4 10816 B9R0.55 CC(Cl)CCCCN(C)Cl Amb25700942 [0,2,0,0,0,0|1,0,1]=4 10817 B9R0.55 CC(Cl)CCCNC(C)=O Amb25275384 [0,2,0,0,0,0|0,0,0]=2 10818 B9R0.55 CC(Cl)\C=C\COC(C)=O Amb25074871 [0,2,0,0,0,0|0,0,2]=4 10819 B9R0.55 CC(F)CCCCC(C)=O Amb25145595 [0,2,0,0,0,0|0,0,0]=2 10820 B9R0.55 CC(F)CCONC(C)=O Amb24747985 [0,2,0,0,0,0|1,0,0]=3 10821 B9R0.55 CC(F)CCONC(N)=O Amb25761182 [0,2,0,0,0,0|2,0,0]=4 10822 B9R0.55 CC(F)CCSCC(C)=O Amb25097655 [0,2,0,0,0,0|0,0,0]=2 10823 B9R0.55 CC(F)COCCC(O)=O Amb25268355 [0,2,0,0,0,0|1,0,0]=3 10824 B9R0.55 CC(N)CCCCC(C)=C Amb24394573 [0,2,0,0,0,0|1,0,0]=3 10825 B9R0.55 CC(N)CCCCC(C)N Amb24637580 [0,2,0,0,0,0|1,0,1]=4 10826 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [0,2,0,0,0,0|1,0,0]=3 10827 B9R0.55 CC(N)CCCCC(O)=O Amb18644199 [0,2,0,0,0,0|1,0,0]=3 10828 B9R0.55 CC(N)CCCCC(O)=O Amb19515386 [0,2,0,0,0,0|1,0,0]=3 10829 B9R0.55 CC(N)CCCCS(C)=O Amb24539207 [0,2,0,0,0,0|1,0,0]=3 10830 B9R0.55 CC(N)CCCNC(C)=O Amb24481145 [0,2,0,0,0,0|0,0,0]=2 10831 B9R0.55 CC(N)CCCNC(N)=O Amb25136886 [0,2,0,0,0,0|1,0,0]=3 10832 B9R0.55 CC(N)CCSCC(=C)Br Amb25374613 [0,2,0,0,0,0|1,0,1]=4 10833 B9R0.55 CC(N)CSCCC(O)=O Amb24435179 [0,2,0,0,0,0|1,0,0]=3 10834 B9R0.55 CC(NCCCC(=O)O)C Amb1111231 [0,2,0,0,0,0|1,0,0]=3 10835 B9R0.55 CC(O)CCC#CC(C)=C Amb24412165 [0,2,0,0,0,0|1,0,1]=4 10836 B9R0.55 CC(O)CCC=C=C(C)C Amb24395750 [0,2,0,0,0,0|1,0,1]=4 10837 B9R0.55 CC(O)CCCCC(O)=O Amb18644264 [0,2,0,0,0,0|1,0,0]=3 10838 B9R0.55 CC(O)CCCCN(C)C Amb24271124 [0,2,0,0,0,0|0,0,2]=4 10839 B9R0.55 CC(O)CCCC[SiH](C)C Amb25043567 [0,2,0,0,0,0|0,0,2]=4 10840 B9R0.55 CC(O)CCCNC(N)=N Amb24481150 [0,2,0,0,0,0|2,0,0]=4 10841 B9R0.55 CC(O)CCCNS(C)=O Amb24551813 [0,2,0,0,0,0|1,0,0]=3 10842 B9R0.55 CC(O)CCNCC(=C)Cl Amb25789297 [0,2,0,0,0,0|1,0,1]=4 10843 B9R0.55 CC(O)CCNCC(C)=C Amb25285801 [0,2,0,0,0,0|1,0,0]=3 10844 B9R0.55 CC(O)CCNCC(O)=O Amb25369892 [0,2,0,0,0,0|1,0,0]=3 10845 B9R0.55 CC(O)CC\C=C\C(O)=O Amb24680771 [0,2,0,0,0,0|1,0,1]=4 10846 B9R0.55 CC(O)CNCC=C(C)C Amb25701248 [0,2,0,0,0,0|1,0,1]=4 10847 B9R0.55 CC(O)CNCCS(C)=O Amb24704852 [0,2,0,0,0,0|1,0,0]=3 10848 B9R0.55 CC(O)CNOCC(C)=C Amb25303181 [0,2,0,0,0,0|2,0,0]=4 10849 B9R0.55 CC(O)COCCC(O)=O Amb24746704 [0,2,0,0,0,0|1,0,0]=3 10850 B9R0.55 CC(O)CSCC=C(C)C Amb25120443 [0,2,0,0,0,0|1,0,1]=4 10851 B9R0.55 CC(O)CSCCC(O)=O Amb18792572 [0,2,0,0,0,0|1,0,0]=3 10852 B9R0.55 CC(O)CSCCN(C)C Amb25806842 [0,2,0,0,0,0|2,0,0]=4 10853 B9R0.55 CC(O)\C=C\CCC(O)=O Amb24453133 [0,2,0,0,0,0|1,0,1]=4 10854 B9R0.55 CC(O)\C=C\COC(C)=O Amb25680659 [0,2,0,0,0,0|0,0,2]=4 10855 B9R0.55 CN(C)CCCCC(N)=N Amb24398280 [0,2,0,0,0,0|2,0,0]=4 10856 B9R0.55 CN(C)CCCCC(N)=O Amb24715012 [0,2,0,0,0,0|1,0,0]=3 10857 B9R0.55 CN(C)CCCCC(N)=S Amb18792306 [0,2,0,0,0,0|1,1,0]=4 10858 B9R0.55 CN(C)CCCCC(O)=O Amb19275569 [0,2,0,0,0,0|1,0,0]=3 10859 B9R0.55 CN(C)CCCOC(=O)Cl Amb25216228 [0,2,0,0,0,0|2,0,0]=4 10860 B9R0.55 CN(C)CCCOC(N)=O Amb24383394 [0,2,0,0,0,0|2,0,0]=4 10861 B9R0.55 CN(C)CCOCC(N)=O Amb25688629 [0,2,0,0,0,0|2,0,0]=4 10862 B9R0.55 CN(C)CCOCC(O)=O Amb20667765 [0,2,0,0,0,0|2,0,0]=4 10863 B9R0.55 CN(C)CCOCC(O)=O Amb22059502 [0,2,0,0,0,0|2,0,0]=4 10864 B9R0.55 CN(C)CCSCC(N)=O Amb21983542 [0,2,0,0,0,0|2,0,0]=4 10865 B9R0.55 CN(CCCNC(=O)N)C Amb1125203 [0,2,0,0,0,0|2,0,0]=4 10866 B9R0.55 CN(CCCNC(=O)N)C Amb13951597 [0,2,0,0,0,0|2,0,0]=4 10867 B9R0.55 CN(CCNCC(=C)C)C Amb17309047 [0,2,0,0,0,0|2,0,0]=4 10868 B9R0.55 CN(CCSCC(=O)O)C Amb1138164 [0,2,0,0,0,0|2,0,0]=4 10869 B9R0.55 CP(=O)CCCCC(O)=O Amb25765822 [0,2,0,0,0,0|1,0,0]=3 10870 B9R0.55 CS(=O)CCCCC(O)=O Amb18788305 [0,2,0,0,0,0|1,0,0]=3 10871 B9R0.55 CS(=O)CCCNC(N)=O Amb25139044 [0,2,0,0,0,0|2,0,0]=4 10872 B9R0.55 CS(=O)CCNCC(O)=O Amb24396496 [0,2,0,0,0,0|2,0,0]=4 10873 B9R0.55 CS(=O)CCOCC(O)=O Amb24600087 [0,2,0,0,0,0|2,0,0]=4 10874 B9R0.55 CS(=O)NCCCC(O)=O Amb24753135 [0,2,0,0,0,0|2,0,0]=4 10875 B9R0.55 C[C@@H](O)C#CCOC(C)=O Amb25357468 [0,2,0,0,0,0|0,0,2]=4 10876 B9R0.55 C[C@@H](O)CCCCC(C)=O Amb25114746 [0,2,0,0,0,0|0,0,0]=2 10877 B9R0.55 C[C@@H](O)CCCCC(O)=O Amb24427549 [0,2,0,0,0,0|1,0,0]=3 10878 B9R0.55 C[C@@H](O)CNCC=C(C)C Amb24481277 [0,2,0,0,0,0|1,0,1]=4 10879 B9R0.55 C[C@@H](O)CNCCC(N)=O Amb24447126 [0,2,0,0,0,0|1,0,0]=3 10880 B9R0.55 C[C@@H](O)CNCCS(C)=O Amb24424223 [0,2,0,0,0,0|1,0,0]=3 10881 B9R0.55 C[C@@H](O)CNOCC(C)=C Amb25229367 [0,2,0,0,0,0|2,0,0]=4 10882 B9R0.55 C[C@@H](O)CSCCN(C)C Amb24504819 [0,2,0,0,0,0|2,0,0]=4 10883 B9R0.55 C[C@H](N)CCCCC(O)=O Amb25229790 [0,2,0,0,0,0|1,0,0]=3 10884 B9R0.55 C[C@H](O)C#CCOC(C)=O Amb25806660 [0,2,0,0,0,0|0,0,2]=4 10885 B9R0.55 C[C@H](O)CCCCC(O)=O Amb24671333 [0,2,0,0,0,0|1,0,0]=3 10886 B9R0.55 C[C@H](O)CNCC=C(C)C Amb24481274 [0,2,0,0,0,0|1,0,1]=4 10887 B9R0.55 C[C@H](O)CNCCC(C)O Amb25352546 [0,2,0,0,0,0|0,0,2]=4 10888 B9R0.55 C[C@H](O)CNCCN(C)C Amb24479100 [0,2,0,0,0,0|2,0,0]=4 10889 B9R0.55 C[C@H](O)\C=C\CCC(C)=O Amb24722887 [0,2,0,0,0,0|0,0,1]=3 10890 B9R0.55 NC(=N)CCCCC(O)=O Amb25147486 [0,2,0,0,0,0|1,0,1]=4 10891 B9R0.55 NC(=O)CCNCC(F)F Amb18791496 [0,2,0,0,0,0|2,0,0]=4 10892 B9R0.55 NC(=O)CCOCC(F)F Amb24711973 [0,2,0,0,0,0|2,0,0]=4 10893 B9R0.55 O=C(Cl)CCOCC(F)F Amb24711925 [0,2,0,0,0,0|2,0,0]=4 10894 B9R0.55 OC(=O)CCCCC(Cl)Cl Amb24482330 [0,2,0,0,0,0|1,0,0]=3 10895 B9R0.55 OC(=O)CCCCC(O)=O Amb22043229 [0,2,0,0,0,0|1,0,1]=4 10896 B9R0.55 OC(=O)CCCCC(O)=O Amb22167453 [0,2,0,0,0,0|1,0,1]=4 10897 B9R0.55 OC(=O)CCCCC(O)=O Amb22336279 [0,2,0,0,0,0|1,0,1]=4 10898 B9R0.55 OC(=O)CCCCC(O)=O Amb22338188 [0,2,0,0,0,0|1,0,1]=4 10899 B9R0.55 OC(=O)CCCCC(O)=O Amb22351345 [0,2,0,0,0,0|1,0,1]=4 10900 B9R0.55 OC(=O)CCCCC(O)=O Amb22351401 [0,2,0,0,0,0|1,0,1]=4 10901 B9R0.55 OC(=O)CCCCC(O)=O Amb22351452 [0,2,0,0,0,0|1,0,1]=4 10902 B9R0.55 OC(=O)CCCCC(O)=O Amb22351586 [0,2,0,0,0,0|1,0,1]=4 10903 B9R0.55 OC(=O)CCCCC(O)=O Amb22353360 [0,2,0,0,0,0|1,0,1]=4 10904 B9R0.55 OC(=O)CCCCC(O)=O Amb22363211 [0,2,0,0,0,0|1,0,1]=4 10905 B9R0.55 OC(=O)CCCSC(C)C Amb17503621 [0,2,0,0,0,0|1,0,0]=3 10906 B9R0.55 OC(=O)CCNCC(F)F Amb18179466 [0,2,0,0,0,0|2,0,0]=4 10907 B9R0.55 OC(=O)CCSCC(F)F Amb18793590 [0,2,0,0,0,0|2,0,0]=4 10908 B9R0.55 OC(=O)CNCCC(F)F Amb24721262 [0,2,0,0,0,0|2,0,0]=4 10909 B9R0.55 O[13C](=O)CCCC[13C](O)=O Amb22338172 [0,2,0,0,0,0|1,0,1]=4 10910 B9R0.55 [O-]C(=O)CCCCC(O)=O Amb21934396 [0,2,0,0,0,0|1,0,1]=4 10911 B9R0.55 [O-]C(=O)CCCCC([O-])=O Amb22168121 [0,2,0,0,0,0|1,0,1]=4 10912 B9R0.55 [O-]C(=O)CCCCC([O-])=O Amb22230380 [0,2,0,0,0,0|1,0,1]=4 10913 B9R0.55 [O-]C(=O)CCCCC([O-])=O Amb22732848 [0,2,0,0,0,0|1,0,1]=4 10914 B9R0.55 [O-][N+](=O)CCCCC(O)=O Amb24596293 [0,2,0,0,0,0|2,0,0]=4 10915 B9R0.3 CCCCC(C)S(=O)(=O)Cl Amb18324731 [0,2,0,0,0,0|2,0,0]=4 10916 B9R0.3 CCCCC(C)S(N)(=O)=O Amb18183522 [0,2,0,0,0,0|2,0,0]=4 10917 B9R0.3 CCCCC(Cl)C(C)(C)C Amb18183500 [0,2,0,0,0,0|1,0,1]=4 10918 B9R0.3 CCCCC(Cl)C(C)(C)O Amb24425552 [0,2,0,0,0,0|0,0,2]=4 10919 B9R0.3 CCCCC(Cl)[Si](C)(C)C Amb25772261 [0,2,0,0,0,0|1,1,0]=4 10920 B9R0.3 CCCCC(F)C(C)(C)N Amb24352596 [0,2,0,0,0,0|1,0,1]=4 10921 B9R0.3 CCCCC(N)C(C)(F)F Amb25027528 [0,2,0,0,0,0|1,0,1]=4 10922 B9R0.3 CCCCC(O)C(C)(C)Cl Amb25220956 [0,2,0,0,0,0|1,0,1]=4 10923 B9R0.3 CCCCC(O)C(C)(C)N Amb24394561 [0,2,0,0,0,0|1,0,1]=4 10924 B9R0.3 CCCCC(O)C(C)(Cl)Cl Amb25360250 [0,2,0,0,0,0|1,0,1]=4 10925 B9R0.3 CCCCC(O)C(C)(F)F Amb25857854 [0,2,0,0,0,0|1,0,1]=4 10926 B9R0.3 CCCCC(O)P(O)(O)=O Amb25356317 [0,2,0,0,0,0|2,0,0]=4 10927 B9R0.3 CCCCC(O)S([O-])(=O)=O Amb25327253 [0,2,0,0,0,0|2,0,0]=4 10928 B9R0.3 CCCCC(O)[Si](C)(C)C Amb24431025 [0,2,0,0,0,0|1,1,0]=4 10929 B9R0.3 CCCC[C@@H](O)C(C)(C)O Amb25721532 [0,2,0,0,0,0|0,0,2]=4 10930 B9R0.3 CCCC[C@H](Cl)C(C)(C)O Amb24571700 [0,2,0,0,0,0|0,0,2]=4 10931 B9R0.3 CCCC[C@H](N)C(C)(C)C Amb25743858 [0,2,0,0,0,0|1,0,1]=4 10932 B9R0.3 CCCC[C@H](O)C(C)(C)C Amb25028019 [0,2,0,0,0,0|1,0,1]=4 10933 B9R0.7 CC(=C)C(=O)CCC(C)C Amb25741534 [0,2,0,0,0,0|1,0,1]=4 10934 B9R0.7 CC(=C)CCC(=C)C(C)=O Amb25700996 [0,2,0,0,0,0|0,0,2]=4 10935 B9R0.7 CC(=C)CCC(=O)C(C)O Amb25280534 [0,2,0,0,0,0|1,0,1]=4 10936 B9R0.7 CC(=C)CCC(C)C(O)=O Amb25809141 [0,2,0,0,0,0|1,0,1]=4 10937 B9R0.7 CC(=C)CCC(O)C(F)F Amb25733685 [0,2,0,0,0,0|2,0,0]=4 10938 B9R0.7 CC(=C)CC[C@@H](C)C(O)=O Amb25685103 [0,2,0,0,0,0|1,0,1]=4 10939 B9R0.7 CC(=C)CC[C@@H](N)C(O)=O Amb25775219 [0,2,0,0,0,0|1,0,1]=4 10940 B9R0.7 CC(=O)C(=C)COC(C)C Amb24546081 [0,2,0,0,0,0|1,0,1]=4 10941 B9R0.7 CC(=O)C(Br)CCC(O)=O Amb25733508 [0,2,0,0,0,0|1,0,1]=4 10942 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [0,2,0,0,0,0|1,0,1]=4 10943 B9R0.7 CC(=O)C(C)CNC(C)=O Amb24072033 [0,2,0,0,0,0|1,0,1]=4 10944 B9R0.7 CC(=O)C(C)SCC(C)=O Amb24482830 [0,2,0,0,0,0|1,0,1]=4 10945 B9R0.7 CC(=O)C(Cl)CCC(=O)Cl Amb24373858 [0,2,0,0,0,0|1,0,1]=4 10946 B9R0.7 CC(=O)C(F)COC(C)=O Amb25319947 [0,2,0,0,0,0|1,0,1]=4 10947 B9R0.7 CC(=O)C(N)CCC(N)=O Amb25231237 [0,2,0,0,0,0|1,0,1]=4 10948 B9R0.7 CC(=O)CCC(=C)C(C)=O Amb25303019 [0,2,0,0,0,0|0,0,2]=4 10949 B9R0.7 CC(=O)CCC(=O)C(C)=O Amb25852390 [0,2,0,0,0,0|0,0,2]=4 10950 B9R0.7 CC(=O)CCC(=O)C(C)C Amb19515553 [0,2,0,0,0,0|0,0,1]=3 10951 B9R0.7 CC(=O)CCC(=O)N(C)C Amb17334213 [0,2,0,0,0,0|1,0,1]=4 10952 B9R0.7 CC(=O)CCC(C)C(C)=C Amb25702190 [0,2,0,0,0,0|0,0,1]=3 10953 B9R0.7 CC(=O)CCC(C)C(C)=O Amb25146789 [0,2,0,0,0,0|0,0,1]=3 10954 B9R0.7 CC(=O)CCC(C)C(O)=O Amb18644099 [0,2,0,0,0,0|1,0,1]=4 10955 B9R0.7 CC(=O)CCC(Cl)C(C)=C Amb25242489 [0,2,0,0,0,0|0,0,1]=3 10956 B9R0.7 CC(=O)CCC(F)C(C)=O Amb25369738 [0,2,0,0,0,0|0,0,1]=3 10957 B9R0.7 CC(=O)CCC(N)C(O)=O Amb20669473 [0,2,0,0,0,0|1,0,1]=4 10958 B9R0.7 CC(=O)CCC(N)C(O)=O Amb22157242 [0,2,0,0,0,0|1,0,1]=4 10959 B9R0.7 CC(=O)CCN(C)C(C)=O Amb24352049 [0,2,0,0,0,0|1,0,1]=4 10960 B9R0.7 CC(=O)CC[C@@H](C)C(C)=C Amb24646916 [0,2,0,0,0,0|0,0,1]=3 10961 B9R0.7 CC(=O)CC[C@@H](N)C(O)=O Amb19130479 [0,2,0,0,0,0|1,0,1]=4 10962 B9R0.7 CC(=O)CC[C@H](C)C(C)=C Amb24583145 [0,2,0,0,0,0|0,0,1]=3 10963 B9R0.7 CC(=O)CC[C@H](C)C(C)=O Amb25692099 [0,2,0,0,0,0|0,0,1]=3 10964 B9R0.7 CC(=O)CC[C@H](N)C(O)=O Amb25147501 [0,2,0,0,0,0|1,0,1]=4 10965 B9R0.7 CC(=O)COC(=C)C(C)C Amb25146600 [0,2,0,0,0,0|1,0,1]=4 10966 B9R0.7 CC(=O)COC(=O)C(C)N Amb24524612 [0,2,0,0,0,0|1,0,1]=4 10967 B9R0.7 CC(=O)COC(=O)[C@@H](C)O Amb25688635 [0,2,0,0,0,0|1,0,1]=4 10968 B9R0.7 CC(=O)COC(=O)[C@H](C)N Amb25147543 [0,2,0,0,0,0|1,0,1]=4 10969 B9R0.7 CC(=O)COC(=O)[C@H](C)O Amb25821081 [0,2,0,0,0,0|1,0,1]=4 10970 B9R0.7 CC(=O)N(C)CCS(C)=O Amb25260062 [0,2,0,0,0,0|2,0,0]=4 10971 B9R0.7 CC(=O)NCC(=O)C(C)C Amb23555718 [0,2,0,0,0,0|1,0,1]=4 10972 B9R0.7 CC(=O)NCC(C)C(C)=C Amb24359912 [0,2,0,0,0,0|1,0,1]=4 10973 B9R0.7 CC(=O)NCC(O)C(F)F Amb24397017 [0,2,0,0,0,0|2,0,0]=4 10974 B9R0.7 CC(=O)OCC(=O)C(C)C Amb24456861 [0,2,0,0,0,0|1,0,1]=4 10975 B9R0.7 CC(=O)OCC(Br)C(C)=C Amb25733514 [0,2,0,0,0,0|1,0,1]=4 10976 B9R0.7 CC(=O)SCC(=O)[C@H](C)N Amb24509522 [0,2,0,0,0,0|1,0,1]=4 10977 B9R0.7 CC(=O)[C@@H](C)CCC(O)=O Amb25333003 [0,2,0,0,0,0|1,0,1]=4 10978 B9R0.7 CC(=O)[C@@H](N)CCC(N)=O Amb25142080 [0,2,0,0,0,0|1,0,1]=4 10979 B9R0.7 CC(=O)[C@@H](N)CCC(O)=O Amb24386065 [0,2,0,0,0,0|1,0,1]=4 10980 B9R0.7 CC(=O)[C@H](C)CCC(O)=O Amb24671283 [0,2,0,0,0,0|1,0,1]=4 10981 B9R0.7 CC(=O)[C@H](C)COC(C)=O Amb24457434 [0,2,0,0,0,0|1,0,1]=4 10982 B9R0.7 CC(C(C)C)NCC(=O)N Amb1113849 [0,2,0,0,0,0|2,0,0]=4 10983 B9R0.7 CC(C)=C(Br)CCC(C)N Amb18655208 [0,2,0,0,0,0|1,0,1]=4 10984 B9R0.7 CC(C)=CCC(C)C(C)=O Amb24727108 [0,2,0,0,0,0|0,0,2]=4 10985 B9R0.7 CC(C)=CCC(Cl)C(C)=O Amb24372865 [0,2,0,0,0,0|0,0,2]=4 10986 B9R0.7 CC(C)=CCC(O)C(C)=O Amb24356685 [0,2,0,0,0,0|0,0,2]=4 10987 B9R0.7 CC(C)=CC[C@@H](O)C(C)=O Amb24662470 [0,2,0,0,0,0|0,0,2]=4 10988 B9R0.7 CC(C)=CC[C@H](O)C(C)=O Amb24648883 [0,2,0,0,0,0|0,0,2]=4 10989 B9R0.7 CC(C)C(Br)CCC(O)=O Amb24640345 [0,2,0,0,0,0|1,0,0]=3 10990 B9R0.7 CC(C)C(Br)CNC(C)=O Amb25717188 [0,2,0,0,0,0|1,0,0]=3 10991 B9R0.7 CC(C)C(Br)COC(C)=O Amb24633343 [0,2,0,0,0,0|1,0,0]=3 10992 B9R0.7 CC(C)C(C)CCC(C)=O Amb24423995 [0,2,0,0,0,0|0,0,0]=2 10993 B9R0.7 CC(C)C(C)CCC(C)N Amb24634754 [0,2,0,0,0,0|1,0,1]=4 10994 B9R0.7 CC(C)C(C)CCC(C)O Amb25788195 [0,2,0,0,0,0|0,0,2]=4 10995 B9R0.7 CC(C)C(C)CCC(O)=O Amb25843702 [0,2,0,0,0,0|1,0,0]=3 10996 B9R0.7 CC(C)C(C)NCC(C)=C Amb25288686 [0,2,0,0,0,0|2,0,0]=4 10997 B9R0.7 CC(C)C(C)OCC(O)=O Amb24479217 [0,2,0,0,0,0|2,0,0]=4 10998 B9R0.7 CC(C)C(C)SCC(C)=C Amb24482847 [0,2,0,0,0,0|2,0,0]=4 10999 B9R0.7 CC(C)C(C)SCC(N)=O Amb25769868 [0,2,0,0,0,0|2,0,0]=4 11000 B9R0.7 CC(C)C(C)\C=C\C(C)=O Amb25063008 [0,2,0,0,0,0|0,0,2]=4 11001 B9R0.7 CC(C)C(Cl)CCC(O)=O Amb24413514 [0,2,0,0,0,0|1,0,0]=3 11002 B9R0.7 CC(C)C(F)CCC(O)=O Amb24480880 [0,2,0,0,0,0|1,0,0]=3 11003 B9R0.7 CC(C)C(N)CCC(C)=C Amb24520722 [0,2,0,0,0,0|1,0,0]=3 11004 B9R0.7 CC(C)C(N)CCC(O)=O Amb18124745 [0,2,0,0,0,0|1,0,0]=3 11005 B9R0.7 CC(C)C(N)CCN(C)C Amb23511488 [0,2,0,0,0,0|2,0,0]=4 11006 B9R0.7 CC(C)C(N)CNC(C)=O Amb24757730 [0,2,0,0,0,0|1,0,0]=3 11007 B9R0.7 CC(C)C(O)CC=C(C)C Amb25848459 [0,2,0,0,0,0|1,0,1]=4 11008 B9R0.7 CC(C)C(O)CCC(C)=O Amb24380845 [0,2,0,0,0,0|0,0,0]=2 11009 B9R0.7 CC(C)C(O)CCC(C)O Amb24717102 [0,2,0,0,0,0|0,0,2]=4 11010 B9R0.7 CC(C)C(O)CCC(O)=O Amb25252592 [0,2,0,0,0,0|1,0,0]=3 11011 B9R0.7 CC(C)C(O)CC[C@H](C)O Amb25346139 [0,2,0,0,0,0|0,0,2]=4 11012 B9R0.7 CC(C)C(O)CNS(C)=O Amb25177235 [0,2,0,0,0,0|2,0,0]=4 11013 B9R0.7 CC(C)C(O)\C=C\C(C)=O Amb24477028 [0,2,0,0,0,0|0,0,2]=4 11014 B9R0.7 CC(C)C(S)CCC(C)=O Amb25723213 [0,2,0,0,0,0|0,0,0]=2 11015 B9R0.7 CC(C)C(S)CCC(O)=O Amb25723893 [0,2,0,0,0,0|1,0,0]=3 11016 B9R0.7 CC(C)CCC(=O)C(=O)Cl Amb24722777 [0,2,0,0,0,0|1,0,1]=4 11017 B9R0.7 CC(C)CCC(Br)C(C)=O Amb25828882 [0,2,0,0,0,0|0,0,0]=2 11018 B9R0.7 CC(C)CCC(Br)C(C)C Amb24476893 [0,2,0,0,0,0|1,0,1]=4 11019 B9R0.7 CC(C)CCC(Br)C(O)=O Amb18131059 [0,2,0,0,0,0|1,0,0]=3 11020 B9R0.7 CC(C)CCC(C)C(C)=O Amb24392384 [0,2,0,0,0,0|0,0,0]=2 11021 B9R0.7 CC(C)CCC(C)C(C)Cl Amb18183502 [0,2,0,0,0,0|1,0,1]=4 11022 B9R0.7 CC(C)CCC(C)C(C)N Amb19033535 [0,2,0,0,0,0|1,0,1]=4 11023 B9R0.7 CC(C)CCC(C)C(C)O Amb25262988 [0,2,0,0,0,0|0,0,2]=4 11024 B9R0.7 CC(C)CCC(C)C(O)=O Amb19033547 [0,2,0,0,0,0|1,0,0]=3 11025 B9R0.7 CC(C)CCC(C)[N+]([O-])=O Amb24555516 [0,2,0,0,0,0|2,0,0]=4 11026 B9R0.7 CC(C)CCC(Cl)C(=O)Cl Amb25225638 [0,2,0,0,0,0|1,0,0]=3 11027 B9R0.7 CC(C)CCC(Cl)C(C)C Amb18183501 [0,2,0,0,0,0|1,0,1]=4 11028 B9R0.7 CC(C)CCC(Cl)C(N)=O Amb25362428 [0,2,0,0,0,0|1,0,0]=3 11029 B9R0.7 CC(C)CCC(F)C(C)=O Amb24383731 [0,2,0,0,0,0|0,0,0]=2 11030 B9R0.7 CC(C)CCC(N)C(C)=C Amb25765968 [0,2,0,0,0,0|1,0,0]=3 11031 B9R0.7 CC(C)CCC(N)C(C)=O Amb18831542 [0,2,0,0,0,0|0,0,0]=2 11032 B9R0.7 CC(C)CCC(N)C(C)O Amb18124763 [0,2,0,0,0,0|0,0,2]=4 11033 B9R0.7 CC(C)CCC(N)C(O)=O Amb19269152 [0,2,0,0,0,0|1,0,0]=3 11034 B9R0.7 CC(C)CCC(O)C(C)=C Amb25043418 [0,2,0,0,0,0|1,0,0]=3 11035 B9R0.7 CC(C)CCC(O)C(C)=O Amb24502166 [0,2,0,0,0,0|0,0,0]=2 11036 B9R0.7 CC(C)CCC(O)C(C)C Amb22228388 [0,2,0,0,0,0|1,0,1]=4 11037 B9R0.7 CC(C)CCC(O)C(C)O Amb25235411 [0,2,0,0,0,0|0,0,2]=4 11038 B9R0.7 CC(C)CCC(O)C(N)=O Amb25210125 [0,2,0,0,0,0|1,0,0]=3 11039 B9R0.7 CC(C)CCN(C)C(C)=N Amb25792554 [0,2,0,0,0,0|2,0,0]=4 11040 B9R0.7 CC(C)CC[C@@H](N)C(=O)Cl Amb25086091 [0,2,0,0,0,0|1,0,0]=3 11041 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb19133196 [0,2,0,0,0,0|1,0,0]=3 11042 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb22899130 [0,2,0,0,0,0|1,0,0]=3 11043 B9R0.7 CC(C)CC[C@H](Cl)C(=O)Cl Amb24544198 [0,2,0,0,0,0|1,0,0]=3 11044 B9R0.7 CC(C)CC[C@H](F)C(C)=O Amb25050234 [0,2,0,0,0,0|0,0,0]=2 11045 B9R0.7 CC(C)CC[C@H](O)C(C)=O Amb25059211 [0,2,0,0,0,0|0,0,0]=2 11046 B9R0.7 CC(C)CNC(C)C(C)=O Amb24480697 [0,2,0,0,0,0|1,0,0]=3 11047 B9R0.7 CC(C)CN[C@H](C)C(N)=O Amb25052017 [0,2,0,0,0,0|2,0,0]=4 11048 B9R0.7 CC(C)CN[C@H](C)C(O)=O Amb25300819 [0,2,0,0,0,0|2,0,0]=4 11049 B9R0.7 CC(C)COC(C)C(N)=O Amb19960054 [0,2,0,0,0,0|2,0,0]=4 11050 B9R0.7 CC(C)CSC(C)C(N)=O Amb18183474 [0,2,0,0,0,0|2,0,0]=4 11051 B9R0.7 CC(C)N(C)CCC(C)=C Amb24449256 [0,2,0,0,0,0|2,0,0]=4 11052 B9R0.7 CC(C)N(C)CCC(N)=O Amb25216072 [0,2,0,0,0,0|2,0,0]=4 11053 B9R0.7 CC(C)NCC(N)C(O)=O Amb25790256 [0,2,0,0,0,0|2,0,0]=4 11054 B9R0.7 CC(C)NCC(O)C(C)=C Amb25221200 [0,2,0,0,0,0|2,0,0]=4 11055 B9R0.7 CC(C)NC[C@H](N)C(O)=O Amb24682685 [0,2,0,0,0,0|2,0,0]=4 11056 B9R0.7 CC(C)NC[C@H](O)C(O)=O Amb24479668 [0,2,0,0,0,0|2,0,0]=4 11057 B9R0.7 CC(C)OCC(C)C(C)=O Amb24646230 [0,2,0,0,0,0|1,0,0]=3 11058 B9R0.7 CC(C)OCC(N)C(C)=C Amb24428467 [0,2,0,0,0,0|2,0,0]=4 11059 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [0,2,0,0,0,0|2,0,0]=4 11060 B9R0.7 CC(C)OCC(O)C(O)=O Amb24583914 [0,2,0,0,0,0|2,0,0]=4 11061 B9R0.7 CC(C)OC[C@@H](N)C(N)=O Amb25267850 [0,2,0,0,0,0|2,0,0]=4 11062 B9R0.7 CC(C)OC[C@@H](N)C(O)=O Amb24479342 [0,2,0,0,0,0|2,0,0]=4 11063 B9R0.7 CC(C)OC[C@H](O)C(O)=O Amb24480796 [0,2,0,0,0,0|2,0,0]=4 11064 B9R0.7 CC(C)S(=O)CCC(O)=O Amb18312508 [0,2,0,0,0,0|2,0,0]=4 11065 B9R0.7 CC(C)SCC(C)C(O)=O Amb18303880 [0,2,0,0,0,0|2,0,0]=4 11066 B9R0.7 CC(C)SCC(N)C(N)=O Amb18788147 [0,2,0,0,0,0|2,0,0]=4 11067 B9R0.7 CC(C)SCC(O)C(O)=O Amb24728812 [0,2,0,0,0,0|2,0,0]=4 11068 B9R0.7 CC(C)SC[C@@H](N)C(O)=O Amb18792510 [0,2,0,0,0,0|2,0,0]=4 11069 B9R0.7 CC(C)SC[C@H](N)C(O)=O Amb25087870 [0,2,0,0,0,0|2,0,0]=4 11070 B9R0.7 CC(C)SC[C@H](O)C(O)=O Amb25362660 [0,2,0,0,0,0|2,0,0]=4 11071 B9R0.7 CC(C)[C@@H](C)CCC(O)=O Amb25076667 [0,2,0,0,0,0|1,0,0]=3 11072 B9R0.7 CC(C)[C@@H](O)CCN(C)C Amb24735119 [0,2,0,0,0,0|2,0,0]=4 11073 B9R0.7 CC(C)[C@@H](O)CC[C@H](C)O Amb24748359 [0,2,0,0,0,0|0,0,2]=4 11074 B9R0.7 CC(C)[C@H](N)CCC(O)=O Amb24452899 [0,2,0,0,0,0|1,0,0]=3 11075 B9R0.7 CC(C)[C@H](O)CC[C@H](C)O Amb25185408 [0,2,0,0,0,0|0,0,2]=4 11076 B9R0.7 CC(CCC(C)=C)C(C)Br Amb24572731 [0,2,0,0,0,0|1,0,0]=3 11077 B9R0.7 CC(CCC(C)Br)C(O)=O Amb24452260 [0,2,0,0,0,0|1,0,0]=3 11078 B9R0.7 CC(CCS(C)=O)C(C)Cl Amb25265317 [0,2,0,0,0,0|1,0,0]=3 11079 B9R0.7 CC(CCS(C)=O)C(C)O Amb24555698 [0,2,0,0,0,0|1,0,0]=3 11080 B9R0.7 CC(CNC(=O)C(=O)C)C Amb17399879 [0,2,0,0,0,0|1,0,1]=4 11081 B9R0.7 CC(CNC(C)=O)N(C)C Amb24479027 [0,2,0,0,0,0|2,0,0]=4 11082 B9R0.7 CC(COC(C)=O)C(C)O Amb24719537 [0,2,0,0,0,0|1,0,0]=3 11083 B9R0.7 CC(Cl)C(=O)CCC(O)=O Amb25362323 [0,2,0,0,0,0|1,0,1]=4 11084 B9R0.7 CC(Cl)C(O)CCC(O)=O Amb24677604 [0,2,0,0,0,0|1,0,0]=3 11085 B9R0.7 CC(Cl)CCC(N)C(O)=O Amb24692699 [0,2,0,0,0,0|1,0,0]=3 11086 B9R0.7 CC(Cl)CC[C@H](N)C(O)=O Amb24692939 [0,2,0,0,0,0|1,0,0]=3 11087 B9R0.7 CC(F)C(O)CCC(O)=O Amb25831840 [0,2,0,0,0,0|1,0,0]=3 11088 B9R0.7 CC(N)C(=O)CCC(O)=O Amb25709431 [0,2,0,0,0,0|1,0,1]=4 11089 B9R0.7 CC(N)C(N)CCC(O)=O Amb24377171 [0,2,0,0,0,0|1,0,0]=3 11090 B9R0.7 CC(N)C(O)CSC(C)=O Amb25286278 [0,2,0,0,0,0|1,0,0]=3 11091 B9R0.7 CC(N)CCN(C)C(C)=O Amb24421216 [0,2,0,0,0,0|1,0,0]=3 11092 B9R0.7 CC(N)CSC(C)C(N)=O Amb24628478 [0,2,0,0,0,0|2,0,0]=4 11093 B9R0.7 CC(NCC(C)N)C(O)=O Amb24599775 [0,2,0,0,0,0|2,0,0]=4 11094 B9R0.7 CC(NCC(O)=O)C(C)N Amb24637505 [0,2,0,0,0,0|2,0,0]=4 11095 B9R0.7 CC(NC[C@@H](C)O)C(N)=O Amb25702192 [0,2,0,0,0,0|2,0,0]=4 11096 B9R0.7 CC(O)C(=O)CCC(O)=O Amb25825263 [0,2,0,0,0,0|1,0,1]=4 11097 B9R0.7 CC(O)C(C)OCC(O)=O Amb25185257 [0,2,0,0,0,0|2,0,0]=4 11098 B9R0.7 CC(O)C(N)CNC(N)=O Amb25809645 [0,2,0,0,0,0|2,0,0]=4 11099 B9R0.7 CC(O)C(O)CCC(O)=O Amb25054706 [0,2,0,0,0,0|1,0,0]=3 11100 B9R0.7 CC(O)C(O)\C=C\C(C)=O Amb24633535 [0,2,0,0,0,0|0,0,2]=4 11101 B9R0.7 CC(O)CCC(=C)C(O)=O Amb24375911 [0,2,0,0,0,0|1,0,1]=4 11102 B9R0.7 CC(O)CCC(C)C(O)=O Amb25848509 [0,2,0,0,0,0|1,0,0]=3 11103 B9R0.7 CC(O)CCC(F)C(C)=O Amb25093785 [0,2,0,0,0,0|0,0,0]=2 11104 B9R0.7 CC(O)CCC(F)C(C)O Amb24520466 [0,2,0,0,0,0|0,0,2]=4 11105 B9R0.7 CC(O)CCN(C)C(N)=O Amb24444738 [0,2,0,0,0,0|2,0,0]=4 11106 B9R0.7 CC(O)CCN(C)S(C)=O Amb24578207 [0,2,0,0,0,0|2,0,0]=4 11107 B9R0.7 CC(O)CC[C@@H](C)[C@@H](C)O Amb25333287 [0,2,0,0,0,0|0,0,2]=4 11108 B9R0.7 CC(O)CNC(C)C(O)=O Amb18523859 [0,2,0,0,0,0|2,0,0]=4 11109 B9R0.7 CC(O)CN[C@@H](C)C(O)=O Amb25129862 [0,2,0,0,0,0|2,0,0]=4 11110 B9R0.7 CC(O)COC(C)C(O)=O Amb25146942 [0,2,0,0,0,0|2,0,0]=4 11111 B9R0.7 CC(O)CSC(C)C(O)=O Amb18303285 [0,2,0,0,0,0|2,0,0]=4 11112 B9R0.7 CC(O)NC[C@H](N)C(O)=O Amb24575047 [0,2,0,0,0,0|2,0,0]=4 11113 B9R0.7 CC(OCC(C)F)C(O)=O Amb25350495 [0,2,0,0,0,0|2,0,0]=4 11114 B9R0.7 CC(SCC(C)=C)C(C)O Amb25732856 [0,2,0,0,0,0|2,0,0]=4 11115 B9R0.7 CC(SCC(C)N)C(O)=O Amb25224815 [0,2,0,0,0,0|2,0,0]=4 11116 B9R0.7 CC(SCC(F)F)C(C)=O Amb25097513 [0,2,0,0,0,0|2,0,0]=4 11117 B9R0.7 CC(SCC(N)=O)C(C)O Amb24426482 [0,2,0,0,0,0|2,0,0]=4 11118 B9R0.7 CN(C)CCC(N)C(N)=O Amb19036813 [0,2,0,0,0,0|2,0,0]=4 11119 B9R0.7 CN(C)CC[C@H](N)C(O)=O Amb25108550 [0,2,0,0,0,0|2,0,0]=4 11120 B9R0.7 CP(O)CCC(N)C(O)=O Amb25295427 [0,2,0,0,0,0|2,0,0]=4 11121 B9R0.7 CS(=N)CCC(N)C(O)=O Amb25243030 [0,2,0,0,0,0|2,0,0]=4 11122 B9R0.7 CS(=N)CC[C@H](N)C(O)=O Amb25100927 [0,2,0,0,0,0|2,0,0]=4 11123 B9R0.7 CS(=O)CC[C@@H](N)C(O)=O Amb19133021 [0,2,0,0,0,0|2,0,0]=4 11124 B9R0.7 CS(C)CCC(N)C(O)=O Amb25695887 [0,2,0,0,0,0|2,0,0]=4 11125 B9R0.7 CS(C)CC[C@H](N)C(O)=O Amb24440849 [0,2,0,0,0,0|2,0,0]=4 11126 B9R0.7 C[C@@H](CC=C(C)C)C(C)O Amb24706240 [0,2,0,0,0,0|1,0,1]=4 11127 B9R0.7 C[C@@H](CCC(C)=O)[C@@H](C)O Amb22747043 [0,2,0,0,0,0|0,0,0]=2 11128 B9R0.7 C[C@@H](F)[C@H](N)CCC(O)=O Amb25042508 [0,2,0,0,0,0|1,0,0]=3 11129 B9R0.7 C[C@@H](O)[C@H](C)SCC(O)=O Amb25774489 [0,2,0,0,0,0|2,0,0]=4 11130 B9R0.7 C[C@H](CC=C(C)C)C(C)O Amb24733053 [0,2,0,0,0,0|1,0,1]=4 11131 B9R0.7 C[C@H](N)C(=O)CCC(O)=O Amb25851449 [0,2,0,0,0,0|1,0,1]=4 11132 B9R0.7 C[C@H](N)C(O)CSC(C)=O Amb24678280 [0,2,0,0,0,0|1,0,0]=3 11133 B9R0.7 C[C@H](N)CC[C@@H](N)C(O)=O Amb25199121 [0,2,0,0,0,0|1,0,0]=3 11134 B9R0.7 C[C@H](O)CC[C@@H](C)C(O)=O Amb25378744 [0,2,0,0,0,0|1,0,0]=3 11135 B9R0.7 C[C@H](O)[C@@H](O)\C=C\C(C)=O Amb24614850 [0,2,0,0,0,0|0,0,2]=4 11136 B9R0.7 C[C@H](O)[C@H](C)CCC(O)=O Amb25340448 [0,2,0,0,0,0|1,0,0]=3 11137 B9R0.7 C[C@H](O)[C@H](O)CCC(N)=O Amb25138530 [0,2,0,0,0,0|1,0,0]=3 11138 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800534 [0,2,0,0,0,0|2,0,0]=4 11139 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800551 [0,2,0,0,0,0|2,0,0]=4 11140 B9R0.7 C[S+](C)CC[C@H](O)C([O-])=O Amb24407452 [0,2,0,0,0,0|2,0,0]=4 11141 B9R0.7 C\C(=C/CC(C)=O)\C(C)C Amb24725292 [0,2,0,0,0,0|0,0,2]=4 11142 B9R0.7 C\C(=C/CC(C)C)\C(C)=O Amb24478340 [0,2,0,0,0,0|0,0,2]=4 11143 B9R0.7 C\C(=C\CC(C)=O)\C(C)C Amb24408897 [0,2,0,0,0,0|0,0,2]=4 11144 B9R0.7 C\C(=N/CC(C)C)\C(C)=O Amb24424901 [0,2,0,0,0,0|1,0,1]=4 11145 B9R0.7 C\C(=N\CC(C)O)\C(C)=O Amb25273034 [0,2,0,0,0,0|1,0,1]=4 11146 B9R0.7 NC(CCC(O)=O)C(F)F Amb19148415 [0,2,0,0,0,0|2,0,0]=4 11147 B9R0.7 N[C@H](C(=O)O)CCC(C)C Amb16183866 [0,2,0,0,0,0|1,0,0]=3 11148 B9R0.7 N[C@H](C(=O)O)CC[S+](C)C Amb10601599 [0,2,0,0,0,0|2,0,0]=4 11149 B9R0.13 CC#CCC(CC)C(C)=O Amb25857154 [0,2,0,0,0,0|0,0,2]=4 11150 B9R0.13 CC(=O)C(CCCC)=C=C Amb24479207 [0,2,0,0,0,0|0,0,1]=3 11151 B9R0.13 CC(=O)N(CCCBr)C=O Amb24477218 [0,2,0,0,0,0|2,0,0]=4 11152 B9R0.13 CC(=O)\C(\CBr)=C/CCC Amb25311206 [0,2,0,0,0,0|0,0,2]=4 11153 B9R0.13 CC(=O)\C(\CBr)=C\CCC Amb24349642 [0,2,0,0,0,0|0,0,2]=4 11154 B9R0.13 CC(=O)\C(\CCCC)=N\O Amb25822238 [0,2,0,0,0,0|0,0,1]=3 11155 B9R0.13 CC(=O)\C(\CCl)=C\CCC Amb25072752 [0,2,0,0,0,0|0,0,2]=4 11156 B9R0.13 CC(=O)\C(\COCC)=N\O Amb25298545 [0,2,0,0,0,0|1,0,1]=4 11157 B9R0.13 CC(Br)C(CCCC)CC Amb24476874 [0,2,0,0,0,0|1,0,1]=4 11158 B9R0.13 CC(C)=C(CCCC)C=O Amb18643632 [0,2,0,0,0,0|1,0,1]=4 11159 B9R0.13 CC(C)=C(CCCC)CC Amb25839850 [0,2,0,0,0,0|1,0,1]=4 11160 B9R0.13 CC(C)C(CBr)CCCC Amb24751694 [0,2,0,0,0,0|1,0,1]=4 11161 B9R0.13 CC(C)C(CCCC)C=O Amb18643968 [0,2,0,0,0,0|1,0,1]=4 11162 B9R0.13 CC(C)C(CCCC)CC Amb22229294 [0,2,0,0,0,0|1,0,1]=4 11163 B9R0.13 CC(C)C(CCCC)NN Amb24374893 [0,2,0,0,0,0|1,0,1]=4 11164 B9R0.13 CC(C)C(CN)CCCC Amb24669139 [0,2,0,0,0,0|1,0,1]=4 11165 B9R0.13 CC(Cl)C(CCCC)CC Amb24345876 [0,2,0,0,0,0|1,0,1]=4 11166 B9R0.13 CC(N)C(CCCC)CC Amb24437807 [0,2,0,0,0,0|1,0,1]=4 11167 B9R0.13 CC(O)C(CCCC)C#N Amb24509183 [0,2,0,0,0,0|0,0,2]=4 11168 B9R0.13 CC(O)C(CCl)CCCC Amb25722423 [0,2,0,0,0,0|0,0,2]=4 11169 B9R0.13 CCC(CCC#C)C(C)=O Amb25140651 [0,2,0,0,0,0|0,0,2]=4 11170 B9R0.13 CCC(CCC#N)C(C)=O Amb18643435 [0,2,0,0,0,0|1,0,1]=4 11171 B9R0.13 CCC(CCCBr)C(O)=O Amb18131058 [0,2,0,0,0,0|2,0,0]=4 11172 B9R0.13 CCC(CCCCl)C(O)=O Amb24480523 [0,2,0,0,0,0|2,0,0]=4 11173 B9R0.13 CCC(CCCF)C(O)=O Amb25104466 [0,2,0,0,0,0|2,0,0]=4 11174 B9R0.13 CCC(CCCN)C(O)=O Amb25703115 [0,2,0,0,0,0|2,0,0]=4 11175 B9R0.13 CCC(CCOC)C(O)=O Amb25289946 [0,2,0,0,0,0|2,0,0]=4 11176 B9R0.13 CCC(CCSC)C(C)=O Amb24536181 [0,2,0,0,0,0|1,0,0]=3 11177 B9R0.13 CCC(CCSC)C(O)=O Amb24373794 [0,2,0,0,0,0|2,0,0]=4 11178 B9R0.13 CCC(CSCC)C(O)=O Amb24482439 [0,2,0,0,0,0|2,0,0]=4 11179 B9R0.13 CCC(OCCC)C(C)=O Amb25372750 [0,2,0,0,0,0|1,0,0]=3 11180 B9R0.13 CCC(SCCC)C(N)=O Amb18177741 [0,2,0,0,0,0|2,0,0]=4 11181 B9R0.13 CCCCC(=CBr)C(O)=O Amb25025162 [0,2,0,0,0,0|1,0,1]=4 11182 B9R0.13 CCCCC(C#C)C(O)=O Amb25122141 [0,2,0,0,0,0|1,0,0]=3 11183 B9R0.13 CCCCC(C#N)C(C)=O Amb24647883 [0,2,0,0,0,0|0,0,0]=2 11184 B9R0.13 CCCCC(C#N)N(C)C Amb23596597 [0,2,0,0,0,0|2,0,0]=4 11185 B9R0.13 CCCCC(C(=O)[O-])CC Amb10807417 [0,2,0,0,0,0|1,0,0]=3 11186 B9R0.13 CCCCC(C(O)C)CC Amb10807396 [0,2,0,0,0,0|0,0,2]=4 11187 B9R0.13 CCCCC(C=C)C(C)=O Amb24353218 [0,2,0,0,0,0|0,0,0]=2 11188 B9R0.13 CCCCC(C=O)C(C)=O Amb25293767 [0,2,0,0,0,0|0,0,0]=2 11189 B9R0.13 CCCCC(C=O)C(O)=O Amb25132913 [0,2,0,0,0,0|1,0,0]=3 11190 B9R0.13 CCCCC(CC)C(C)=C Amb22229296 [0,2,0,0,0,0|1,0,0]=3 11191 B9R0.13 CCCCC(CC)C(C)=O Amb25049588 [0,2,0,0,0,0|0,0,0]=2 11192 B9R0.13 CCCCC(CC)C(O)=O Amb22232366 [0,2,0,0,0,0|1,0,0]=3 11193 B9R0.13 CCCCC(CC)C(O)=O Amb22334224 [0,2,0,0,0,0|1,0,0]=3 11194 B9R0.13 CCCCC(CC)C(O)=O Amb22337839 [0,2,0,0,0,0|1,0,0]=3 11195 B9R0.13 CCCCC(CC)C(O)=O Amb22351159 [0,2,0,0,0,0|1,0,0]=3 11196 B9R0.13 CCCCC(CC)C(O)=O Amb22351729 [0,2,0,0,0,0|1,0,0]=3 11197 B9R0.13 CCCCC(CC)C(O)=O Amb22351933 [0,2,0,0,0,0|1,0,0]=3 11198 B9R0.13 CCCCC(CC)C(O)=O Amb22363218 [0,2,0,0,0,0|1,0,0]=3 11199 B9R0.13 CCCCC(CC)C([O-])=O Amb22043361 [0,2,0,0,0,0|1,0,0]=3 11200 B9R0.13 CCCCC(CC)C([O-])=O Amb22045502 [0,2,0,0,0,0|1,0,0]=3 11201 B9R0.13 CCCCC(CC)C([O-])=O Amb22045517 [0,2,0,0,0,0|1,0,0]=3 11202 B9R0.13 CCCCC(CC)C([O-])=O Amb22045537 [0,2,0,0,0,0|1,0,0]=3 11203 B9R0.13 CCCCC(CC)C([O-])=O Amb22045545 [0,2,0,0,0,0|1,0,0]=3 11204 B9R0.13 CCCCC(CC)C([O-])=O Amb22045678 [0,2,0,0,0,0|1,0,0]=3 11205 B9R0.13 CCCCC(CC)C([O-])=O Amb22045702 [0,2,0,0,0,0|1,0,0]=3 11206 B9R0.13 CCCCC(CC)C([O-])=O Amb22045706 [0,2,0,0,0,0|1,0,0]=3 11207 B9R0.13 CCCCC(CC)C([O-])=O Amb22045755 [0,2,0,0,0,0|1,0,0]=3 11208 B9R0.13 CCCCC(CC)C([O-])=O Amb22045778 [0,2,0,0,0,0|1,0,0]=3 11209 B9R0.13 CCCCC(CC)C([O-])=O Amb22045868 [0,2,0,0,0,0|1,0,0]=3 11210 B9R0.13 CCCCC(CC)C([O-])=O Amb22052434 [0,2,0,0,0,0|1,0,0]=3 11211 B9R0.13 CCCCC(CC)C([O-])=O Amb22053628 [0,2,0,0,0,0|1,0,0]=3 11212 B9R0.13 CCCCC(CC)C([O-])=O Amb22053638 [0,2,0,0,0,0|1,0,0]=3 11213 B9R0.13 CCCCC(CC)C([O-])=O Amb22053677 [0,2,0,0,0,0|1,0,0]=3 11214 B9R0.13 CCCCC(CC)C([O-])=O Amb22053733 [0,2,0,0,0,0|1,0,0]=3 11215 B9R0.13 CCCCC(CC)C([O-])=O Amb22053863 [0,2,0,0,0,0|1,0,0]=3 11216 B9R0.13 CCCCC(CC)C([O-])=O Amb22054110 [0,2,0,0,0,0|1,0,0]=3 11217 B9R0.13 CCCCC(CC)C([O-])=O Amb22054112 [0,2,0,0,0,0|1,0,0]=3 11218 B9R0.13 CCCCC(CC)C([O-])=O Amb22054129 [0,2,0,0,0,0|1,0,0]=3 11219 B9R0.13 CCCCC(CC)C([O-])=O Amb22054137 [0,2,0,0,0,0|1,0,0]=3 11220 B9R0.13 CCCCC(CC)C([O-])=O Amb22054141 [0,2,0,0,0,0|1,0,0]=3 11221 B9R0.13 CCCCC(CC)C([O-])=O Amb22055551 [0,2,0,0,0,0|1,0,0]=3 11222 B9R0.13 CCCCC(CC)C([O-])=O Amb22234920 [0,2,0,0,0,0|1,0,0]=3 11223 B9R0.13 CCCCC(CC)C([O-])=O Amb22338477 [0,2,0,0,0,0|1,0,0]=3 11224 B9R0.13 CCCCC(CC)C([O-])=O Amb22730062 [0,2,0,0,0,0|1,0,0]=3 11225 B9R0.13 CCCCC(CC)C([O-])=O Amb22730373 [0,2,0,0,0,0|1,0,0]=3 11226 B9R0.13 CCCCC(CC)C([O-])=O Amb22730960 [0,2,0,0,0,0|1,0,0]=3 11227 B9R0.13 CCCCC(CC)C([O-])=O Amb22732748 [0,2,0,0,0,0|1,0,0]=3 11228 B9R0.13 CCCCC(CC)C([O-])=O Amb22732981 [0,2,0,0,0,0|1,0,0]=3 11229 B9R0.13 CCCCC(CN)N(C)C Amb23596598 [0,2,0,0,0,0|2,0,0]=4 11230 B9R0.13 CCCCC(CO)C(C)=O Amb22234725 [0,2,0,0,0,0|0,0,0]=2 11231 B9R0.13 CCCCC(CO)N(C)C Amb24116645 [0,2,0,0,0,0|2,0,0]=4 11232 B9R0.13 CCCCC(NC)C(N)=O Amb24116641 [0,2,0,0,0,0|1,0,0]=3 11233 B9R0.13 CCCCC(NC)C(O)=O Amb24116642 [0,2,0,0,0,0|1,0,0]=3 11234 B9R0.13 CCCCC(NN)C(O)=O Amb18644274 [0,2,0,0,0,0|1,0,0]=3 11235 B9R0.13 CCCCC(ON)C(O)=O Amb25140283 [0,2,0,0,0,0|1,0,0]=3 11236 B9R0.13 CCCCC(SC)C(N)=O Amb25801007 [0,2,0,0,0,0|1,0,0]=3 11237 B9R0.13 CCCCC(SC)C(O)=O Amb24478447 [0,2,0,0,0,0|1,0,0]=3 11238 B9R0.13 CCCCN(C(=O)Cl)CC Amb17563080 [0,2,0,0,0,0|2,0,0]=4 11239 B9R0.13 CCCCN(CC)C(C)=N Amb25262294 [0,2,0,0,0,0|2,0,0]=4 11240 B9R0.13 CCCCN(N=O)C(N)=O Amb24074260 [0,2,0,0,0,0|2,0,0]=4 11241 B9R0.13 CCCC[C@@H](C(=O)O)CO Amb16232529 [0,2,0,0,0,0|1,0,0]=3 11242 B9R0.13 CCCC[C@@H](CBr)C(C)=C Amb24724761 [0,2,0,0,0,0|1,0,0]=3 11243 B9R0.13 CCCC[C@@H](CC)C(N)=O Amb24600233 [0,2,0,0,0,0|1,0,0]=3 11244 B9R0.13 CCCC[C@@H](CO)C(O)=O Amb22745320 [0,2,0,0,0,0|1,0,0]=3 11245 B9R0.13 CCCC[C@@H](NC)C(O)=O Amb22799980 [0,2,0,0,0,0|1,0,0]=3 11246 B9R0.13 CCCC[C@@H](NN)C(O)=O Amb25076236 [0,2,0,0,0,0|1,0,0]=3 11247 B9R0.13 CCCC[C@H](CBr)C(C)=C Amb25255427 [0,2,0,0,0,0|1,0,0]=3 11248 B9R0.13 CCCC[C@H](CC)C(C)=O Amb24478140 [0,2,0,0,0,0|0,0,0]=2 11249 B9R0.13 CCCC[C@H](CC)C(O)=O Amb24671282 [0,2,0,0,0,0|1,0,0]=3 11250 B9R0.13 CCCC[C@H](CN)C(O)=O Amb25307811 [0,2,0,0,0,0|1,0,0]=3 11251 B9R0.13 CCCC[C@H](NCl)C(O)=O Amb24482437 [0,2,0,0,0,0|1,0,0]=3 11252 B9R0.13 CCCC\C(=C/Br)\C(O)=O Amb24757714 [0,2,0,0,0,0|1,0,1]=4 11253 B9R0.13 CCCC\C(=C/C)\C(N)=O Amb25790366 [0,2,0,0,0,0|1,0,1]=4 11254 B9R0.13 CCCNC(CO)C(O)=O Amb18637569 [0,2,0,0,0,0|2,0,0]=4 11255 B9R0.13 CCCN[C@@H](CO)C(O)=O Amb24351588 [0,2,0,0,0,0|2,0,0]=4 11256 B9R0.13 CCCOC(C(=O)N)CC Amb2131091 [0,2,0,0,0,0|2,0,0]=4 11257 B9R0.13 CCCOC(CN)C(O)=O Amb25827128 [0,2,0,0,0,0|2,0,0]=4 11258 B9R0.13 CCCSC(CO)C(C)=O Amb25050259 [0,2,0,0,0,0|1,0,0]=3 11259 B9R0.13 CCN(CCCBr)C(C)=O Amb24678489 [0,2,0,0,0,0|2,0,0]=4 11260 B9R0.13 CCN(CCCO)C(C)=O Amb25147734 [0,2,0,0,0,0|2,0,0]=4 11261 B9R0.13 CCN(CCNC)C(C)=O Amb24096601 [0,2,0,0,0,0|2,0,0]=4 11262 B9R0.13 CCN(CCOC)C(C)=O Amb25767204 [0,2,0,0,0,0|2,0,0]=4 11263 B9R0.13 CCOCC(NN)C(C)=C Amb24606062 [0,2,0,0,0,0|2,0,0]=4 11264 B9R0.13 CCSCC(NC)C(N)=O Amb18788145 [0,2,0,0,0,0|2,0,0]=4 11265 B9R0.13 CCSCC(NC)C(O)=O Amb18788225 [0,2,0,0,0,0|2,0,0]=4 11266 B9R0.13 CNC(CCCN)C(O)=O Amb18644280 [0,2,0,0,0,0|2,0,0]=4 11267 B9R0.13 CNC(CCOC)C(N)=O Amb24476849 [0,2,0,0,0,0|2,0,0]=4 11268 B9R0.13 CNC(CCOC)C(O)=O Amb24405197 [0,2,0,0,0,0|2,0,0]=4 11269 B9R0.13 CNC(CCSC)C(C)=C Amb24744692 [0,2,0,0,0,0|2,0,0]=4 11270 B9R0.13 CNC(CCSC)C(N)=O Amb18792442 [0,2,0,0,0,0|2,0,0]=4 11271 B9R0.13 CNC(CCSC)C(O)=O Amb18792506 [0,2,0,0,0,0|2,0,0]=4 11272 B9R0.13 CN[C@@H](CCCN)C(O)=O Amb24584680 [0,2,0,0,0,0|2,0,0]=4 11273 B9R0.13 COC(CCCO)C(C)=O Amb25059738 [0,2,0,0,0,0|1,0,0]=3 11274 B9R0.13 COC(CCSC)C(C)=O Amb25172858 [0,2,0,0,0,0|1,0,0]=3 11275 B9R0.13 COCCC(CN)C(O)=O Amb24697893 [0,2,0,0,0,0|2,0,0]=4 11276 B9R0.13 COCCC(OC)C(C)=O Amb25146751 [0,2,0,0,0,0|1,0,0]=3 11277 B9R0.13 CSCCC(CN)C(O)=O Amb24618199 [0,2,0,0,0,0|2,0,0]=4 11278 B9R0.13 CSCCC(NO)C(N)=O Amb25240562 [0,2,0,0,0,0|2,0,0]=4 11279 B9R0.13 CSCCC(SC)C(O)=O Amb25111182 [0,2,0,0,0,0|2,0,0]=4 11280 B9R0.13 CSCC[C@H](NO)C(O)=O Amb25306086 [0,2,0,0,0,0|2,0,0]=4 11281 B9R0.13 C[C@@H](Cl)[C@H](CO)CCCC Amb24724897 [0,2,0,0,0,0|1,0,1]=4 11282 B9R0.13 C[C@@H](O)[C@H](CCCC)CC Amb25345118 [0,2,0,0,0,0|0,0,2]=4 11283 B9R0.13 C[C@@H](O)[C@H](CO)CCCC Amb25725498 [0,2,0,0,0,0|0,0,2]=4 11284 B9R0.13 NCCCC(C#N)C(O)=O Amb25147461 [0,2,0,0,0,0|2,0,0]=4 11285 B9R0.13 NCCCC(CN)C(O)=O Amb25072736 [0,2,0,0,0,0|2,0,0]=4 11286 B9R0.13 NCCCC(NCl)C(O)=O Amb24373822 [0,2,0,0,0,0|2,0,0]=4 11287 B9R0.13 NCCCC(NN)C(O)=O Amb18644331 [0,2,0,0,0,0|2,0,0]=4 11288 B9R0.13 NCCCC(NN)C(O)=O Amb22229924 [0,2,0,0,0,0|2,0,0]=4 11289 B9R0.13 NCCC[C@@H](NN)C(O)=O Amb22801170 [0,2,0,0,0,0|2,0,0]=4 11290 B9R0.42 CC(=C)C(=O)CC(C)CC Amb25064630 [0,2,0,0,0,0|1,0,1]=4 11291 B9R0.42 CC(=C)C(O)CC(=O)CC Amb24588855 [0,2,0,0,0,0|1,0,1]=4 11292 B9R0.42 CC(=O)C(=O)CC(=O)CC Amb25110491 [0,2,0,0,0,0|0,0,2]=4 11293 B9R0.42 CC(=O)C(=O)CC(C)CC Amb24707036 [0,2,0,0,0,0|0,0,1]=3 11294 B9R0.42 CC(=O)C(=O)C[C@H](O)CO Amb25735840 [0,2,0,0,0,0|1,0,1]=4 11295 B9R0.42 CC(=O)C(C)CC(=C)CC Amb24529318 [0,2,0,0,0,0|0,0,1]=3 11296 B9R0.42 CC(=O)C(C)CC(=C)CO Amb24477027 [0,2,0,0,0,0|1,0,1]=4 11297 B9R0.42 CC(=O)C(C)CC(=O)CC Amb25146752 [0,2,0,0,0,0|0,0,1]=3 11298 B9R0.42 CC(=O)C(Cl)CC(=O)OC Amb25061154 [0,2,0,0,0,0|1,0,1]=4 11299 B9R0.42 CC(=O)C(Cl)CC(Cl)C#N Amb18648320 [0,2,0,0,0,0|1,0,1]=4 11300 B9R0.42 CC(=O)C(N)CC(=O)OC Amb24529258 [0,2,0,0,0,0|1,0,1]=4 11301 B9R0.42 CC(=O)C(O)CC(=O)CC Amb24467028 [0,2,0,0,0,0|0,0,1]=3 11302 B9R0.42 CC(=O)C(O)CC(=O)OC Amb25146688 [0,2,0,0,0,0|1,0,1]=4 11303 B9R0.42 CC(=O)N(C)CC(N)CO Amb25275478 [0,2,0,0,0,0|2,0,0]=4 11304 B9R0.42 CC(=O)N(C)C[C@H](N)CO Amb24411873 [0,2,0,0,0,0|2,0,0]=4 11305 B9R0.42 CC(=O)[C@@H](C)CC(=C)CO Amb24423877 [0,2,0,0,0,0|1,0,1]=4 11306 B9R0.42 CC(C)=C(C)CC(Br)CC Amb24741756 [0,2,0,0,0,0|1,0,1]=4 11307 B9R0.42 CC(C)C(N)CC(C)CC Amb18311331 [0,2,0,0,0,0|1,0,1]=4 11308 B9R0.42 CC(C)C(O)CC(N)CC Amb25741800 [0,2,0,0,0,0|1,0,1]=4 11309 B9R0.42 CC(C)[C@@H](N)C[C@H](O)CC Amb19929610 [0,2,0,0,0,0|1,0,1]=4 11310 B9R0.42 CC(C)[C@@H](O)C[C@@H](N)CC Amb19929612 [0,2,0,0,0,0|1,0,1]=4 11311 B9R0.42 CC(C)[C@@H](O)C[C@H](N)CC Amb19929611 [0,2,0,0,0,0|1,0,1]=4 11312 B9R0.42 CC(CC(Br)C(O)=O)CN Amb24478240 [0,2,0,0,0,0|2,0,0]=4 11313 B9R0.42 CC(CC(C)C#N)C(C)=O Amb18643436 [0,2,0,0,0,0|1,0,1]=4 11314 B9R0.42 CC(CC(F)C(O)=O)CN Amb25265347 [0,2,0,0,0,0|2,0,0]=4 11315 B9R0.42 CC(CC(F)C(O)=O)OC Amb25298262 [0,2,0,0,0,0|2,0,0]=4 11316 B9R0.42 CC(CC(N)C(C)=C)OC Amb25851059 [0,2,0,0,0,0|2,0,0]=4 11317 B9R0.42 CC(CC(N)C(C)=O)CC Amb25747386 [0,2,0,0,0,0|0,0,0]=2 11318 B9R0.42 CC(CC(N)C(N)=O)OC Amb25349298 [0,2,0,0,0,0|2,0,0]=4 11319 B9R0.42 CC(CC(N)C(O)=O)CC Amb18313985 [0,2,0,0,0,0|1,0,0]=3 11320 B9R0.42 CC(CC(N)C(O)=O)CC Amb20667726 [0,2,0,0,0,0|1,0,0]=3 11321 B9R0.42 CC(CC(N)C(O)=O)CCl Amb24480574 [0,2,0,0,0,0|2,0,0]=4 11322 B9R0.42 CC(CC(N)C(O)=O)CO Amb25147300 [0,2,0,0,0,0|2,0,0]=4 11323 B9R0.42 CC(CC(N)C(O)=O)NC Amb24711878 [0,2,0,0,0,0|2,0,0]=4 11324 B9R0.42 CC(CC(N)C(O)=O)OC Amb25147752 [0,2,0,0,0,0|2,0,0]=4 11325 B9R0.42 CC(CC(N)C(O)=O)SC Amb24365891 [0,2,0,0,0,0|2,0,0]=4 11326 B9R0.42 CC(CC(O)C(O)=O)CC Amb25849308 [0,2,0,0,0,0|1,0,0]=3 11327 B9R0.42 CC(CC(O)CN)C(O)=O Amb25375725 [0,2,0,0,0,0|2,0,0]=4 11328 B9R0.42 CC(CC(S)C(O)=O)CC Amb18798152 [0,2,0,0,0,0|1,0,0]=3 11329 B9R0.42 CC(CC(S)C(O)=O)OC Amb24641528 [0,2,0,0,0,0|2,0,0]=4 11330 B9R0.42 CC(CC)OC(F)C(O)=O Amb25043871 [0,2,0,0,0,0|2,0,0]=4 11331 B9R0.42 CC(CN)CC(C)C(O)=O Amb24717285 [0,2,0,0,0,0|2,0,0]=4 11332 B9R0.42 CC(CN)CN(C)C(C)=O Amb18523773 [0,2,0,0,0,0|2,0,0]=4 11333 B9R0.42 CC(CO)CN(C)C(C)=O Amb25136734 [0,2,0,0,0,0|2,0,0]=4 11334 B9R0.42 CC(C[C@@H](N)C(O)=O)CC Amb25127143 [0,2,0,0,0,0|1,0,0]=3 11335 B9R0.42 CC(C[C@@H](N)C(O)=O)OC Amb24412403 [0,2,0,0,0,0|2,0,0]=4 11336 B9R0.42 CC(C[C@@H](N)C(O)=O)SC Amb24692660 [0,2,0,0,0,0|2,0,0]=4 11337 B9R0.42 CC(C[C@H](N)C(O)=O)CCl Amb24479195 [0,2,0,0,0,0|2,0,0]=4 11338 B9R0.42 CC(O)C(O)CC(N)CC Amb24711986 [0,2,0,0,0,0|0,0,2]=4 11339 B9R0.42 CC(OC(C)CN)C(C)=O Amb18110684 [0,2,0,0,0,0|2,0,0]=4 11340 B9R0.42 CCC(=C)CC(C)C(O)=O Amb25342029 [0,2,0,0,0,0|1,0,1]=4 11341 B9R0.42 CCC(=C)CC(N)C(N)=O Amb24429018 [0,2,0,0,0,0|1,0,1]=4 11342 B9R0.42 CCC(=C)CC(O)C(O)=O Amb25200851 [0,2,0,0,0,0|1,0,1]=4 11343 B9R0.42 CCC(=C)C[C@H](C)C(O)=O Amb24384990 [0,2,0,0,0,0|1,0,1]=4 11344 B9R0.42 CCC(=C)C[C@H](N)C(O)=O Amb25694434 [0,2,0,0,0,0|1,0,1]=4 11345 B9R0.42 CCC(=O)CC(N)C(N)=O Amb25129863 [0,2,0,0,0,0|1,0,1]=4 11346 B9R0.42 CCC(=O)CC(N)C(O)=O Amb22546324 [0,2,0,0,0,0|1,0,1]=4 11347 B9R0.42 CCC(=O)CC(N)C(O)=O Amb24479073 [0,2,0,0,0,0|1,0,1]=4 11348 B9R0.42 CCC(=O)C[C@@H](C)C(O)=O Amb24680887 [0,2,0,0,0,0|1,0,1]=4 11349 B9R0.42 CCC(=O)C[C@H](N)C(O)=O Amb24479266 [0,2,0,0,0,0|1,0,1]=4 11350 B9R0.42 CCC(C)CC(C)C(C)=O Amb25056188 [0,2,0,0,0,0|0,0,0]=2 11351 B9R0.42 CCC(C)CC(C)C(C)Cl Amb18183503 [0,2,0,0,0,0|1,0,1]=4 11352 B9R0.42 CCC(C)CC(C)C(C)O Amb24478003 [0,2,0,0,0,0|0,0,2]=4 11353 B9R0.42 CCC(C)CC(C)C(O)=O Amb22228338 [0,2,0,0,0,0|1,0,0]=3 11354 B9R0.42 CCC(C)CC(O)C(C)O Amb25265593 [0,2,0,0,0,0|0,0,2]=4 11355 B9R0.42 CCC(C)N[C@@H](C)C(O)=O Amb25691180 [0,2,0,0,0,0|2,0,0]=4 11356 B9R0.42 CCC(C)N[C@H](C)C(O)=O Amb24375136 [0,2,0,0,0,0|2,0,0]=4 11357 B9R0.42 CCC(C)OC(C)C(O)=O Amb25357779 [0,2,0,0,0,0|2,0,0]=4 11358 B9R0.42 CCC(C)SC(C)C(N)=O Amb18800585 [0,2,0,0,0,0|2,0,0]=4 11359 B9R0.42 CCC(Cl)CC(N)C(O)=O Amb24374416 [0,2,0,0,0,0|1,0,0]=3 11360 B9R0.42 CCC(NC(=O)C(=O)C)C Amb17399880 [0,2,0,0,0,0|1,0,1]=4 11361 B9R0.42 CCC(O)CC(N)C(O)=O Amb24117068 [0,2,0,0,0,0|1,0,0]=3 11362 B9R0.42 CCC(O)C[C@H](N)C(O)=O Amb24759913 [0,2,0,0,0,0|1,0,0]=3 11363 B9R0.42 CCN(C)CC(Cl)C(O)=O Amb25713950 [0,2,0,0,0,0|2,0,0]=4 11364 B9R0.42 CCN(C)CC(O)C(O)=O Amb25367420 [0,2,0,0,0,0|2,0,0]=4 11365 B9R0.42 CCN(O)CC(O)C(O)=O Amb24699297 [0,2,0,0,0,0|2,0,0]=4 11366 B9R0.42 CCS(=N)CC(N)C(O)=O Amb25046702 [0,2,0,0,0,0|2,0,0]=4 11367 B9R0.42 CCS(=N)C[C@H](N)C(O)=O Amb24502175 [0,2,0,0,0,0|2,0,0]=4 11368 B9R0.42 CCS(=O)CC(C)C(O)=O Amb19012076 [0,2,0,0,0,0|2,0,0]=4 11369 B9R0.42 CC[C@@H](C)C[C@H](C)C(O)=O Amb24426532 [0,2,0,0,0,0|1,0,0]=3 11370 B9R0.42 CC[C@@H](F)C[C@H](N)C(O)=O Amb25147291 [0,2,0,0,0,0|1,0,0]=3 11371 B9R0.42 CC[C@H](C)CC(=C)C(O)=O Amb25367282 [0,2,0,0,0,0|1,0,1]=4 11372 B9R0.42 CC[C@H](C)CC(C)C(C)=O Amb25821401 [0,2,0,0,0,0|0,0,0]=2 11373 B9R0.42 CC[C@H](C)C[C@@H](C)C(O)=O Amb24480420 [0,2,0,0,0,0|1,0,0]=3 11374 B9R0.42 CNC(C)CC(C)C(O)=O Amb25291515 [0,2,0,0,0,0|2,0,0]=4 11375 B9R0.42 CNC(C)CN(C)C(C)=O Amb24096771 [0,2,0,0,0,0|2,0,0]=4 11376 B9R0.42 COC(=O)CC(C(=O)C)Br Amb17403794 [0,2,0,0,0,0|1,0,1]=4 11377 B9R0.42 CO[C@@H](C)C[C@H](C)C(O)=O Amb24691586 [0,2,0,0,0,0|2,0,0]=4 11378 B9R0.42 C[C@@H](C[C@@H](N)C(O)=O)CC Amb25844637 [0,2,0,0,0,0|1,0,0]=3 11379 B9R0.42 C[C@@H](C[C@@H](O)CC)N(C)C Amb24412935 [0,2,0,0,0,0|2,0,0]=4 11380 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CC Amb24619367 [0,2,0,0,0,0|1,0,0]=3 11381 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CF Amb25147611 [0,2,0,0,0,0|2,0,0]=4 11382 B9R0.42 C[C@@H](C[C@H](O)CC)N(C)C Amb24675478 [0,2,0,0,0,0|2,0,0]=4 11383 B9R0.42 C[C@@H](C[C@H](O)CN)C(O)=O Amb24447195 [0,2,0,0,0,0|2,0,0]=4 11384 B9R0.42 C[C@H](C[C@@H](N)C(O)=O)CC Amb25738618 [0,2,0,0,0,0|1,0,0]=3 11385 B9R0.42 C[C@H](C[C@H](C)C=C)C(C)=O Amb24640833 [0,2,0,0,0,0|0,0,2]=4 11386 B9R0.42 C[C@H](C[C@H](C)C=O)C(C)=O Amb25043958 [0,2,0,0,0,0|1,0,1]=4 11387 B9R0.42 C[C@H](C[C@H](C)CO)C(O)=O Amb24480419 [0,2,0,0,0,0|2,0,0]=4 11388 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CC Amb25662528 [0,2,0,0,0,0|1,0,0]=3 11389 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CF Amb25378691 [0,2,0,0,0,0|2,0,0]=4 11390 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CO Amb25378739 [0,2,0,0,0,0|2,0,0]=4 11391 B9R0.42 C[C@H](C[C@H](N)C(O)=O)SC Amb25848560 [0,2,0,0,0,0|2,0,0]=4 11392 B9R0.42 C[C@H](C[C@H](O)C(O)=O)CC Amb24446982 [0,2,0,0,0,0|1,0,0]=3 11393 B9R0.42 C\C(=C/C(C)CC)\C(C)=O Amb25146534 [0,2,0,0,0,0|0,0,2]=4 11394 B9R0.42 C\C(=C/[C@@H](C)CC)\C(C)=O Amb24586848 [0,2,0,0,0,0|0,0,2]=4 11395 B9R0.42 C\C(=C\C(C)CC)\C(C)=O Amb25112631 [0,2,0,0,0,0|0,0,2]=4 11396 B9R0.42 NC(CC(F)CN)C(O)=O Amb24709973 [0,2,0,0,0,0|2,0,0]=4 11397 B9R0.42 NC(CC(O)CCl)C(O)=O Amb20179638 [0,2,0,0,0,0|2,0,0]=4 11398 B9R0.42 NC(CC(O)CO)C(O)=O Amb18644388 [0,2,0,0,0,0|2,0,0]=4 11399 B9R0.42 NC(CC(O)CO)C(O)=O Amb24117285 [0,2,0,0,0,0|2,0,0]=4 11400 B9R0.42 NC[C@H](O)C[C@H](O)C(O)=O Amb24383534 [0,2,0,0,0,0|2,0,0]=4 11401 B9R0.42 N[C@@H](CC(F)CO)C(O)=O Amb24079182 [0,2,0,0,0,0|2,0,0]=4 11402 B9R0.42 N[C@@H](CC(O)CN)C(O)=O Amb24455060 [0,2,0,0,0,0|2,0,0]=4 11403 B9R0.42 N[C@@H](C[C@@H](O)CN)C(O)=O Amb25320209 [0,2,0,0,0,0|2,0,0]=4 11404 B9R0.42 N[C@@H](C[C@@H](O)CO)C(O)=O Amb24680903 [0,2,0,0,0,0|2,0,0]=4 11405 B9R0.42 N[C@@H](C[C@H](O)CCl)C(O)=O Amb25265266 [0,2,0,0,0,0|2,0,0]=4 11406 B9R0.42 N[C@@H](C[C@H](O)CN)C(O)=O Amb24446199 [0,2,0,0,0,0|2,0,0]=4 11407 B9R0.42 N[C@H](C[C@@H](O)CN)C(O)=O Amb24480730 [0,2,0,0,0,0|2,0,0]=4 11408 B9R0.42 N[C@H](C[C@H](O)CN)C(O)=O Amb25147418 [0,2,0,0,0,0|2,0,0]=4 11409 B9R0.42 OCC(O)CC(O)C(O)=O Amb18644410 [0,2,0,0,0,0|2,0,0]=4 11410 B9R0.42 OC[C@@H](O)C[C@@H](O)C(O)=O Amb25227512 [0,2,0,0,0,0|2,0,0]=4 11411 B9R0.42 OC[C@@H](O)C[C@H](O)C(O)=O Amb25336564 [0,2,0,0,0,0|2,0,0]=4 11412 B9R0.42 OC[C@H](O)C[C@@H](O)C(O)=O Amb25774509 [0,2,0,0,0,0|2,0,0]=4 11413 B9R0.51 CC#CCC(C)(C)C(C)=O Amb24424857 [0,2,0,0,0,0|0,0,2]=4 11414 B9R0.51 CC(=C)C(C)(C)CCCCl Amb25791669 [0,2,0,0,0,0|2,0,0]=4 11415 B9R0.51 CC(=C)C(C)(F)CCCN Amb24332440 [0,2,0,0,0,0|2,0,0]=4 11416 B9R0.51 CC(=O)C(C)(C)CCC#N Amb18643431 [0,2,0,0,0,0|1,0,1]=4 11417 B9R0.51 CC(=O)C(C)(C)CCC=O Amb25759012 [0,2,0,0,0,0|1,0,1]=4 11418 B9R0.51 CC(=O)C(C)(C)SCCCl Amb25257410 [0,2,0,0,0,0|2,0,0]=4 11419 B9R0.51 CC(=O)C(C)(O)CCCO Amb24520546 [0,2,0,0,0,0|1,0,0]=3 11420 B9R0.51 CC(C(=O)O)(CCCC)O Amb17593657 [0,2,0,0,0,0|1,0,0]=3 11421 B9R0.51 CC(C)(CCCBr)C(O)=O Amb18131057 [0,2,0,0,0,0|2,0,0]=4 11422 B9R0.51 CC(C)(CCCS)C(O)=O Amb25699465 [0,2,0,0,0,0|2,0,0]=4 11423 B9R0.51 CC(N)(CCCN)C(N)=O Amb24583159 [0,2,0,0,0,0|2,0,0]=4 11424 B9R0.51 CC(N)(CCCN)C(O)=O Amb18644277 [0,2,0,0,0,0|2,0,0]=4 11425 B9R0.51 CC(N)(CCCO)C(N)=O Amb24353259 [0,2,0,0,0,0|2,0,0]=4 11426 B9R0.51 CC(N)(CCCO)C(O)=O Amb24061058 [0,2,0,0,0,0|2,0,0]=4 11427 B9R0.51 CC(O)(CCCN)C(O)=O Amb25380779 [0,2,0,0,0,0|2,0,0]=4 11428 B9R0.51 CCCCC(C(C)C)(O)C Amb10807398 [0,2,0,0,0,0|1,0,1]=4 11429 B9R0.51 CCCCC(C)(C)C(=O)Cl Amb24705541 [0,2,0,0,0,0|1,0,0]=3 11430 B9R0.51 CCCCC(C)(C)C(C)=O Amb25302438 [0,2,0,0,0,0|0,0,0]=2 11431 B9R0.51 CCCCC(C)(C)C(N)=O Amb25798396 [0,2,0,0,0,0|1,0,0]=3 11432 B9R0.51 CCCCC(C)(Cl)C(O)=O Amb24373145 [0,2,0,0,0,0|1,0,0]=3 11433 B9R0.51 CCCCC(C)(F)C(O)=O Amb24444856 [0,2,0,0,0,0|1,0,0]=3 11434 B9R0.51 CCCCC(C)(N)C(C)C Amb18312893 [0,2,0,0,0,0|1,0,1]=4 11435 B9R0.51 CCCCC(C)(N)C(N)=O Amb25321316 [0,2,0,0,0,0|1,0,0]=3 11436 B9R0.51 CCCCC(C)(O)C(C)Cl Amb24664032 [0,2,0,0,0,0|1,0,1]=4 11437 B9R0.51 CCCCC(F)(F)C(O)=O Amb19929267 [0,2,0,0,0,0|1,0,0]=3 11438 B9R0.51 CCCCC(F)(F)C([O-])=O Amb22008194 [0,2,0,0,0,0|1,0,0]=3 11439 B9R0.51 CCCC[C@@](C)(F)C(O)=O Amb24622375 [0,2,0,0,0,0|1,0,0]=3 11440 B9R0.51 CCCC[C@@](C)(N)C(O)=O Amb19929613 [0,2,0,0,0,0|1,0,0]=3 11441 B9R0.51 CCCNC(C)(C)C(N)=O Amb18304449 [0,2,0,0,0,0|2,0,0]=4 11442 B9R0.51 CCCOC(C)(C)C(O)=O Amb18305285 [0,2,0,0,0,0|2,0,0]=4 11443 B9R0.51 CCCOC(C)(O)C(O)=O Amb25341784 [0,2,0,0,0,0|2,0,0]=4 11444 B9R0.51 CCCSC(C(=O)O)(C)C Amb17501481 [0,2,0,0,0,0|2,0,0]=4 11445 B9R0.51 CCCSC(C)(C)C(N)=O Amb24634366 [0,2,0,0,0,0|2,0,0]=4 11446 B9R0.51 CCNCC(C)(C)C(O)=O Amb25232529 [0,2,0,0,0,0|2,0,0]=4 11447 B9R0.51 CCOCC(C)(O)C(C)=O Amb25134140 [0,2,0,0,0,0|1,0,0]=3 11448 B9R0.51 CCSCC(C)(N)C(N)=O Amb18788144 [0,2,0,0,0,0|2,0,0]=4 11449 B9R0.51 CCSCC(C)(N)C(O)=O Amb18788224 [0,2,0,0,0,0|2,0,0]=4 11450 B9R0.51 CCSCC(C)(O)C(N)=O Amb25301235 [0,2,0,0,0,0|2,0,0]=4 11451 B9R0.51 CCSCC(C)(O)C(O)=O Amb18646119 [0,2,0,0,0,0|2,0,0]=4 11452 B9R0.51 CCSC[C@](C)(N)C(O)=O Amb24390760 [0,2,0,0,0,0|2,0,0]=4 11453 B9R0.51 COCCC(C)(C)C(N)=O Amb25688614 [0,2,0,0,0,0|2,0,0]=4 11454 B9R0.51 COCCC(C)(C)C(O)=O Amb19029437 [0,2,0,0,0,0|2,0,0]=4 11455 B9R0.51 COCCC(C)(N)C(N)=O Amb24478104 [0,2,0,0,0,0|2,0,0]=4 11456 B9R0.51 COCCC(C)(N)C(O)=O Amb23580585 [0,2,0,0,0,0|2,0,0]=4 11457 B9R0.51 COCCC(C)(O)C(N)=O Amb25352238 [0,2,0,0,0,0|2,0,0]=4 11458 B9R0.51 COCCC(C)(O)C(O)=O Amb23454643 [0,2,0,0,0,0|2,0,0]=4 11459 B9R0.51 COCC[C@@](C)(N)C(O)=O Amb24664972 [0,2,0,0,0,0|2,0,0]=4 11460 B9R0.51 CSCCC(C(=O)O)(C)C Amb10844081 [0,2,0,0,0,0|2,0,0]=4 11461 B9R0.51 CSCCC(C)(N)C(N)=O Amb18788148 [0,2,0,0,0,0|2,0,0]=4 11462 B9R0.51 CSCC[C@@](C)(N)C(O)=O Amb24482190 [0,2,0,0,0,0|2,0,0]=4 11463 B9R0.51 C[C@](N)(CCCN)C(O)=O Amb24480786 [0,2,0,0,0,0|2,0,0]=4 11464 B9R0.51 C\C=C\CC(C)(O)C(C)=O Amb25095124 [0,2,0,0,0,0|0,0,2]=4 11465 B9R0.51 NC(N)(CCCO)C(O)=O Amb25300624 [0,2,0,0,0,0|2,0,0]=4 11466 B9R0.51 NCCCC(Br)(Br)C(O)=O Amb25120084 [0,2,0,0,0,0|2,0,0]=4 11467 B9R0.51 NCCCC(C(=O)O)(Cl)Cl Amb17594797 [0,2,0,0,0,0|2,0,0]=4 11468 B9R0.51 OC(=O)C(Cl)(Cl)CCCCl Amb25075193 [0,2,0,0,0,0|2,0,0]=4 11469 B9R0.51 OCCCC(F)(F)C(O)=O Amb24652882 [0,2,0,0,0,0|2,0,0]=4 11470 B9R0.51 [2H]C(N)(CCSC)C(O)=O Amb22367539 [0,2,0,0,0,0|2,0,0]=4 11471 B9R0.51 [2H]C([2H])(CCCC)C(O)=O Amb22338412 [0,2,0,0,0,0|1,0,0]=3 11472 B9R0.21 CC(CBr)CCS(C)(=O)=O Amb25796734 [0,2,0,0,0,0|2,0,0]=4 11473 B9R0.21 CC(CCl)CCS(C)(=O)=O Amb24363403 [0,2,0,0,0,0|2,0,0]=4 11474 B9R0.21 CC(CN)CCS(C)(=O)=O Amb18312080 [0,2,0,0,0,0|2,0,0]=4 11475 B9R0.21 CC(CO)CCS(C)(=O)=O Amb25302914 [0,2,0,0,0,0|2,0,0]=4 11476 B9R0.21 CCC(=O)CCS(C)(=O)=O Amb18798350 [0,2,0,0,0,0|1,0,1]=4 11477 B9R0.21 CCC(Br)CCC(C)(C)C Amb24619304 [0,2,0,0,0,0|1,0,1]=4 11478 B9R0.21 CCC(C)CCS(N)(=O)=O Amb25371078 [0,2,0,0,0,0|2,0,0]=4 11479 B9R0.21 CCC(C)COS(C)(=O)=O Amb24724645 [0,2,0,0,0,0|2,0,0]=4 11480 B9R0.21 CCC(Cl)CCS(N)(=O)=O Amb25269437 [0,2,0,0,0,0|2,0,0]=4 11481 B9R0.21 CCC(Cl)CNS(C)(=O)=O Amb24643296 [0,2,0,0,0,0|2,0,0]=4 11482 B9R0.21 CCC(Cl)COS(C)(=O)=O Amb25290783 [0,2,0,0,0,0|2,0,0]=4 11483 B9R0.21 CCC(N)CCC(C)(C)C Amb19026128 [0,2,0,0,0,0|1,0,1]=4 11484 B9R0.21 CCC(N)CCC(C)(C)O Amb18124762 [0,2,0,0,0,0|0,0,2]=4 11485 B9R0.21 CCC(N)CCS(C)(=O)=O Amb19026127 [0,2,0,0,0,0|1,0,0]=3 11486 B9R0.21 CCC(N)CNS(C)(=O)=O Amb25309044 [0,2,0,0,0,0|2,0,0]=4 11487 B9R0.21 CCC(N)COS(C)(=O)=O Amb25200094 [0,2,0,0,0,0|2,0,0]=4 11488 B9R0.21 CCC(O)CCS(C)(=O)=O Amb18798675 [0,2,0,0,0,0|1,0,0]=3 11489 B9R0.21 CC[C@@H](Cl)COS(C)(=O)=O Amb24482423 [0,2,0,0,0,0|2,0,0]=4 11490 B9R0.21 CC[C@H](C)COS(C)(=O)=O Amb22367081 [0,2,0,0,0,0|2,0,0]=4 11491 B9R0.21 CC[C@H](N)CCC(C)(C)C Amb24594412 [0,2,0,0,0,0|1,0,1]=4 11492 B9R0.21 CC[C@H](N)CCC(C)(C)O Amb24351090 [0,2,0,0,0,0|0,0,2]=4 11493 B9R0.21 CC[C@H](O)CNS(C)(=O)=O Amb24722321 [0,2,0,0,0,0|2,0,0]=4 11494 B9R0.21 CNC(C)CCS(C)(=O)=O Amb18313524 [0,2,0,0,0,0|2,0,0]=4 11495 B9R0.21 CS(=O)(=O)CCC(N)CO Amb24413059 [0,2,0,0,0,0|2,0,0]=4 11496 B9R0.21 CS(=O)(=O)CCC(O)CN Amb25803143 [0,2,0,0,0,0|2,0,0]=4 11497 B9R0.43 CC(=C)CCC(CO)C=C Amb25796425 [0,2,0,0,0,0|2,0,0]=4 11498 B9R0.43 CC(=C)CNC(CC)CC Amb25704535 [0,2,0,0,0,0|2,0,0]=4 11499 B9R0.43 CC(=O)C=CC(CC)CC Amb22345907 [0,2,0,0,0,0|0,0,2]=4 11500 B9R0.43 CC(=O)CC=C(CC)CC Amb25320085 [0,2,0,0,0,0|0,0,2]=4 11501 B9R0.43 CC(=O)CCC(C#N)C#N Amb25320040 [0,2,0,0,0,0|1,0,1]=4 11502 B9R0.43 CC(=O)CCC(C=C)C=O Amb24619623 [0,2,0,0,0,0|0,0,2]=4 11503 B9R0.43 CC(=O)CCC(CC)=C=C Amb25320141 [0,2,0,0,0,0|0,0,1]=3 11504 B9R0.43 CC(=O)CCC(CC)=CC Amb24518433 [0,2,0,0,0,0|0,0,1]=3 11505 B9R0.43 CC(=O)CCC(OC)OC Amb25146554 [0,2,0,0,0,0|1,0,0]=3 11506 B9R0.43 CC(=O)CC\C(\C=O)=C\C Amb18643605 [0,2,0,0,0,0|0,0,2]=4 11507 B9R0.43 CC(=O)CC\C(\CC)=C\C Amb25857597 [0,2,0,0,0,0|0,0,1]=3 11508 B9R0.43 CC(=O)CSC(CC)CC Amb24431275 [0,2,0,0,0,0|1,0,0]=3 11509 B9R0.43 CC(=O)NCC(CC)=CC Amb24478998 [0,2,0,0,0,0|1,0,1]=4 11510 B9R0.43 CC(=O)NCN(CC)CC Amb24472258 [0,2,0,0,0,0|2,0,0]=4 11511 B9R0.43 CC(=O)OCC(CCl)CCl Amb24726208 [0,2,0,0,0,0|2,0,0]=4 11512 B9R0.43 CC(=O)OC[C@H](CO)C=C Amb25284293 [0,2,0,0,0,0|2,0,0]=4 11513 B9R0.43 CC(Br)CCC(CC)OC Amb24540724 [0,2,0,0,0,0|1,0,1]=4 11514 B9R0.43 CC(C)CCC(CBr)CC Amb25334410 [0,2,0,0,0,0|1,0,1]=4 11515 B9R0.43 CC(C)CCC(CC)NC Amb24350213 [0,2,0,0,0,0|1,0,1]=4 11516 B9R0.43 CC(C)CCC(CCl)CC Amb25726963 [0,2,0,0,0,0|1,0,1]=4 11517 B9R0.43 CC(Cl)CCC(CC)CC Amb25319541 [0,2,0,0,0,0|1,0,1]=4 11518 B9R0.43 CC(N)CCC(CC)CC Amb25147370 [0,2,0,0,0,0|1,0,1]=4 11519 B9R0.43 CC(O)CCC(CC)C=O Amb25835034 [0,2,0,0,0,0|0,0,2]=4 11520 B9R0.43 CCC(C#N)SCC(C)=O Amb24541426 [0,2,0,0,0,0|1,0,0]=3 11521 B9R0.43 CCC(C#N)SCC(O)=O Amb18182420 [0,2,0,0,0,0|2,0,0]=4 11522 B9R0.43 CCC(CBr)CCS(C)=O Amb25292711 [0,2,0,0,0,0|1,0,0]=3 11523 B9R0.43 CCC(CC)SCC(N)=O Amb25769020 [0,2,0,0,0,0|2,0,0]=4 11524 B9R0.43 CCC(CC=C(C)C)C=O Amb18643625 [0,2,0,0,0,0|1,0,1]=4 11525 B9R0.43 CCC(CCC(C)=O)C#N Amb18643428 [0,2,0,0,0,0|0,0,0]=2 11526 B9R0.43 CCC(CCC(C)=O)C=C Amb24354954 [0,2,0,0,0,0|0,0,0]=2 11527 B9R0.43 CCC(CCC(C)=O)C=O Amb18643911 [0,2,0,0,0,0|0,0,0]=2 11528 B9R0.43 CCC(CCC(N)=O)CC Amb25784811 [0,2,0,0,0,0|1,0,0]=3 11529 B9R0.43 CCC(CCC(O)=O)=CC Amb24480728 [0,2,0,0,0,0|1,0,1]=4 11530 B9R0.43 CCC(CCC(O)=O)C#N Amb18643712 [0,2,0,0,0,0|1,0,0]=3 11531 B9R0.43 CCC(CCC(O)=O)C=O Amb25378745 [0,2,0,0,0,0|1,0,0]=3 11532 B9R0.43 CCC(CCC(O)=O)NN Amb24478238 [0,2,0,0,0,0|1,0,0]=3 11533 B9R0.43 CCC(CCl)CCS(C)=O Amb24617545 [0,2,0,0,0,0|1,0,0]=3 11534 B9R0.43 CCC(CCl)COC(C)=O Amb24480383 [0,2,0,0,0,0|1,0,0]=3 11535 B9R0.43 CCC(CN)CCS(C)=O Amb24699721 [0,2,0,0,0,0|1,0,0]=3 11536 B9R0.43 CCC(CNC(C)=O)OC Amb25852654 [0,2,0,0,0,0|1,0,0]=3 11537 B9R0.43 CCC(CNC(N)=O)CC Amb25789490 [0,2,0,0,0,0|2,0,0]=4 11538 B9R0.43 CCC(CO)COC(N)=O Amb25840638 [0,2,0,0,0,0|2,0,0]=4 11539 B9R0.43 CCC(CO)NCC(C)=C Amb24469956 [0,2,0,0,0,0|2,0,0]=4 11540 B9R0.43 CCC(COC(=O)Cl)CC Amb25142812 [0,2,0,0,0,0|2,0,0]=4 11541 B9R0.43 CCC(CSC(C)=O)C=O Amb24497347 [0,2,0,0,0,0|1,0,0]=3 11542 B9R0.43 CCC(C\C=C(\C)/Cl)C=O Amb24476983 [0,2,0,0,0,0|1,0,1]=4 11543 B9R0.43 CCC(NCC(=O)N)CC Amb1121177 [0,2,0,0,0,0|2,0,0]=4 11544 B9R0.43 CCN(CCC(=O)N)CC Amb17231985 [0,2,0,0,0,0|2,0,0]=4 11545 B9R0.43 CCN(CCC(C)=O)C=O Amb24458250 [0,2,0,0,0,0|1,0,0]=3 11546 B9R0.43 CCN(CCC(O)=O)C=O Amb19010092 [0,2,0,0,0,0|2,0,0]=4 11547 B9R0.43 CCN(CCC(O)=O)N=O Amb24659873 [0,2,0,0,0,0|2,0,0]=4 11548 B9R0.43 CCP(CCC(O)=O)CC Amb24390842 [0,2,0,0,0,0|2,0,0]=4 11549 B9R0.43 CC[C@@H](CBr)COC(C)=O Amb24441456 [0,2,0,0,0,0|1,0,0]=3 11550 B9R0.43 CC[C@@H](CCC(C)=O)C=O Amb24573990 [0,2,0,0,0,0|0,0,0]=2 11551 B9R0.43 CC[C@@H](CCC(O)=O)NN Amb24640349 [0,2,0,0,0,0|1,0,0]=3 11552 B9R0.43 CC[S+](CCC(O)=O)CC Amb24702750 [0,2,0,0,0,0|2,0,0]=4 11553 B9R0.43 CN[C@H](CS)CCC(O)=O Amb24482183 [0,2,0,0,0,0|2,0,0]=4 11554 B9R0.43 COC(CCC(N)=O)OC Amb25843468 [0,2,0,0,0,0|2,0,0]=4 11555 B9R0.43 COC(CCC(O)=O)OC Amb24657204 [0,2,0,0,0,0|2,0,0]=4 11556 B9R0.43 COC(CNC(=O)C)OC Amb10808671 [0,2,0,0,0,0|2,0,0]=4 11557 B9R0.43 COC(COC(C)=O)CC Amb24323241 [0,2,0,0,0,0|1,0,0]=3 11558 B9R0.43 CO[C@H](CN)CCC(O)=O Amb24544386 [0,2,0,0,0,0|2,0,0]=4 11559 B9R0.43 CO[C@H](CO)COC(C)=O Amb25271459 [0,2,0,0,0,0|2,0,0]=4 11560 B9R0.43 CS(=O)CCC(CCl)C#N Amb24563062 [0,2,0,0,0,0|2,0,0]=4 11561 B9R0.43 CS(=O)CCC(CO)C#N Amb24581490 [0,2,0,0,0,0|2,0,0]=4 11562 B9R0.43 CS(=O)CCC(CO)CO Amb24538997 [0,2,0,0,0,0|2,0,0]=4 11563 B9R0.43 NCC(CCC(O)=O)CN Amb25062561 [0,2,0,0,0,0|2,0,0]=4 11564 B9R0.64 CC(=O)CCC(C)(C)C#N Amb18124540 [0,2,0,0,0,0|1,0,1]=4 11565 B9R0.64 CC(=O)CCC(C)(C)C=O Amb18643910 [0,2,0,0,0,0|1,0,1]=4 11566 B9R0.64 CC(=O)CCC(C)(Cl)C#N Amb18645254 [0,2,0,0,0,0|1,0,1]=4 11567 B9R0.64 CC(=O)CCC(C)(O)C=C Amb25087724 [0,2,0,0,0,0|0,0,2]=4 11568 B9R0.64 CC(=O)CCC(C)(O)CO Amb25713212 [0,2,0,0,0,0|1,0,0]=3 11569 B9R0.64 CC(=O)COC(C)(C)CCl Amb25739312 [0,2,0,0,0,0|2,0,0]=4 11570 B9R0.64 CC(=O)NCC(C)(C)CN Amb25810145 [0,2,0,0,0,0|2,0,0]=4 11571 B9R0.64 CC(=O)NCC(C)(O)CO Amb25685703 [0,2,0,0,0,0|2,0,0]=4 11572 B9R0.64 CC(=O)NCC(F)(F)CN Amb25047077 [0,2,0,0,0,0|2,0,0]=4 11573 B9R0.64 CC(=O)OCC(C)(C)CBr Amb25350030 [0,2,0,0,0,0|2,0,0]=4 11574 B9R0.64 CC(=O)OCC(C)(C)CCl Amb24560912 [0,2,0,0,0,0|2,0,0]=4 11575 B9R0.64 CC(O)(CCC(O)=O)CO Amb25108439 [0,2,0,0,0,0|2,0,0]=4 11576 B9R0.64 CCC(C)(C)CCC(C)Cl Amb25211524 [0,2,0,0,0,0|1,0,1]=4 11577 B9R0.64 CCC(C)(C)CCC(C)O Amb25168708 [0,2,0,0,0,0|0,0,2]=4 11578 B9R0.64 CCC(C)(C)CCC(O)=O Amb18644164 [0,2,0,0,0,0|1,0,0]=3 11579 B9R0.64 CCC(C)(C)N=CC(C)=O Amb25233570 [0,2,0,0,0,0|1,0,1]=4 11580 B9R0.64 CCC(C)(C)\C=C\C(C)=O Amb24633582 [0,2,0,0,0,0|0,0,2]=4 11581 B9R0.64 CCC(C)(C)\N=C\C(C)=O Amb24725377 [0,2,0,0,0,0|1,0,1]=4 11582 B9R0.64 CCC(C)(N)CCC(C)C Amb19026067 [0,2,0,0,0,0|1,0,1]=4 11583 B9R0.64 CCC(C)(O)C#CC(C)=O Amb25130662 [0,2,0,0,0,0|0,0,2]=4 11584 B9R0.64 CCC(C)(O)CCC(N)=O Amb25723101 [0,2,0,0,0,0|1,0,0]=3 11585 B9R0.64 CCC(C)(O)CCC(O)=O Amb25317242 [0,2,0,0,0,0|1,0,0]=3 11586 B9R0.64 CCC(C)(O)CNS(C)=O Amb24707643 [0,2,0,0,0,0|2,0,0]=4 11587 B9R0.64 CC[C@@](C)(O)CCC(O)=O Amb24461550 [0,2,0,0,0,0|1,0,0]=3 11588 B9R0.64 CC[Si](C)(C)CCC(O)=O Amb24482202 [0,2,0,0,0,0|1,1,0]=4 11589 B9R0.64 CNC(C)(C)COC(C)=O Amb24712887 [0,2,0,0,0,0|2,0,0]=4 11590 B9R0.64 COC(C)(C)CCC(C)=O Amb25767114 [0,2,0,0,0,0|1,0,0]=3 11591 B9R0.64 COC(C)(C)OCC(C)=O Amb24564909 [0,2,0,0,0,0|2,0,0]=4 11592 B9R0.64 COP(C)(=O)CCC(C)=O Amb25707535 [0,2,0,0,0,0|2,0,0]=4 11593 B9R0.64 COP(O)(=O)CCC(C)=O Amb24435493 [0,2,0,0,0,0|2,0,0]=4 11594 B9R0.64 CS(=O)CCC(C)(C)CBr Amb25292710 [0,2,0,0,0,0|2,0,0]=4 11595 B9R0.64 CS(=O)CCC(C)(C)CO Amb24538996 [0,2,0,0,0,0|2,0,0]=4 11596 B9R0.64 NCC(O)(O)CCC(O)=O Amb24401314 [0,2,0,0,0,0|2,0,0]=4 11597 B9R0.64 OC(=O)CCC(F)(F)CBr Amb25766479 [0,2,0,0,0,0|2,0,0]=4 11598 B9R0.56 CC(=C)CCCC(C)(C)O Amb22353103 [0,2,0,0,0,0|1,0,0]=3 11599 B9R0.56 CC(=C)CCC[Si](C)(C)C Amb24568286 [0,2,0,0,0,0|1,1,0]=4 11600 B9R0.56 CC(=C)CCNC(C)(C)C Amb19025233 [0,2,0,0,0,0|2,0,0]=4 11601 B9R0.56 CC(=C)CNCC(C)(C)N Amb24607722 [0,2,0,0,0,0|2,0,0]=4 11602 B9R0.56 CC(=C)CNCC(C)(C)O Amb24662791 [0,2,0,0,0,0|2,0,0]=4 11603 B9R0.56 CC(=C)COCC(C)(C)N Amb18630818 [0,2,0,0,0,0|2,0,0]=4 11604 B9R0.56 CC(=C)CSCC(C)(C)C Amb24482671 [0,2,0,0,0,0|2,0,0]=4 11605 B9R0.56 CC(=N)NCCC(C)(F)F Amb24706546 [0,2,0,0,0,0|2,0,0]=4 11606 B9R0.56 CC(=O)CC#CC(C)(C)O Amb24380834 [0,2,0,0,0,0|0,0,2]=4 11607 B9R0.56 CC(=O)CCCC(C)(C)Cl Amb25146588 [0,2,0,0,0,0|0,0,0]=2 11608 B9R0.56 CC(=O)CCCC(C)(C)F Amb25694464 [0,2,0,0,0,0|0,0,0]=2 11609 B9R0.56 CC(=O)CCCC(O)(C)C Amb17593627 [0,2,0,0,0,0|0,0,0]=2 11610 B9R0.56 CC(=O)CCCS(=O)(=O)F Amb25706977 [0,2,0,0,0,0|2,0,0]=4 11611 B9R0.56 CC(=O)CCCS(C)(=O)=O Amb18180080 [0,2,0,0,0,0|1,0,0]=3 11612 B9R0.56 CC(=O)CCC[N+](C)(C)C Amb25150329 [0,2,0,0,0,0|1,0,0]=3 11613 B9R0.56 CC(=O)CCNC(C)(C)C Amb24478983 [0,2,0,0,0,0|1,0,0]=3 11614 B9R0.56 CC(=O)CCNS(=O)(=O)C Amb17102926 [0,2,0,0,0,0|2,0,0]=4 11615 B9R0.56 CC(=O)CCO[Si](C)(C)C Amb24723895 [0,2,0,0,0,0|1,1,0]=4 11616 B9R0.56 CC(=O)COCC(C)(C)N Amb18106342 [0,2,0,0,0,0|1,0,0]=3 11617 B9R0.56 CC(=O)CSCC(C)(C)F Amb25212458 [0,2,0,0,0,0|1,0,0]=3 11618 B9R0.56 CC(=O)CSCC(Cl)(Cl)Cl Amb24393736 [0,2,0,0,0,0|2,0,0]=4 11619 B9R0.56 CC(=O)CSC[Si](C)(C)C Amb24504841 [0,2,0,0,0,0|1,1,0]=4 11620 B9R0.56 CC(=O)CSSC(C)(C)C Amb24402807 [0,2,0,0,0,0|2,0,0]=4 11621 B9R0.56 CC(=O)C\C=C\C(C)(C)C Amb25320062 [0,2,0,0,0,0|0,0,2]=4 11622 B9R0.56 CC(=O)NCCC(C)(C)C Amb24351644 [0,2,0,0,0,0|1,0,0]=3 11623 B9R0.56 CC(=O)NCCC(C)(F)F Amb25059540 [0,2,0,0,0,0|1,0,0]=3 11624 B9R0.56 CC(=O)NCCC(F)(Cl)Cl Amb25095185 [0,2,0,0,0,0|2,0,0]=4 11625 B9R0.56 CC(=O)NCCS(=O)(=O)C Amb16971455 [0,2,0,0,0,0|2,0,0]=4 11626 B9R0.56 CC(=O)NCSC(C)(C)C Amb10559955 [0,2,0,0,0,0|2,0,0]=4 11627 B9R0.56 CC(=O)NNCC(C)(C)O Amb25741973 [0,2,0,0,0,0|2,0,0]=4 11628 B9R0.56 CC(=O)NOCC(C)(C)O Amb25734130 [0,2,0,0,0,0|2,0,0]=4 11629 B9R0.56 CC(=O)OCCC(C)(F)F Amb25296921 [0,2,0,0,0,0|1,0,0]=3 11630 B9R0.56 CC(=O)OCCC(Cl)(Cl)Cl Amb25215667 [0,2,0,0,0,0|2,0,0]=4 11631 B9R0.56 CC(=O)OCCC(F)(F)F Amb25221294 [0,2,0,0,0,0|2,0,0]=4 11632 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb22350025 [0,2,0,0,0,0|2,0,0]=4 11633 B9R0.56 CC(=O)OCC[Si](C)(C)Cl Amb19893511 [0,2,0,0,0,0|1,1,0]=4 11634 B9R0.56 CC(=O)OCC[Si](C)(Cl)Cl Amb19893512 [0,2,0,0,0,0|1,1,0]=4 11635 B9R0.56 CC(=O)O[Hg]CC(C)(C)C Amb22347654 [0,2,0,0,0,0|2,0,0]=4 11636 B9R0.56 CC(=O)SCCS(C)(=O)=O Amb24368886 [0,2,0,0,0,0|2,0,0]=4 11637 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb17940581 [0,2,0,0,0,0|2,0,0]=4 11638 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb22264795 [0,2,0,0,0,0|2,0,0]=4 11639 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb22729102 [0,2,0,0,0,0|2,0,0]=4 11640 B9R0.56 CC(=O)\C=C\CC(C)(C)C Amb24614709 [0,2,0,0,0,0|0,0,2]=4 11641 B9R0.56 CC(Br)CCCS(C)(=O)=O Amb24513822 [0,2,0,0,0,0|1,0,0]=3 11642 B9R0.56 CC(C)(C)CCCC(N)=O Amb25268901 [0,2,0,0,0,0|1,0,0]=3 11643 B9R0.56 CC(C)(C)CCCC(N)=S Amb24479423 [0,2,0,0,0,0|1,1,0]=4 11644 B9R0.56 CC(C)(C)CCCC(O)=O Amb18307485 [0,2,0,0,0,0|1,0,0]=3 11645 B9R0.56 CC(C)(C)CCNC(N)=O Amb24618143 [0,2,0,0,0,0|2,0,0]=4 11646 B9R0.56 CC(C)(C)CCOC(=O)Cl Amb24705073 [0,2,0,0,0,0|2,0,0]=4 11647 B9R0.56 CC(C)(C)CCOC(N)=O Amb24575181 [0,2,0,0,0,0|2,0,0]=4 11648 B9R0.56 CC(C)(C)CNCC(N)=O Amb18315719 [0,2,0,0,0,0|2,0,0]=4 11649 B9R0.56 CC(C)(C)CNCC(O)=O Amb19012829 [0,2,0,0,0,0|2,0,0]=4 11650 B9R0.56 CC(C)(C)COCC(=O)Cl Amb21964966 [0,2,0,0,0,0|2,0,0]=4 11651 B9R0.56 CC(C)(C)COCC(O)=O Amb25079059 [0,2,0,0,0,0|2,0,0]=4 11652 B9R0.56 CC(C)(C)CSCC(N)=O Amb25333192 [0,2,0,0,0,0|2,0,0]=4 11653 B9R0.56 CC(C)(C)SCCC(N)=O Amb18800586 [0,2,0,0,0,0|2,0,0]=4 11654 B9R0.56 CC(C)(F)CCCC(O)=O Amb25270576 [0,2,0,0,0,0|1,0,0]=3 11655 B9R0.56 CC(C)(F)COCC(O)=O Amb25234238 [0,2,0,0,0,0|2,0,0]=4 11656 B9R0.56 CC(C)(F)CSCC(O)=O Amb24596449 [0,2,0,0,0,0|2,0,0]=4 11657 B9R0.56 CC(C)(N)CCCC(O)=O Amb25839402 [0,2,0,0,0,0|1,0,0]=3 11658 B9R0.56 CC(C)(N)CNCC(O)=O Amb24415937 [0,2,0,0,0,0|2,0,0]=4 11659 B9R0.56 CC(C)(N)COCC(N)=O Amb25228927 [0,2,0,0,0,0|2,0,0]=4 11660 B9R0.56 CC(C)(N)COCC(O)=O Amb18630788 [0,2,0,0,0,0|2,0,0]=4 11661 B9R0.56 CC(C)(N)CSCC(O)=O Amb25831613 [0,2,0,0,0,0|2,0,0]=4 11662 B9R0.56 CC(C)(O)CCCC(O)=O Amb24340189 [0,2,0,0,0,0|1,0,0]=3 11663 B9R0.56 CC(C)(O)CNCC(N)=O Amb18304038 [0,2,0,0,0,0|2,0,0]=4 11664 B9R0.56 CC(C)(O)CNCC(O)=O Amb18304065 [0,2,0,0,0,0|2,0,0]=4 11665 B9R0.56 CC(C)(O)CSCC(O)=O Amb18307056 [0,2,0,0,0,0|2,0,0]=4 11666 B9R0.56 CC(C)=CCCC(C)(C)O Amb22228370 [0,2,0,0,0,0|1,0,1]=4 11667 B9R0.56 CC(C)CCCC(C)(C)C Amb25844471 [0,2,0,0,0,0|1,0,1]=4 11668 B9R0.56 CC(C)CCCC(C)(C)O Amb22043432 [0,2,0,0,0,0|0,0,2]=4 11669 B9R0.56 CC(C)CCCS(=O)(=O)Cl Amb24478902 [0,2,0,0,0,0|2,0,0]=4 11670 B9R0.56 CC(C)CCCS(N)(=O)=O Amb24479274 [0,2,0,0,0,0|2,0,0]=4 11671 B9R0.56 CC(C)CCOS(C)(=O)=O Amb24451339 [0,2,0,0,0,0|2,0,0]=4 11672 B9R0.56 CC(C)NCCS(C)(=O)=O Amb18800964 [0,2,0,0,0,0|2,0,0]=4 11673 B9R0.56 CC(C)SCCS(C)(=O)=O Amb24482904 [0,2,0,0,0,0|2,0,0]=4 11674 B9R0.56 CC(CCCC(O)(C)C)N Amb1089414 [0,2,0,0,0,0|0,0,2]=4 11675 B9R0.56 CC(CCCC(O)(C)C)N Amb2099767 [0,2,0,0,0,0|0,0,2]=4 11676 B9R0.56 CC(CCNS(=O)(=O)C)C Amb1777719 [0,2,0,0,0,0|2,0,0]=4 11677 B9R0.56 CC(Cl)CCCC(C)(C)C Amb18800683 [0,2,0,0,0,0|1,0,1]=4 11678 B9R0.56 CC(Cl)CCCS(C)(=O)=O Amb18325490 [0,2,0,0,0,0|1,0,0]=3 11679 B9R0.56 CC(Cl)CCCS(N)(=O)=O Amb24692944 [0,2,0,0,0,0|2,0,0]=4 11680 B9R0.56 CC(F)CCNS(C)(=O)=O Amb25196099 [0,2,0,0,0,0|2,0,0]=4 11681 B9R0.56 CC(N)=NCCC(C)(C)O Amb24464457 [0,2,0,0,0,0|2,0,0]=4 11682 B9R0.56 CC(N)CCCC(C)(C)C Amb19018535 [0,2,0,0,0,0|1,0,1]=4 11683 B9R0.56 CC(N)CCCS(C)(=O)=O Amb19029752 [0,2,0,0,0,0|1,0,0]=3 11684 B9R0.56 CC(N)CCNS(C)(=O)=O Amb24476812 [0,2,0,0,0,0|2,0,0]=4 11685 B9R0.56 CC(O)CCCC(C)(C)N Amb25265263 [0,2,0,0,0,0|0,0,2]=4 11686 B9R0.56 CC(O)CCCS(C)(=O)=O Amb18801118 [0,2,0,0,0,0|1,0,0]=3 11687 B9R0.56 CC(O)CCNS(C)(=O)=O Amb24701690 [0,2,0,0,0,0|2,0,0]=4 11688 B9R0.56 CC(O)CCOS(C)(=O)=O Amb25065466 [0,2,0,0,0,0|2,0,0]=4 11689 B9R0.56 CN(C)(C)CCCC(O)=O Amb22732541 [0,2,0,0,0,0|2,0,0]=4 11690 B9R0.56 CN(C)CCCC(C)(C)C Amb24696273 [0,2,0,0,0,0|2,0,0]=4 11691 B9R0.56 CN(C)CCCC(C)(C)N Amb18202382 [0,2,0,0,0,0|2,0,0]=4 11692 B9R0.56 CP(O)(=O)CCCC(O)=O Amb24524573 [0,2,0,0,0,0|2,0,0]=4 11693 B9R0.56 CS(=O)(=O)CCCC(N)=O Amb18409109 [0,2,0,0,0,0|2,0,0]=4 11694 B9R0.56 CS(=O)CCNC(C)(C)C Amb25826903 [0,2,0,0,0,0|2,0,0]=4 11695 B9R0.56 CS(=O)NCCC(C)(C)O Amb24589633 [0,2,0,0,0,0|2,0,0]=4 11696 B9R0.56 C[C@@H](Cl)CCOS(C)(=O)=O Amb24710245 [0,2,0,0,0,0|2,0,0]=4 11697 B9R0.56 C[C@H](N)CCCC(C)(C)O Amb25147289 [0,2,0,0,0,0|0,0,2]=4 11698 B9R0.56 C[C@H](O)CCCC(C)(C)O Amb25027992 [0,2,0,0,0,0|0,0,2]=4 11699 B9R0.56 C[C@H](O)CCNS(C)(=O)=O Amb25297146 [0,2,0,0,0,0|2,0,0]=4 11700 B9R0.56 C[N+](C)(C)CCCC(N)=O Amb24365354 [0,2,0,0,0,0|2,0,0]=4 11701 B9R0.56 C[N+](C)(C)CCCC([O-])=O Amb22054610 [0,2,0,0,0,0|2,0,0]=4 11702 B9R0.56 C[Si](C)(C)CCCC(N)=O Amb24482275 [0,2,0,0,0,0|1,1,0]=4 11703 B9R0.56 OC(=O)CCCC(F)(F)C Amb17593778 [0,2,0,0,0,0|1,0,0]=3 11704 B9R0.56 OC(=O)CCCC(F)(F)F Amb10839991 [0,2,0,0,0,0|2,0,0]=4 11705 B9R0.56 OC(=O)CCCS(=O)(=O)C Amb17503668 [0,2,0,0,0,0|2,0,0]=4 11706 B9R0.56 OC(=O)CCNC(C)(C)C Amb1106324 [0,2,0,0,0,0|2,0,0]=4 11707 B7R1.2 C=C1CC(Br)CC1 Amb25135798 [1,0,0,1,0,0|2,0,0]=4 11708 B7R1.2 C=C1CC(N)CC1 Amb24352464 [1,0,0,1,0,0|2,0,0]=4 11709 B7R1.2 C=C1CC(O)CC1 Amb25246529 [1,0,0,1,0,0|2,0,0]=4 11710 B7R1.2 CC1=CC(NC1)C Amb17593062 [1,0,0,1,0,0|2,0,0]=4 11711 B7R1.2 CC1BC(C)CC1 Amb25760363 [1,0,0,1,0,0|1,0,1]=4 11712 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,0,0]=3 11713 B7R1.2 CC1CC(=O)NC1 Amb10608004 [1,0,0,1,0,0|1,0,0]=3 11714 B7R1.2 CC1CC(Cl)CC1 Amb25129430 [1,0,0,1,0,0|1,0,1]=4 11715 B7R1.2 CC1CC(N)CC1 Amb20669202 [1,0,0,1,0,0|1,0,1]=4 11716 B7R1.2 CC1CC(N)CC1 Amb24062164 [1,0,0,1,0,0|1,0,1]=4 11717 B7R1.2 CC1CC(S)CC1 Amb25829470 [1,0,0,1,0,0|0,1,1]=4 11718 B7R1.2 CC1CC=C(C)C1 Amb17674172 [1,0,0,1,0,0|1,0,1]=4 11719 B7R1.2 CC1CCC(=N)N1 Amb24479850 [1,0,0,1,0,0|2,0,0]=4 11720 B7R1.2 CC1CCC(=O)N1 Amb19267101 [1,0,0,1,0,0|1,0,0]=3 11721 B7R1.2 CC1CCC(=S)O1 Amb25361484 [1,0,0,1,0,0|1,0,1]=4 11722 B7R1.2 CC1CCC(C)=C1 Amb24479860 [1,0,0,1,0,0|1,0,0]=3 11723 B7R1.2 CC1CCC(C)=N1 Amb24598049 [1,0,0,1,0,0|1,0,0]=3 11724 B7R1.2 CC1CCC(C)N1 Amb20626165 [1,0,0,1,0,0|1,0,1]=4 11725 B7R1.2 CC1CCC(O1)C Amb10602551 [1,0,0,1,0,0|0,0,2]=4 11726 B7R1.2 CC1CN(N)CC1 Amb24385963 [1,0,0,1,0,0|2,0,0]=4 11727 B7R1.2 CC1CN=C(C)O1 Amb25360042 [1,0,0,1,0,0|1,0,1]=4 11728 B7R1.2 CC1CNC(=O)N1 Amb17506853 [1,0,0,1,0,0|2,0,0]=4 11729 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|2,0,0]=4 11730 B7R1.2 CC1CNC(=O)S1 Amb25367335 [1,0,0,1,0,0|2,0,0]=4 11731 B7R1.2 CC1CNC(C)=C1 Amb25806978 [1,0,0,1,0,0|2,0,0]=4 11732 B7R1.2 CC1CNC(C)=N1 Amb22733191 [1,0,0,1,0,0|2,0,0]=4 11733 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|1,0,0]=3 11734 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|2,0,0]=4 11735 B7R1.2 CC1CS(=O)CC1 Amb24333540 [1,0,0,1,0,0|1,0,0]=3 11736 B7R1.2 CC1CSC(=O)C1 Amb25136024 [1,0,0,1,0,0|1,0,0]=3 11737 B7R1.2 CC1CSC(=O)S1 Amb22055765 [1,0,0,1,0,0|2,0,0]=4 11738 B7R1.2 CC1NNC(=O)C1 Amb2371659 [1,0,0,1,0,0|2,0,0]=4 11739 B7R1.2 CC1OC(=O)CS1 Amb25314322 [1,0,0,1,0,0|2,0,0]=4 11740 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [1,0,0,1,0,0|0,0,2]=4 11741 B7R1.2 CC=1CC[C@H](O)C1 Amb24705946 [1,0,0,1,0,0|2,0,0]=4 11742 B7R1.2 CN1CC(=O)CC1 Amb22236123 [1,0,0,1,0,0|1,0,0]=3 11743 B7R1.2 CN1CCC(=O)N1 Amb24064860 [1,0,0,1,0,0|2,0,0]=4 11744 B7R1.2 CN1CNC(=O)C1 Amb24733801 [1,0,0,1,0,0|2,0,0]=4 11745 B7R1.2 C[C@@H]1CC(=O)CC1 Amb22801305 [1,0,0,1,0,0|0,0,0]=2 11746 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|0,0,0]=2 11747 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [1,0,0,1,0,0|1,0,0]=3 11748 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb22366804 [1,0,0,1,0,0|1,0,1]=4 11749 B7R1.2 C[C@@H]1CC[C@@H](N1)C Amb10567751 [1,0,0,1,0,0|1,0,1]=4 11750 B7R1.2 C[C@@H]1CC[C@H](C)N1 Amb24681649 [1,0,0,1,0,0|1,0,1]=4 11751 B7R1.2 C[C@@H]1CC[C@H](C)O1 Amb22799402 [1,0,0,1,0,0|0,0,2]=4 11752 B7R1.2 C[C@@H]1CC[C@H](N1)C Amb17613372 [1,0,0,1,0,0|1,0,1]=4 11753 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|1,0,0]=3 11754 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|2,0,0]=4 11755 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|1,0,0]=3 11756 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|2,0,0]=4 11757 B7R1.2 C[C@@H]1COC(C)=N1 Amb24480955 [1,0,0,1,0,0|2,0,0]=4 11758 B7R1.2 C[C@@H]1C[C@@H](C)CC1 Amb22747863 [1,0,0,1,0,0|1,0,1]=4 11759 B7R1.2 C[C@@H]1C[C@H](Br)CC1 Amb25026616 [1,0,0,1,0,0|1,0,1]=4 11760 B7R1.2 C[C@@H]1C[C@H](C)CC1 Amb22230412 [1,0,0,1,0,0|1,0,1]=4 11761 B7R1.2 C[C@@H]1C[C@H](I)CC1 Amb24561074 [1,0,0,1,0,0|1,0,1]=4 11762 B7R1.2 C[C@@H]1C[C@H](N)CC1 Amb25179651 [1,0,0,1,0,0|1,0,1]=4 11763 B7R1.2 C[C@@H]1C[C@H](O)CC1 Amb25241408 [1,0,0,1,0,0|0,0,2]=4 11764 B7R1.2 C[C@H]1CC(=O)CN1 Amb25746539 [1,0,0,1,0,0|1,0,0]=3 11765 B7R1.2 C[C@H]1CCC(C)N1 Amb25147635 [1,0,0,1,0,0|1,0,1]=4 11766 B7R1.2 C[C@H]1CC[C@H](C)O1 Amb25810674 [1,0,0,1,0,0|0,0,2]=4 11767 B7R1.2 C[C@H]1CNC(=O)O1 Amb24480854 [1,0,0,1,0,0|2,0,0]=4 11768 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|1,0,0]=3 11769 B7R1.2 C[C@H]1C[C@H](C)CC1 Amb25176920 [1,0,0,1,0,0|1,0,1]=4 11770 B7R1.2 C[C@H]1C[C@H](I)CC1 Amb25338105 [1,0,0,1,0,0|1,0,1]=4 11771 B7R1.2 C[C@H]1C[C@H](O)CC1 Amb25241604 [1,0,0,1,0,0|0,0,2]=4 11772 B7R1.2 NC1CC(=O)CC1 Amb22236085 [1,0,0,1,0,0|1,0,0]=3 11773 B7R1.2 NC1CC(=O)CC1 Amb22494268 [1,0,0,1,0,0|1,0,0]=3 11774 B7R1.2 NC1CC(=O)CS1 Amb25090377 [1,0,0,1,0,0|2,0,0]=4 11775 B7R1.2 NC1CCC(=O)N1 Amb24480433 [1,0,0,1,0,0|2,0,0]=4 11776 B7R1.2 NC1CCC(=O)O1 Amb17593085 [1,0,0,1,0,0|2,0,0]=4 11777 B7R1.2 NC1CCC(=O)S1 Amb24479819 [1,0,0,1,0,0|2,0,0]=4 11778 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,0,0,1,0,0|2,0,0]=4 11779 B7R1.2 NC1CS(=O)CC1 Amb19149072 [1,0,0,1,0,0|2,0,0]=4 11780 B7R1.2 NC1CS(=O)CC1 Amb25133789 [1,0,0,1,0,0|2,0,0]=4 11781 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,0,0,1,0,0|2,0,0]=4 11782 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,0,0,1,0,0|2,0,0]=4 11783 B7R1.2 N[C@H]1CC(=O)OC1 Amb16233747 [1,0,0,1,0,0|2,0,0]=4 11784 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,0,0,1,0,0|2,0,0]=4 11785 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,0,0,1,0,0|2,0,0]=4 11786 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,0,0,1,0,0|2,0,0]=4 11787 B7R1.2 O=C1CC(Br)CC1 Amb24334292 [1,0,0,1,0,0|1,0,0]=3 11788 B7R1.2 O=C1CC(Br)CO1 Amb25803413 [1,0,0,1,0,0|2,0,0]=4 11789 B7R1.2 O=C1CC(Cl)CO1 Amb24608923 [1,0,0,1,0,0|2,0,0]=4 11790 B7R1.2 O=C1CC(F)CC1 Amb21963553 [1,0,0,1,0,0|1,0,0]=3 11791 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,0,0,1,0,0|2,0,0]=4 11792 B7R1.2 O=C1CC(I)CC1 Amb22001809 [1,0,0,1,0,0|1,0,0]=3 11793 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,0,0,1,0,0|2,0,0]=4 11794 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [1,0,0,1,0,0|2,0,0]=4 11795 B7R1.2 O=C1CCC(Cl)N1 Amb24689591 [1,0,0,1,0,0|2,0,0]=4 11796 B7R1.2 O=C1CC[C@@H](Cl)O1 Amb24710047 [1,0,0,1,0,0|2,0,0]=4 11797 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,0,0,1,0,0|2,0,0]=4 11798 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,0,0,1,0,0|2,0,0]=4 11799 B7R1.2 OC1CC(=O)CC1 Amb22057378 [1,0,0,1,0,0|1,0,0]=3 11800 B7R1.2 OC1CCC(=O)N1 Amb21963236 [1,0,0,1,0,0|2,0,0]=4 11801 B7R1.2 OC1CCC(=O)O1 Amb22740957 [1,0,0,1,0,0|2,0,0]=4 11802 B7R1.2 OC1CNC(=O)C1 Amb19958404 [1,0,0,1,0,0|2,0,0]=4 11803 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [1,0,0,1,0,0|2,0,0]=4 11804 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,0,0,1,0,0|2,0,0]=4 11805 B7R1.3 BN1CCCCC1 Amb24621882 [1,0,0,1,0,0|2,0,0]=4 11806 B7R1.3 BrC=1CCCCC1 Amb21856761 [1,0,0,1,0,0|1,0,1]=4 11807 B7R1.3 C=C1CCNCC1 Amb19514763 [1,0,0,1,0,0|2,0,0]=4 11808 B7R1.3 C=C1CCNCC1 Amb24079604 [1,0,0,1,0,0|2,0,0]=4 11809 B7R1.3 C=C1CCOCC1 Amb22000865 [1,0,0,1,0,0|2,0,0]=4 11810 B7R1.3 C=C1CCSCC1 Amb25811623 [1,0,0,1,0,0|2,0,0]=4 11811 B7R1.3 C=C1CNCCC1 Amb19514641 [1,0,0,1,0,0|2,0,0]=4 11812 B7R1.3 C=C1CNCCC1 Amb22059305 [1,0,0,1,0,0|2,0,0]=4 11813 B7R1.3 C=C1CSCCC1 Amb22494848 [1,0,0,1,0,0|2,0,0]=4 11814 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|0,0,2]=4 11815 B7R1.3 CC1=NCCCS1 Amb25808748 [1,0,0,1,0,0|1,1,0]=4 11816 B7R1.3 CC1CCCCN1 Amb10552680 [1,0,0,1,0,0|1,0,1]=4 11817 B7R1.3 CC1CCCCS1 Amb17666899 [1,0,0,1,0,0|0,1,1]=4 11818 B7R1.3 CC=1CCCNC1 Amb25694414 [1,0,0,1,0,0|2,0,0]=4 11819 B7R1.3 CC=1CCNCC1 Amb18639053 [1,0,0,1,0,0|2,0,0]=4 11820 B7R1.3 CC=1CCNCC1 Amb21961140 [1,0,0,1,0,0|2,0,0]=4 11821 B7R1.3 CC=1CCOCC1 Amb24070517 [1,0,0,1,0,0|2,0,0]=4 11822 B7R1.3 CC=1CNCCC1 Amb23439963 [1,0,0,1,0,0|2,0,0]=4 11823 B7R1.3 CC=1CNCCC1 Amb25063349 [1,0,0,1,0,0|2,0,0]=4 11824 B7R1.3 CC=1CNCCN1 Amb22755966 [1,0,0,1,0,0|2,0,0]=4 11825 B7R1.3 CN1CCCCN1 Amb24681349 [1,0,0,1,0,0|2,0,0]=4 11826 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [1,0,0,1,0,0|1,0,1]=4 11827 B7R1.3 FN1CCCCC1 Amb24541335 [1,0,0,1,0,0|2,0,0]=4 11828 B7R1.3 N=C1CCCCN1 Amb17616049 [1,0,0,1,0,0|2,0,0]=4 11829 B7R1.3 N=C1CCNCC1 Amb24626089 [1,0,0,1,0,0|2,0,0]=4 11830 B7R1.3 N=C1CCOCC1 Amb24618556 [1,0,0,1,0,0|2,0,0]=4 11831 B7R1.3 NC1CCCCC1 Amb17837163 [1,0,0,1,0,0|1,0,1]=4 11832 B7R1.3 NC1CCCCC1 Amb20246801 [1,0,0,1,0,0|1,0,1]=4 11833 B7R1.3 NC1CCCCC1 Amb22350215 [1,0,0,1,0,0|1,0,1]=4 11834 B7R1.3 NC1CCCCC1 Amb22352716 [1,0,0,1,0,0|1,0,1]=4 11835 B7R1.3 O=C1CC=CCC1 Amb22365196 [1,0,0,1,0,0|0,0,2]=4 11836 B7R1.3 O=C1CCCC=C1 Amb17843126 [1,0,0,1,0,0|0,0,2]=4 11837 B7R1.3 O=C1CCCCS1 Amb25186924 [1,0,0,1,0,0|1,0,0]=3 11838 B7R1.3 O=C1CCCNC1 Amb10070944 [1,0,0,1,0,0|1,0,0]=3 11839 B7R1.3 O=C1CCCNC1 Amb10602349 [1,0,0,1,0,0|1,0,0]=3 11840 B7R1.3 O=C1CCCNN1 Amb18061622 [1,0,0,1,0,0|2,0,0]=4 11841 B7R1.3 O=C1CCCSC1 Amb13952257 [1,0,0,1,0,0|1,0,0]=3 11842 B7R1.3 O=C1CCSCC1 Amb1154265 [1,0,0,1,0,0|1,0,0]=3 11843 B7R1.3 O=C1CCSCN1 Amb24479868 [1,0,0,1,0,0|2,0,0]=4 11844 B7R1.3 O=C1CNCCC1 Amb19958010 [1,0,0,1,0,0|1,0,0]=3 11845 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,1,0,0|2,0,0]=4 11846 B7R1.3 O=C1CNCNC1 Amb24479362 [1,0,0,1,0,0|2,0,0]=4 11847 B7R1.3 O=C1COCCC1 Amb19373430 [1,0,0,1,0,0|1,0,0]=3 11848 B7R1.3 O=C1COCCN1 Amb15691115 [1,0,0,1,0,0|2,0,0]=4 11849 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|2,0,0]=4 11850 B7R1.3 O=C1COCOC1 Amb25319015 [1,0,0,1,0,0|2,0,0]=4 11851 B7R1.3 O=C1CSCCS1 Amb24539369 [1,0,0,1,0,0|2,0,0]=4 11852 B7R1.3 O=C1CSCSC1 Amb19148039 [1,0,0,1,0,0|2,0,0]=4 11853 B7R1.3 O=C1CSSCC1 Amb25718327 [1,0,0,1,0,0|2,0,0]=4 11854 B7R1.3 O=C1NCCCO1 Amb10608499 [1,0,0,1,0,0|2,0,0]=4 11855 B7R1.3 O=C1NCCCS1 Amb24117134 [1,0,0,1,0,0|2,0,0]=4 11856 B7R1.3 O=S1CCNCC1 Amb18943760 [1,0,0,1,0,0|2,0,0]=4 11857 B7R1.3 O=S1CCSCC1 Amb25679286 [1,0,0,1,0,0|2,0,0]=4 11858 B7R1.3 O=[13C]1CCCCC1 Amb22367406 [1,0,0,1,0,0|0,0,0]=2 11859 B7R1.3 O[13CH]1CCCCC1 Amb22336567 [1,0,0,1,0,0|0,0,2]=4 11860 B7R1.3 PC1CCCCC1 Amb19889857 [1,0,0,1,0,0|1,0,1]=4 11861 B7R1.3 S=C1CCCCC1 Amb24565839 [1,0,0,1,0,0|0,1,0]=3 11862 B7R1.3 S=C1CNCCC1 Amb24334274 [1,0,0,1,0,0|1,1,0]=4 11863 B7R1.3 SN1CCCCC1 Amb24479351 [1,0,0,1,0,0|1,1,0]=4 11864 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [1,0,0,1,0,0|1,0,1]=4 11865 B7R1.3 [NH3+]C1CCCCC1 Amb10552681 [1,0,0,1,0,0|1,0,1]=4 11866 B7R1.3 [SiH3]N1CCCCC1 Amb24565228 [1,0,0,1,0,0|2,0,0]=4 11867 B7R1.5 C=C1CC1CCBr Amb25700897 [1,0,0,1,0,0|2,0,0]=4 11868 B7R1.5 C=C1CC1CCO Amb25251181 [1,0,0,1,0,0|2,0,0]=4 11869 B7R1.5 CC1CC1CCC Amb24699677 [1,0,0,1,0,0|1,0,1]=4 11870 B7R1.5 CCCC1CC1N Amb18523756 [1,0,0,1,0,0|1,0,1]=4 11871 B7R1.5 CCCC1CC1N Amb20623324 [1,0,0,1,0,0|1,0,1]=4 11872 B7R1.5 CCCC1CC1O Amb25811022 [1,0,0,1,0,0|0,0,2]=4 11873 B7R1.5 CCCC1ON1C Amb22232363 [1,0,0,1,0,0|1,0,1]=4 11874 B7R1.5 CCC[C@H]1C[C@@H]1Cl Amb25176030 [1,0,0,1,0,0|1,0,1]=4 11875 B7R1.5 C[C@@H]1C[C@@H]1CCC Amb24544739 [1,0,0,1,0,0|1,0,1]=4 11876 B7R1.5 C[C@H]1C[C@H]1CCC Amb25302063 [1,0,0,1,0,0|1,0,1]=4 11877 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|0,0,2]=4 11878 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|0,0,2]=4 11879 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|0,0,2]=4 11880 B7R1.7 ClCCCC=1CC1 Amb24681071 [1,0,0,1,0,0|2,0,0]=4 11881 B7R1.10 C=C1CC(CBr)C1 Amb24365342 [1,0,0,1,0,0|2,0,0]=4 11882 B7R1.10 C=C1CC(CO)C1 Amb25854323 [1,0,0,1,0,0|2,0,0]=4 11883 B7R1.10 CCC1CC(=C)C1 Amb25719578 [1,0,0,1,0,0|1,0,0]=3 11884 B7R1.10 CCC1CC(=O)C1 Amb24406738 [1,0,0,1,0,0|0,0,0]=2 11885 B7R1.10 CCC1CC(O)C1 Amb24654646 [1,0,0,1,0,0|0,0,2]=4 11886 B7R1.10 CC[C@H]1CC(=O)N1 Amb24479784 [1,0,0,1,0,0|1,0,0]=3 11887 B7R1.10 CNC1CC(=C)C1 Amb16230428 [1,0,0,1,0,0|2,0,0]=4 11888 B7R1.10 COC1CC(=C)C1 Amb24733012 [1,0,0,1,0,0|2,0,0]=4 11889 B7R1.10 COC1CC(=O)C1 Amb22754340 [1,0,0,1,0,0|1,0,0]=3 11890 B7R1.10 CSC1CC(=O)N1 Amb25265230 [1,0,0,1,0,0|2,0,0]=4 11891 B7R1.10 ClCC1CC(=O)C1 Amb10610581 [1,0,0,1,0,0|1,0,0]=3 11892 B7R1.10 N#CC1CC(=O)C1 Amb10603718 [1,0,0,1,0,0|1,0,1]=4 11893 B7R1.10 NCC1CC(=C)C1 Amb10071401 [1,0,0,1,0,0|2,0,0]=4 11894 B7R1.10 NCC1CC(=C)C1 Amb10976021 [1,0,0,1,0,0|2,0,0]=4 11895 B7R1.10 NCC1CC(=O)C1 Amb18251063 [1,0,0,1,0,0|1,0,0]=3 11896 B7R1.10 NCC1CC(=O)C1 Amb22406094 [1,0,0,1,0,0|1,0,0]=3 11897 B7R1.10 NCC1CC(=O)N1 Amb25230632 [1,0,0,1,0,0|2,0,0]=4 11898 B7R1.10 NC[C@@H]1CC(=O)N1 Amb24120375 [1,0,0,1,0,0|2,0,0]=4 11899 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [1,0,0,1,0,0|1,0,0]=3 11900 B7R1.10 O=C1CC(CBr)N1 Amb25779168 [1,0,0,1,0,0|2,0,0]=4 11901 B7R1.10 O=C1CC(CI)O1 Amb25169535 [1,0,0,1,0,0|2,0,0]=4 11902 B7R1.10 OCC1CC(=O)C1 Amb16231082 [1,0,0,1,0,0|1,0,0]=3 11903 B7R1.10 OCC1CC(=O)N1 Amb22388379 [1,0,0,1,0,0|2,0,0]=4 11904 B7R1.10 OCC1CC(=O)O1 Amb25706008 [1,0,0,1,0,0|2,0,0]=4 11905 B7R1.10 OC[C@@H]1CC(=O)N1 Amb24578924 [1,0,0,1,0,0|2,0,0]=4 11906 B7R1.10 OC[C@H]1CC(=O)O1 Amb25769462 [1,0,0,1,0,0|2,0,0]=4 11907 B7R1.12 CC(=O)C1CC1Br Amb24426068 [1,0,0,1,0,0|1,0,0]=3 11908 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [1,0,0,1,0,0|1,0,0]=3 11909 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [1,0,0,1,0,0|1,0,0]=3 11910 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [1,0,0,1,0,0|1,0,0]=3 11911 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [1,0,0,1,0,0|1,0,0]=3 11912 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [1,0,0,1,0,0|1,0,0]=3 11913 B7R1.12 CC1=CC1C(C)=O Amb24736062 [1,0,0,1,0,0|0,0,2]=4 11914 B7R1.12 CC1CC1C(C)=C Amb25694889 [1,0,0,1,0,0|1,0,0]=3 11915 B7R1.12 CC1CC1C(C)=O Amb25720437 [1,0,0,1,0,0|0,0,0]=2 11916 B7R1.12 CC1CC1C(C)N Amb24592597 [1,0,0,1,0,0|1,0,1]=4 11917 B7R1.12 CC1CC1C(C)O Amb25849677 [1,0,0,1,0,0|0,0,2]=4 11918 B7R1.12 CC1CC1C(C)S Amb25102055 [1,0,0,1,0,0|0,1,1]=4 11919 B7R1.12 CC1CC1C(N)=N Amb25139920 [1,0,0,1,0,0|2,0,0]=4 11920 B7R1.12 CC1CC1C(N)=S Amb25302556 [1,0,0,1,0,0|1,1,0]=4 11921 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [1,0,0,1,0,0|0,0,2]=4 11922 B7R1.12 CC1CC1[C@H](C)N Amb25687220 [1,0,0,1,0,0|1,0,1]=4 11923 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [1,0,0,1,0,0|0,0,2]=4 11924 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|2,0,0]=4 11925 B7R1.12 CC1SC1C(C)=O Amb24333031 [1,0,0,1,0,0|1,0,0]=3 11926 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [1,0,0,1,0,0|0,0,0]=2 11927 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [1,0,0,1,0,0|1,0,0]=3 11928 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [1,0,0,1,0,0|1,0,0]=3 11929 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [1,0,0,1,0,0|1,0,0]=3 11930 B7R1.12 C[C@@H]1C[C@H]1C(C)N Amb24120602 [1,0,0,1,0,0|1,0,1]=4 11931 B7R1.12 C[C@@H]1C[C@H]1C(C)O Amb24714696 [1,0,0,1,0,0|0,0,2]=4 11932 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [1,0,0,1,0,0|1,0,0]=3 11933 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [1,0,0,1,0,0|2,0,0]=4 11934 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [1,0,0,1,0,0|2,0,0]=4 11935 B7R1.12 C[C@@H]1S[C@H]1C(C)=O Amb24374150 [1,0,0,1,0,0|1,0,0]=3 11936 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [1,0,0,1,0,0|1,0,0]=3 11937 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|1,0,0]=3 11938 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [1,0,0,1,0,0|0,0,0]=2 11939 B7R1.12 C[C@H]1C[C@H]1C(C)O Amb24593507 [1,0,0,1,0,0|0,0,2]=4 11940 B7R1.12 C[C@H]1C[C@H]1[C@@H](C)O Amb25026747 [1,0,0,1,0,0|0,0,2]=4 11941 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [1,0,0,1,0,0|2,0,0]=4 11942 B7R1.12 NC1CC1C(N)=O Amb18279694 [1,0,0,1,0,0|2,0,0]=4 11943 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [1,0,0,1,0,0|2,0,0]=4 11944 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [1,0,0,1,0,0|2,0,0]=4 11945 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [1,0,0,1,0,0|2,0,0]=4 11946 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [1,0,0,1,0,0|2,0,0]=4 11947 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [1,0,0,1,0,0|2,0,0]=4 11948 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [1,0,0,1,0,0|2,0,0]=4 11949 B7R1.12 OC(=O)C1CC1F Amb22490547 [1,0,0,1,0,0|2,0,0]=4 11950 B7R1.12 OC(=O)C1CC1S Amb20246988 [1,0,0,1,0,0|2,0,0]=4 11951 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [1,0,0,1,0,0|2,0,0]=4 11952 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [1,0,0,1,0,0|2,0,0]=4 11953 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [1,0,0,1,0,0|2,0,0]=4 11954 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [1,0,0,1,0,0|2,0,0]=4 11955 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [1,0,0,1,0,0|2,0,0]=4 11956 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [1,0,0,1,0,0|2,0,0]=4 11957 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [1,0,0,1,0,0|2,0,0]=4 11958 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [1,0,0,1,0,0|2,0,0]=4 11959 B7R1.12 OC1CC1C(O)=O Amb24360896 [1,0,0,1,0,0|2,0,0]=4 11960 B7R1.14 CC1(Br)CCCC1 Amb24612443 [1,0,0,1,0,0|1,0,1]=4 11961 B7R1.14 CC1(N)CCCC1 Amb10609055 [1,0,0,1,0,0|1,0,1]=4 11962 B7R1.14 CP1(=O)CCCO1 Amb22732093 [1,0,0,1,0,0|2,0,0]=4 11963 B7R1.14 C[Si]1(C)CCCC1 Amb19893503 [1,0,0,1,0,0|1,1,0]=4 11964 B7R1.14 C[Si]1(Cl)CCCC1 Amb19893715 [1,0,0,1,0,0|1,1,0]=4 11965 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [1,0,0,1,0,0|2,0,0]=4 11966 B7R1.17 CC1CCC1(C)O Amb24620558 [1,0,0,1,0,0|0,0,2]=4 11967 B7R1.17 CC1CCS1(=O)=O Amb22364950 [1,0,0,1,0,0|2,0,0]=4 11968 B7R1.18 CC(=C)C1CCC1 Amb25662691 [1,0,0,1,0,0|1,0,0]=3 11969 B7R1.18 CC(=O)C1CC=C1 Amb25807635 [1,0,0,1,0,0|0,0,2]=4 11970 B7R1.18 CC(=O)C1CCO1 Amb25745997 [1,0,0,1,0,0|1,0,0]=3 11971 B7R1.18 CC(=O)C1CCS1 Amb24105980 [1,0,0,1,0,0|1,0,0]=3 11972 B7R1.18 CC(=O)C1CNC1 Amb23400009 [1,0,0,1,0,0|1,0,0]=3 11973 B7R1.18 CC(=O)C1CNC1 Amb23401240 [1,0,0,1,0,0|1,0,0]=3 11974 B7R1.18 CC(=O)C=1CCC1 Amb23453500 [1,0,0,1,0,0|0,0,2]=4 11975 B7R1.18 CC(=O)N1CCC1 Amb22008358 [1,0,0,1,0,0|1,0,0]=3 11976 B7R1.18 CC(C)C1CCC1 Amb24479859 [1,0,0,1,0,0|1,0,1]=4 11977 B7R1.18 CC(C1CCC1)O Amb10603414 [1,0,0,1,0,0|0,0,2]=4 11978 B7R1.18 CC(Cl)C1CCC1 Amb25186056 [1,0,0,1,0,0|1,0,1]=4 11979 B7R1.18 CC(N)C1CCC1 Amb24183538 [1,0,0,1,0,0|1,0,1]=4 11980 B7R1.18 CC(S)C1CCC1 Amb24509376 [1,0,0,1,0,0|0,1,1]=4 11981 B7R1.18 CN(N)C1CCC1 Amb24396575 [1,0,0,1,0,0|2,0,0]=4 11982 B7R1.18 CS(=O)C1CNC1 Amb24506496 [1,0,0,1,0,0|2,0,0]=4 11983 B7R1.18 C[C@@H](N)C1CCC1 Amb22747302 [1,0,0,1,0,0|1,0,1]=4 11984 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [1,0,0,1,0,0|0,0,2]=4 11985 B7R1.18 C[C@H](N)C1CCC1 Amb24562787 [1,0,0,1,0,0|1,0,1]=4 11986 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [1,0,0,1,0,0|0,0,2]=4 11987 B7R1.18 NC(=N)C1CCC1 Amb19894979 [1,0,0,1,0,0|2,0,0]=4 11988 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,1,0,0|2,0,0]=4 11989 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,1,0,0|2,0,0]=4 11990 B7R1.18 NC(=O)C1CCO1 Amb24478900 [1,0,0,1,0,0|2,0,0]=4 11991 B7R1.18 NC(=O)C1CNC1 Amb10976072 [1,0,0,1,0,0|2,0,0]=4 11992 B7R1.18 NC(=O)C1CNC1 Amb20061301 [1,0,0,1,0,0|2,0,0]=4 11993 B7R1.18 NC(=O)C1CNC1 Amb21960249 [1,0,0,1,0,0|2,0,0]=4 11994 B7R1.18 NC(=O)N1CCC1 Amb25326782 [1,0,0,1,0,0|2,0,0]=4 11995 B7R1.18 NC(=S)C1CCC1 Amb18108358 [1,0,0,1,0,0|1,1,0]=4 11996 B7R1.18 O=C(Cl)C1COC1 Amb25201101 [1,0,0,1,0,0|2,0,0]=4 11997 B7R1.18 OC(=O)C1CCN1 Amb2371568 [1,0,0,1,0,0|2,0,0]=4 11998 B7R1.18 OC(=O)C1CCO1 Amb2383526 [1,0,0,1,0,0|2,0,0]=4 11999 B7R1.18 OC(=O)C1CNC1 Amb2444164 [1,0,0,1,0,0|2,0,0]=4 12000 B7R1.18 OC(=O)C1CSC1 Amb20171470 [1,0,0,1,0,0|2,0,0]=4 12001 B7R1.18 [O-][N+](=O)C1CCC1 Amb13883563 [1,0,0,1,0,0|2,0,0]=4 12002 B7R1.20 CC(=N)NC1CC1 Amb25369501 [1,0,0,1,0,0|2,0,0]=4 12003 B7R1.20 CC(=O)CC1CC1 Amb10603417 [1,0,0,1,0,0|0,0,0]=2 12004 B7R1.20 CC(=O)CC1CO1 Amb25718439 [1,0,0,1,0,0|1,0,0]=3 12005 B7R1.20 CC(=O)OC1CC1 Amb24334499 [1,0,0,1,0,0|1,0,0]=3 12006 B7R1.20 CC(=O)OC1CO1 Amb25261586 [1,0,0,1,0,0|2,0,0]=4 12007 B7R1.20 CC(Cl)CC1CC1 Amb24635709 [1,0,0,1,0,0|1,0,1]=4 12008 B7R1.20 CC(N)CC1CC1 Amb18958998 [1,0,0,1,0,0|1,0,1]=4 12009 B7R1.20 CN(CC1CC1)C Amb1795989 [1,0,0,1,0,0|2,0,0]=4 12010 B7R1.20 CS(=O)CC1CO1 Amb25060906 [1,0,0,1,0,0|2,0,0]=4 12011 B7R1.20 CS(=O)C[C@H]1CO1 Amb24431713 [1,0,0,1,0,0|2,0,0]=4 12012 B7R1.20 CS(=O)NC1CC1 Amb25231505 [1,0,0,1,0,0|2,0,0]=4 12013 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [1,0,0,1,0,0|0,0,2]=4 12014 B7R1.20 NC(=N)CC1CC1 Amb21964664 [1,0,0,1,0,0|2,0,0]=4 12015 B7R1.20 NC(=O)CC1CO1 Amb24654802 [1,0,0,1,0,0|2,0,0]=4 12016 B7R1.20 NC(=O)NC1CC1 Amb1152776 [1,0,0,1,0,0|2,0,0]=4 12017 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [1,0,0,1,0,0|1,0,0]=3 12018 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [1,0,0,1,0,0|2,0,0]=4 12019 B7R1.20 OC(=O)CC1CO1 Amb25244347 [1,0,0,1,0,0|2,0,0]=4 12020 B7R1.20 [O-][N+](=O)CC1CC1 Amb23589308 [1,0,0,1,0,0|2,0,0]=4 12021 B7R1.23 CCC1CC1(C)C Amb24333362 [1,0,0,1,0,0|1,0,1]=4 12022 B7R1.23 CCC1CC1(C)O Amb24334471 [1,0,0,1,0,0|0,0,2]=4 12023 B7R1.1 BrCC1CC=CC1 Amb25216921 [1,0,0,1,0,0|1,0,1]=4 12024 B7R1.1 BrCC1CNCC1 Amb20618587 [1,0,0,1,0,0|2,0,0]=4 12025 B7R1.1 BrCC1CNCC1 Amb22229236 [1,0,0,1,0,0|2,0,0]=4 12026 B7R1.1 BrC[C@@H]1CNCC1 Amb25702233 [1,0,0,1,0,0|2,0,0]=4 12027 B7R1.1 BrC[C@H]1CNCC1 Amb24753555 [1,0,0,1,0,0|2,0,0]=4 12028 B7R1.1 C=CC1CCCC1 Amb17934190 [1,0,0,1,0,0|0,0,1]=3 12029 B7R1.1 C=CC1CCCN1 Amb23536605 [1,0,0,1,0,0|1,0,1]=4 12030 B7R1.1 C=CC1CCCN1 Amb24082686 [1,0,0,1,0,0|1,0,1]=4 12031 B7R1.1 C=CC1CNCC1 Amb22587509 [1,0,0,1,0,0|1,0,1]=4 12032 B7R1.1 C=CC1COCC1 Amb24478877 [1,0,0,1,0,0|1,0,1]=4 12033 B7R1.1 C=CN1CCCC1 Amb25133406 [1,0,0,1,0,0|1,0,1]=4 12034 B7R1.1 C=C[C@H]1CCCN1 Amb24642810 [1,0,0,1,0,0|1,0,1]=4 12035 B7R1.1 CCC1C=CCN1 Amb22587170 [1,0,0,1,0,0|1,0,1]=4 12036 B7R1.1 CCC1CCCC1 Amb22053788 [1,0,0,1,0,0|0,0,1]=3 12037 B7R1.1 CCC1CCCN1 Amb19515009 [1,0,0,1,0,0|1,0,1]=4 12038 B7R1.1 CCC1CCCS1 Amb17939242 [1,0,0,1,0,0|0,1,1]=4 12039 B7R1.1 CCC1CNC=N1 Amb24481042 [1,0,0,1,0,0|2,0,0]=4 12040 B7R1.1 CCC1CNCC1 Amb18946548 [1,0,0,1,0,0|1,0,0]=3 12041 B7R1.1 CCC1CNCC1 Amb20630619 [1,0,0,1,0,0|1,0,0]=3 12042 B7R1.1 CCC1CNOC1 Amb25747042 [1,0,0,1,0,0|2,0,0]=4 12043 B7R1.1 CCC1COCN1 Amb24090823 [1,0,0,1,0,0|2,0,0]=4 12044 B7R1.1 CCC1COCO1 Amb24567580 [1,0,0,1,0,0|2,0,0]=4 12045 B7R1.1 CCC1NCC=C1 Amb10608188 [1,0,0,1,0,0|1,0,1]=4 12046 B7R1.1 CCN1CCCC1 Amb17938866 [1,0,0,1,0,0|1,0,1]=4 12047 B7R1.1 CC[C@@H]1CCCN1 Amb22225172 [1,0,0,1,0,0|1,0,1]=4 12048 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [1,0,0,1,0,0|1,0,1]=4 12049 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [1,0,0,1,0,0|1,0,1]=4 12050 B7R1.1 CC[C@H]1CNCC1 Amb24479851 [1,0,0,1,0,0|1,0,0]=3 12051 B7R1.1 CNC1CC=CC1 Amb25800350 [1,0,0,1,0,0|1,0,1]=4 12052 B7R1.1 CNC1CCC=C1 Amb25062560 [1,0,0,1,0,0|1,0,1]=4 12053 B7R1.1 CNC1CCCC1 Amb1223228 [1,0,0,1,0,0|1,0,0]=3 12054 B7R1.1 CNC1CNCC1 Amb22491402 [1,0,0,1,0,0|2,0,0]=4 12055 B7R1.1 CNC1COCC1 Amb20241377 [1,0,0,1,0,0|2,0,0]=4 12056 B7R1.1 CNC1CSCC1 Amb1139583 [1,0,0,1,0,0|2,0,0]=4 12057 B7R1.1 CNC1CSCC1 Amb22741543 [1,0,0,1,0,0|2,0,0]=4 12058 B7R1.1 CN[C@@H]1COCC1 Amb20240861 [1,0,0,1,0,0|2,0,0]=4 12059 B7R1.1 CN[C@@H]1COCC1 Amb20241500 [1,0,0,1,0,0|2,0,0]=4 12060 B7R1.1 CN[C@H]1COCC1 Amb20241026 [1,0,0,1,0,0|2,0,0]=4 12061 B7R1.1 COC1CCC=N1 Amb24703504 [1,0,0,1,0,0|2,0,0]=4 12062 B7R1.1 COC1CCCN1 Amb22493883 [1,0,0,1,0,0|2,0,0]=4 12063 B7R1.1 COC1CCCO1 Amb22505257 [1,0,0,1,0,0|2,0,0]=4 12064 B7R1.1 COC1CNCC1 Amb10603699 [1,0,0,1,0,0|2,0,0]=4 12065 B7R1.1 CO[C@@H]1CNCC1 Amb10603275 [1,0,0,1,0,0|2,0,0]=4 12066 B7R1.1 CO[C@@H]1CNCC1 Amb20241379 [1,0,0,1,0,0|2,0,0]=4 12067 B7R1.1 CO[C@H]1CNCC1 Amb10603225 [1,0,0,1,0,0|2,0,0]=4 12068 B7R1.1 CO[C@H]1CNCC1 Amb10603226 [1,0,0,1,0,0|2,0,0]=4 12069 B7R1.1 CSC1CCCC1 Amb22230463 [1,0,0,1,0,0|1,0,0]=3 12070 B7R1.1 CSC1CNCC1 Amb18279428 [1,0,0,1,0,0|2,0,0]=4 12071 B7R1.1 CS[C@H]1CNCC1 Amb24610101 [1,0,0,1,0,0|2,0,0]=4 12072 B7R1.1 C\C=C\1/CNCC1 Amb24380188 [1,0,0,1,0,0|1,0,1]=4 12073 B7R1.1 ClC=[N+]1CCCC1 Amb25210586 [1,0,0,1,0,0|2,0,0]=4 12074 B7R1.1 ClCC1CC=CC1 Amb25059951 [1,0,0,1,0,0|1,0,1]=4 12075 B7R1.1 ClCC1CCC=C1 Amb24624574 [1,0,0,1,0,0|1,0,1]=4 12076 B7R1.1 ClCC1CNCC1 Amb20618586 [1,0,0,1,0,0|2,0,0]=4 12077 B7R1.1 ClCC1CNCC1 Amb22229271 [1,0,0,1,0,0|2,0,0]=4 12078 B7R1.1 ClC[C@@H]1CNCC1 Amb25064501 [1,0,0,1,0,0|2,0,0]=4 12079 B7R1.1 Cl[Mg]C1CCCC1 Amb17689222 [1,0,0,1,0,0|2,0,0]=4 12080 B7R1.1 FCC1CNCC1 Amb24423478 [1,0,0,1,0,0|2,0,0]=4 12081 B7R1.1 FC[C@@H]1CNCC1 Amb24184002 [1,0,0,1,0,0|2,0,0]=4 12082 B7R1.1 ICC1CC=CC1 Amb24078965 [1,0,0,1,0,0|1,0,1]=4 12083 B7R1.1 ICC1CCC=C1 Amb24358200 [1,0,0,1,0,0|1,0,1]=4 12084 B7R1.1 ICC1CNCC1 Amb21861201 [1,0,0,1,0,0|2,0,0]=4 12085 B7R1.1 ICC1CNCC1 Amb22229332 [1,0,0,1,0,0|2,0,0]=4 12086 B7R1.1 ICC1COCC1 Amb23439064 [1,0,0,1,0,0|2,0,0]=4 12087 B7R1.1 IC[C@@H]1CCC=C1 Amb24366727 [1,0,0,1,0,0|1,0,1]=4 12088 B7R1.1 NCC1CC=CC1 Amb22301490 [1,0,0,1,0,0|1,0,1]=4 12089 B7R1.1 NCC1CCC=C1 Amb18119742 [1,0,0,1,0,0|1,0,1]=4 12090 B7R1.1 NCC1CCCC1 Amb1127194 [1,0,0,1,0,0|1,0,1]=4 12091 B7R1.1 NCC1CCCC1 Amb13951760 [1,0,0,1,0,0|1,0,1]=4 12092 B7R1.1 NCC1CNCC1 Amb20242959 [1,0,0,1,0,0|2,0,0]=4 12093 B7R1.1 NCC1COCC1 Amb1117962 [1,0,0,1,0,0|2,0,0]=4 12094 B7R1.1 NCC1CSCC1 Amb18198289 [1,0,0,1,0,0|2,0,0]=4 12095 B7R1.1 NC[C@@H]1CNCC1 Amb20242961 [1,0,0,1,0,0|2,0,0]=4 12096 B7R1.1 NC[C@@H]1CNCC1 Amb25079280 [1,0,0,1,0,0|2,0,0]=4 12097 B7R1.1 NC[C@@H]1COCC1 Amb23439065 [1,0,0,1,0,0|2,0,0]=4 12098 B7R1.1 NC[C@@H]1COCC1 Amb23439174 [1,0,0,1,0,0|2,0,0]=4 12099 B7R1.1 NC[C@H]1CNCC1 Amb20242960 [1,0,0,1,0,0|2,0,0]=4 12100 B7R1.1 NNC1CCCC1 Amb10071294 [1,0,0,1,0,0|2,0,0]=4 12101 B7R1.1 NOC1CCCC1 Amb17101093 [1,0,0,1,0,0|2,0,0]=4 12102 B7R1.1 NOC1CCCC1 Amb22750164 [1,0,0,1,0,0|2,0,0]=4 12103 B7R1.1 O=C=C1CCCC1 Amb17673796 [1,0,0,1,0,0|0,0,2]=4 12104 B7R1.1 O=CC1=CCCC1 Amb17138358 [1,0,0,1,0,0|0,0,2]=4 12105 B7R1.1 O=CC1CC=CC1 Amb18638871 [1,0,0,1,0,0|0,0,2]=4 12106 B7R1.1 O=CC1CCCN1 Amb20618600 [1,0,0,1,0,0|1,0,0]=3 12107 B7R1.1 O=CC1CCCN1 Amb22231416 [1,0,0,1,0,0|1,0,0]=3 12108 B7R1.1 O=CC1CNCC1 Amb18197564 [1,0,0,1,0,0|1,0,0]=3 12109 B7R1.1 O=CC1CNCC1 Amb22231419 [1,0,0,1,0,0|1,0,0]=3 12110 B7R1.1 O=CC1COCO1 Amb25767896 [1,0,0,1,0,0|2,0,0]=4 12111 B7R1.1 O=CC1CSCC1 Amb18199140 [1,0,0,1,0,0|1,0,0]=3 12112 B7R1.1 O=CC1SCCS1 Amb25169582 [1,0,0,1,0,0|2,0,0]=4 12113 B7R1.1 O=CN1CCCO1 Amb24470900 [1,0,0,1,0,0|2,0,0]=4 12114 B7R1.1 O=C[C@@H]1CCCN1 Amb22226769 [1,0,0,1,0,0|1,0,0]=3 12115 B7R1.1 O=C[C@@H]1CCCO1 Amb25338193 [1,0,0,1,0,0|1,0,0]=3 12116 B7R1.1 O=C[C@@H]1COCC1 Amb25123223 [1,0,0,1,0,0|1,0,0]=3 12117 B7R1.1 O=C[C@H]1CCC=C1 Amb25116186 [1,0,0,1,0,0|0,0,2]=4 12118 B7R1.1 O=C[C@H]1CCCN1 Amb25684302 [1,0,0,1,0,0|1,0,0]=3 12119 B7R1.1 O=C[C@H]1CCCO1 Amb25216742 [1,0,0,1,0,0|1,0,0]=3 12120 B7R1.1 OCC1CCC=C1 Amb23455253 [1,0,0,1,0,0|1,0,1]=4 12121 B7R1.1 OCC1CNCC1 Amb20240954 [1,0,0,1,0,0|2,0,0]=4 12122 B7R1.1 OCC1CNCC1 Amb21858960 [1,0,0,1,0,0|2,0,0]=4 12123 B7R1.1 OCC1CSCC1 Amb18203349 [1,0,0,1,0,0|2,0,0]=4 12124 B7R1.1 OC[C@@H]1CNCC1 Amb10067155 [1,0,0,1,0,0|2,0,0]=4 12125 B7R1.1 OC[C@@H]1COCC1 Amb22746669 [1,0,0,1,0,0|2,0,0]=4 12126 B7R1.1 OC[C@H]1CCC=C1 Amb25723081 [1,0,0,1,0,0|1,0,1]=4 12127 B7R1.1 SCC1CCCC1 Amb19514712 [1,0,0,1,0,0|0,1,1]=4 12128 B7R1.1 SCC1CNCC1 Amb22299730 [1,0,0,1,0,0|2,0,0]=4 12129 B7R1.1 SCC1CNCC1 Amb25198695 [1,0,0,1,0,0|2,0,0]=4 12130 B7R1.1 [C-]#[N+]C1CCCC1 Amb1981028 [1,0,0,1,0,0|1,0,1]=4 12131 B7R1.4 C=C1CCCC1Br Amb24634099 [1,0,0,1,0,0|1,0,1]=4 12132 B7R1.4 C=C1CCCC1O Amb25045562 [1,0,0,1,0,0|1,0,1]=4 12133 B7R1.4 C=C1CCC[C@@H]1O Amb24642468 [1,0,0,1,0,0|1,0,1]=4 12134 B7R1.4 CC1=CCCC1Br Amb25279491 [1,0,0,1,0,0|1,0,1]=4 12135 B7R1.4 CC1=CCCC1Cl Amb25139325 [1,0,0,1,0,0|1,0,1]=4 12136 B7R1.4 CC1=CCCC1O Amb25220686 [1,0,0,1,0,0|1,0,1]=4 12137 B7R1.4 CC1=CCC[C@@H]1O Amb24506387 [1,0,0,1,0,0|1,0,1]=4 12138 B7R1.4 CC1C=CCC1=O Amb25233761 [1,0,0,1,0,0|0,0,2]=4 12139 B7R1.4 CC1CC=CC1=O Amb25143468 [1,0,0,1,0,0|0,0,2]=4 12140 B7R1.4 CC1CCC=C1C Amb24479857 [1,0,0,1,0,0|0,0,1]=3 12141 B7R1.4 CC1CCCC1=C Amb25066862 [1,0,0,1,0,0|0,0,1]=3 12142 B7R1.4 CC1CCCC1Br Amb18180261 [1,0,0,1,0,0|1,0,1]=4 12143 B7R1.4 CC1CCCC1I Amb24658382 [1,0,0,1,0,0|1,0,1]=4 12144 B7R1.4 CC1CCCC1N Amb19373269 [1,0,0,1,0,0|1,0,1]=4 12145 B7R1.4 CC1CCCC1O Amb22052652 [1,0,0,1,0,0|0,0,2]=4 12146 B7R1.4 CC1CCCN1N Amb25068361 [1,0,0,1,0,0|2,0,0]=4 12147 B7R1.4 CC1CCCN1O Amb25221771 [1,0,0,1,0,0|1,0,1]=4 12148 B7R1.4 CC1CCN=C1C Amb24411616 [1,0,0,1,0,0|1,0,0]=3 12149 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,1,0,0|1,0,1]=4 12150 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,1,0,0|1,0,1]=4 12151 B7R1.4 CC1CCSC1=O Amb25271791 [1,0,0,1,0,0|1,0,0]=3 12152 B7R1.4 CC1CNCC1C Amb18121224 [1,0,0,1,0,0|1,0,1]=4 12153 B7R1.4 CC1CNCC1C Amb19149226 [1,0,0,1,0,0|1,0,1]=4 12154 B7R1.4 CC1COCC1=C Amb25830669 [1,0,0,1,0,0|1,0,1]=4 12155 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|1,0,0]=3 12156 B7R1.4 CC1CSCC1=O Amb21964769 [1,0,0,1,0,0|1,0,0]=3 12157 B7R1.4 CC1CSSC1=O Amb25757909 [1,0,0,1,0,0|2,0,0]=4 12158 B7R1.4 CC1NCOC1=O Amb24409631 [1,0,0,1,0,0|2,0,0]=4 12159 B7R1.4 CC1OCCC1=C Amb25254786 [1,0,0,1,0,0|1,0,1]=4 12160 B7R1.4 CC1SCOC1=O Amb25347819 [1,0,0,1,0,0|2,0,0]=4 12161 B7R1.4 CC=1CCCC1Br Amb24479762 [1,0,0,1,0,0|1,0,1]=4 12162 B7R1.4 CC=1CCCC1C Amb22227705 [1,0,0,1,0,0|0,0,1]=3 12163 B7R1.4 CC=1COCC1C Amb25294665 [1,0,0,1,0,0|1,0,1]=4 12164 B7R1.4 CC=1SCC[N+]1C Amb24060954 [1,0,0,1,0,0|2,0,0]=4 12165 B7R1.4 CN1CCC=C1C Amb17938859 [1,0,0,1,0,0|1,0,1]=4 12166 B7R1.4 CN1CCCC1=N Amb20669437 [1,0,0,1,0,0|2,0,0]=4 12167 B7R1.4 CN1CCCC1=O Amb22493780 [1,0,0,1,0,0|1,0,0]=3 12168 B7R1.4 CN1CCCC1Br Amb24652845 [1,0,0,1,0,0|2,0,0]=4 12169 B7R1.4 CN1CCCC1O Amb24064861 [1,0,0,1,0,0|2,0,0]=4 12170 B7R1.4 CN1CCC[C@H]1O Amb25788080 [1,0,0,1,0,0|2,0,0]=4 12171 B7R1.4 CN1CCOC1=O Amb22347786 [1,0,0,1,0,0|2,0,0]=4 12172 B7R1.4 CN1NCCC1=O Amb18559311 [1,0,0,1,0,0|2,0,0]=4 12173 B7R1.4 CN1OCCC1=O Amb25229271 [1,0,0,1,0,0|2,0,0]=4 12174 B7R1.4 CN1SCCC1=O Amb25746503 [1,0,0,1,0,0|2,0,0]=4 12175 B7R1.4 C[C@@H]1CCC[C@@H]1C Amb22230410 [1,0,0,1,0,0|0,0,1]=3 12176 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [1,0,0,1,0,0|1,0,1]=4 12177 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [1,0,0,1,0,0|1,0,1]=4 12178 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [1,0,0,1,0,0|0,0,2]=4 12179 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,1,0,0|0,0,1]=3 12180 B7R1.4 C[C@@H]1CCC[C@H]1Cl Amb24597933 [1,0,0,1,0,0|1,0,1]=4 12181 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [1,0,0,1,0,0|1,0,0]=3 12182 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,1,0,0|1,0,1]=4 12183 B7R1.4 C[C@@H]1CCN[C@H]1C Amb24515067 [1,0,0,1,0,0|1,0,1]=4 12184 B7R1.4 C[C@@H]1CNC[C@@H]1C Amb22757862 [1,0,0,1,0,0|1,0,1]=4 12185 B7R1.4 C[C@@H]1CNC[C@H]1C Amb22757861 [1,0,0,1,0,0|1,0,1]=4 12186 B7R1.4 C[C@@H]1CNC[C@H]1C Amb24597585 [1,0,0,1,0,0|1,0,1]=4 12187 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [1,0,0,1,0,0|1,0,0]=3 12188 B7R1.4 C[C@@H]1NCOC1=O Amb25273957 [1,0,0,1,0,0|2,0,0]=4 12189 B7R1.4 C[C@@H]1OCCC1=O Amb24728733 [1,0,0,1,0,0|1,0,0]=3 12190 B7R1.4 C[C@@H]1OCNC1=O Amb25115508 [1,0,0,1,0,0|2,0,0]=4 12191 B7R1.4 C[C@H]1CC=CC1=O Amb24364068 [1,0,0,1,0,0|0,0,2]=4 12192 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,1,0,0|0,0,1]=3 12193 B7R1.4 C[C@H]1CCC[C@H]1Br Amb24595359 [1,0,0,1,0,0|1,0,1]=4 12194 B7R1.4 C[C@H]1CCC[C@H]1Cl Amb24690084 [1,0,0,1,0,0|1,0,1]=4 12195 B7R1.4 C[C@H]1CNC[C@@H]1C Amb24567666 [1,0,0,1,0,0|1,0,1]=4 12196 B7R1.4 C[C@H]1OCCC1=O Amb25811510 [1,0,0,1,0,0|1,0,0]=3 12197 B7R1.4 C[N+]1=C(C)CCC1 Amb10552692 [1,0,0,1,0,0|1,0,0]=3 12198 B7R1.4 N=C1CCCN1C Amb16204491 [1,0,0,1,0,0|2,0,0]=4 12199 B7R1.4 NC1CCCC1=O Amb17939050 [1,0,0,1,0,0|1,0,0]=3 12200 B7R1.4 NC1CCNC1=O Amb21955321 [1,0,0,1,0,0|2,0,0]=4 12201 B7R1.4 NC1CCOC1=O Amb22233082 [1,0,0,1,0,0|2,0,0]=4 12202 B7R1.4 NC1CSCC1=O Amb18202693 [1,0,0,1,0,0|2,0,0]=4 12203 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [1,0,0,1,0,0|2,0,0]=4 12204 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [1,0,0,1,0,0|2,0,0]=4 12205 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [1,0,0,1,0,0|2,0,0]=4 12206 B7R1.4 N[C@@H]1CCSC1=O Amb22745304 [1,0,0,1,0,0|2,0,0]=4 12207 B7R1.4 N[C@@H]1CCSC1=O Amb22750668 [1,0,0,1,0,0|2,0,0]=4 12208 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [1,0,0,1,0,0|2,0,0]=4 12209 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [1,0,0,1,0,0|2,0,0]=4 12210 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [1,0,0,1,0,0|2,0,0]=4 12211 B7R1.4 O=C1CCCC1=C Amb17593061 [1,0,0,1,0,0|0,0,2]=4 12212 B7R1.4 O=C1CCCC1=O Amb24053064 [1,0,0,1,0,0|1,0,1]=4 12213 B7R1.4 O=C1CCCC1Br Amb16234114 [1,0,0,1,0,0|1,0,0]=3 12214 B7R1.4 O=C1CCCC1I Amb25756212 [1,0,0,1,0,0|1,0,0]=3 12215 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|1,0,0]=3 12216 B7R1.4 O=C1CCC[C@H]1Br Amb25778341 [1,0,0,1,0,0|1,0,0]=3 12217 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [1,0,0,1,0,0|1,0,0]=3 12218 B7R1.4 O=C1CCOC1Br Amb24061539 [1,0,0,1,0,0|2,0,0]=4 12219 B7R1.4 O=C1CCSC1Cl Amb24552901 [1,0,0,1,0,0|2,0,0]=4 12220 B7R1.4 O=C1CNCC1F Amb24540356 [1,0,0,1,0,0|2,0,0]=4 12221 B7R1.4 O=C1COCC1Br Amb24525921 [1,0,0,1,0,0|2,0,0]=4 12222 B7R1.4 O=C1NCCC1Br Amb20623055 [1,0,0,1,0,0|2,0,0]=4 12223 B7R1.4 O=C1NCCC1C Amb10603701 [1,0,0,1,0,0|1,0,0]=3 12224 B7R1.4 O=C1NCCC1F Amb25838145 [1,0,0,1,0,0|2,0,0]=4 12225 B7R1.4 O=C1NCCC1O Amb10603089 [1,0,0,1,0,0|2,0,0]=4 12226 B7R1.4 O=C1NCCC1S Amb18202686 [1,0,0,1,0,0|2,0,0]=4 12227 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [1,0,0,1,0,0|2,0,0]=4 12228 B7R1.4 O=C1NCC[C@@H]1S Amb25366927 [1,0,0,1,0,0|2,0,0]=4 12229 B7R1.4 O=C1NCC[C@H]1Cl Amb25331827 [1,0,0,1,0,0|2,0,0]=4 12230 B7R1.4 O=C1NCC[C@H]1F Amb24481058 [1,0,0,1,0,0|2,0,0]=4 12231 B7R1.4 O=C1NCC[C@H]1S Amb25304928 [1,0,0,1,0,0|2,0,0]=4 12232 B7R1.4 O=C1OCCC1C Amb16185414 [1,0,0,1,0,0|1,0,0]=3 12233 B7R1.4 O=C1OCCC1Cl Amb25065373 [1,0,0,1,0,0|2,0,0]=4 12234 B7R1.4 O=C1OCCC1I Amb24418518 [1,0,0,1,0,0|2,0,0]=4 12235 B7R1.4 O=C1OCCC1N Amb1151850 [1,0,0,1,0,0|2,0,0]=4 12236 B7R1.4 O=C1OCCC1N Amb17614991 [1,0,0,1,0,0|2,0,0]=4 12237 B7R1.4 O=C1OCCC1S Amb25146639 [1,0,0,1,0,0|2,0,0]=4 12238 B7R1.4 O=C1OCC[C@@H]1N Amb10982617 [1,0,0,1,0,0|2,0,0]=4 12239 B7R1.4 O=C1OCC[C@H]1N Amb10601656 [1,0,0,1,0,0|2,0,0]=4 12240 B7R1.4 O=C1SCCC1N Amb1151877 [1,0,0,1,0,0|2,0,0]=4 12241 B7R1.4 O=C1SCC[C@@H]1Cl Amb25279498 [1,0,0,1,0,0|2,0,0]=4 12242 B7R1.4 O=S1CCC[C@@H]1Br Amb25257694 [1,0,0,1,0,0|2,0,0]=4 12243 B7R1.4 O=S1CCC[C@@H]1Cl Amb25242432 [1,0,0,1,0,0|2,0,0]=4 12244 B7R1.4 O=S1CCC[C@H]1Cl Amb25708398 [1,0,0,1,0,0|2,0,0]=4 12245 B7R1.4 OC1CNCC1=O Amb22500423 [1,0,0,1,0,0|2,0,0]=4 12246 B7R1.4 O[C@@H]1CCCC1=O Amb25166028 [1,0,0,1,0,0|1,0,0]=3 12247 B7R1.4 O[C@@H]1CCNC1=O Amb22225343 [1,0,0,1,0,0|2,0,0]=4 12248 B7R1.4 O[C@H]1CCC[C@@H]1C Amb10844719 [1,0,0,1,0,0|0,0,2]=4 12249 B7R1.4 S=C1CCCN1C Amb10562641 [1,0,0,1,0,0|1,1,0]=4 12250 B7R1.4 [13CH3]N1[13CH2]CC[13C]1=O Amb22055816 [1,0,0,1,0,0|1,0,0]=3 12251 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [1,0,0,1,0,0|2,0,0]=4 12252 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [1,0,0,1,0,0|2,0,0]=4 12253 B7R1.6 BrCCC1CNC1 Amb24480690 [1,0,0,1,0,0|2,0,0]=4 12254 B7R1.6 BrCCC1CSC1 Amb25228072 [1,0,0,1,0,0|2,0,0]=4 12255 B7R1.6 C=CCC1CNC1 Amb23439504 [1,0,0,1,0,0|1,0,1]=4 12256 B7R1.6 C=CCC1COC1 Amb25856439 [1,0,0,1,0,0|1,0,1]=4 12257 B7R1.6 C=CCC1CSC1 Amb24623573 [1,0,0,1,0,0|1,0,1]=4 12258 B7R1.6 C=CC[C@@H]1CCN1 Amb25198891 [1,0,0,1,0,0|1,0,1]=4 12259 B7R1.6 C=CC[C@H]1CCN1 Amb25107968 [1,0,0,1,0,0|1,0,1]=4 12260 B7R1.6 CCCC1CCN1 Amb24504364 [1,0,0,1,0,0|1,0,1]=4 12261 B7R1.6 CCCC1CNC1 Amb25297768 [1,0,0,1,0,0|1,0,0]=3 12262 B7R1.6 CCNC1CCC1 Amb18960935 [1,0,0,1,0,0|1,0,1]=4 12263 B7R1.6 CCNC1CCC1 Amb19515593 [1,0,0,1,0,0|1,0,1]=4 12264 B7R1.6 CCNC1CNC1 Amb24619347 [1,0,0,1,0,0|2,0,0]=4 12265 B7R1.6 CCNC1COC1 Amb22406248 [1,0,0,1,0,0|2,0,0]=4 12266 B7R1.6 CCNC1COC1 Amb22736884 [1,0,0,1,0,0|2,0,0]=4 12267 B7R1.6 CCOC1CNC1 Amb18523751 [1,0,0,1,0,0|2,0,0]=4 12268 B7R1.6 CCOC1CNC1 Amb19889815 [1,0,0,1,0,0|2,0,0]=4 12269 B7R1.6 CCSC1CNC1 Amb22395437 [1,0,0,1,0,0|2,0,0]=4 12270 B7R1.6 CNCC1CCC1 Amb19373005 [1,0,0,1,0,0|1,0,0]=3 12271 B7R1.6 CNCC1CCN1 Amb24651166 [1,0,0,1,0,0|2,0,0]=4 12272 B7R1.6 CNCC1CNC1 Amb22227648 [1,0,0,1,0,0|2,0,0]=4 12273 B7R1.6 CNCC1COC1 Amb22405905 [1,0,0,1,0,0|2,0,0]=4 12274 B7R1.6 CNCC1CSC1 Amb25218287 [1,0,0,1,0,0|2,0,0]=4 12275 B7R1.6 COCC1CCN1 Amb23439866 [1,0,0,1,0,0|2,0,0]=4 12276 B7R1.6 COCC1CNC1 Amb15691981 [1,0,0,1,0,0|2,0,0]=4 12277 B7R1.6 COCC1CNC1 Amb19958983 [1,0,0,1,0,0|2,0,0]=4 12278 B7R1.6 COCC1CNC1 Amb21960717 [1,0,0,1,0,0|2,0,0]=4 12279 B7R1.6 COC[C@@H]1CCN1 Amb22757160 [1,0,0,1,0,0|2,0,0]=4 12280 B7R1.6 COC[C@@H]1CCN1 Amb23440214 [1,0,0,1,0,0|2,0,0]=4 12281 B7R1.6 COC[C@H]1CCN1 Amb25808228 [1,0,0,1,0,0|2,0,0]=4 12282 B7R1.6 CONC1CCC1 Amb22897036 [1,0,0,1,0,0|2,0,0]=4 12283 B7R1.6 CSCC1CCC1 Amb24613430 [1,0,0,1,0,0|1,0,0]=3 12284 B7R1.6 CSCC1CNC1 Amb25313820 [1,0,0,1,0,0|2,0,0]=4 12285 B7R1.6 ClCCC1COC1 Amb25769308 [1,0,0,1,0,0|2,0,0]=4 12286 B7R1.6 ICCC1CCC1 Amb25291483 [1,0,0,1,0,0|1,0,1]=4 12287 B7R1.6 ICCC1COC1 Amb25207110 [1,0,0,1,0,0|2,0,0]=4 12288 B7R1.6 NCCC1CCC1 Amb19516795 [1,0,0,1,0,0|1,0,1]=4 12289 B7R1.6 NCCC1CCC1 Amb20667967 [1,0,0,1,0,0|1,0,1]=4 12290 B7R1.6 NCCC1COC1 Amb21864698 [1,0,0,1,0,0|2,0,0]=4 12291 B7R1.6 NCCC1COC1 Amb22896746 [1,0,0,1,0,0|2,0,0]=4 12292 B7R1.6 NNCC1CCC1 Amb19893039 [1,0,0,1,0,0|2,0,0]=4 12293 B7R1.6 NOCC1CCC1 Amb22896602 [1,0,0,1,0,0|2,0,0]=4 12294 B7R1.6 O=CCC1CCC1 Amb22002603 [1,0,0,1,0,0|0,0,0]=2 12295 B7R1.6 O=CCC1COC1 Amb23440119 [1,0,0,1,0,0|1,0,0]=3 12296 B7R1.6 O=CCN1CCC1 Amb25831216 [1,0,0,1,0,0|1,0,0]=3 12297 B7R1.6 O=CNC1CCC1 Amb22295895 [1,0,0,1,0,0|1,0,0]=3 12298 B7R1.6 OCCC1CC=C1 Amb25271839 [1,0,0,1,0,0|1,0,1]=4 12299 B7R1.6 OCCC1CCC1 Amb22371147 [1,0,0,1,0,0|0,0,2]=4 12300 B7R1.6 OCCC1CNC1 Amb22737370 [1,0,0,1,0,0|2,0,0]=4 12301 B7R1.6 OCCC1COC1 Amb20671348 [1,0,0,1,0,0|2,0,0]=4 12302 B7R1.6 OCCC1CSC1 Amb24574115 [1,0,0,1,0,0|2,0,0]=4 12303 B7R1.6 SCCC1CCC1 Amb24581445 [1,0,0,1,0,0|0,1,1]=4 12304 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|1,0,1]=4 12305 B7R1.8 CC1CCC1CN Amb23512778 [1,0,0,1,0,0|1,0,1]=4 12306 B7R1.8 CC1CCC1CO Amb23512661 [1,0,0,1,0,0|0,0,2]=4 12307 B7R1.8 CC1CCC1NC Amb25790859 [1,0,0,1,0,0|1,0,0]=3 12308 B7R1.8 CC1COC1CC Amb25024514 [1,0,0,1,0,0|1,0,1]=4 12309 B7R1.8 CCC1OCC1=O Amb23456089 [1,0,0,1,0,0|1,0,0]=3 12310 B7R1.8 CN1CCC1CN Amb25108789 [1,0,0,1,0,0|2,0,0]=4 12311 B7R1.8 CN1CC[C@@H]1CN Amb25701112 [1,0,0,1,0,0|2,0,0]=4 12312 B7R1.8 CN1CC[C@@H]1CO Amb23401423 [1,0,0,1,0,0|2,0,0]=4 12313 B7R1.8 CN1CC[C@H]1CN Amb25216747 [1,0,0,1,0,0|2,0,0]=4 12314 B7R1.8 CNC1CCC1O Amb24741053 [1,0,0,1,0,0|2,0,0]=4 12315 B7R1.8 CN[C@@H]1CC[C@H]1O Amb25224473 [1,0,0,1,0,0|2,0,0]=4 12316 B7R1.8 COC1CCC1=O Amb22896543 [1,0,0,1,0,0|1,0,0]=3 12317 B7R1.8 CO[C@@H]1CC[C@H]1N Amb25026007 [1,0,0,1,0,0|2,0,0]=4 12318 B7R1.8 CSC1CCC1N Amb25743480 [1,0,0,1,0,0|2,0,0]=4 12319 B7R1.8 C[C@@H]1CC[C@@H]1CCl Amb24514841 [1,0,0,1,0,0|1,0,1]=4 12320 B7R1.8 C[C@@H]1CC[C@H]1CO Amb24520389 [1,0,0,1,0,0|0,0,2]=4 12321 B7R1.8 C[C@H]1CC[C@H]1C=O Amb25373249 [1,0,0,1,0,0|0,0,0]=2 12322 B7R1.8 C[C@H]1CC[C@H]1CI Amb24519631 [1,0,0,1,0,0|1,0,1]=4 12323 B7R1.8 C\C=C/1\CCC1=O Amb24512730 [1,0,0,1,0,0|0,0,2]=4 12324 B7R1.8 C\C=C\1/CCC1=O Amb24576011 [1,0,0,1,0,0|0,0,2]=4 12325 B7R1.8 N#CC1CCC1=O Amb25691967 [1,0,0,1,0,0|1,0,1]=4 12326 B7R1.8 O=C1CCC1CBr Amb24633095 [1,0,0,1,0,0|1,0,0]=3 12327 B7R1.8 OCC1CCC1=O Amb24722181 [1,0,0,1,0,0|1,0,0]=3 12328 B7R1.8 OC[C@H]1NCC1=O Amb25313229 [1,0,0,1,0,0|2,0,0]=4 12329 B7R1.9 C=CC1CC1C=O Amb25706757 [1,0,0,1,0,0|0,0,2]=4 12330 B7R1.9 C=CC1CC1CBr Amb25274052 [1,0,0,1,0,0|1,0,1]=4 12331 B7R1.9 C=C[C@@H]1C[C@H]1C=O Amb24550243 [1,0,0,1,0,0|0,0,2]=4 12332 B7R1.9 C=C[C@H]1C[C@@H]1C=O Amb24713815 [1,0,0,1,0,0|0,0,2]=4 12333 B7R1.9 C=C[C@H]1C[C@@H]1CO Amb25176489 [1,0,0,1,0,0|1,0,1]=4 12334 B7R1.9 C=C[C@H]1C[C@H]1C=O Amb24670531 [1,0,0,1,0,0|0,0,2]=4 12335 B7R1.9 C=C[C@H]1C[C@H]1CO Amb24519860 [1,0,0,1,0,0|1,0,1]=4 12336 B7R1.9 CCC1CC1C=O Amb24435958 [1,0,0,1,0,0|0,0,0]=2 12337 B7R1.9 CCC1CC1CCl Amb25278342 [1,0,0,1,0,0|1,0,1]=4 12338 B7R1.9 CCC1CC1CN Amb18963643 [1,0,0,1,0,0|1,0,1]=4 12339 B7R1.9 CCC1CC1NC Amb24480727 [1,0,0,1,0,0|1,0,0]=3 12340 B7R1.9 CCC1OC1C=O Amb25292367 [1,0,0,1,0,0|1,0,0]=3 12341 B7R1.9 CC[C@@H]1C[C@@H]1CO Amb24519658 [1,0,0,1,0,0|0,0,2]=4 12342 B7R1.9 CC[C@@H]1C[C@H]1C=O Amb24603090 [1,0,0,1,0,0|0,0,0]=2 12343 B7R1.9 CC[C@@H]1C[C@H]1CBr Amb24545997 [1,0,0,1,0,0|1,0,1]=4 12344 B7R1.9 CC[C@@H]1C[C@H]1CO Amb24586149 [1,0,0,1,0,0|0,0,2]=4 12345 B7R1.9 CC[C@H]1C[C@@H]1CO Amb25215336 [1,0,0,1,0,0|0,0,2]=4 12346 B7R1.9 CC[C@H]1C[C@H]1C=O Amb25366612 [1,0,0,1,0,0|0,0,0]=2 12347 B7R1.9 CC[C@H]1O[C@@H]1C=O Amb24627851 [1,0,0,1,0,0|1,0,0]=3 12348 B7R1.9 CN[C@@H]1C[C@@H]1CO Amb24551057 [1,0,0,1,0,0|2,0,0]=4 12349 B7R1.9 N#CC1CC1C=O Amb24378434 [1,0,0,1,0,0|1,0,1]=4 12350 B7R1.9 O=CC1CC1CBr Amb25087452 [1,0,0,1,0,0|1,0,0]=3 12351 B7R1.9 O=C[C@@H]1C[C@@H]1C=O Amb25349499 [1,0,0,1,0,0|1,0,1]=4 12352 B7R1.9 O=C[C@@H]1C[C@H]1C=O Amb25179869 [1,0,0,1,0,0|1,0,1]=4 12353 B7R1.9 OCC1CC1C=O Amb25726392 [1,0,0,1,0,0|1,0,0]=3 12354 B7R1.24 C1C=CCCCN1 Amb25104535 [1,0,0,1,0,0|1,0,1]=4 12355 B7R1.24 C1C=CCCCO1 Amb22490272 [1,0,0,1,0,0|1,0,1]=4 12356 B7R1.24 C1C=NCCCN1 Amb24760906 [1,0,0,1,0,0|2,0,0]=4 12357 B7R1.24 C1CC=CCCN1 Amb22169408 [1,0,0,1,0,0|1,0,1]=4 12358 B7R1.24 C1CC=CCCN1 Amb24530335 [1,0,0,1,0,0|1,0,1]=4 12359 B7R1.24 C1CC=CCCO1 Amb22490271 [1,0,0,1,0,0|1,0,1]=4 12360 B7R1.24 C1CCCCCO1 Amb22045221 [1,0,0,1,0,0|1,0,0]=3 12361 B7R1.24 C1CCCCNN1 Amb18061998 [1,0,0,1,0,0|2,0,0]=4 12362 B7R1.24 C1CCCCON1 Amb25025475 [1,0,0,1,0,0|1,0,1]=4 12363 B7R1.24 C1CCCCSC1 Amb17620604 [1,0,0,1,0,0|1,0,0]=3 12364 B7R1.24 C1CCCC[NH2+]C1 Amb10552679 [1,0,0,1,0,0|1,0,0]=3 12365 B7R1.24 C1CCCN=CN1 Amb24480900 [1,0,0,1,0,0|2,0,0]=4 12366 B7R1.24 C1CCOCCN1 Amb19889085 [1,0,0,1,0,0|2,0,0]=4 12367 B7R1.24 C1CNCCSC1 Amb13951191 [1,0,0,1,0,0|2,0,0]=4 12368 B7R1.24 C1NCCCCN1 Amb24426822 [1,0,0,1,0,0|2,0,0]=4 12369 B7R1.24 C1OCCCCO1 Amb22731870 [1,0,0,1,0,0|2,0,0]=4 12370 B7R1.24 C1SCCCCS1 Amb22227736 [1,0,0,1,0,0|2,0,0]=4 12371 B9R1.7 C#CCC1CC(=O)CC1 Amb25343081 [0,1,0,1,0,0|0,0,1]=3 12372 B9R1.7 C#CCC1CCC(=O)N1 Amb25742847 [0,1,0,1,0,0|1,0,1]=4 12373 B9R1.7 C(C#N)C1CCC(=O)N1 Amb2372618 [0,1,0,1,0,0|1,0,1]=4 12374 B9R1.7 C=C1CC(CCO)CC1 Amb24575578 [0,1,0,1,0,0|1,0,0]=3 12375 B9R1.7 C=CCC1CCC(=O)N1 Amb25090368 [0,1,0,1,0,0|1,0,1]=4 12376 B9R1.7 C=CCC1CNC(=O)C1 Amb25694415 [0,1,0,1,0,0|0,0,2]=4 12377 B9R1.7 C=CC[C@@H]1CC(=O)CC1 Amb25358940 [0,1,0,1,0,0|0,0,1]=3 12378 B9R1.7 C=CC[C@H]1CC(=O)CC1 Amb24613923 [0,1,0,1,0,0|0,0,1]=3 12379 B9R1.7 CC1CCC(C1)NCC Amb24706042 [0,1,0,1,0,0|1,0,1]=4 12380 B9R1.7 CC1CCC(CCCl)O1 Amb25130051 [0,1,0,1,0,0|0,0,2]=4 12381 B9R1.7 CC1CCC(CCN)N1 Amb23560219 [0,1,0,1,0,0|1,0,1]=4 12382 B9R1.7 CC1CCC(CCN)O1 Amb25107033 [0,1,0,1,0,0|0,0,2]=4 12383 B9R1.7 CC1CCC(CCO)N1 Amb25195208 [0,1,0,1,0,0|1,0,1]=4 12384 B9R1.7 CC1CCC(CCO)O1 Amb24420913 [0,1,0,1,0,0|0,0,2]=4 12385 B9R1.7 CC1CCC(CNC)O1 Amb18642726 [0,1,0,1,0,0|0,0,2]=4 12386 B9R1.7 CC1CC[C@H](COC)N1 Amb24401447 [0,1,0,1,0,0|1,0,1]=4 12387 B9R1.7 CC1CNC(C1)CCC Amb24474040 [0,1,0,1,0,0|1,0,1]=4 12388 B9R1.7 CC1CSC(CCC)N1 Amb25350086 [0,1,0,1,0,0|1,0,1]=4 12389 B9R1.7 CCCC1=CCC(=O)N1 Amb25714570 [0,1,0,1,0,0|1,0,1]=4 12390 B9R1.7 CCCC1=CCC(=O)S1 Amb25239434 [0,1,0,1,0,0|1,0,1]=4 12391 B9R1.7 CCCC1=NC(=O)CS1 Amb24482012 [0,1,0,1,0,0|1,0,1]=4 12392 B9R1.7 CCCC1C=CC(=O)O1 Amb25793308 [0,1,0,1,0,0|1,0,1]=4 12393 B9R1.7 CCCC1C=CC(=O)S1 Amb25274697 [0,1,0,1,0,0|1,0,1]=4 12394 B9R1.7 CCCC1CC(=O)C=C1 Amb25768578 [0,1,0,1,0,0|0,0,1]=3 12395 B9R1.7 CCCC1CC(=O)CC1 Amb24087435 [0,1,0,1,0,0|0,0,0]=2 12396 B9R1.7 CCCC1CC(O)CN1 Amb24428583 [0,1,0,1,0,0|0,0,2]=4 12397 B9R1.7 CCCC1CCC(=O)N1 Amb17940083 [0,1,0,1,0,0|1,0,0]=3 12398 B9R1.7 CCCC1CCC(=S)N1 Amb17673620 [0,1,0,1,0,0|1,1,0]=4 12399 B9R1.7 CCCC1CCC(Br)C1 Amb25115513 [0,1,0,1,0,0|1,0,1]=4 12400 B9R1.7 CCCC1CCC(O)C1 Amb24554977 [0,1,0,1,0,0|0,0,2]=4 12401 B9R1.7 CCCC1CN(N)CC1 Amb25189011 [0,1,0,1,0,0|2,0,0]=4 12402 B9R1.7 CCCC1CNC(=N)C1 Amb24410446 [0,1,0,1,0,0|1,0,0]=3 12403 B9R1.7 CCCC1CNC(=O)C1 Amb16186658 [0,1,0,1,0,0|0,0,0]=2 12404 B9R1.7 CCCC1CNC(N)=N1 Amb24481961 [0,1,0,1,0,0|2,0,0]=4 12405 B9R1.7 CCCC1COC(N)=N1 Amb24750095 [0,1,0,1,0,0|2,0,0]=4 12406 B9R1.7 CCCC=1CC(=O)ON1 Amb24581199 [0,1,0,1,0,0|1,0,1]=4 12407 B9R1.7 CCCC=1CCC(=O)C1 Amb25337676 [0,1,0,1,0,0|0,0,1]=3 12408 B9R1.7 CCCC=1NCC(=O)N1 Amb24079418 [0,1,0,1,0,0|1,0,1]=4 12409 B9R1.7 CCCN1CC(Cl)CC1 Amb25185358 [0,1,0,1,0,0|1,0,1]=4 12410 B9R1.7 CCCN1CCC(=O)N1 Amb24062255 [0,1,0,1,0,0|1,0,0]=3 12411 B9R1.7 CCCN1CCC(N)=N1 Amb25095673 [0,1,0,1,0,0|2,0,0]=4 12412 B9R1.7 CCCN1C[C@H](O)CC1 Amb24396613 [0,1,0,1,0,0|0,0,2]=4 12413 B9R1.7 CCC[C@@H]1CC(=O)CC1 Amb25802135 [0,1,0,1,0,0|0,0,0]=2 12414 B9R1.7 CCC[C@@H]1CCC(=O)N1 Amb25824143 [0,1,0,1,0,0|1,0,0]=3 12415 B9R1.7 CCC[C@@H]1CC[C@H](N1)C Amb10569094 [0,1,0,1,0,0|1,0,1]=4 12416 B9R1.7 CCC[C@H]1CC(=O)C=C1 Amb24620152 [0,1,0,1,0,0|0,0,1]=3 12417 B9R1.7 CCC[C@H]1CC(=O)CC1 Amb25298534 [0,1,0,1,0,0|0,0,0]=2 12418 B9R1.7 CCC[C@H]1CCC(=O)N1 Amb24477475 [0,1,0,1,0,0|1,0,0]=3 12419 B9R1.7 CCC[C@H]1CNC(=O)C1 Amb25146172 [0,1,0,1,0,0|0,0,0]=2 12420 B9R1.7 CCC[C@H]1CNC(=O)S1 Amb25698617 [0,1,0,1,0,0|1,0,0]=3 12421 B9R1.7 CCN[C@@H]1CN(C)CC1 Amb22230700 [0,1,0,1,0,0|2,0,0]=4 12422 B9R1.7 CCN[C@H]1CN(C)CC1 Amb22230643 [0,1,0,1,0,0|2,0,0]=4 12423 B9R1.7 CCOC1CCC(=O)O1 Amb24117269 [0,1,0,1,0,0|1,0,0]=3 12424 B9R1.7 CCOC1CCC(O)C1 Amb24642566 [0,1,0,1,0,0|0,0,2]=4 12425 B9R1.7 CCOC1OC(=O)CS1 Amb24373299 [0,1,0,1,0,0|2,0,0]=4 12426 B9R1.7 CCOC=1CCC(=O)C1 Amb21984008 [0,1,0,1,0,0|0,0,2]=4 12427 B9R1.7 CCO[C@@H]1CC[C@H](O)C1 Amb25175111 [0,1,0,1,0,0|0,0,2]=4 12428 B9R1.7 CCSC1CCC(N)C1 Amb19148312 [0,1,0,1,0,0|1,0,1]=4 12429 B9R1.7 CN1CC(CCBr)CC1 Amb25702136 [0,1,0,1,0,0|2,0,0]=4 12430 B9R1.7 CN1CC(CCCl)CC1 Amb22228950 [0,1,0,1,0,0|2,0,0]=4 12431 B9R1.7 CN1CC(CCO)CC1 Amb22585688 [0,1,0,1,0,0|2,0,0]=4 12432 B9R1.7 CN1CCC(CCO)O1 Amb25236560 [0,1,0,1,0,0|1,0,1]=4 12433 B9R1.7 CNCC1CCC(=O)N1 Amb2372617 [0,1,0,1,0,0|1,0,0]=3 12434 B9R1.7 CNCC1CCC(F)C1 Amb25744972 [0,1,0,1,0,0|1,0,1]=4 12435 B9R1.7 CNCC1CN(C)CC1 Amb20671399 [0,1,0,1,0,0|2,0,0]=4 12436 B9R1.7 CNCC1CNC(=O)O1 Amb17506101 [0,1,0,1,0,0|2,0,0]=4 12437 B9R1.7 CNCC1COC(=O)N1 Amb25115897 [0,1,0,1,0,0|2,0,0]=4 12438 B9R1.7 CNCC1ON=C(C1)C Amb10249072 [0,1,0,1,0,0|1,0,1]=4 12439 B9R1.7 CNC[C@H]1CNC(=O)O1 Amb25199568 [0,1,0,1,0,0|2,0,0]=4 12440 B9R1.7 COCC1CCC(=O)N1 Amb24713685 [0,1,0,1,0,0|1,0,0]=3 12441 B9R1.7 COCC1CCC(C)=N1 Amb24423945 [0,1,0,1,0,0|1,0,0]=3 12442 B9R1.7 COCC1CCC(N)=N1 Amb24558671 [0,1,0,1,0,0|2,0,0]=4 12443 B9R1.7 COCC1CCC(N)C1 Amb25683802 [0,1,0,1,0,0|1,0,1]=4 12444 B9R1.7 COCC1CCC(O)C1 Amb25692823 [0,1,0,1,0,0|0,0,2]=4 12445 B9R1.7 COCC1CNC(=O)C1 Amb25693762 [0,1,0,1,0,0|1,0,0]=3 12446 B9R1.7 COC[C@@H]1CCC(=O)N1 Amb25145589 [0,1,0,1,0,0|1,0,0]=3 12447 B9R1.7 COC[C@@H]1CCC(C)=N1 Amb24368110 [0,1,0,1,0,0|1,0,0]=3 12448 B9R1.7 COC[C@@H]1CNC(=O)O1 Amb22746095 [0,1,0,1,0,0|2,0,0]=4 12449 B9R1.7 COC[C@@H]1COC(=O)N1 Amb24381462 [0,1,0,1,0,0|2,0,0]=4 12450 B9R1.7 COC[C@@H]1COC(=O)O1 Amb22366849 [0,1,0,1,0,0|2,0,0]=4 12451 B9R1.7 COC[C@H]1CNC(=O)O1 Amb22225377 [0,1,0,1,0,0|2,0,0]=4 12452 B9R1.7 COC[C@H]1COC(=O)O1 Amb22226690 [0,1,0,1,0,0|2,0,0]=4 12453 B9R1.7 CSCC1COC(=O)N1 Amb25304404 [0,1,0,1,0,0|2,0,0]=4 12454 B9R1.7 C[C@@H]1CC[C@@H](CCC)N1 Amb24674087 [0,1,0,1,0,0|1,0,1]=4 12455 B9R1.7 C[C@@H]1CC[C@H](CCO)O1 Amb25358333 [0,1,0,1,0,0|0,0,2]=4 12456 B9R1.7 C[C@@H]1CC[C@H](COC)N1 Amb25305372 [0,1,0,1,0,0|1,0,1]=4 12457 B9R1.7 C[C@H]1CC[C@@H](CSC)N1 Amb24573697 [0,1,0,1,0,0|1,0,1]=4 12458 B9R1.7 C[C@H]1CC[C@H](CCO)O1 Amb25238048 [0,1,0,1,0,0|0,0,2]=4 12459 B9R1.7 C[C@H]1CC[C@H](COC)N1 Amb25187990 [0,1,0,1,0,0|1,0,1]=4 12460 B9R1.7 C\C=C/[C@@H]1CCC(=O)C1 Amb25319155 [0,1,0,1,0,0|0,0,1]=3 12461 B9R1.7 C\C=C/[C@H]1CCC(=O)C1 Amb24646663 [0,1,0,1,0,0|0,0,1]=3 12462 B9R1.7 C\C=C\C1CNC(=O)C1 Amb25278424 [0,1,0,1,0,0|0,0,2]=4 12463 B9R1.7 N#CCC1CC(=O)CC1 Amb25091467 [0,1,0,1,0,0|0,0,1]=3 12464 B9R1.7 N#CCC1CCC(=O)O1 Amb25270224 [0,1,0,1,0,0|1,0,1]=4 12465 B9R1.7 N#CC[C@@H]1CC(=O)CC1 Amb24447318 [0,1,0,1,0,0|0,0,1]=3 12466 B9R1.7 N#CC[C@@H]1CCC(=O)N1 Amb23385242 [0,1,0,1,0,0|1,0,1]=4 12467 B9R1.7 N#CC[C@H]1CCC(=O)N1 Amb23385279 [0,1,0,1,0,0|1,0,1]=4 12468 B9R1.7 NC1CC(CC1)CCF Amb25202354 [0,1,0,1,0,0|1,0,1]=4 12469 B9R1.7 NCCC1CC(=O)CC1 Amb24409510 [0,1,0,1,0,0|0,0,0]=2 12470 B9R1.7 NCCC1CCC(=O)N1 Amb18832609 [0,1,0,1,0,0|1,0,0]=3 12471 B9R1.7 NCCC1CCC(=O)O1 Amb25146052 [0,1,0,1,0,0|1,0,0]=3 12472 B9R1.7 NCCC1CNC(=O)C1 Amb18832612 [0,1,0,1,0,0|1,0,0]=3 12473 B9R1.7 NCCC1COC(=O)N1 Amb24732121 [0,1,0,1,0,0|2,0,0]=4 12474 B9R1.7 NCCC1COC(=O)O1 Amb24746673 [0,1,0,1,0,0|2,0,0]=4 12475 B9R1.7 NCCN1CCC(=O)N1 Amb24741988 [0,1,0,1,0,0|2,0,0]=4 12476 B9R1.7 NCC[C@@H]1CC[C@@H](O)C1 Amb17933186 [0,1,0,1,0,0|0,0,2]=4 12477 B9R1.7 NCC[C@@H]1CC[C@H](O)C1 Amb17933187 [0,1,0,1,0,0|0,0,2]=4 12478 B9R1.7 NCC[C@H]1CCC(=O)N1 Amb24616850 [0,1,0,1,0,0|1,0,0]=3 12479 B9R1.7 NOCC1CCC(=O)N1 Amb25115375 [0,1,0,1,0,0|2,0,0]=4 12480 B9R1.7 O=C1CCC(CCBr)N1 Amb25059535 [0,1,0,1,0,0|1,0,0]=3 12481 B9R1.7 O=C1CCC(CCCl)O1 Amb24459566 [0,1,0,1,0,0|1,0,0]=3 12482 B9R1.7 O=C1CN(CCF)CC1 Amb24685571 [0,1,0,1,0,0|1,0,0]=3 12483 B9R1.7 O=C1NCC(CCCl)O1 Amb25145966 [0,1,0,1,0,0|2,0,0]=4 12484 B9R1.7 O=CCC1CC(=O)CC1 Amb18642410 [0,1,0,1,0,0|0,0,1]=3 12485 B9R1.7 O=CCC1COC(=O)C1 Amb24633507 [0,1,0,1,0,0|1,0,1]=4 12486 B9R1.7 OCCC1CC(=O)CC1 Amb24467811 [0,1,0,1,0,0|0,0,0]=2 12487 B9R1.7 OCCC1CC(=O)CN1 Amb24574037 [0,1,0,1,0,0|1,0,0]=3 12488 B9R1.7 OCCC1CC(=O)NN1 Amb24070734 [0,1,0,1,0,0|2,0,0]=4 12489 B9R1.7 OCCC1CCC(=O)O1 Amb25188957 [0,1,0,1,0,0|1,0,0]=3 12490 B9R1.7 OCCC1CNC(=O)C1 Amb23598230 [0,1,0,1,0,0|1,0,0]=3 12491 B9R1.7 OCCC1CNC(=O)O1 Amb24604919 [0,1,0,1,0,0|2,0,0]=4 12492 B9R1.7 OCCC1COC(=O)C1 Amb24577239 [0,1,0,1,0,0|1,0,0]=3 12493 B9R1.7 OCCC1COC(=O)N1 Amb24477775 [0,1,0,1,0,0|2,0,0]=4 12494 B9R1.7 OCCC=1CCC(=O)C1 Amb25773413 [0,1,0,1,0,0|0,0,2]=4 12495 B9R1.7 OCC[C@@H]1CC(=O)CC1 Amb24750224 [0,1,0,1,0,0|0,0,0]=2 12496 B9R1.7 OCC[C@@H]1CCC(=O)N1 Amb24761403 [0,1,0,1,0,0|1,0,0]=3 12497 B9R1.7 OCC[C@@H]1CNC(=O)O1 Amb25340109 [0,1,0,1,0,0|2,0,0]=4 12498 B9R1.7 OCC[C@@H]1COC(=O)N1 Amb25354215 [0,1,0,1,0,0|2,0,0]=4 12499 B9R1.7 OCC[C@H]1CCC(=O)O1 Amb24397212 [0,1,0,1,0,0|1,0,0]=3 12500 B9R1.7 OCC[C@H]1COC(=O)C1 Amb25740657 [0,1,0,1,0,0|1,0,0]=3 12501 B9R1.7 OCC[C@H]1COC(=O)N1 Amb24649331 [0,1,0,1,0,0|2,0,0]=4 12502 B9R1.7 O[C@@H]1CC[C@H](C1)CCO Amb24719687 [0,1,0,1,0,0|0,0,2]=4 12503 B9R1.13 BrC(=C)CN1CCCC1 Amb1790909 [0,1,0,1,0,0|1,0,1]=4 12504 B9R1.13 C=C(Cl)CN1CCCC1 Amb25690490 [0,1,0,1,0,0|1,0,1]=4 12505 B9R1.13 CC(=C)CC1CCCC1 Amb22052678 [0,1,0,1,0,0|1,0,0]=3 12506 B9R1.13 CC(=C)CC1CCCN1 Amb25162820 [0,1,0,1,0,0|1,0,0]=3 12507 B9R1.13 CC(=C)CC1NCCS1 Amb25146179 [0,1,0,1,0,0|2,0,0]=4 12508 B9R1.13 CC(=C)CC=1CCCC1 Amb25243894 [0,1,0,1,0,0|1,0,1]=4 12509 B9R1.13 CC(=C)CN1CCCC1 Amb25761635 [0,1,0,1,0,0|1,0,0]=3 12510 B9R1.13 CC(=CN1CCCC1)C Amb15693470 [0,1,0,1,0,0|1,0,1]=4 12511 B9R1.13 CC(=O)CC1=CCCO1 Amb24583510 [0,1,0,1,0,0|0,0,2]=4 12512 B9R1.13 CC(=O)CC1=NCCO1 Amb24064239 [0,1,0,1,0,0|1,0,1]=4 12513 B9R1.13 CC(=O)CC1=NCCS1 Amb25736747 [0,1,0,1,0,0|1,0,1]=4 12514 B9R1.13 CC(=O)CC1CC=CC1 Amb25337514 [0,1,0,1,0,0|0,0,1]=3 12515 B9R1.13 CC(=O)CC1CCCN1 Amb24064067 [0,1,0,1,0,0|0,0,0]=2 12516 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [0,1,0,1,0,0|0,0,0]=2 12517 B9R1.13 CC(=O)CC1COCC1 Amb20622791 [0,1,0,1,0,0|0,0,0]=2 12518 B9R1.13 CC(=O)CC1OCCO1 Amb22359800 [0,1,0,1,0,0|1,0,0]=3 12519 B9R1.13 CC(=O)CC=1CCCN1 Amb24659155 [0,1,0,1,0,0|0,0,1]=3 12520 B9R1.13 CC(=O)C[C@@H]1CCC=C1 Amb25358818 [0,1,0,1,0,0|0,0,1]=3 12521 B9R1.13 CC(=O)C[C@@H]1CCCN1 Amb24709255 [0,1,0,1,0,0|0,0,0]=2 12522 B9R1.13 CC(=O)C[C@H]1CCC=C1 Amb24380779 [0,1,0,1,0,0|0,0,1]=3 12523 B9R1.13 CC(=O)C[C@H]1CCCO1 Amb24752778 [0,1,0,1,0,0|0,0,0]=2 12524 B9R1.13 CC(=O)NC1CCC=C1 Amb25146151 [0,1,0,1,0,0|0,0,2]=4 12525 B9R1.13 CC(=O)NC1COCC1 Amb25185374 [0,1,0,1,0,0|1,0,0]=3 12526 B9R1.13 CC(=O)NN1CCCC1 Amb25730851 [0,1,0,1,0,0|1,0,0]=3 12527 B9R1.13 CC(=O)N[C@@H]1CCCN1 Amb25848370 [0,1,0,1,0,0|1,0,0]=3 12528 B9R1.13 CC(=O)N[C@@H]1CNCC1 Amb22744974 [0,1,0,1,0,0|1,0,0]=3 12529 B9R1.13 CC(=O)N[C@H]1CCC=C1 Amb25739070 [0,1,0,1,0,0|0,0,2]=4 12530 B9R1.13 CC(=O)N[C@H]1CNCC1 Amb10067002 [0,1,0,1,0,0|1,0,0]=3 12531 B9R1.13 CC(=O)OC1CCC=C1 Amb24532884 [0,1,0,1,0,0|0,0,2]=4 12532 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [0,1,0,1,0,0|1,0,0]=3 12533 B9R1.13 CC(=O)OC1CCCS1 Amb24402377 [0,1,0,1,0,0|1,0,0]=3 12534 B9R1.13 CC(=O)OC1CNCC1 Amb21956160 [0,1,0,1,0,0|1,0,0]=3 12535 B9R1.13 CC(=O)OC1CNCC1 Amb22011811 [0,1,0,1,0,0|1,0,0]=3 12536 B9R1.13 CC(=O)OC1COCC1 Amb25052014 [0,1,0,1,0,0|1,0,0]=3 12537 B9R1.13 CC(=O)O[C@@H]1CONC1 Amb24473930 [0,1,0,1,0,0|2,0,0]=4 12538 B9R1.13 CC(=O)SC1CCCC1 Amb22337902 [0,1,0,1,0,0|0,0,0]=2 12539 B9R1.13 CC(=O)SC1CNCC1 Amb25146202 [0,1,0,1,0,0|1,0,0]=3 12540 B9R1.13 CC(=O)SC1COCC1 Amb13892074 [0,1,0,1,0,0|1,0,0]=3 12541 B9R1.13 CC(=O)\C=C/1\CCCN1 Amb17593301 [0,1,0,1,0,0|0,0,2]=4 12542 B9R1.13 CC(=O)\C=C/1\CCCO1 Amb25241353 [0,1,0,1,0,0|0,0,2]=4 12543 B9R1.13 CC(Br)CC1CCCC1 Amb24693833 [0,1,0,1,0,0|1,0,1]=4 12544 B9R1.13 CC(Br)CC1CCCN1 Amb25306699 [0,1,0,1,0,0|1,0,1]=4 12545 B9R1.13 CC(C)=C[C@@H]1CCCN1 Amb25835184 [0,1,0,1,0,0|1,0,1]=4 12546 B9R1.13 CC(C)CC1CCCC1 Amb22230763 [0,1,0,1,0,0|1,0,1]=4 12547 B9R1.13 CC(C)CC1CCCN1 Amb17659147 [0,1,0,1,0,0|1,0,1]=4 12548 B9R1.13 CC(C)C[C@@H]1CCCN1 Amb25338158 [0,1,0,1,0,0|1,0,1]=4 12549 B9R1.13 CC(C)C[C@H]1CCCN1 Amb25757364 [0,1,0,1,0,0|1,0,1]=4 12550 B9R1.13 CC(CC1CCCN1)C Amb10068751 [0,1,0,1,0,0|1,0,1]=4 12551 B9R1.13 CC(CC1CCCN1)C Amb2234647 [0,1,0,1,0,0|1,0,1]=4 12552 B9R1.13 CC(CC1CCCO1)N Amb13952622 [0,1,0,1,0,0|1,0,1]=4 12553 B9R1.13 CC(CC1CNCC1)C Amb10607826 [0,1,0,1,0,0|1,0,1]=4 12554 B9R1.13 CC(CN1CCCC1)C Amb17231850 [0,1,0,1,0,0|1,0,1]=4 12555 B9R1.13 CC(CN1CCCC1)N Amb1099344 [0,1,0,1,0,0|1,0,1]=4 12556 B9R1.13 CC(Cl)CC1CCCC1 Amb25205158 [0,1,0,1,0,0|1,0,1]=4 12557 B9R1.13 CC(N)CC1CCCC1 Amb18962767 [0,1,0,1,0,0|1,0,1]=4 12558 B9R1.13 CC(N)CC1CCCN1 Amb25770853 [0,1,0,1,0,0|1,0,1]=4 12559 B9R1.13 CC(N)CC1CCNC1 Amb24569495 [0,1,0,1,0,0|1,0,1]=4 12560 B9R1.13 CC(N)CC1CCOC1 Amb18959070 [0,1,0,1,0,0|1,0,1]=4 12561 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,1,0,1,0,0|0,0,2]=4 12562 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,1,0,1,0,0|0,0,2]=4 12563 B9R1.13 CC(O)C[C@@H]1CCCN1 Amb25027963 [0,1,0,1,0,0|0,0,2]=4 12564 B9R1.13 CN(C)CC1CCCN1 Amb19372997 [0,1,0,1,0,0|2,0,0]=4 12565 B9R1.13 CN(C)CC1CCCN1 Amb22491543 [0,1,0,1,0,0|2,0,0]=4 12566 B9R1.13 CN(C)CC1CCCO1 Amb25075157 [0,1,0,1,0,0|2,0,0]=4 12567 B9R1.13 CN(C)CC1CNCC1 Amb20671402 [0,1,0,1,0,0|2,0,0]=4 12568 B9R1.13 CN(C)CC1CNCC1 Amb22728251 [0,1,0,1,0,0|2,0,0]=4 12569 B9R1.13 CN(C)CC1COCC1 Amb25246055 [0,1,0,1,0,0|2,0,0]=4 12570 B9R1.13 CN(C)C[C@@H]1CCCN1 Amb20671401 [0,1,0,1,0,0|2,0,0]=4 12571 B9R1.13 CN(C)C[C@@H]1CCCN1 Amb22230578 [0,1,0,1,0,0|2,0,0]=4 12572 B9R1.13 CN(C)C[C@@H]1CNCC1 Amb25146018 [0,1,0,1,0,0|2,0,0]=4 12573 B9R1.13 CN(CC1CCCC1)C Amb17231852 [0,1,0,1,0,0|2,0,0]=4 12574 B9R1.13 CN(CC1CCCN1)C Amb2237185 [0,1,0,1,0,0|2,0,0]=4 12575 B9R1.13 CN(N)CC1CCCC1 Amb25358257 [0,1,0,1,0,0|2,0,0]=4 12576 B9R1.13 CN(N)CC1CCCO1 Amb24340207 [0,1,0,1,0,0|2,0,0]=4 12577 B9R1.13 CS(=O)CC1CCCN1 Amb25772181 [0,1,0,1,0,0|1,0,0]=3 12578 B9R1.13 CS(=O)NC1CNCC1 Amb24597116 [0,1,0,1,0,0|2,0,0]=4 12579 B9R1.13 CS(=O)N[C@H]1CNCC1 Amb25177105 [0,1,0,1,0,0|2,0,0]=4 12580 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,1,0,1,0,0|1,0,1]=4 12581 B9R1.13 C[C@@H](N)CC1CCOC1 Amb25720103 [0,1,0,1,0,0|1,0,1]=4 12582 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,1,0,1,0,0|0,0,2]=4 12583 B9R1.13 C[C@H](O)C[C@@H]1CCCO1 Amb25176662 [0,1,0,1,0,0|0,0,2]=4 12584 B9R1.13 ClC(=O)CN1CCCC1 Amb17142871 [0,1,0,1,0,0|1,0,0]=3 12585 B9R1.13 ClC(=O)OC1CCCC1 Amb10070029 [0,1,0,1,0,0|1,0,0]=3 12586 B9R1.13 NC(=N)CC1CNCC1 Amb24566322 [0,1,0,1,0,0|2,0,0]=4 12587 B9R1.13 NC(=N)CC1COCC1 Amb25132816 [0,1,0,1,0,0|2,0,0]=4 12588 B9R1.13 NC(=N)CN1CCCC1 Amb10609235 [0,1,0,1,0,0|2,0,0]=4 12589 B9R1.13 NC(=N)NC1CCCC1 Amb17773433 [0,1,0,1,0,0|2,0,0]=4 12590 B9R1.13 NC(=N)NC1CCCC1 Amb22828136 [0,1,0,1,0,0|2,0,0]=4 12591 B9R1.13 NC(=O)C=C1CCCC1 Amb20622621 [0,1,0,1,0,0|1,0,1]=4 12592 B9R1.13 NC(=O)CC1CCC=C1 Amb16233726 [0,1,0,1,0,0|1,0,1]=4 12593 B9R1.13 NC(=O)CC1CCCN1 Amb18282785 [0,1,0,1,0,0|1,0,0]=3 12594 B9R1.13 NC(=O)CC1COCC1 Amb25228942 [0,1,0,1,0,0|1,0,0]=3 12595 B9R1.13 NC(=O)CC1NCCS1 Amb25308974 [0,1,0,1,0,0|2,0,0]=4 12596 B9R1.13 NC(=O)CC=1CCCC1 Amb24384197 [0,1,0,1,0,0|1,0,1]=4 12597 B9R1.13 NC(=O)CN1CCCC1 Amb10671440 [0,1,0,1,0,0|1,0,0]=3 12598 B9R1.13 NC(=O)CN1CCCC1 Amb19387226 [0,1,0,1,0,0|1,0,0]=3 12599 B9R1.13 NC(=O)C[C@@H]1CCCN1 Amb24583408 [0,1,0,1,0,0|1,0,0]=3 12600 B9R1.13 NC(=O)C[C@H]1CNCC1 Amb25724831 [0,1,0,1,0,0|1,0,0]=3 12601 B9R1.13 NC(=O)NC1CCCC1 Amb1151267 [0,1,0,1,0,0|1,0,0]=3 12602 B9R1.13 NC(=O)NC1CSCC1 Amb24612307 [0,1,0,1,0,0|2,0,0]=4 12603 B9R1.13 NC(=O)OC1CNCC1 Amb23598229 [0,1,0,1,0,0|2,0,0]=4 12604 B9R1.13 NC(=O)OC1COCC1 Amb25141917 [0,1,0,1,0,0|2,0,0]=4 12605 B9R1.13 NC(=O)O[C@H]1CNCC1 Amb25267939 [0,1,0,1,0,0|2,0,0]=4 12606 B9R1.13 NC(=S)NC1CCCC1 Amb1105651 [0,1,0,1,0,0|1,1,0]=4 12607 B9R1.13 NC(=S)SC1CCCC1 Amb25147107 [0,1,0,1,0,0|1,1,0]=4 12608 B9R1.13 NC(N)=NC1CCCC1 Amb19338139 [0,1,0,1,0,0|2,0,0]=4 12609 B9R1.13 O=C(Cl)CC1CCC=C1 Amb24754210 [0,1,0,1,0,0|1,0,1]=4 12610 B9R1.13 O=C(Cl)CC1COCC1 Amb22642272 [0,1,0,1,0,0|1,0,0]=3 12611 B9R1.13 O=C(Cl)CN1CCCC1 Amb18364315 [0,1,0,1,0,0|1,0,0]=3 12612 B9R1.13 O=C(Cl)NN1CCCC1 Amb24564632 [0,1,0,1,0,0|2,0,0]=4 12613 B9R1.13 O=C(Cl)OC1CCCO1 Amb24760352 [0,1,0,1,0,0|2,0,0]=4 12614 B9R1.13 O=C(Cl)OC1COCC1 Amb22642258 [0,1,0,1,0,0|2,0,0]=4 12615 B9R1.13 O=C(Cl)O[C@@H]1CCCO1 Amb24638442 [0,1,0,1,0,0|2,0,0]=4 12616 B9R1.13 O=C(F)NC1CCCC1 Amb25711539 [0,1,0,1,0,0|1,0,0]=3 12617 B9R1.13 OC(=O)CC1CC=CC1 Amb25673915 [0,1,0,1,0,0|1,0,1]=4 12618 B9R1.13 OC(=O)CC1CCCC1 Amb16192937 [0,1,0,1,0,0|1,0,0]=3 12619 B9R1.13 OC(=O)CC1CCCN1 Amb20668514 [0,1,0,1,0,0|1,0,0]=3 12620 B9R1.13 OC(=O)CC1CCCO1 Amb1088908 [0,1,0,1,0,0|1,0,0]=3 12621 B9R1.13 OC(=O)CC1CCCS1 Amb18644290 [0,1,0,1,0,0|1,0,0]=3 12622 B9R1.13 OC(=O)CC1CCNO1 Amb25261098 [0,1,0,1,0,0|2,0,0]=4 12623 B9R1.13 OC(=O)CC1CSCC1 Amb18202318 [0,1,0,1,0,0|1,0,0]=3 12624 B9R1.13 OC(=O)CC1NCCS1 Amb18644340 [0,1,0,1,0,0|2,0,0]=4 12625 B9R1.13 OC(=O)CC1OCCO1 Amb22740193 [0,1,0,1,0,0|2,0,0]=4 12626 B9R1.13 OC(=O)CC1SCCS1 Amb25361118 [0,1,0,1,0,0|2,0,0]=4 12627 B9R1.13 OC(=O)CC=1CCCC1 Amb18642404 [0,1,0,1,0,0|1,0,1]=4 12628 B9R1.13 OC(=O)C[C@@H]1CCCN1 Amb13891876 [0,1,0,1,0,0|1,0,0]=3 12629 B9R1.13 OC(=O)C[C@@H]1CCCO1 Amb24271115 [0,1,0,1,0,0|1,0,0]=3 12630 B9R1.13 OC(=O)C[C@@H]1COCC1 Amb23401495 [0,1,0,1,0,0|1,0,0]=3 12631 B9R1.13 OC(=O)C[C@H]1CCC=C1 Amb25378723 [0,1,0,1,0,0|1,0,1]=4 12632 B9R1.13 OC(=O)C[C@H]1CCCN1 Amb16184011 [0,1,0,1,0,0|1,0,0]=3 12633 B9R1.13 OC(=O)C[C@H]1CCCO1 Amb24271109 [0,1,0,1,0,0|1,0,0]=3 12634 B9R1.13 OC(=O)C[C@H]1CNCC1 Amb10067024 [0,1,0,1,0,0|1,0,0]=3 12635 B9R1.13 OC(=O)NN1CCCC1 Amb24082039 [0,1,0,1,0,0|2,0,0]=4 12636 B9R1.13 [O-][N+](=O)CC1CNCC1 Amb18203199 [0,1,0,1,0,0|2,0,0]=4 12637 B9R1.22 C=C1CC(O)C(C1)CO Amb25080201 [0,1,0,1,0,0|2,0,0]=4 12638 B9R1.22 CC1=CC(=O)CC1CC Amb24686502 [0,1,0,1,0,0|0,0,2]=4 12639 B9R1.22 CC1CC(=O)CC1CC Amb25032178 [0,1,0,1,0,0|0,0,0]=2 12640 B9R1.22 CC1CC(=O)CC1OC Amb24364094 [0,1,0,1,0,0|1,0,0]=3 12641 B9R1.22 CC1CC(=O)NC1CC Amb24578188 [0,1,0,1,0,0|1,0,0]=3 12642 B9R1.22 CC1CC(=O)OC1CBr Amb25240937 [0,1,0,1,0,0|2,0,0]=4 12643 B9R1.22 CC1CC(=O)OC1CCl Amb24480344 [0,1,0,1,0,0|2,0,0]=4 12644 B9R1.22 CC1CC(=O)OC1CN Amb25300550 [0,1,0,1,0,0|2,0,0]=4 12645 B9R1.22 CC1CC(=O)O[C@@H]1CN Amb25222804 [0,1,0,1,0,0|2,0,0]=4 12646 B9R1.22 CC1N=C(C)NC1CC Amb25275283 [0,1,0,1,0,0|2,0,0]=4 12647 B9R1.22 CC1N=C(C)SC1CC Amb24716975 [0,1,0,1,0,0|1,1,0]=4 12648 B9R1.22 CC1NC(=N)CC1CC Amb25340640 [0,1,0,1,0,0|2,0,0]=4 12649 B9R1.22 CC1NC(=O)CC1CO Amb24670468 [0,1,0,1,0,0|2,0,0]=4 12650 B9R1.22 CC1NC(=O)OC1CC Amb25679025 [0,1,0,1,0,0|2,0,0]=4 12651 B9R1.22 CC1OC(=O)CC1CO Amb25110752 [0,1,0,1,0,0|2,0,0]=4 12652 B9R1.22 CC1OC(=O)CC1NC Amb24476703 [0,1,0,1,0,0|2,0,0]=4 12653 B9R1.22 CCC1=CC(=O)CC1C Amb24597151 [0,1,0,1,0,0|0,0,2]=4 12654 B9R1.22 CCC1CC(=O)CC1O Amb25237318 [0,1,0,1,0,0|0,0,0]=2 12655 B9R1.22 CCC1CC(=O)NC1=O Amb24117084 [0,1,0,1,0,0|1,0,1]=4 12656 B9R1.22 CCC1CC(=O)NN1C Amb24598970 [0,1,0,1,0,0|2,0,0]=4 12657 B9R1.22 CCC1CC(=O)OC1=O Amb24571652 [0,1,0,1,0,0|1,0,1]=4 12658 B9R1.22 CCC1CN(C)CC1N Amb18203238 [0,1,0,1,0,0|2,0,0]=4 12659 B9R1.22 CCC1NC(=O)CC1=O Amb18203277 [0,1,0,1,0,0|1,0,1]=4 12660 B9R1.22 CCC1OC(=O)CC1O Amb25788884 [0,1,0,1,0,0|1,0,0]=3 12661 B9R1.22 CCN1CC(=O)CC1=O Amb24649940 [0,1,0,1,0,0|1,0,1]=4 12662 B9R1.22 CCN1NC(=O)CC1C Amb24473638 [0,1,0,1,0,0|2,0,0]=4 12663 B9R1.22 CC[C@@H]1CC(=O)C[C@H]1O Amb24534308 [0,1,0,1,0,0|0,0,0]=2 12664 B9R1.22 CC[C@@H]1NC(=O)C[C@@H]1N Amb25240439 [0,1,0,1,0,0|1,0,0]=3 12665 B9R1.22 CC[C@@H]1NC(=O)C[C@@H]1O Amb25258693 [0,1,0,1,0,0|1,0,0]=3 12666 B9R1.22 CC[C@@H]1NC(=O)C[C@H]1O Amb24513054 [0,1,0,1,0,0|1,0,0]=3 12667 B9R1.22 CC[C@@H]1OC(=O)C[C@H]1Br Amb25362262 [0,1,0,1,0,0|1,0,0]=3 12668 B9R1.22 CC[C@H]1CC(=O)C[C@H]1O Amb24575930 [0,1,0,1,0,0|0,0,0]=2 12669 B9R1.22 CC[C@H]1CC(=O)NC1=O Amb24606518 [0,1,0,1,0,0|1,0,1]=4 12670 B9R1.22 CC[C@H]1CC(=O)OC1O Amb25725427 [0,1,0,1,0,0|1,0,0]=3 12671 B9R1.22 CC[C@H]1NC(=O)C[C@@H]1O Amb24374772 [0,1,0,1,0,0|1,0,0]=3 12672 B9R1.22 CC[C@H]1OC(=O)C[C@@H]1O Amb25195896 [0,1,0,1,0,0|1,0,0]=3 12673 B9R1.22 COC1NC(=O)CC1O Amb24724345 [0,1,0,1,0,0|2,0,0]=4 12674 B9R1.22 C[C@@H]1CC(=N)N[C@H]1CC Amb25302320 [0,1,0,1,0,0|2,0,0]=4 12675 B9R1.22 C[C@@H]1CC(=O)N[C@H]1CI Amb24629581 [0,1,0,1,0,0|2,0,0]=4 12676 B9R1.22 C[C@@H]1CC(=O)O[C@@H]1CO Amb25176497 [0,1,0,1,0,0|2,0,0]=4 12677 B9R1.22 C[C@@H]1N=C(C)N[C@H]1CC Amb24568900 [0,1,0,1,0,0|2,0,0]=4 12678 B9R1.22 C[C@@H]1NC(=O)C[C@@H]1CO Amb24667931 [0,1,0,1,0,0|2,0,0]=4 12679 B9R1.22 C[C@@H]1NC(=O)OC1CC Amb25694156 [0,1,0,1,0,0|2,0,0]=4 12680 B9R1.22 C[C@@H]1OC(=O)C[C@H]1CO Amb25176881 [0,1,0,1,0,0|2,0,0]=4 12681 B9R1.22 C[C@@H]1OC(=O)C[C@H]1NC Amb24610195 [0,1,0,1,0,0|2,0,0]=4 12682 B9R1.22 C[C@@H]1OC(=O)N[C@H]1CC Amb24699385 [0,1,0,1,0,0|2,0,0]=4 12683 B9R1.22 C[C@H]1CC(=O)C[C@H]1CC Amb25179756 [0,1,0,1,0,0|0,0,0]=2 12684 B9R1.22 C[C@H]1CC(=O)N[C@H]1CI Amb24681330 [0,1,0,1,0,0|2,0,0]=4 12685 B9R1.22 C[C@H]1CC(=O)N[C@H]1CO Amb25175007 [0,1,0,1,0,0|2,0,0]=4 12686 B9R1.22 C[C@H]1CC(=O)O[C@@H]1CBr Amb25210841 [0,1,0,1,0,0|2,0,0]=4 12687 B9R1.22 C[C@H]1CC(=O)O[C@H]1CCl Amb24554768 [0,1,0,1,0,0|2,0,0]=4 12688 B9R1.22 C[C@H]1CC(=O)O[C@H]1CO Amb25175374 [0,1,0,1,0,0|2,0,0]=4 12689 B9R1.22 C[C@H]1NC(=O)O[C@@H]1CC Amb24713487 [0,1,0,1,0,0|2,0,0]=4 12690 B9R1.22 C[C@H]1OC(=O)C[C@H]1CO Amb25257020 [0,1,0,1,0,0|2,0,0]=4 12691 B9R1.22 N[C@H]1CC(=O)N[C@H]1CO Amb25258095 [0,1,0,1,0,0|2,0,0]=4 12692 B9R1.22 OC1CC(=O)OC1CO Amb24356603 [0,1,0,1,0,0|2,0,0]=4 12693 B9R1.22 O[C@@H]1CC(=O)O[C@@H]1CO Amb24515317 [0,1,0,1,0,0|2,0,0]=4 12694 B9R1.22 O[C@@H]1CC(=O)O[C@H]1CBr Amb24555733 [0,1,0,1,0,0|2,0,0]=4 12695 B9R1.22 O[C@@H]1CC(=O)O[C@H]1CO Amb22748461 [0,1,0,1,0,0|2,0,0]=4 12696 B9R1.22 O[C@H]1CC(=O)N[C@@H]1CO Amb24677654 [0,1,0,1,0,0|2,0,0]=4 12697 B9R1.22 O[C@H]1CC(=O)OC1CO Amb24404778 [0,1,0,1,0,0|2,0,0]=4 12698 B9R1.22 O[C@H]1CC(=O)O[C@@H]1CBr Amb25176060 [0,1,0,1,0,0|2,0,0]=4 12699 B9R1.22 O[C@H]1CC(=O)O[C@@H]1CO Amb20242107 [0,1,0,1,0,0|2,0,0]=4 12700 B9R1.22 O[C@H]1CC(=O)O[C@H]1CCl Amb24598576 [0,1,0,1,0,0|2,0,0]=4 12701 B9R1.25 CC(=O)C1C(CC)C1=C Amb24340210 [0,1,0,1,0,0|0,0,1]=3 12702 B9R1.25 CC1C(C=C)C1C(C)=O Amb25094320 [0,1,0,1,0,0|0,0,2]=4 12703 B9R1.25 CC1C(CO)C1C(O)=O Amb25131333 [0,1,0,1,0,0|2,0,0]=4 12704 B9R1.25 CC1C(OC)C1C(O)=O Amb24383463 [0,1,0,1,0,0|2,0,0]=4 12705 B9R1.25 CC[C@H]1[C@@H](C1=C)C(O)=O Amb24683736 [0,1,0,1,0,0|1,0,1]=4 12706 B9R1.25 C[C@@H]1[C@@H](CO)[C@@H]1C(O)=O Amb25264080 [0,1,0,1,0,0|2,0,0]=4 12707 B9R1.25 C[C@@H]1[C@@H](CO)[C@H]1C(O)=O Amb24560911 [0,1,0,1,0,0|2,0,0]=4 12708 B9R1.34 CC1CC(=O)C=[N+]([O-])C1 Amb25366372 [0,1,0,1,0,0|1,0,1]=4 12709 B9R1.34 CC1CC(=O)CC(=O)N1 Amb22750293 [0,1,0,1,0,0|1,0,1]=4 12710 B9R1.34 CC1CC(=O)CC(=O)O1 Amb24422515 [0,1,0,1,0,0|1,0,1]=4 12711 B9R1.34 CC1CC(=O)CC(C)N1 Amb18642530 [0,1,0,1,0,0|1,0,0]=3 12712 B9R1.34 CC1CC(=O)CC(C)N1 Amb22228395 [0,1,0,1,0,0|1,0,0]=3 12713 B9R1.34 CC1CC(=O)NC(=O)C1 Amb17940391 [0,1,0,1,0,0|1,0,1]=4 12714 B9R1.34 CC1CC(=S)CC(C)N1 Amb25706152 [0,1,0,1,0,0|1,1,0]=4 12715 B9R1.34 CC1CC(Br)CC(C)C1 Amb25147183 [0,1,0,1,0,0|1,0,1]=4 12716 B9R1.34 CC1CC(Br)CN(C)C1 Amb25250956 [0,1,0,1,0,0|2,0,0]=4 12717 B9R1.34 CC1CC(C)N=C(N)C1 Amb25766396 [0,1,0,1,0,0|2,0,0]=4 12718 B9R1.34 CC1CC(C)NC(=N)C1 Amb17616044 [0,1,0,1,0,0|2,0,0]=4 12719 B9R1.34 CC1CC(Cl)CC(C)C1 Amb24370181 [0,1,0,1,0,0|1,0,1]=4 12720 B9R1.34 CC1CC(Cl)CC(C)O1 Amb24479940 [0,1,0,1,0,0|0,0,2]=4 12721 B9R1.34 CC1CC(I)CC(C)C1 Amb25147177 [0,1,0,1,0,0|1,0,1]=4 12722 B9R1.34 CC1CC(N)C=C(C)C1 Amb25721977 [0,1,0,1,0,0|1,0,1]=4 12723 B9R1.34 CC1CC(N)CC(C)C1 Amb19514974 [0,1,0,1,0,0|1,0,1]=4 12724 B9R1.34 CC1CC(N)CC(C)N1 Amb23535949 [0,1,0,1,0,0|1,0,1]=4 12725 B9R1.34 CC1CC(N)CC(C)O1 Amb22059487 [0,1,0,1,0,0|0,0,2]=4 12726 B9R1.34 CC1CC(N)CN(C)C1 Amb18832586 [0,1,0,1,0,0|2,0,0]=4 12727 B9R1.34 CC1CC(N)NC(=O)C1 Amb24590810 [0,1,0,1,0,0|1,0,0]=3 12728 B9R1.34 CC1CC(O)CC(=O)O1 Amb23455145 [0,1,0,1,0,0|1,0,0]=3 12729 B9R1.34 CC1CC(O)CC(C)C1 Amb19514923 [0,1,0,1,0,0|0,0,2]=4 12730 B9R1.34 CC1CC(O)CC(C)N1 Amb22899513 [0,1,0,1,0,0|1,0,1]=4 12731 B9R1.34 CC1CC(O)CC(C)O1 Amb19892414 [0,1,0,1,0,0|0,0,2]=4 12732 B9R1.34 CC1CC(O)CN(C1)C Amb1017305 [0,1,0,1,0,0|2,0,0]=4 12733 B9R1.34 CC1CC(O)CN(N)C1 Amb24549183 [0,1,0,1,0,0|2,0,0]=4 12734 B9R1.34 CC1CC(S)CC(C)C1 Amb24539821 [0,1,0,1,0,0|0,1,1]=4 12735 B9R1.34 CC1CC(S)CC(C)O1 Amb25276017 [0,1,0,1,0,0|0,0,2]=4 12736 B9R1.34 CC1CN(C)CC(=O)C1 Amb2369958 [0,1,0,1,0,0|1,0,0]=3 12737 B9R1.34 CC1C[C@@H](Cl)C[C@H](Cl)C1 Amb24602083 [0,1,0,1,0,0|1,0,1]=4 12738 B9R1.34 CC1C[C@@H](O)CC(O)C1 Amb24747781 [0,1,0,1,0,0|0,0,2]=4 12739 B9R1.34 CC1C[C@H](O)C[C@@H](O)C1 Amb25246152 [0,1,0,1,0,0|0,0,2]=4 12740 B9R1.34 CC1NC(C)CC(C)=N1 Amb25131654 [0,1,0,1,0,0|2,0,0]=4 12741 B9R1.34 CC1OC(C)CC(=O)C1 Amb10072038 [0,1,0,1,0,0|1,0,0]=3 12742 B9R1.34 CC=1C[C@@H](C)CC(=O)C1 Amb25044278 [0,1,0,1,0,0|0,0,2]=4 12743 B9R1.34 CC=1C[C@H](C)CC(=O)C1 Amb24631557 [0,1,0,1,0,0|0,0,2]=4 12744 B9R1.34 CN1CC(=O)CC(=O)C1 Amb22802168 [0,1,0,1,0,0|1,0,1]=4 12745 B9R1.34 C[C@@H]1CC(=O)CC(=O)N1 Amb22750988 [0,1,0,1,0,0|1,0,1]=4 12746 B9R1.34 C[C@@H]1CC(=O)CN(C)C1 Amb25298503 [0,1,0,1,0,0|1,0,0]=3 12747 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)N1 Amb25244740 [0,1,0,1,0,0|1,0,0]=3 12748 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)O1 Amb24056554 [0,1,0,1,0,0|1,0,0]=3 12749 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)C1 Amb24568269 [0,1,0,1,0,0|0,0,0]=2 12750 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)N1 Amb22751257 [0,1,0,1,0,0|1,0,0]=3 12751 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)O1 Amb24620055 [0,1,0,1,0,0|1,0,0]=3 12752 B9R1.34 C[C@@H]1CC(O)C[C@@H](C)N1 Amb24580385 [0,1,0,1,0,0|1,0,1]=4 12753 B9R1.34 C[C@@H]1CC(O)C[C@H](C)N1 Amb25147213 [0,1,0,1,0,0|1,0,1]=4 12754 B9R1.34 C[C@@H]1CN(N)C[C@H](C)C1 Amb25347730 [0,1,0,1,0,0|2,0,0]=4 12755 B9R1.34 C[C@@H]1C[C@@H](C)C[C@H](C)C1 Amb22800007 [0,1,0,1,0,0|1,0,1]=4 12756 B9R1.34 C[C@@H]1C[C@@H](Cl)C[C@@H](Cl)C1 Amb24664460 [0,1,0,1,0,0|1,0,1]=4 12757 B9R1.34 C[C@@H]1C[C@@H](N)CC(=O)N1 Amb24566495 [0,1,0,1,0,0|1,0,0]=3 12758 B9R1.34 C[C@@H]1C[C@H](C)C[C@H](C)C1 Amb24099375 [0,1,0,1,0,0|1,0,1]=4 12759 B9R1.34 C[C@@H]1C[C@H](C)NC(C)=N1 Amb25229063 [0,1,0,1,0,0|2,0,0]=4 12760 B9R1.34 C[C@@H]1C[C@H](C)N[C@H](C)C1 Amb25145967 [0,1,0,1,0,0|1,0,1]=4 12761 B9R1.34 C[C@@H]1C[C@H](N)C[C@H](C)C1 Amb25230869 [0,1,0,1,0,0|1,0,1]=4 12762 B9R1.34 C[C@@H]1C[C@H](N)C[C@H](N)C1 Amb24698964 [0,1,0,1,0,0|1,0,1]=4 12763 B9R1.34 C[C@@H]1C[C@H](O)CC(=O)O1 Amb25246833 [0,1,0,1,0,0|1,0,0]=3 12764 B9R1.34 C[C@@H]1C[C@H](O)CN(C)C1 Amb25810142 [0,1,0,1,0,0|2,0,0]=4 12765 B9R1.34 C[C@@H]1C[C@H](O)C[C@H](C)C1 Amb25791561 [0,1,0,1,0,0|0,0,2]=4 12766 B9R1.34 C[C@H]1CC(=O)C=C(N)C1 Amb25162761 [0,1,0,1,0,0|0,0,2]=4 12767 B9R1.34 C[C@H]1CC(=O)CC(C)C1 Amb25849622 [0,1,0,1,0,0|0,0,0]=2 12768 B9R1.34 C[C@H]1CC(=O)C[C@H](C)N1 Amb24517463 [0,1,0,1,0,0|1,0,0]=3 12769 B9R1.34 C[C@H]1CC(=O)C[C@H](C)O1 Amb22737479 [0,1,0,1,0,0|1,0,0]=3 12770 B9R1.34 C[C@H]1CC(N)C[C@H](C)C1 Amb24649036 [0,1,0,1,0,0|1,0,1]=4 12771 B9R1.34 C[C@H]1CC(O)CC(=O)O1 Amb24541561 [0,1,0,1,0,0|1,0,0]=3 12772 B9R1.34 C[C@H]1CC(O)C[C@H](C)C1 Amb24099374 [0,1,0,1,0,0|0,0,2]=4 12773 B9R1.34 C[C@H]1CC(O)C[C@H](C)O1 Amb25317612 [0,1,0,1,0,0|0,0,2]=4 12774 B9R1.34 C[C@H]1CN(N)C[C@H](C)C1 Amb25707932 [0,1,0,1,0,0|2,0,0]=4 12775 B9R1.34 C[C@H]1C[C@@H](O)C=C(C)C1 Amb24694187 [0,1,0,1,0,0|1,0,1]=4 12776 B9R1.34 C[C@H]1C[C@@H](O)CC(=O)N1 Amb24586779 [0,1,0,1,0,0|1,0,0]=3 12777 B9R1.34 C[C@H]1C[C@@H](O)CC(=O)O1 Amb25220495 [0,1,0,1,0,0|1,0,0]=3 12778 B9R1.34 C[C@H]1C[C@H](O)CC(=O)N1 Amb24517205 [0,1,0,1,0,0|1,0,0]=3 12779 B9R1.34 C[C@H]1C[C@H](O)CC(=O)O1 Amb25176759 [0,1,0,1,0,0|1,0,0]=3 12780 B9R1.34 C[C@H]1C[C@H](O)C[C@@H](C)C1 Amb24431909 [0,1,0,1,0,0|0,0,2]=4 12781 B9R1.34 NC1CC(=O)CC(N)C1 Amb25303940 [0,1,0,1,0,0|1,0,0]=3 12782 B9R1.34 OC1CS(=O)CC(O)C1 Amb25819904 [0,1,0,1,0,0|2,0,0]=4 12783 B9R1.38 CC1CC(N)CC1(C)C Amb25146156 [0,1,0,1,0,0|1,0,1]=4 12784 B9R1.38 CC1CC(S(=O)(=O)C1)C Amb2227622 [0,1,0,1,0,0|2,0,0]=4 12785 B9R1.41 C=C(Br)C1CCCC1O Amb24370598 [0,1,0,1,0,0|1,0,1]=4 12786 B9R1.41 C=C1CCCC1C(O)=O Amb18642417 [0,1,0,1,0,0|1,0,1]=4 12787 B9R1.41 CC(=C)C1CCCC1=O Amb25032164 [0,1,0,1,0,0|1,0,1]=4 12788 B9R1.41 CC(=C)C1CNCC1O Amb24568954 [0,1,0,1,0,0|2,0,0]=4 12789 B9R1.41 CC(=C)[C@H]1CCC[C@H]1O Amb25276295 [0,1,0,1,0,0|1,0,0]=3 12790 B9R1.41 CC(=C)[C@H]1CNC[C@@H]1O Amb25206231 [0,1,0,1,0,0|2,0,0]=4 12791 B9R1.41 CC(=N)C1CCCC1=O Amb25728897 [0,1,0,1,0,0|1,0,1]=4 12792 B9R1.41 CC(=O)C1=CCC[C@H]1C Amb25724215 [0,1,0,1,0,0|0,0,1]=3 12793 B9R1.41 CC(=O)C1CCC=C1Cl Amb24372540 [0,1,0,1,0,0|0,0,2]=4 12794 B9R1.41 CC(=O)C1CCCC1=S Amb24646456 [0,1,0,1,0,0|0,0,1]=3 12795 B9R1.41 CC(=O)C1CCCC1Br Amb24710867 [0,1,0,1,0,0|0,0,0]=2 12796 B9R1.41 CC(=O)C1CCCC1Cl Amb24063968 [0,1,0,1,0,0|0,0,0]=2 12797 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [0,1,0,1,0,0|0,0,0]=2 12798 B9R1.41 CC(=O)C1CCCN1C Amb25295317 [0,1,0,1,0,0|0,0,0]=2 12799 B9R1.41 CC(=O)C1CCOC1=O Amb2404781 [0,1,0,1,0,0|1,0,1]=4 12800 B9R1.41 CC(=O)C1CCSC1=O Amb24340323 [0,1,0,1,0,0|1,0,1]=4 12801 B9R1.41 CC(=O)C1CSCC1O Amb25685933 [0,1,0,1,0,0|1,0,0]=3 12802 B9R1.41 CC(=O)[C@@H]1CSC[C@@H]1O Amb25046323 [0,1,0,1,0,0|1,0,0]=3 12803 B9R1.41 CC(=O)[C@@H]1CSC[C@H]1O Amb25110108 [0,1,0,1,0,0|1,0,0]=3 12804 B9R1.41 CC(=O)[C@H]1CCC[C@@H]1O Amb24512739 [0,1,0,1,0,0|0,0,0]=2 12805 B9R1.41 CC(=O)[C@H]1CSC[C@@H]1O Amb25174811 [0,1,0,1,0,0|1,0,0]=3 12806 B9R1.41 CC(=O)[C@H]1CSC[C@H]1O Amb24594984 [0,1,0,1,0,0|1,0,0]=3 12807 B9R1.41 CC(=O)[C@H]1OCC[C@@H]1Cl Amb25232993 [0,1,0,1,0,0|1,0,0]=3 12808 B9R1.41 CC(C)C1CCCC1Br Amb19073226 [0,1,0,1,0,0|1,0,1]=4 12809 B9R1.41 CC(C)C1CCCC1Cl Amb24402060 [0,1,0,1,0,0|1,0,1]=4 12810 B9R1.41 CC(C)C1CCCC1N Amb18947760 [0,1,0,1,0,0|1,0,1]=4 12811 B9R1.41 CC(C)C1CCCC1O Amb25749420 [0,1,0,1,0,0|1,0,1]=4 12812 B9R1.41 CC(C)C1CCNC1C Amb18947270 [0,1,0,1,0,0|1,0,1]=4 12813 B9R1.41 CC(C)[C@@H]1CCC[C@@H]1N Amb24622101 [0,1,0,1,0,0|1,0,1]=4 12814 B9R1.41 CC(C)[C@@H]1CCC[C@@H]1O Amb25175483 [0,1,0,1,0,0|1,0,1]=4 12815 B9R1.41 CC(C)[C@@H]1CCN[C@H]1C Amb25291900 [0,1,0,1,0,0|1,0,1]=4 12816 B9R1.41 CC(C)[C@@H]1NCC[C@H]1C Amb18832663 [0,1,0,1,0,0|1,0,1]=4 12817 B9R1.41 CC(C)[C@H]1NCC[C@@H]1C Amb25254691 [0,1,0,1,0,0|1,0,1]=4 12818 B9R1.41 CC(N)[C@@H]1CCCN1C Amb25836836 [0,1,0,1,0,0|1,0,1]=4 12819 B9R1.41 CC(O)[C@@H]1CCCN1C Amb24534366 [0,1,0,1,0,0|0,0,2]=4 12820 B9R1.41 CC1=COCC1C(C)=O Amb25244405 [0,1,0,1,0,0|0,0,2]=4 12821 B9R1.41 CC1=NSCC1C(C)=O Amb24339913 [0,1,0,1,0,0|1,0,1]=4 12822 B9R1.41 CC1C=CCC1C(O)=O Amb25304598 [0,1,0,1,0,0|1,0,1]=4 12823 B9R1.41 CC1CCCC1C(=O)C Amb17593321 [0,1,0,1,0,0|0,0,0]=2 12824 B9R1.41 CC1CCCC1C(C)Cl Amb24713516 [0,1,0,1,0,0|1,0,1]=4 12825 B9R1.41 CC1CCCC1C(N)=O Amb24680775 [0,1,0,1,0,0|1,0,0]=3 12826 B9R1.41 CC1CCCC1[C@H](C)O Amb24738206 [0,1,0,1,0,0|0,0,2]=4 12827 B9R1.41 CC1CCCN1C(=O)Cl Amb25131803 [0,1,0,1,0,0|1,0,0]=3 12828 B9R1.41 CC1CCCN1C(C)=N Amb25041351 [0,1,0,1,0,0|1,0,0]=3 12829 B9R1.41 CC1CCCN1C(N)=S Amb24661063 [0,1,0,1,0,0|1,1,0]=4 12830 B9R1.41 CC1CCCN1[N+]([O-])=O Amb24457391 [0,1,0,1,0,0|2,0,0]=4 12831 B9R1.41 CC1CCNC1C(O)=O Amb22496299 [0,1,0,1,0,0|1,0,0]=3 12832 B9R1.41 CC1CCN[C@@H]1C(O)=O Amb25786199 [0,1,0,1,0,0|1,0,0]=3 12833 B9R1.41 CC1CCOC1C(C)O Amb24332228 [0,1,0,1,0,0|0,0,2]=4 12834 B9R1.41 CC1CCOC1C(N)=O Amb25107757 [0,1,0,1,0,0|1,0,0]=3 12835 B9R1.41 CC1CCOC1C(O)=O Amb20668280 [0,1,0,1,0,0|1,0,0]=3 12836 B9R1.41 CC1CNCC1C(C)=C Amb25124347 [0,1,0,1,0,0|1,0,0]=3 12837 B9R1.41 CC1CNCC1N(C)C Amb20623248 [0,1,0,1,0,0|2,0,0]=4 12838 B9R1.41 CC1COCC1C(O)=O Amb25326733 [0,1,0,1,0,0|1,0,0]=3 12839 B9R1.41 CC1NCCC1C(C)=O Amb24393053 [0,1,0,1,0,0|0,0,0]=2 12840 B9R1.41 CC1NCCC1C(O)=O Amb18118138 [0,1,0,1,0,0|1,0,0]=3 12841 B9R1.41 CC1NCCC1N(C)C Amb24518040 [0,1,0,1,0,0|2,0,0]=4 12842 B9R1.41 CC1OCCC1C(=O)Cl Amb24334543 [0,1,0,1,0,0|1,0,0]=3 12843 B9R1.41 CC1OCCC1C(O)=O Amb22059743 [0,1,0,1,0,0|1,0,0]=3 12844 B9R1.41 CC1OCNC1C(O)=O Amb24564435 [0,1,0,1,0,0|2,0,0]=4 12845 B9R1.41 CC1SCCC1C(C)=O Amb25218259 [0,1,0,1,0,0|0,0,0]=2 12846 B9R1.41 CN(C)C1CCCC1O Amb19650708 [0,1,0,1,0,0|2,0,0]=4 12847 B9R1.41 CN(C)[C@@H]1CCCN1C Amb24540884 [0,1,0,1,0,0|2,0,0]=4 12848 B9R1.41 CN(C)[C@@H]1CCC[C@@H]1O Amb22899696 [0,1,0,1,0,0|2,0,0]=4 12849 B9R1.41 CN(C)[C@@H]1CCC[C@H]1N Amb22748683 [0,1,0,1,0,0|2,0,0]=4 12850 B9R1.41 CN(C)[C@@H]1CCC[C@H]1N Amb22757950 [0,1,0,1,0,0|2,0,0]=4 12851 B9R1.41 CN(C)[C@H]1CCCC1O Amb25369374 [0,1,0,1,0,0|2,0,0]=4 12852 B9R1.41 CN(C)[C@H]1CCC[C@@H]1N Amb24598663 [0,1,0,1,0,0|2,0,0]=4 12853 B9R1.41 CN(C)[C@H]1CCC[C@@H]1O Amb25852161 [0,1,0,1,0,0|2,0,0]=4 12854 B9R1.41 CN(C)[C@H]1CCC[C@H]1N Amb24550518 [0,1,0,1,0,0|2,0,0]=4 12855 B9R1.41 CN(C1CCCC1N)C Amb1124963 [0,1,0,1,0,0|2,0,0]=4 12856 B9R1.41 CN(N)C1CCCC1O Amb24371238 [0,1,0,1,0,0|2,0,0]=4 12857 B9R1.41 CN([C@@H]1CCC[C@H]1O)C Amb16230278 [0,1,0,1,0,0|2,0,0]=4 12858 B9R1.41 CN1CCCC1C(=O)Cl Amb25250467 [0,1,0,1,0,0|1,0,0]=3 12859 B9R1.41 CN1CCCC1C(N)=O Amb22371060 [0,1,0,1,0,0|1,0,0]=3 12860 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb17935722 [0,1,0,1,0,0|1,0,0]=3 12861 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb18559228 [0,1,0,1,0,0|1,0,0]=3 12862 B9R1.41 CN1CCC[C@@H]1C(O)=O Amb22748316 [0,1,0,1,0,0|1,0,0]=3 12863 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [0,1,0,1,0,0|1,0,0]=3 12864 B9R1.41 CN1CCC[C@H]1C(O)=O Amb22587172 [0,1,0,1,0,0|1,0,0]=3 12865 B9R1.41 CN1CSCC1C(O)=O Amb19650934 [0,1,0,1,0,0|2,0,0]=4 12866 B9R1.41 CN1CSCC1C(O)=O Amb21959971 [0,1,0,1,0,0|2,0,0]=4 12867 B9R1.41 CN1CSC[C@H]1C(=O)O Amb10608462 [0,1,0,1,0,0|2,0,0]=4 12868 B9R1.41 CN1CSC[C@H]1C(O)=O Amb22587250 [0,1,0,1,0,0|2,0,0]=4 12869 B9R1.41 CS(=O)C1CCCC1=O Amb24357722 [0,1,0,1,0,0|1,0,1]=4 12870 B9R1.41 CS(=O)C1CNCC1O Amb24674532 [0,1,0,1,0,0|2,0,0]=4 12871 B9R1.41 CS(=O)N1CCCC1N Amb25348682 [0,1,0,1,0,0|2,0,0]=4 12872 B9R1.41 CS(=O)[C@@H]1CNC[C@H]1O Amb24495227 [0,1,0,1,0,0|2,0,0]=4 12873 B9R1.41 C[C@@H]1CCCN1[N+]([O-])=O Amb24068218 [0,1,0,1,0,0|2,0,0]=4 12874 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|1,0,0]=3 12875 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|1,0,0]=3 12876 B9R1.41 C[C@@H]1CCC[C@H]1C(C)=O Amb24692616 [0,1,0,1,0,0|0,0,0]=2 12877 B9R1.41 C[C@@H]1CCC[C@H]1C(N)=O Amb24598612 [0,1,0,1,0,0|1,0,0]=3 12878 B9R1.41 C[C@@H]1CCN[C@H]1C(O)=O Amb22747259 [0,1,0,1,0,0|1,0,0]=3 12879 B9R1.41 C[C@@H]1CCO[C@@H]1C(O)=O Amb25251332 [0,1,0,1,0,0|1,0,0]=3 12880 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb25319543 [0,1,0,1,0,0|1,0,0]=3 12881 B9R1.41 C[C@@H]1COC[C@@H]1C(O)=O Amb24649146 [0,1,0,1,0,0|1,0,0]=3 12882 B9R1.41 C[C@@H]1NCC[C@H]1C(O)=O Amb18832568 [0,1,0,1,0,0|1,0,0]=3 12883 B9R1.41 C[C@@H]1OCC[C@@H]1C(O)=O Amb22886528 [0,1,0,1,0,0|1,0,0]=3 12884 B9R1.41 C[C@@H]1SCN[C@@H]1C(O)=O Amb24514827 [0,1,0,1,0,0|2,0,0]=4 12885 B9R1.41 C[C@@H]1SCN[C@H]1C(O)=O Amb24670517 [0,1,0,1,0,0|2,0,0]=4 12886 B9R1.41 C[C@H](N)[C@@H]1CCCN1C Amb24540854 [0,1,0,1,0,0|1,0,1]=4 12887 B9R1.41 C[C@H](N)[C@H]1CCC[C@H]1O Amb24621967 [0,1,0,1,0,0|1,0,1]=4 12888 B9R1.41 C[C@H]1C=CC[C@@H]1C(O)=O Amb25180008 [0,1,0,1,0,0|1,0,1]=4 12889 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|1,0,0]=3 12890 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|1,0,0]=3 12891 B9R1.41 C[C@H]1CCN[C@@H]1C(N)=O Amb25174509 [0,1,0,1,0,0|1,0,0]=3 12892 B9R1.41 C[C@H]1CCN[C@H]1C(O)=O Amb24715733 [0,1,0,1,0,0|1,0,0]=3 12893 B9R1.41 C[C@H]1CNCC1C(O)=O Amb24546979 [0,1,0,1,0,0|1,0,0]=3 12894 B9R1.41 C[C@H]1COC[C@@H]1C(C)=O Amb24645383 [0,1,0,1,0,0|0,0,0]=2 12895 B9R1.41 C[C@H]1NCC[C@@H]1C(O)=O Amb24539923 [0,1,0,1,0,0|1,0,0]=3 12896 B9R1.41 C[C@H]1OCC[C@H]1C(O)=O Amb25253338 [0,1,0,1,0,0|1,0,0]=3 12897 B9R1.41 C[C@H]1SCN[C@@H]1C(O)=O Amb24539832 [0,1,0,1,0,0|2,0,0]=4 12898 B9R1.41 C[S+]1CCCC1C(O)=O Amb24634112 [0,1,0,1,0,0|1,0,0]=3 12899 B9R1.41 NC(=O)C1CCCC1=O Amb16233729 [0,1,0,1,0,0|1,0,1]=4 12900 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [0,1,0,1,0,0|1,0,0]=3 12901 B9R1.41 NC(=O)C1CCCN1N Amb25703126 [0,1,0,1,0,0|2,0,0]=4 12902 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [0,1,0,1,0,0|2,0,0]=4 12903 B9R1.41 NC(=O)N1CCCC1O Amb24476791 [0,1,0,1,0,0|2,0,0]=4 12904 B9R1.41 NC(=O)[C@@H]1CCCC1=O Amb24182045 [0,1,0,1,0,0|1,0,1]=4 12905 B9R1.41 NC(=O)[C@@H]1CCCN1O Amb24476639 [0,1,0,1,0,0|2,0,0]=4 12906 B9R1.41 NC(=O)[C@@H]1CCC[C@H]1O Amb24120348 [0,1,0,1,0,0|1,0,0]=3 12907 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [0,1,0,1,0,0|2,0,0]=4 12908 B9R1.41 NC(=O)[C@H]1CCC[C@@H]1O Amb24514485 [0,1,0,1,0,0|1,0,0]=3 12909 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [0,1,0,1,0,0|2,0,0]=4 12910 B9R1.41 NC1CCCC1C(N)=O Amb19148786 [0,1,0,1,0,0|1,0,0]=3 12911 B9R1.41 NC1CCCC1C(N)=S Amb25688172 [0,1,0,1,0,0|1,1,0]=4 12912 B9R1.41 NC1CCN[C@@H]1C(O)=O Amb25032243 [0,1,0,1,0,0|2,0,0]=4 12913 B9R1.41 NC1CCSC1C(O)=O Amb25314364 [0,1,0,1,0,0|2,0,0]=4 12914 B9R1.41 NC1COCC1C(N)=O Amb25129487 [0,1,0,1,0,0|2,0,0]=4 12915 B9R1.41 NC1COCC1C(O)=O Amb24709230 [0,1,0,1,0,0|2,0,0]=4 12916 B9R1.41 NC1CSCC1C(O)=O Amb24457278 [0,1,0,1,0,0|2,0,0]=4 12917 B9R1.41 NC1OCCC1C(O)=O Amb24441640 [0,1,0,1,0,0|2,0,0]=4 12918 B9R1.41 NN1CCCC1C(O)=O Amb18642792 [0,1,0,1,0,0|2,0,0]=4 12919 B9R1.41 NN1CCC[C@@H]1C(=O)O Amb10069459 [0,1,0,1,0,0|2,0,0]=4 12920 B9R1.41 N[C@@H]1CCC[C@H]1C(N)=O Amb25269871 [0,1,0,1,0,0|1,0,0]=3 12921 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb20241297 [0,1,0,1,0,0|1,0,0]=3 12922 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=O Amb22224830 [0,1,0,1,0,0|1,0,0]=3 12923 B9R1.41 N[C@@H]1CCC[C@H]1C(O)=[ClH] Amb24627931 [0,1,0,1,0,0|1,0,1]=4 12924 B9R1.41 N[C@@H]1CCN[C@@H]1C(O)=O Amb19929517 [0,1,0,1,0,0|2,0,0]=4 12925 B9R1.41 N[C@@H]1CCS[C@H]1C(O)=O Amb24061395 [0,1,0,1,0,0|2,0,0]=4 12926 B9R1.41 N[C@@H]1CNC[C@@H]1C(O)=O Amb25685466 [0,1,0,1,0,0|2,0,0]=4 12927 B9R1.41 N[C@@H]1COC[C@@H]1C(O)=O Amb24078777 [0,1,0,1,0,0|2,0,0]=4 12928 B9R1.41 N[C@@H]1CSC[C@@H]1C(O)=O Amb25685470 [0,1,0,1,0,0|2,0,0]=4 12929 B9R1.41 N[C@@H]1OCC[C@@H]1C(O)=O Amb24581227 [0,1,0,1,0,0|2,0,0]=4 12930 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb20241298 [0,1,0,1,0,0|1,0,0]=3 12931 B9R1.41 N[C@H]1CCC[C@@H]1C(O)=O Amb22224860 [0,1,0,1,0,0|1,0,0]=3 12932 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [0,1,0,1,0,0|1,0,0]=3 12933 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [0,1,0,1,0,0|1,0,0]=3 12934 B9R1.41 N[C@H]1CCS[C@H]1C(O)=O Amb24061394 [0,1,0,1,0,0|2,0,0]=4 12935 B9R1.41 N[C@H]1CNC[C@H]1C(O)=O Amb24628081 [0,1,0,1,0,0|2,0,0]=4 12936 B9R1.41 N[C@H]1COC[C@@H]1C(O)=O Amb24605467 [0,1,0,1,0,0|2,0,0]=4 12937 B9R1.41 N[C@H]1COC[C@H]1C(O)=O Amb24763623 [0,1,0,1,0,0|2,0,0]=4 12938 B9R1.41 O=C1CCCC1C(=O)Cl Amb21961757 [0,1,0,1,0,0|1,0,1]=4 12939 B9R1.41 OC(=O)C1CCCC1=O Amb18642571 [0,1,0,1,0,0|1,0,1]=4 12940 B9R1.41 OC(=O)C1CCCC1=S Amb25273371 [0,1,0,1,0,0|1,0,1]=4 12941 B9R1.41 OC(=O)C1CCCC1Br Amb24480063 [0,1,0,1,0,0|1,0,0]=3 12942 B9R1.41 OC(=O)C1CCCC1S Amb18280971 [0,1,0,1,0,0|1,0,0]=3 12943 B9R1.41 OC(=O)C1CCCN1Cl Amb25291925 [0,1,0,1,0,0|2,0,0]=4 12944 B9R1.41 OC(=O)C1NCCC1Br Amb24694082 [0,1,0,1,0,0|2,0,0]=4 12945 B9R1.41 OC(=O)C1NCCC1Cl Amb25080543 [0,1,0,1,0,0|2,0,0]=4 12946 B9R1.41 OC(=O)C1NCCC1F Amb25772909 [0,1,0,1,0,0|2,0,0]=4 12947 B9R1.41 OC(=O)C1NCCC1S Amb24556940 [0,1,0,1,0,0|2,0,0]=4 12948 B9R1.41 OC(=O)C1OCCC1Cl Amb25124121 [0,1,0,1,0,0|2,0,0]=4 12949 B9R1.41 OC(=O)[C@@H]1CCCN1Br Amb24480123 [0,1,0,1,0,0|2,0,0]=4 12950 B9R1.41 OC(=O)[C@H]1CCCN1F Amb24534439 [0,1,0,1,0,0|2,0,0]=4 12951 B9R1.41 OC(=O)[C@H]1CCC[C@@H]1Br Amb25251282 [0,1,0,1,0,0|1,0,0]=3 12952 B9R1.41 OC(=O)[C@H]1CCC[C@H]1Br Amb24693868 [0,1,0,1,0,0|1,0,0]=3 12953 B9R1.41 OC(=O)[C@H]1NCCC1F Amb25312348 [0,1,0,1,0,0|2,0,0]=4 12954 B9R1.41 OC(=O)[C@H]1NCC[C@@H]1S Amb24548407 [0,1,0,1,0,0|2,0,0]=4 12955 B9R1.41 OC1CCCC1C(=O)Cl Amb24524192 [0,1,0,1,0,0|1,0,0]=3 12956 B9R1.41 OC1CCCC1C(O)=O Amb19148040 [0,1,0,1,0,0|1,0,0]=3 12957 B9R1.41 OC1CCNC1C(O)=O Amb22387784 [0,1,0,1,0,0|2,0,0]=4 12958 B9R1.41 OC1CCN[C@@H]1C(=O)O Amb10604192 [0,1,0,1,0,0|2,0,0]=4 12959 B9R1.41 OC1CCN[C@H]1C(O)=O Amb24359065 [0,1,0,1,0,0|2,0,0]=4 12960 B9R1.41 OC1CCSC1C(O)=O Amb24061424 [0,1,0,1,0,0|2,0,0]=4 12961 B9R1.41 OC1CNCC1C(O)=O Amb22886381 [0,1,0,1,0,0|2,0,0]=4 12962 B9R1.41 OC1CSCC1C(O)=O Amb18831363 [0,1,0,1,0,0|2,0,0]=4 12963 B9R1.41 O[C@@H]1CCC[C@@H]1C(O)=O Amb22747315 [0,1,0,1,0,0|1,0,0]=3 12964 B9R1.41 O[C@@H]1CCC[C@H]1C(O)=O Amb24120349 [0,1,0,1,0,0|1,0,0]=3 12965 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb22746928 [0,1,0,1,0,0|2,0,0]=4 12966 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb23439285 [0,1,0,1,0,0|2,0,0]=4 12967 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb24183503 [0,1,0,1,0,0|2,0,0]=4 12968 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb22746713 [0,1,0,1,0,0|2,0,0]=4 12969 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb24183557 [0,1,0,1,0,0|2,0,0]=4 12970 B9R1.41 O[C@@H]1CNC[C@H]1C(O)=O Amb24120417 [0,1,0,1,0,0|2,0,0]=4 12971 B9R1.41 O[C@H]1CCC[C@H]1C(=O)O Amb10844853 [0,1,0,1,0,0|1,0,0]=3 12972 B9R1.41 O[C@H]1CCN[C@@H]1C(O)=O Amb24055327 [0,1,0,1,0,0|2,0,0]=4 12973 B9R1.41 O[C@H]1CCN[C@H]1C(O)=O Amb22230426 [0,1,0,1,0,0|2,0,0]=4 12974 B9R1.41 O[C@H]1CNC[C@H]1C(O)=O Amb22274552 [0,1,0,1,0,0|2,0,0]=4 12975 B9R1.41 [O-][N+](=O)C1CCCC1O Amb18203186 [0,1,0,1,0,0|2,0,0]=4 12976 B9R1.44 CC(C)CC1(O)CC1C Amb25775612 [0,1,0,1,0,0|1,0,1]=4 12977 B9R1.44 CC1CC1(N)CN(C)C Amb25249378 [0,1,0,1,0,0|2,0,0]=4 12978 B9R1.44 CC1C[C@]1(N)CC(O)=O Amb25844887 [0,1,0,1,0,0|1,0,0]=3 12979 B9R1.44 C[C@@H]1C[C@@]1(N)CC(O)=O Amb24540980 [0,1,0,1,0,0|1,0,0]=3 12980 B9R1.48 C=C1CC(O)CCCC1 Amb25045697 [0,1,0,1,0,0|1,0,0]=3 12981 B9R1.48 C=C1CC(O)COCC1 Amb25854214 [0,1,0,1,0,0|2,0,0]=4 12982 B9R1.48 CC1=CC(=O)CCCC1 Amb17593284 [0,1,0,1,0,0|0,0,1]=3 12983 B9R1.48 CC1=CC(=O)CCCN1 Amb24428221 [0,1,0,1,0,0|0,0,2]=4 12984 B9R1.48 CC1CC(=N)NCCC1 Amb25695240 [0,1,0,1,0,0|1,0,0]=3 12985 B9R1.48 CC1CC(=N)NCCS1 Amb24669595 [0,1,0,1,0,0|2,0,0]=4 12986 B9R1.48 CC1CC(=O)NCCN1 Amb18832620 [0,1,0,1,0,0|1,0,0]=3 12987 B9R1.48 CC1CC(=O)NCCS1 Amb22642277 [0,1,0,1,0,0|1,0,0]=3 12988 B9R1.48 CC1CC(C)=NCCN1 Amb22527040 [0,1,0,1,0,0|2,0,0]=4 12989 B9R1.48 CC1CC(C)CNCC1 Amb20622727 [0,1,0,1,0,0|1,0,1]=4 12990 B9R1.48 CC1CC(Cl)CCCC1 Amb25147199 [0,1,0,1,0,0|1,0,1]=4 12991 B9R1.48 CC1CC(N)CCCC1 Amb25842051 [0,1,0,1,0,0|1,0,1]=4 12992 B9R1.48 CC1CC(O)CCNC1 Amb25725421 [0,1,0,1,0,0|0,0,2]=4 12993 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,1,0,0|0,0,0]=2 12994 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [0,1,0,1,0,0|1,0,0]=3 12995 B9R1.48 CC1CCCCC(=S)N1 Amb25145977 [0,1,0,1,0,0|1,1,0]=4 12996 B9R1.48 CC1CCCCC(N)=N1 Amb25725950 [0,1,0,1,0,0|2,0,0]=4 12997 B9R1.48 CC1CCCCC(O)O1 Amb24752219 [0,1,0,1,0,0|0,0,2]=4 12998 B9R1.48 CC1CN(C)CCCN1 Amb22587015 [0,1,0,1,0,0|2,0,0]=4 12999 B9R1.48 CC1CNC=CC(=O)C1 Amb24546980 [0,1,0,1,0,0|0,0,2]=4 13000 B9R1.48 CC1CNCCC(C)=N1 Amb24477680 [0,1,0,1,0,0|1,0,0]=3 13001 B9R1.48 CC1CNCCC(C)N1 Amb24740219 [0,1,0,1,0,0|1,0,1]=4 13002 B9R1.48 CC1CNCCC(C)S1 Amb24475559 [0,1,0,1,0,0|0,1,1]=4 13003 B9R1.48 CC1CNCCN(C)C1 Amb18943771 [0,1,0,1,0,0|2,0,0]=4 13004 B9R1.48 CC=1CC(=O)CCCC1 Amb24686530 [0,1,0,1,0,0|0,0,1]=3 13005 B9R1.48 CC=1CCCC=C(C)C1 Amb22365190 [0,1,0,1,0,0|1,0,1]=4 13006 B9R1.48 CC=1CCCCC(N)N1 Amb24548235 [0,1,0,1,0,0|1,0,0]=3 13007 B9R1.48 CC=1CCCNC(=O)C1 Amb25693390 [0,1,0,1,0,0|0,0,2]=4 13008 B9R1.48 CC=1COCCN(C)C1 Amb25780197 [0,1,0,1,0,0|2,0,0]=4 13009 B9R1.48 CN1CC(=S)NCCC1 Amb25146132 [0,1,0,1,0,0|1,1,0]=4 13010 B9R1.48 CN1CC(Cl)CCCC1 Amb24532544 [0,1,0,1,0,0|1,0,1]=4 13011 B9R1.48 CN1CC(F)CCCC1 Amb25823034 [0,1,0,1,0,0|1,0,1]=4 13012 B9R1.48 CN1CC(N)=NCCC1 Amb25194922 [0,1,0,1,0,0|2,0,0]=4 13013 B9R1.48 CN1CC(N)CCCC1 Amb19516791 [0,1,0,1,0,0|1,0,1]=4 13014 B9R1.48 CN1CCCNC(C1)C Amb10607815 [0,1,0,1,0,0|2,0,0]=4 13015 B9R1.48 C[C@@H]1CC(=O)C=CCC1 Amb25353106 [0,1,0,1,0,0|0,0,1]=3 13016 B9R1.48 C[C@@H]1CC(=O)CCCC1 Amb25044345 [0,1,0,1,0,0|0,0,0]=2 13017 B9R1.48 C[C@@H]1CN(C)CCCN1 Amb18832596 [0,1,0,1,0,0|2,0,0]=4 13018 B9R1.48 C[C@@H]1CN(C)CCCN1 Amb23385288 [0,1,0,1,0,0|2,0,0]=4 13019 B9R1.48 C[C@@H]1C[C@@H](O)CCCC1 Amb24593171 [0,1,0,1,0,0|0,0,2]=4 13020 B9R1.48 C[C@H]1CC(=O)C=CCC1 Amb24384662 [0,1,0,1,0,0|0,0,1]=3 13021 B9R1.48 C[C@H]1CN(C)CCCN1 Amb22587589 [0,1,0,1,0,0|2,0,0]=4 13022 B9R1.48 C[C@H]1CN(C)CCCN1 Amb23385303 [0,1,0,1,0,0|2,0,0]=4 13023 B9R1.48 C[C@H]1C[C@@H](O)CCCC1 Amb25221381 [0,1,0,1,0,0|0,0,2]=4 13024 B9R1.48 Cl[C@@H]1C[C@H](Cl)CCCC1 Amb24480094 [0,1,0,1,0,0|1,0,1]=4 13025 B9R1.48 Cl[C@H]1C[C@H](Cl)CCCC1 Amb24531890 [0,1,0,1,0,0|1,0,1]=4 13026 B9R1.48 NC1CC(=O)NCCC1 Amb22229644 [0,1,0,1,0,0|1,0,0]=3 13027 B9R1.48 NC1CC(=O)NCCC1 Amb22276469 [0,1,0,1,0,0|1,0,0]=3 13028 B9R1.48 NC1CC(F)CCCC1 Amb24454709 [0,1,0,1,0,0|1,0,1]=4 13029 B9R1.48 NC1CC(O)CCCC1 Amb24374638 [0,1,0,1,0,0|0,0,2]=4 13030 B9R1.48 NC1CCCCC(=O)N1 Amb22492650 [0,1,0,1,0,0|1,0,0]=3 13031 B9R1.48 NC=1CCCCC(=O)C1 Amb25146097 [0,1,0,1,0,0|0,0,2]=4 13032 B9R1.48 N[C@@H]1CC(=O)NCCC1 Amb24442197 [0,1,0,1,0,0|1,0,0]=3 13033 B9R1.48 O=C1CC(=O)NCCC1 Amb18832700 [0,1,0,1,0,0|1,0,1]=4 13034 B9R1.48 O=C1CC(Br)CCCC1 Amb25685402 [0,1,0,1,0,0|0,0,0]=2 13035 B9R1.48 O=C1CC(Cl)CCCC1 Amb25061378 [0,1,0,1,0,0|0,0,0]=2 13036 B9R1.48 O=C1CC(Cl)CCCN1 Amb25105399 [0,1,0,1,0,0|1,0,0]=3 13037 B9R1.48 O=C1CCCCC(=O)C1 Amb10603368 [0,1,0,1,0,0|0,0,1]=3 13038 B9R1.48 O=C1CCCCC(=S)N1 Amb24374795 [0,1,0,1,0,0|1,0,1]=4 13039 B9R1.48 O=C1CCCCC(Cl)=C1 Amb24357156 [0,1,0,1,0,0|0,0,2]=4 13040 B9R1.48 O=C1CCCCC(Cl)N1 Amb25843742 [0,1,0,1,0,0|1,0,0]=3 13041 B9R1.48 O=C1COCCC(Cl)C1 Amb25102535 [0,1,0,1,0,0|1,0,0]=3 13042 B9R1.48 O=C1CSCCS(=O)C1 Amb25112564 [0,1,0,1,0,0|2,0,0]=4 13043 B9R1.48 OC1CC(=O)NCCC1 Amb25147021 [0,1,0,1,0,0|1,0,0]=3 13044 B9R1.48 OC1CCCCC(=O)N1 Amb24477685 [0,1,0,1,0,0|1,0,0]=3 13045 B9R1.48 O[C@@H]1CCCCC(=O)O1 Amb25296333 [0,1,0,1,0,0|1,0,0]=3 13046 B9R1.48 O[C@@H]1C[C@H](O)CCCC1 Amb24556565 [0,1,0,1,0,0|0,0,2]=4 13047 B9R1.48 O[C@H]1CCCCC(=O)O1 Amb24529319 [0,1,0,1,0,0|1,0,0]=3 13048 B9R1.48 O[C@H]1CCCCC(Br)=C1 Amb24466250 [0,1,0,1,0,0|1,0,1]=4 13049 B9R1.48 O[C@H]1C[C@H](O)CCCC1 Amb25288223 [0,1,0,1,0,0|0,0,2]=4 13050 B9R1.52 CC1CC(C)C1C(O)=O Amb25047286 [0,1,0,1,0,0|1,0,0]=3 13051 B9R1.52 CC1CC(C)N1C(N)=O Amb25215581 [0,1,0,1,0,0|2,0,0]=4 13052 B9R1.53 CC(=C)CC1CC(=O)N1 Amb25122775 [0,1,0,1,0,0|1,0,1]=4 13053 B9R1.53 CC(=C)C[C@@H]1CC(=O)N1 Amb25368714 [0,1,0,1,0,0|1,0,1]=4 13054 B9R1.53 CC(=O)CC1CN(C)C1 Amb25249609 [0,1,0,1,0,0|1,0,0]=3 13055 B9R1.53 CC(=O)CN1CC(O)C1 Amb25231501 [0,1,0,1,0,0|1,0,0]=3 13056 B9R1.53 CC(=O)NC1CC(=C)C1 Amb25214195 [0,1,0,1,0,0|1,0,1]=4 13057 B9R1.53 CC(=O)OC1CC(=O)C1 Amb21961279 [0,1,0,1,0,0|1,0,1]=4 13058 B9R1.53 CC(=O)OC1CC(Cl)C1 Amb25123136 [0,1,0,1,0,0|1,0,0]=3 13059 B9R1.53 CC(=O)O[C@@H]1C[C@@H](Cl)C1 Amb25725070 [0,1,0,1,0,0|1,0,0]=3 13060 B9R1.53 CC(=O)O[C@@H]1C[C@@H](O)C1 Amb25777769 [0,1,0,1,0,0|1,0,0]=3 13061 B9R1.53 CC(=O)O[C@H]1C[C@@H](Cl)C1 Amb25109325 [0,1,0,1,0,0|1,0,0]=3 13062 B9R1.53 CC(=O)SC1CC(O)C1 Amb24732003 [0,1,0,1,0,0|1,0,0]=3 13063 B9R1.53 CC(=O)S[C@@H]1C[C@@H](O)C1 Amb25344944 [0,1,0,1,0,0|1,0,0]=3 13064 B9R1.53 CC(C)CC1CC(N)C1 Amb24450562 [0,1,0,1,0,0|1,0,1]=4 13065 B9R1.53 CC(C)CC1CC(O)C1 Amb24679530 [0,1,0,1,0,0|0,0,2]=4 13066 B9R1.53 CC(C)CN1CC(=O)C1 Amb25340866 [0,1,0,1,0,0|1,0,0]=3 13067 B9R1.53 CC(C)OC1CC(=O)N1 Amb25145976 [0,1,0,1,0,0|2,0,0]=4 13068 B9R1.53 CC(N)CC1CN(C)C1 Amb24727512 [0,1,0,1,0,0|2,0,0]=4 13069 B9R1.53 CC1CC(C1)CC(C)N Amb24756873 [0,1,0,1,0,0|1,0,1]=4 13070 B9R1.53 CC1CC(C1)NC(C)=N Amb25090700 [0,1,0,1,0,0|2,0,0]=4 13071 B9R1.53 CC1CC(C1)NC(N)=O Amb23538249 [0,1,0,1,0,0|2,0,0]=4 13072 B9R1.53 CN(C)CC1CC(Br)C1 Amb24523084 [0,1,0,1,0,0|2,0,0]=4 13073 B9R1.53 CN(C)CC1CC(Cl)C1 Amb24529033 [0,1,0,1,0,0|2,0,0]=4 13074 B9R1.53 CN(C)CC1CC(N)C1 Amb25135633 [0,1,0,1,0,0|2,0,0]=4 13075 B9R1.53 CN(C)C[C@@H]1C[C@@H](N)C1 Amb25209521 [0,1,0,1,0,0|2,0,0]=4 13076 B9R1.53 CN(C)C[C@@H]1C[C@@H](O)C1 Amb24700348 [0,1,0,1,0,0|2,0,0]=4 13077 B9R1.53 CN(C)C[C@H]1C[C@@H](O)C1 Amb25326293 [0,1,0,1,0,0|2,0,0]=4 13078 B9R1.53 C[C@@H]1C[C@H](CC(O)=O)C1 Amb24372826 [0,1,0,1,0,0|1,0,0]=3 13079 B9R1.53 C[C@H]1C[C@H](C1)CC(C)=O Amb24722132 [0,1,0,1,0,0|0,0,0]=2 13080 B9R1.53 NC(=O)CN1CC(O)C1 Amb24761040 [0,1,0,1,0,0|2,0,0]=4 13081 B9R1.53 NC1CC(C1)OC(N)=O Amb25040399 [0,1,0,1,0,0|2,0,0]=4 13082 B9R1.53 NC1CC(CC(O)=O)C1 Amb23440231 [0,1,0,1,0,0|1,0,0]=3 13083 B9R1.53 NC1CN(C1)CC(O)=O Amb25347187 [0,1,0,1,0,0|2,0,0]=4 13084 B9R1.53 N[C@@H]1C[C@@H](CC(O)=O)C1 Amb23440233 [0,1,0,1,0,0|1,0,0]=3 13085 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb23440232 [0,1,0,1,0,0|1,0,0]=3 13086 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb24056536 [0,1,0,1,0,0|1,0,0]=3 13087 B9R1.53 O=C(Cl)CC1CC(Cl)C1 Amb25708345 [0,1,0,1,0,0|1,0,0]=3 13088 B9R1.53 O=C1CC(CC(F)F)C1 Amb25099504 [0,1,0,1,0,0|1,0,0]=3 13089 B9R1.53 OC(=O)CC1CC(Cl)C1 Amb25145965 [0,1,0,1,0,0|1,0,0]=3 13090 B9R1.53 OC1CC(C1)CC(O)=O Amb24481941 [0,1,0,1,0,0|1,0,0]=3 13091 B9R1.53 OC1CN(C1)CC(O)=O Amb25339150 [0,1,0,1,0,0|2,0,0]=4 13092 B9R1.53 O[C@@H]1C[C@H](C1)CC(O)=O Amb25204858 [0,1,0,1,0,0|1,0,0]=3 13093 B9R1.59 CC(C)C1CC1CNC Amb18995730 [0,1,0,1,0,0|1,0,1]=4 13094 B9R1.59 CC(O)[C@@H]1O[C@H]1CCC Amb24583802 [0,1,0,1,0,0|0,0,2]=4 13095 B9R1.59 CCCC1=CC1C(O)=O Amb24701359 [0,1,0,1,0,0|1,0,1]=4 13096 B9R1.59 CCCC1CC1C(N)=O Amb24473639 [0,1,0,1,0,0|1,0,0]=3 13097 B9R1.59 CCCC1CC1C(O)=O Amb19001459 [0,1,0,1,0,0|1,0,0]=3 13098 B9R1.59 CCCC1OC1C(O)=O Amb24561183 [0,1,0,1,0,0|1,0,0]=3 13099 B9R1.59 CCC[C@@H]1C[C@H]1C(O)=O Amb25368727 [0,1,0,1,0,0|1,0,0]=3 13100 B9R1.59 CCC[C@@H]1O[C@H]1C(C)=O Amb24366229 [0,1,0,1,0,0|0,0,0]=2 13101 B9R1.59 CCOC1CC1C(N)=O Amb24450491 [0,1,0,1,0,0|1,0,0]=3 13102 B9R1.59 CNC[C@@H]1C[C@H]1C(O)=O Amb24744378 [0,1,0,1,0,0|1,0,0]=3 13103 B9R1.59 C[C@H](O)[C@@H]1O[C@H]1CCC Amb24660197 [0,1,0,1,0,0|0,0,2]=4 13104 B9R1.59 OC(=O)[C@@H]1C[C@H]1CCBr Amb24519204 [0,1,0,1,0,0|1,0,0]=3 13105 B9R1.66 CC1(C)CC(=C)CCO1 Amb24478632 [0,1,0,1,0,0|2,0,0]=4 13106 B9R1.66 CC1(C)CC(=N)NCC1 Amb24481893 [0,1,0,1,0,0|2,0,0]=4 13107 B9R1.66 CC1(C)CC(=O)CCN1 Amb18832677 [0,1,0,1,0,0|1,0,0]=3 13108 B9R1.66 CC1(C)CC(=O)CCN1 Amb22756378 [0,1,0,1,0,0|1,0,0]=3 13109 B9R1.66 CC1(C)CC(=O)NCC1 Amb24451332 [0,1,0,1,0,0|1,0,0]=3 13110 B9R1.66 CC1(C)CC(N)CCC1 Amb25054220 [0,1,0,1,0,0|1,0,1]=4 13111 B9R1.66 CC1(C)CC(S)CCC1 Amb25147171 [0,1,0,1,0,0|0,1,1]=4 13112 B9R1.66 CC1(C)CCCC(N)=N1 Amb25694929 [0,1,0,1,0,0|2,0,0]=4 13113 B9R1.66 CC1(C)CCNC(=O)O1 Amb25083672 [0,1,0,1,0,0|2,0,0]=4 13114 B9R1.66 CC1(C)CN(N)CCC1 Amb25724356 [0,1,0,1,0,0|2,0,0]=4 13115 B9R1.66 CC1(C)CNCC(=O)N1 Amb25858036 [0,1,0,1,0,0|2,0,0]=4 13116 B9R1.66 CC1(C)CS(=O)CCN1 Amb24271114 [0,1,0,1,0,0|2,0,0]=4 13117 B9R1.66 CC1(C)CSCC(=O)C1 Amb21927887 [0,1,0,1,0,0|1,0,0]=3 13118 B9R1.66 CC1(C)C[C@@H](N)CCC1 Amb25213273 [0,1,0,1,0,0|1,0,1]=4 13119 B9R1.66 CC1(C)C[C@@H](O)CCC1 Amb24675497 [0,1,0,1,0,0|0,0,2]=4 13120 B9R1.66 CC1(C)C[C@H](O)CCC1 Amb24735248 [0,1,0,1,0,0|0,0,2]=4 13121 B9R1.66 CC1(Cl)CC(Cl)CCC1 Amb25702343 [0,1,0,1,0,0|1,0,1]=4 13122 B9R1.66 CC1(F)CC(O)CCC1 Amb24515861 [0,1,0,1,0,0|0,0,2]=4 13123 B9R1.66 CC1(N)CC(=O)CCC1 Amb25290133 [0,1,0,1,0,0|0,0,0]=2 13124 B9R1.66 CC1(O)CC(=O)NCC1 Amb24548836 [0,1,0,1,0,0|1,0,0]=3 13125 B9R1.66 CC1(O)CC(N)CCC1 Amb18642710 [0,1,0,1,0,0|0,0,2]=4 13126 B9R1.66 CC1(O)CCCC(=O)N1 Amb25373927 [0,1,0,1,0,0|1,0,0]=3 13127 B9R1.66 CC1(O)CCOC(=O)[13CH2]1 Amb22353493 [0,1,0,1,0,0|1,0,0]=3 13128 B9R1.66 CC1(O)CN(N)CCC1 Amb25765526 [0,1,0,1,0,0|2,0,0]=4 13129 B9R1.66 CC1(O)C[13CH2]CC(=O)C1 Amb22367566 [0,1,0,1,0,0|0,0,0]=2 13130 B9R1.66 CC1(S)CC(=O)CCC1 Amb24339898 [0,1,0,1,0,0|0,0,0]=2 13131 B9R1.66 CC1=NC(C)(C)CCO1 Amb22396066 [0,1,0,1,0,0|2,0,0]=4 13132 B9R1.66 CC1CC(C)(C)CCC1 Amb22232328 [0,1,0,1,0,0|1,0,1]=4 13133 B9R1.66 CC1CC(F)(F)CCC1 Amb19892744 [0,1,0,1,0,0|1,0,1]=4 13134 B9R1.66 CC1CCCC(C)(C)N1 Amb18642555 [0,1,0,1,0,0|1,0,1]=4 13135 B9R1.66 CC1CCCC(C)(C)O1 Amb24477890 [0,1,0,1,0,0|0,0,2]=4 13136 B9R1.66 CC1CS(=O)(=O)CCN1 Amb19515399 [0,1,0,1,0,0|2,0,0]=4 13137 B9R1.66 CC1C[C@](C)(N)CCC1 Amb24745751 [0,1,0,1,0,0|1,0,1]=4 13138 B9R1.66 CC=1CC(C)(C)CCC1 Amb24683640 [0,1,0,1,0,0|1,0,1]=4 13139 B9R1.66 CC=1CCCC(C)(C)C1 Amb24622005 [0,1,0,1,0,0|1,0,0]=3 13140 B9R1.66 CC=1CCCC(C)(C)N1 Amb24101420 [0,1,0,1,0,0|1,0,0]=3 13141 B9R1.66 CN1CC(C)(N)CCC1 Amb18203240 [0,1,0,1,0,0|2,0,0]=4 13142 B9R1.66 CN1CC(C)(O)CCC1 Amb24421024 [0,1,0,1,0,0|2,0,0]=4 13143 B9R1.66 C[C@@H]1CCCC(C)(C)N1 Amb24453232 [0,1,0,1,0,0|1,0,1]=4 13144 B9R1.66 C[C@@H]1CS(=O)(=O)CCN1 Amb24652818 [0,1,0,1,0,0|2,0,0]=4 13145 B9R1.66 C[C@@H]1CS(=O)(=O)CCO1 Amb25072952 [0,1,0,1,0,0|2,0,0]=4 13146 B9R1.66 C[C@@H]1C[C@](C)(N)CCC1 Amb25259809 [0,1,0,1,0,0|1,0,1]=4 13147 B9R1.66 C[C@@]1(O)CC(=O)OCC1 Amb22800043 [0,1,0,1,0,0|1,0,0]=3 13148 B9R1.66 C[C@H]1CS(=O)(=O)CCN1 Amb25246713 [0,1,0,1,0,0|2,0,0]=4 13149 B9R1.66 C[C@H]1C[C@](C)(N)CCC1 Amb19889798 [0,1,0,1,0,0|1,0,1]=4 13150 B9R1.66 C[C@H]1C[C@](C)(N)CCC1 Amb24568878 [0,1,0,1,0,0|1,0,1]=4 13151 B9R1.66 C[C@]1(O)CC(=O)OCC1 Amb22388612 [0,1,0,1,0,0|1,0,0]=3 13152 B9R1.66 C[C@]1(O)C[C@@H](N)CCC1 Amb24609881 [0,1,0,1,0,0|0,0,2]=4 13153 B9R1.66 C[C@]1(O)C[C@@H](O)CCC1 Amb25219285 [0,1,0,1,0,0|0,0,2]=4 13154 B9R1.66 C[C@]1(O)C[C@H](O)CCC1 Amb25176552 [0,1,0,1,0,0|0,0,2]=4 13155 B9R1.66 C[C@]1(S)C[C@@H](O)CCC1 Amb24704354 [0,1,0,1,0,0|0,0,2]=4 13156 B9R1.66 NC1CCCS(=O)(=O)C1 Amb13953229 [0,1,0,1,0,0|2,0,0]=4 13157 B9R1.66 NC1CS(=O)(=O)CCC1 Amb19319042 [0,1,0,1,0,0|2,0,0]=4 13158 B9R1.66 O=C1CC(F)(F)CCC1 Amb24543971 [0,1,0,1,0,0|1,0,0]=3 13159 B9R1.66 O=C1CC(F)(F)CCN1 Amb24567328 [0,1,0,1,0,0|2,0,0]=4 13160 B9R1.66 O=C1CCCC(C1)(C)C Amb13883565 [0,1,0,1,0,0|0,0,0]=2 13161 B9R1.66 O=C1CCCS(=O)(=O)C1 Amb13953230 [0,1,0,1,0,0|2,0,0]=4 13162 B9R1.66 O=C1CCSC(C1)(C)C Amb17593636 [0,1,0,1,0,0|1,0,0]=3 13163 B9R1.66 O=S1(=O)CC(Br)CCC1 Amb24449193 [0,1,0,1,0,0|2,0,0]=4 13164 B9R1.66 OC1(Cl)CC(=O)CCC1 Amb24576033 [0,1,0,1,0,0|1,0,0]=3 13165 B9R1.66 OC1CS(=O)(=O)CCC1 Amb20622668 [0,1,0,1,0,0|2,0,0]=4 13166 B9R1.66 [13CH3]C1(O)CC(=O)OCC1 Amb22367288 [0,1,0,1,0,0|1,0,0]=3 13167 B9R1.75 CC(CCC)CC1CO1 Amb25769573 [0,1,0,1,0,0|0,0,2]=4 13168 B9R1.75 CCCC(N)CC1CC1 Amb18832669 [0,1,0,1,0,0|1,0,1]=4 13169 B9R1.75 CCCC(O)CC1CC1 Amb25281509 [0,1,0,1,0,0|1,0,1]=4 13170 B9R1.75 CCCC(O)CC1CO1 Amb25739633 [0,1,0,1,0,0|0,0,2]=4 13171 B9R1.75 CCC[C@@H](O)CC1CC1 Amb25109763 [0,1,0,1,0,0|1,0,1]=4 13172 B9R1.75 CCC[C@H](O)CC1CC1 Amb25202528 [0,1,0,1,0,0|1,0,1]=4 13173 B9R1.75 CCC[C@H](O)C[C@@H]1CO1 Amb25221355 [0,1,0,1,0,0|0,0,2]=4 13174 B9R1.86 CC(=C)CC1OC1CO Amb24430852 [0,1,0,1,0,0|2,0,0]=4 13175 B9R1.86 CC(=C)C[C@@H]1O[C@H]1CCl Amb24617362 [0,1,0,1,0,0|2,0,0]=4 13176 B9R1.86 CC(=O)NC1CC1CO Amb25846832 [0,1,0,1,0,0|1,0,0]=3 13177 B9R1.86 CC(C)=CC1CC1CO Amb24684171 [0,1,0,1,0,0|1,0,1]=4 13178 B9R1.86 CC(C)CC1CC1CN Amb18302671 [0,1,0,1,0,0|1,0,1]=4 13179 B9R1.86 CC(C)CC1CC1CO Amb25756770 [0,1,0,1,0,0|1,0,1]=4 13180 B9R1.86 CC(N)=NC1CC1CO Amb24504882 [0,1,0,1,0,0|2,0,0]=4 13181 B9R1.86 CC(O)CC1CC1CC Amb24356232 [0,1,0,1,0,0|0,0,2]=4 13182 B9R1.86 CCC1CC1NC(C)=O Amb25208251 [0,1,0,1,0,0|0,0,0]=2 13183 B9R1.86 CCC1CC1NC(N)=N Amb25055361 [0,1,0,1,0,0|2,0,0]=4 13184 B9R1.86 CCC1CC1NC(N)=O Amb25208250 [0,1,0,1,0,0|1,0,0]=3 13185 B9R1.86 CN(C)CC1CC1CN Amb25175781 [0,1,0,1,0,0|2,0,0]=4 13186 B9R1.86 CN(C)C[C@@H]1C[C@@H]1CO Amb25219230 [0,1,0,1,0,0|2,0,0]=4 13187 B9R1.86 C[C@@H](O)C[C@@H]1C[C@@H]1CC Amb25204804 [0,1,0,1,0,0|0,0,2]=4 13188 B9R1.86 OC(=O)CC1CC1CBr Amb25269489 [0,1,0,1,0,0|1,0,0]=3 13189 B9R1.136 NCCC1CS(=O)(=O)C1 Amb25845705 [0,1,0,1,0,0|2,0,0]=4 13190 B9R1.136 O=S1(=O)CC(CCBr)C1 Amb24645610 [0,1,0,1,0,0|2,0,0]=4 13191 B9R1.136 O=S1(=O)CC(CCCl)C1 Amb25688873 [0,1,0,1,0,0|2,0,0]=4 13192 B9R1.136 O=S1(=O)CC(CCI)C1 Amb24654633 [0,1,0,1,0,0|2,0,0]=4 13193 B9R1.136 OCCC1CS(=O)(=O)C1 Amb25790952 [0,1,0,1,0,0|2,0,0]=4 13194 B9R1.137 CC(=C)CC(N)C1CC1 Amb24532851 [0,1,0,1,0,0|1,0,0]=3 13195 B9R1.137 CC(=C)CC(O)C1CC1 Amb24478669 [0,1,0,1,0,0|1,0,0]=3 13196 B9R1.137 CC(=O)CC(O)C1CC1 Amb25274131 [0,1,0,1,0,0|0,0,0]=2 13197 B9R1.137 CC(=O)NC(=O)C1CC1 Amb25258842 [0,1,0,1,0,0|1,0,1]=4 13198 B9R1.137 CC(=S)CC(=O)C1CC1 Amb24752830 [0,1,0,1,0,0|0,1,1]=4 13199 B9R1.137 CC(C)=CC(O)C1CC1 Amb25267402 [0,1,0,1,0,0|1,0,1]=4 13200 B9R1.137 CC(C)CC(N)C1CC1 Amb18993302 [0,1,0,1,0,0|1,0,1]=4 13201 B9R1.137 CC(CC(C)=O)=C1CC1 Amb25718421 [0,1,0,1,0,0|0,0,2]=4 13202 B9R1.137 CC(CC(C)Br)C1CC1 Amb25325631 [0,1,0,1,0,0|1,0,1]=4 13203 B9R1.137 CC(CC(C)Cl)C1CC1 Amb25737179 [0,1,0,1,0,0|1,0,1]=4 13204 B9R1.137 CC(CC(C)N)C1CC1 Amb25791148 [0,1,0,1,0,0|1,0,1]=4 13205 B9R1.137 CC(CC(C)O)C1CC1 Amb25117501 [0,1,0,1,0,0|0,0,2]=4 13206 B9R1.137 CC(NC(C)=O)C1CC1 Amb25355157 [0,1,0,1,0,0|1,0,0]=3 13207 B9R1.137 CN(C)CC(N)C1CC1 Amb18832584 [0,1,0,1,0,0|2,0,0]=4 13208 B9R1.137 CN(CC(N)=O)C1CC1 Amb25342036 [0,1,0,1,0,0|2,0,0]=4 13209 B9R1.137 CS(=O)CC(N)C1CC1 Amb24391211 [0,1,0,1,0,0|1,0,0]=3 13210 B9R1.137 C[C@H](OC(C)=O)C1CC1 Amb25767468 [0,1,0,1,0,0|1,0,0]=3 13211 B9R1.137 NC(CC(N)=O)C1CC1 Amb18988331 [0,1,0,1,0,0|1,0,0]=3 13212 B9R1.137 NC(CC(N)=O)C1CC1 Amb19307935 [0,1,0,1,0,0|1,0,0]=3 13213 B9R1.137 N[C@H](CC(N)=O)C1CC1 Amb25259754 [0,1,0,1,0,0|1,0,0]=3 13214 B9R1.137 N[C@H](CC(O)=O)C1CC1 Amb24349802 [0,1,0,1,0,0|1,0,0]=3 13215 B9R1.137 O=C(C1CC1)CC(=O)O Amb10576272 [0,1,0,1,0,0|1,0,1]=4 13216 B9R1.137 OC(=O)CS(=O)C1CC1 Amb25272361 [0,1,0,1,0,0|2,0,0]=4 13217 B9R1.137 OC(C1CC1)CC(=O)O Amb17231863 [0,1,0,1,0,0|1,0,0]=3 13218 B9R1.137 OC(CC(O)=O)C1CO1 Amb25854287 [0,1,0,1,0,0|2,0,0]=4 13219 B9R1.137 O[C@H](CC(O)=O)C1CC1 Amb25367343 [0,1,0,1,0,0|1,0,0]=3 13220 B9R1.137 [O-]C(=O)C[C@@H](O)[C@H]1CO1 Amb25302277 [0,1,0,1,0,0|2,0,0]=4 13221 B9R1.137 [O-][N+](=O)CC(O)C1CC1 Amb22262975 [0,1,0,1,0,0|2,0,0]=4 13222 B9R1.171 CC(=C)CC1(O)COC1 Amb22896984 [0,1,0,1,0,0|2,0,0]=4 13223 B9R1.171 CC(=O)NC1(C)CCC1 Amb16229572 [0,1,0,1,0,0|1,0,0]=3 13224 B9R1.171 CC(=O)OC1(C)CCC1 Amb24481922 [0,1,0,1,0,0|1,0,0]=3 13225 B9R1.171 CC(C)CC1(N)CCC1 Amb25705758 [0,1,0,1,0,0|1,0,1]=4 13226 B9R1.171 CC(N)CC1(C)CCC1 Amb25068591 [0,1,0,1,0,0|1,0,1]=4 13227 B9R1.171 CC1(CC(N)=N)CCC1 Amb25195221 [0,1,0,1,0,0|2,0,0]=4 13228 B9R1.171 CC1(CC(N)=O)CCC1 Amb25772136 [0,1,0,1,0,0|1,0,0]=3 13229 B9R1.171 CC1(CC(O)=O)CCC1 Amb22735897 [0,1,0,1,0,0|1,0,0]=3 13230 B9R1.171 CC1(CCC1)OC(N)=O Amb25230380 [0,1,0,1,0,0|2,0,0]=4 13231 B9R1.171 CC1(COC1)CC(O)=O Amb20671333 [0,1,0,1,0,0|2,0,0]=4 13232 B9R1.171 CN(C)CC1(C)CCC1 Amb25742658 [0,1,0,1,0,0|2,0,0]=4 13233 B9R1.171 NC(=O)CC1(N)CCC1 Amb20622461 [0,1,0,1,0,0|1,0,0]=3 13234 B9R1.171 NC(=O)CC1(N)CCC1 Amb22059756 [0,1,0,1,0,0|1,0,0]=3 13235 B9R1.171 NC(=O)CC1(N)COC1 Amb22039447 [0,1,0,1,0,0|2,0,0]=4 13236 B9R1.171 NC1(CC(O)=O)CCC1 Amb20623514 [0,1,0,1,0,0|1,0,0]=3 13237 B9R1.171 NC1(CC(O)=O)CCC1 Amb22059493 [0,1,0,1,0,0|1,0,0]=3 13238 B9R1.171 NC1(COC1)CC(O)=O Amb20671385 [0,1,0,1,0,0|2,0,0]=4 13239 B9R1.171 OC(=O)CC1(F)COC1 Amb24564061 [0,1,0,1,0,0|2,0,0]=4 13240 B9R1.171 OC(=O)CC1(O)CCC1 Amb18961452 [0,1,0,1,0,0|1,0,0]=3 13241 B9R1.171 OC(=O)CC1(O)CNC1 Amb25041173 [0,1,0,1,0,0|2,0,0]=4 13242 B9R1.171 [O-][N+](=O)CC1(O)CCC1 Amb19958573 [0,1,0,1,0,0|2,0,0]=4 13243 B9R1.177 CCCC1(F)CC(N)C1 Amb25078224 [0,1,0,1,0,0|1,0,1]=4 13244 B9R1.177 CCCC1(N)CC(C)C1 Amb23449243 [0,1,0,1,0,0|1,0,1]=4 13245 B9R1.177 COCC1(C)CC(=O)C1 Amb25112540 [0,1,0,1,0,0|1,0,0]=3 13246 B9R1.183 CC1CC1[C@@H](N)CCC Amb25702074 [0,1,0,1,0,0|1,0,1]=4 13247 B9R1.183 CC1CC1[C@H](N)CCC Amb25111025 [0,1,0,1,0,0|1,0,1]=4 13248 B9R1.183 CCCC(=O)C1CC1=C Amb24378316 [0,1,0,1,0,0|1,0,1]=4 13249 B9R1.183 CCCC(C)C1OC1C Amb24596468 [0,1,0,1,0,0|0,0,2]=4 13250 B9R1.183 CCCC(O)C1CC1=C Amb25800899 [0,1,0,1,0,0|1,0,0]=3 13251 B9R1.183 CCC[C@H](O)[C@@H]1CC1=C Amb24541572 [0,1,0,1,0,0|1,0,0]=3 13252 B9R1.1 BrCC1CCC(=C)CC1 Amb15695263 [0,1,0,1,0,0|2,0,0]=4 13253 B9R1.1 CC1CCC(CC1)CC Amb22227949 [0,1,0,1,0,0|1,0,1]=4 13254 B9R1.1 CC=1CCC(CBr)CC1 Amb25298144 [0,1,0,1,0,0|2,0,0]=4 13255 B9R1.1 CC=1CCC(CBr)ON1 Amb24480136 [0,1,0,1,0,0|1,0,1]=4 13256 B9R1.1 CC=1CCC(CN)CC1 Amb18642352 [0,1,0,1,0,0|2,0,0]=4 13257 B9R1.1 CCC1CCC(=S)CC1 Amb24478607 [0,1,0,1,0,0|0,1,0]=3 13258 B9R1.1 CCC1CCC(CC1)N Amb1117745 [0,1,0,1,0,0|1,0,1]=4 13259 B9R1.1 CCC1CCC(I)CC1 Amb25147180 [0,1,0,1,0,0|1,0,1]=4 13260 B9R1.1 CCC1CCC(O)OC1 Amb24593816 [0,1,0,1,0,0|0,0,2]=4 13261 B9R1.1 CCC1CNC(=O)CC1 Amb25727228 [0,1,0,1,0,0|0,0,0]=2 13262 B9R1.1 CCC1CNC(=O)CN1 Amb18832614 [0,1,0,1,0,0|1,0,0]=3 13263 B9R1.1 CCC1CNC(=O)CS1 Amb24597647 [0,1,0,1,0,0|1,0,0]=3 13264 B9R1.1 CCC1CNC(=O)OC1 Amb24645209 [0,1,0,1,0,0|1,0,0]=3 13265 B9R1.1 CCC=1CCC(=O)NN1 Amb24061570 [0,1,0,1,0,0|1,0,1]=4 13266 B9R1.1 CCN1CCC(=CC1)Br Amb13888776 [0,1,0,1,0,0|2,0,0]=4 13267 B9R1.1 CC[C@@H]1CCC(=O)C=C1 Amb24736307 [0,1,0,1,0,0|0,0,1]=3 13268 B9R1.1 CC[C@@H]1CC[C@@H](Br)CC1 Amb25363274 [0,1,0,1,0,0|1,0,1]=4 13269 B9R1.1 CC[C@@H]1CC[C@@H](O)CC1 Amb22231677 [0,1,0,1,0,0|0,0,2]=4 13270 B9R1.1 CC[C@H]1CC[C@@H](N)CC1 Amb25731260 [0,1,0,1,0,0|1,0,1]=4 13271 B9R1.1 CNC1CCC(=O)CC1 Amb10602371 [0,1,0,1,0,0|1,0,0]=3 13272 B9R1.1 CNC1CCC(=O)CC1 Amb22170247 [0,1,0,1,0,0|1,0,0]=3 13273 B9R1.1 CNC1CCS(=O)CC1 Amb18948971 [0,1,0,1,0,0|2,0,0]=4 13274 B9R1.1 CNC1CCS(=O)CC1 Amb19374966 [0,1,0,1,0,0|2,0,0]=4 13275 B9R1.1 COC1CC=C(C)CC1 Amb25279365 [0,1,0,1,0,0|2,0,0]=4 13276 B9R1.1 COC1CCC(=C)CC1 Amb24481794 [0,1,0,1,0,0|2,0,0]=4 13277 B9R1.1 COC1CCC(=O)CC1 Amb2385260 [0,1,0,1,0,0|1,0,0]=3 13278 B9R1.1 CON1CCC(=O)CC1 Amb20670427 [0,1,0,1,0,0|2,0,0]=4 13279 B9R1.1 CSC1CCC(=O)CC1 Amb25707895 [0,1,0,1,0,0|1,0,0]=3 13280 B9R1.1 C[C@@H]1CC[C@H](CC1)CC Amb22231656 [0,1,0,1,0,0|1,0,1]=4 13281 B9R1.1 C[C@H]1CC[C@H](CC1)CC Amb22230416 [0,1,0,1,0,0|1,0,1]=4 13282 B9R1.1 N#CC1CCC(=O)CC1 Amb16231535 [0,1,0,1,0,0|1,0,1]=4 13283 B9R1.1 N#CC1CCC(=O)CS1 Amb23596953 [0,1,0,1,0,0|1,0,1]=4 13284 B9R1.1 N#CC1CNC(=O)CC1 Amb25314394 [0,1,0,1,0,0|1,0,1]=4 13285 B9R1.1 NCC1CC=C(F)CC1 Amb25354297 [0,1,0,1,0,0|2,0,0]=4 13286 B9R1.1 NCC1CCC(=C)CC1 Amb13882965 [0,1,0,1,0,0|2,0,0]=4 13287 B9R1.1 NCC1CCC(=O)CC1 Amb20247631 [0,1,0,1,0,0|1,0,0]=3 13288 B9R1.1 NCC1CNC(=O)CC1 Amb18832607 [0,1,0,1,0,0|1,0,0]=3 13289 B9R1.1 NCC1CNC(=O)CN1 Amb25194789 [0,1,0,1,0,0|2,0,0]=4 13290 B9R1.1 NCC1CNC(=O)CO1 Amb22235660 [0,1,0,1,0,0|2,0,0]=4 13291 B9R1.1 NCC1CNC(=O)CO1 Amb24682214 [0,1,0,1,0,0|2,0,0]=4 13292 B9R1.1 NCC1CNC(=O)CS1 Amb25242244 [0,1,0,1,0,0|2,0,0]=4 13293 B9R1.1 O=C1CCC(CBr)CN1 Amb23597460 [0,1,0,1,0,0|1,0,0]=3 13294 B9R1.1 O=C1CCC(CF)CC1 Amb25217167 [0,1,0,1,0,0|1,0,0]=3 13295 B9R1.1 OCC1CCC(=C)CC1 Amb10975464 [0,1,0,1,0,0|2,0,0]=4 13296 B9R1.1 OCC1CCC(=O)CC1 Amb10071596 [0,1,0,1,0,0|1,0,0]=3 13297 B9R1.1 OCC1CCC(=O)CN1 Amb25207554 [0,1,0,1,0,0|1,0,0]=3 13298 B9R1.1 OCC1CNC(=O)CC1 Amb19958990 [0,1,0,1,0,0|1,0,0]=3 13299 B9R1.1 OCC1CNC(=O)CN1 Amb25187358 [0,1,0,1,0,0|2,0,0]=4 13300 B9R1.1 OCC1CNC(=O)CO1 Amb22236094 [0,1,0,1,0,0|2,0,0]=4 13301 B9R1.1 OCC1CNC(=O)CS1 Amb25374316 [0,1,0,1,0,0|2,0,0]=4 13302 B9R1.1 OCC1CNC(=O)NC1 Amb25291682 [0,1,0,1,0,0|2,0,0]=4 13303 B9R1.1 OCC1CNC(=O)OC1 Amb25247634 [0,1,0,1,0,0|2,0,0]=4 13304 B9R1.1 OC[C@@H]1CNC(=O)CO1 Amb10067153 [0,1,0,1,0,0|2,0,0]=4 13305 B9R1.1 [C-]#[N+]C1CCC(=O)CC1 Amb25783347 [0,1,0,1,0,0|1,0,1]=4 13306 B9R1.2 BrCC1CCCN(C1)C Amb15701567 [0,1,0,1,0,0|2,0,0]=4 13307 B9R1.2 C#C[C@H]1CC(=O)CCC1 Amb24378497 [0,1,0,1,0,0|0,0,1]=3 13308 B9R1.2 C=C1CC(CO)NCC1 Amb25219592 [0,1,0,1,0,0|2,0,0]=4 13309 B9R1.2 C=CC1CCCC(=O)O1 Amb25687134 [0,1,0,1,0,0|1,0,1]=4 13310 B9R1.2 C=CC1CNCC(=O)C1 Amb25804731 [0,1,0,1,0,0|0,0,2]=4 13311 B9R1.2 CC1=NC(CBr)CCO1 Amb25123982 [0,1,0,1,0,0|2,0,0]=4 13312 B9R1.2 CC1CC(C=C)=CCC1 Amb24481663 [0,1,0,1,0,0|1,0,1]=4 13313 B9R1.2 CC1CC(C=O)=CCC1 Amb18642246 [0,1,0,1,0,0|0,0,1]=3 13314 B9R1.2 CC1CC(C=O)OCC1 Amb25032291 [0,1,0,1,0,0|1,0,1]=4 13315 B9R1.2 CC1CC(CBr)=CCC1 Amb25804111 [0,1,0,1,0,0|1,0,1]=4 13316 B9R1.2 CC1CC(CBr)CCC1 Amb22059638 [0,1,0,1,0,0|1,0,1]=4 13317 B9R1.2 CC1CC(CCC1)C=C Amb24478706 [0,1,0,1,0,0|1,0,1]=4 13318 B9R1.2 CC1CC(CCC1)C=O Amb22059519 [0,1,0,1,0,0|0,0,1]=3 13319 B9R1.2 CC1CC(CCN1)CC Amb25063477 [0,1,0,1,0,0|1,0,1]=4 13320 B9R1.2 CC1CC(CCO1)=NO Amb24425946 [0,1,0,1,0,0|1,0,1]=4 13321 B9R1.2 CC1CC(CCO1)C=O Amb18642617 [0,1,0,1,0,0|1,0,1]=4 13322 B9R1.2 CC1CC(CO)CCC1 Amb20248640 [0,1,0,1,0,0|0,0,2]=4 13323 B9R1.2 CC1CCCC(CC)N1 Amb25146110 [0,1,0,1,0,0|1,0,1]=4 13324 B9R1.2 CC1CCCC(CF)N1 Amb25768224 [0,1,0,1,0,0|1,0,1]=4 13325 B9R1.2 CC1CCCC(CO)=C1 Amb25811041 [0,1,0,1,0,0|1,0,0]=3 13326 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [0,1,0,1,0,0|1,0,1]=4 13327 B9R1.2 CC1CCCC(CO)O1 Amb25085302 [0,1,0,1,0,0|0,0,2]=4 13328 B9R1.2 CC1CCCC(N1)=NN Amb24745015 [0,1,0,1,0,0|2,0,0]=4 13329 B9R1.2 CC1CCNC(CCl)=N1 Amb24721134 [0,1,0,1,0,0|2,0,0]=4 13330 B9R1.2 CC1CCSC(CC)N1 Amb24532853 [0,1,0,1,0,0|1,0,1]=4 13331 B9R1.2 CC1CN(CCC1)C=O Amb25066806 [0,1,0,1,0,0|1,0,0]=3 13332 B9R1.2 CC1CN(CCS1)C=O Amb24601318 [0,1,0,1,0,0|2,0,0]=4 13333 B9R1.2 CC1CNCC(C1)CC Amb24477764 [0,1,0,1,0,0|1,0,1]=4 13334 B9R1.2 CC1COCC(CC)N1 Amb18063152 [0,1,0,1,0,0|1,0,1]=4 13335 B9R1.2 CC1NC(CCN1)CC Amb24477765 [0,1,0,1,0,0|1,0,1]=4 13336 B9R1.2 CC=1CC(CN)CCC1 Amb18642353 [0,1,0,1,0,0|1,0,1]=4 13337 B9R1.2 CC=1CC(CO)CCC1 Amb25320000 [0,1,0,1,0,0|1,0,1]=4 13338 B9R1.2 CCC1C=CCC(=O)N1 Amb24477360 [0,1,0,1,0,0|1,0,1]=4 13339 B9R1.2 CCC1CC(=C)CCC1 Amb24420328 [0,1,0,1,0,0|1,0,0]=3 13340 B9R1.2 CCC1CC(=O)C=CS1 Amb25373158 [0,1,0,1,0,0|0,0,2]=4 13341 B9R1.2 CCC1CC(=O)CCC1 Amb19335038 [0,1,0,1,0,0|0,0,0]=2 13342 B9R1.2 CCC1CC(=O)CCN1 Amb22228813 [0,1,0,1,0,0|0,0,0]=2 13343 B9R1.2 CCC1CC(=O)CCN1 Amb24589388 [0,1,0,1,0,0|0,0,0]=2 13344 B9R1.2 CCC1CC(=O)CCO1 Amb19373926 [0,1,0,1,0,0|0,0,0]=2 13345 B9R1.2 CCC1CC(=O)NCC1 Amb25791122 [0,1,0,1,0,0|0,0,0]=2 13346 B9R1.2 CCC1CC(=O)OCC1 Amb24707973 [0,1,0,1,0,0|0,0,0]=2 13347 B9R1.2 CCC1CC(Br)CCO1 Amb24432480 [0,1,0,1,0,0|1,0,1]=4 13348 B9R1.2 CCC1CC(N)=NCC1 Amb25779626 [0,1,0,1,0,0|1,0,0]=3 13349 B9R1.2 CCC1CC(N)CCN1 Amb25320367 [0,1,0,1,0,0|1,0,1]=4 13350 B9R1.2 CCC1CC(N)CCO1 Amb19373927 [0,1,0,1,0,0|1,0,1]=4 13351 B9R1.2 CCC1CC(O)CCO1 Amb24391236 [0,1,0,1,0,0|0,0,2]=4 13352 B9R1.2 CCC1CC(O)CCS1 Amb24464826 [0,1,0,1,0,0|0,0,2]=4 13353 B9R1.2 CCC1CC(S)CCO1 Amb25724681 [0,1,0,1,0,0|0,1,1]=4 13354 B9R1.2 CCC1CCCC(=O)N1 Amb13883424 [0,1,0,1,0,0|1,0,0]=3 13355 B9R1.2 CCC1CCCC(Br)C1 Amb25793528 [0,1,0,1,0,0|1,0,1]=4 13356 B9R1.2 CCC1CCCC(C1)O Amb17593352 [0,1,0,1,0,0|0,0,2]=4 13357 B9R1.2 CCC1CCCC(Cl)C1 Amb24737995 [0,1,0,1,0,0|1,0,1]=4 13358 B9R1.2 CCC1CCCC(N)C1 Amb19374220 [0,1,0,1,0,0|1,0,1]=4 13359 B9R1.2 CCC1CCNC(O)=N1 Amb24481964 [0,1,0,1,0,0|1,0,1]=4 13360 B9R1.2 CCC1CN(C)CCN1 Amb18832590 [0,1,0,1,0,0|2,0,0]=4 13361 B9R1.2 CCC1CNCC(=O)N1 Amb24427566 [0,1,0,1,0,0|1,0,0]=3 13362 B9R1.2 CCC1COCC(=O)N1 Amb10608051 [0,1,0,1,0,0|1,0,0]=3 13363 B9R1.2 CCC1CSCC(=O)N1 Amb24476643 [0,1,0,1,0,0|1,0,0]=3 13364 B9R1.2 CCC=1CCC[C@H](O)C1 Amb25207396 [0,1,0,1,0,0|2,0,0]=4 13365 B9R1.2 CCC=1CCNC(C)C1 Amb24478591 [0,1,0,1,0,0|2,0,0]=4 13366 B9R1.2 CCN1CC(=O)CCC1 Amb23440927 [0,1,0,1,0,0|0,0,0]=2 13367 B9R1.2 CCN1CC(=O)NCC1 Amb19516973 [0,1,0,1,0,0|1,0,0]=3 13368 B9R1.2 CCN1CC(=O)NCC1 Amb21961561 [0,1,0,1,0,0|1,0,0]=3 13369 B9R1.2 CCN1CC(=O)OCC1 Amb24367827 [0,1,0,1,0,0|1,0,0]=3 13370 B9R1.2 CCN1CC(Br)CCC1 Amb25831004 [0,1,0,1,0,0|1,0,1]=4 13371 B9R1.2 CCN1CC(C)CCC1 Amb22291782 [0,1,0,1,0,0|1,0,1]=4 13372 B9R1.2 CCN1CC(Cl)CCC1 Amb19651964 [0,1,0,1,0,0|1,0,1]=4 13373 B9R1.2 CCN1CC(Cl)CCC1 Amb21961612 [0,1,0,1,0,0|1,0,1]=4 13374 B9R1.2 CCN1CC(N)CCC1 Amb19374686 [0,1,0,1,0,0|1,0,1]=4 13375 B9R1.2 CCN1CC(N)CCC1 Amb22055228 [0,1,0,1,0,0|1,0,1]=4 13376 B9R1.2 CCN1CCC=C(C1)Br Amb13888778 [0,1,0,1,0,0|1,0,1]=4 13377 B9R1.2 CCN1CCCC(C1)N Amb1099118 [0,1,0,1,0,0|1,0,1]=4 13378 B9R1.2 CCN1CCC[C@@H](C1)N Amb17134811 [0,1,0,1,0,0|1,0,1]=4 13379 B9R1.2 CCN1C[C@H](Cl)CCC1 Amb24390309 [0,1,0,1,0,0|1,0,1]=4 13380 B9R1.2 CCN1C[C@H](N)CCC1 Amb24393166 [0,1,0,1,0,0|1,0,1]=4 13381 B9R1.2 CC[C@@H]1CC(=O)CCC1 Amb25373198 [0,1,0,1,0,0|0,0,0]=2 13382 B9R1.2 CC[C@@H]1CC(=O)CCN1 Amb24558461 [0,1,0,1,0,0|0,0,0]=2 13383 B9R1.2 CC[C@@H]1CC(=O)CCO1 Amb25373176 [0,1,0,1,0,0|0,0,0]=2 13384 B9R1.2 CC[C@@H]1CCCC(=O)N1 Amb22746831 [0,1,0,1,0,0|1,0,0]=3 13385 B9R1.2 CC[C@@H]1CN(C)CCN1 Amb25147060 [0,1,0,1,0,0|2,0,0]=4 13386 B9R1.2 CC[C@@H]1COCC(=O)N1 Amb25146204 [0,1,0,1,0,0|1,0,0]=3 13387 B9R1.2 CC[C@@H]1C[C@@H](O)CCO1 Amb25175513 [0,1,0,1,0,0|0,0,2]=4 13388 B9R1.2 CC[C@H]1CC(=O)CCN1 Amb24652709 [0,1,0,1,0,0|0,0,0]=2 13389 B9R1.2 CC[C@H]1CC(=O)CCO1 Amb24633506 [0,1,0,1,0,0|0,0,0]=2 13390 B9R1.2 CC[C@H]1CCC[C@H](N)C1 Amb25369620 [0,1,0,1,0,0|1,0,1]=4 13391 B9R1.2 CC[C@H]1CN(C)CCN1 Amb25756657 [0,1,0,1,0,0|2,0,0]=4 13392 B9R1.2 CC[C@H]1COCC(=O)N1 Amb25831485 [0,1,0,1,0,0|1,0,0]=3 13393 B9R1.2 CC[C@H]1C[C@@H](Cl)CCO1 Amb25241544 [0,1,0,1,0,0|1,0,1]=4 13394 B9R1.2 CC[C@H]1C[C@H](O)CCO1 Amb25215427 [0,1,0,1,0,0|0,0,2]=4 13395 B9R1.2 CN1CC(=CCC1)C=O Amb17593300 [0,1,0,1,0,0|1,0,1]=4 13396 B9R1.2 CN1CC(CBr)CCC1 Amb21959789 [0,1,0,1,0,0|2,0,0]=4 13397 B9R1.2 CN1CC(CCl)CCC1 Amb19514801 [0,1,0,1,0,0|2,0,0]=4 13398 B9R1.2 CN1CC(CI)CCC1 Amb21860300 [0,1,0,1,0,0|2,0,0]=4 13399 B9R1.2 CN1C[C@@H](CN)CCC1 Amb22405892 [0,1,0,1,0,0|2,0,0]=4 13400 B9R1.2 CN1C[C@@H](CN)CCC1 Amb22899759 [0,1,0,1,0,0|2,0,0]=4 13401 B9R1.2 CN1C[C@H](CN)CCC1 Amb22405895 [0,1,0,1,0,0|2,0,0]=4 13402 B9R1.2 CNC1=CC(=O)CCC1 Amb2386653 [0,1,0,1,0,0|0,0,2]=4 13403 B9R1.2 CNC1CCCC(C1)C Amb1112718 [0,1,0,1,0,0|1,0,1]=4 13404 B9R1.2 CNC1CCCC(F)C1 Amb25312690 [0,1,0,1,0,0|1,0,1]=4 13405 B9R1.2 CNC1CCCC(N)C1 Amb24098472 [0,1,0,1,0,0|1,0,1]=4 13406 B9R1.2 CNC1CCCC(O)C1 Amb18642723 [0,1,0,1,0,0|0,0,2]=4 13407 B9R1.2 CNC1CCNC(=O)N1 Amb25808930 [0,1,0,1,0,0|2,0,0]=4 13408 B9R1.2 CNC1CN(C)CCC1 Amb18947664 [0,1,0,1,0,0|2,0,0]=4 13409 B9R1.2 CN[C@@H]1CC(C)=CCC1 Amb24630194 [0,1,0,1,0,0|1,0,1]=4 13410 B9R1.2 CN[C@@H]1CN(C)CCC1 Amb22230929 [0,1,0,1,0,0|2,0,0]=4 13411 B9R1.2 CN[C@H]1CC(C)=CCC1 Amb24623003 [0,1,0,1,0,0|1,0,1]=4 13412 B9R1.2 CN[C@H]1CCC[C@H](O)C1 Amb24712944 [0,1,0,1,0,0|0,0,2]=4 13413 B9R1.2 CN[C@H]1CN(C)CCC1 Amb22230886 [0,1,0,1,0,0|2,0,0]=4 13414 B9R1.2 COC1CC(=C)CCC1 Amb24654634 [0,1,0,1,0,0|1,0,0]=3 13415 B9R1.2 COC1CC(=O)CCC1 Amb20671002 [0,1,0,1,0,0|0,0,0]=2 13416 B9R1.2 COC1CC=CC(=O)C1 Amb24636360 [0,1,0,1,0,0|0,0,2]=4 13417 B9R1.2 COC1CCCC(Br)C1 Amb24436237 [0,1,0,1,0,0|1,0,1]=4 13418 B9R1.2 COC1CCCC(C1)N Amb13894888 [0,1,0,1,0,0|1,0,1]=4 13419 B9R1.2 COC1CCCC(C1)O Amb13951102 [0,1,0,1,0,0|0,0,2]=4 13420 B9R1.2 COC1CCCC(Cl)C1 Amb25040040 [0,1,0,1,0,0|1,0,1]=4 13421 B9R1.2 COC1CCCC(I)C1 Amb25147176 [0,1,0,1,0,0|1,0,1]=4 13422 B9R1.2 COC=1CCCC(=O)C1 Amb19930192 [0,1,0,1,0,0|0,0,2]=4 13423 B9R1.2 CO[C@@H]1CCC[C@@H](Br)C1 Amb24519451 [0,1,0,1,0,0|1,0,1]=4 13424 B9R1.2 CO[C@@H]1CCC[C@H](N)C1 Amb25834599 [0,1,0,1,0,0|1,0,1]=4 13425 B9R1.2 CO[C@H]1CCC[C@@H](N)C1 Amb24539646 [0,1,0,1,0,0|1,0,1]=4 13426 B9R1.2 CO[C@H]1CCC[C@@H](O)C1 Amb25271471 [0,1,0,1,0,0|0,0,2]=4 13427 B9R1.2 CSC1CC(=O)CCC1 Amb25328147 [0,1,0,1,0,0|0,0,0]=2 13428 B9R1.2 CSC1CCCC(Cl)C1 Amb24433965 [0,1,0,1,0,0|1,0,1]=4 13429 B9R1.2 CSC1CCCC(N)C1 Amb19335809 [0,1,0,1,0,0|1,0,1]=4 13430 B9R1.2 CSC=1CCCC(=O)C1 Amb25735167 [0,1,0,1,0,0|0,0,2]=4 13431 B9R1.2 CS[C@@H]1CCC[C@@H](Cl)C1 Amb24540821 [0,1,0,1,0,0|1,0,1]=4 13432 B9R1.2 CS[C@@H]1CCC[C@H](Cl)C1 Amb24612102 [0,1,0,1,0,0|1,0,1]=4 13433 B9R1.2 C[C@@H]1CCC[C@@H](C1)CC Amb22230415 [0,1,0,1,0,0|1,0,1]=4 13434 B9R1.2 C[C@@H]1CCC[C@@H](CO)N1 Amb24585706 [0,1,0,1,0,0|1,0,1]=4 13435 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [0,1,0,1,0,0|1,0,1]=4 13436 B9R1.2 C[C@@H]1COC[C@@H](CC)N1 Amb24424122 [0,1,0,1,0,0|1,0,1]=4 13437 B9R1.2 C[C@@H]1C[C@@H](CCO1)C=O Amb25195965 [0,1,0,1,0,0|1,0,1]=4 13438 B9R1.2 C[C@@H]1C[C@H](C=O)OCC1 Amb25366622 [0,1,0,1,0,0|1,0,1]=4 13439 B9R1.2 C[C@@H]1C[C@H](CO)CCC1 Amb25176090 [0,1,0,1,0,0|0,0,2]=4 13440 B9R1.2 C[C@H]1CC(CCC1)C=O Amb24648931 [0,1,0,1,0,0|0,0,1]=3 13441 B9R1.2 C[C@H]1CC(CN)CCC1 Amb24569298 [0,1,0,1,0,0|1,0,1]=4 13442 B9R1.2 C[C@H]1CCC[C@@H](CC)N1 Amb24562231 [0,1,0,1,0,0|1,0,1]=4 13443 B9R1.2 C[C@H]1CCC[C@@H](CO)N1 Amb25174876 [0,1,0,1,0,0|1,0,1]=4 13444 B9R1.2 C[C@H]1CCC[C@@H](CO)O1 Amb25259234 [0,1,0,1,0,0|0,0,2]=4 13445 B9R1.2 C[C@H]1CCC[C@H](C1)CC Amb25756224 [0,1,0,1,0,0|1,0,1]=4 13446 B9R1.2 C[C@H]1CN(CCN1)C=O Amb25113420 [0,1,0,1,0,0|2,0,0]=4 13447 B9R1.2 C[C@H]1C[C@H](C=O)OCC1 Amb25339741 [0,1,0,1,0,0|1,0,1]=4 13448 B9R1.2 C[C@H]1C[C@H](CO)CCC1 Amb24519733 [0,1,0,1,0,0|0,0,2]=4 13449 B9R1.2 C\C=C\1/CC(N)CCC1 Amb25225108 [0,1,0,1,0,0|2,0,0]=4 13450 B9R1.2 ClC1CCCC(C1)CCl Amb25064320 [0,1,0,1,0,0|1,0,1]=4 13451 B9R1.2 ClCC1CCCC(=O)C1 Amb17593666 [0,1,0,1,0,0|0,0,0]=2 13452 B9R1.2 N#CC1CC(=O)CCC1 Amb18642100 [0,1,0,1,0,0|0,0,1]=3 13453 B9R1.2 N#CC1CC(=O)CCN1 Amb18203328 [0,1,0,1,0,0|1,0,1]=4 13454 B9R1.2 N#CC1CCCC(=O)N1 Amb24477787 [0,1,0,1,0,0|1,0,1]=4 13455 B9R1.2 NC1CC(CF)CCC1 Amb24654055 [0,1,0,1,0,0|1,0,1]=4 13456 B9R1.2 NC1CC(CO)CCC1 Amb24426645 [0,1,0,1,0,0|1,0,1]=4 13457 B9R1.2 NC1CN(CCC1)C=O Amb25684164 [0,1,0,1,0,0|2,0,0]=4 13458 B9R1.2 NCC1CC(=O)NCC1 Amb18832611 [0,1,0,1,0,0|1,0,0]=3 13459 B9R1.2 NCC1CC(=O)NCC1 Amb22405878 [0,1,0,1,0,0|1,0,0]=3 13460 B9R1.2 NCC1CCCC(=O)N1 Amb18832610 [0,1,0,1,0,0|1,0,0]=3 13461 B9R1.2 NCC1CCCC(=O)N1 Amb22754591 [0,1,0,1,0,0|1,0,0]=3 13462 B9R1.2 NCC1CCCC(C1)N Amb16233731 [0,1,0,1,0,0|1,0,1]=4 13463 B9R1.2 NCC1CCCN(C1)C Amb1995183 [0,1,0,1,0,0|2,0,0]=4 13464 B9R1.2 NCC1COCC(=O)N1 Amb24481993 [0,1,0,1,0,0|2,0,0]=4 13465 B9R1.2 NNC1CCCC(C1)C Amb10610509 [0,1,0,1,0,0|1,0,1]=4 13466 B9R1.2 N[C@@H]1C[C@H](CCl)CCC1 Amb24699165 [0,1,0,1,0,0|1,0,1]=4 13467 B9R1.2 N[C@@H]1C[C@H](CO)CCC1 Amb23385323 [0,1,0,1,0,0|1,0,1]=4 13468 B9R1.2 N[C@H]1CCC[C@H](C1)CN Amb25770684 [0,1,0,1,0,0|1,0,1]=4 13469 B9R1.2 O=C1CCCC(CCl)N1 Amb19374373 [0,1,0,1,0,0|1,0,0]=3 13470 B9R1.2 O=C1CCCC(CI)O1 Amb24675480 [0,1,0,1,0,0|1,0,0]=3 13471 B9R1.2 O=C1CCC[C@@H](CCl)O1 Amb24408738 [0,1,0,1,0,0|1,0,0]=3 13472 B9R1.2 O=C1COCC(CF)N1 Amb25316026 [0,1,0,1,0,0|2,0,0]=4 13473 B9R1.2 O=C1C\C(\CCC1)=C/Cl Amb24524211 [0,1,0,1,0,0|0,0,2]=4 13474 B9R1.2 O=CC1CC(=O)CCC1 Amb18642402 [0,1,0,1,0,0|0,0,1]=3 13475 B9R1.2 O=CC1CC(=O)CCN1 Amb25116003 [0,1,0,1,0,0|1,0,1]=4 13476 B9R1.2 O=CC1CC(=O)CCO1 Amb25310449 [0,1,0,1,0,0|1,0,1]=4 13477 B9R1.2 O=CC1CCCC(F)C1 Amb24541768 [0,1,0,1,0,0|1,0,1]=4 13478 B9R1.2 O=C[C@@H]1CC(=O)CCO1 Amb24602543 [0,1,0,1,0,0|1,0,1]=4 13479 B9R1.2 OC1CC(CCC1)C=O Amb24456710 [0,1,0,1,0,0|1,0,1]=4 13480 B9R1.2 OC1CC(CCl)CCC1 Amb25342173 [0,1,0,1,0,0|0,0,2]=4 13481 B9R1.2 OC1CC(CF)CCC1 Amb25222936 [0,1,0,1,0,0|0,0,2]=4 13482 B9R1.2 OC1CC(CI)CCC1 Amb25144515 [0,1,0,1,0,0|0,0,2]=4 13483 B9R1.2 OC1CCCC(C1)CO Amb24429742 [0,1,0,1,0,0|0,0,2]=4 13484 B9R1.2 OC1CCCC(C=O)=C1 Amb18642406 [0,1,0,1,0,0|1,0,1]=4 13485 B9R1.2 OC1CN(CCC1)N=O Amb25829015 [0,1,0,1,0,0|2,0,0]=4 13486 B9R1.2 OCC1CC(=O)CC=C1 Amb24524209 [0,1,0,1,0,0|0,0,2]=4 13487 B9R1.2 OCC1CC(=O)CCN1 Amb25147026 [0,1,0,1,0,0|1,0,0]=3 13488 B9R1.2 OCC1CC(=O)NCC1 Amb21960758 [0,1,0,1,0,0|1,0,0]=3 13489 B9R1.2 OCC1CCCC(=O)C1 Amb16231079 [0,1,0,1,0,0|0,0,0]=2 13490 B9R1.2 OCC1CCCC(=O)N1 Amb13886257 [0,1,0,1,0,0|1,0,0]=3 13491 B9R1.2 OCC1CCCC(F)C1 Amb24518717 [0,1,0,1,0,0|1,0,1]=4 13492 B9R1.2 OCC1COCC(=O)N1 Amb22236095 [0,1,0,1,0,0|2,0,0]=4 13493 B9R1.2 OCC1COCC(=O)O1 Amb25246215 [0,1,0,1,0,0|2,0,0]=4 13494 B9R1.2 OC[C@@H]1CC(=O)CCC1 Amb22748907 [0,1,0,1,0,0|0,0,0]=2 13495 B9R1.2 OC[C@@H]1CC=CC(=O)C1 Amb24658579 [0,1,0,1,0,0|0,0,2]=4 13496 B9R1.2 OC[C@@H]1CCCC(=O)N1 Amb22745829 [0,1,0,1,0,0|1,0,0]=3 13497 B9R1.2 OC[C@@H]1CCCC(=O)O1 Amb25045754 [0,1,0,1,0,0|1,0,0]=3 13498 B9R1.2 OC[C@@H]1CCCN(C1)C Amb10068404 [0,1,0,1,0,0|2,0,0]=4 13499 B9R1.2 OC[C@H]1CCCC(=O)N1 Amb25187085 [0,1,0,1,0,0|1,0,0]=3 13500 B9R1.2 OC[C@H]1CCCN(C1)C Amb10068405 [0,1,0,1,0,0|2,0,0]=4 13501 B9R1.2 OC[C@H]1COCC(=O)N1 Amb25050078 [0,1,0,1,0,0|2,0,0]=4 13502 B9R1.2 O[C@@H]1CCCC(C=O)=C1 Amb24527967 [0,1,0,1,0,0|1,0,1]=4 13503 B9R1.2 O\N=C/1\CCCC(=O)C1 Amb25319163 [0,1,0,1,0,0|1,0,1]=4 13504 B9R1.2 O\N=C\1/CC(Cl)CCC1 Amb25114780 [0,1,0,1,0,0|1,0,1]=4 13505 B9R1.2 [N-]=[N+]=C1CCCC(=O)C1 Amb17593275 [0,1,0,1,0,0|1,0,1]=4 13506 B9R1.2 [O-]N=[N+]1CC(=O)CCC1 Amb25179444 [0,1,0,1,0,0|2,0,0]=4 13507 B9R1.3 C=C1CCC[C@@H](O)[C@@H]1O Amb25332473 [0,1,0,1,0,0|2,0,0]=4 13508 B9R1.3 CC1=C(C)CCCC1=O Amb17593288 [0,1,0,1,0,0|0,0,1]=3 13509 B9R1.3 CC1=C(O)CCCC1=O Amb25147218 [0,1,0,1,0,0|1,0,1]=4 13510 B9R1.3 CC1=CCC[C@@H](C)C1=O Amb24706792 [0,1,0,1,0,0|0,0,1]=3 13511 B9R1.3 CC1=CCSC(C)C1=O Amb25086618 [0,1,0,1,0,0|1,0,1]=4 13512 B9R1.3 CC1=COCC(C)C1=O Amb24545605 [0,1,0,1,0,0|1,0,1]=4 13513 B9R1.3 CC1C(=O)CCCS1=O Amb25802270 [0,1,0,1,0,0|2,0,0]=4 13514 B9R1.3 CC1C(=O)NCCN1C Amb19723393 [0,1,0,1,0,0|2,0,0]=4 13515 B9R1.3 CC1C(=O)NCCN1C Amb21961555 [0,1,0,1,0,0|2,0,0]=4 13516 B9R1.3 CC1C(C)CCCC1C Amb22227691 [0,1,0,1,0,0|1,0,1]=4 13517 B9R1.3 CC1C(C)NCCC1=O Amb18642528 [0,1,0,1,0,0|1,0,0]=3 13518 B9R1.3 CC1C(C)NCCS1=O Amb19514961 [0,1,0,1,0,0|2,0,0]=4 13519 B9R1.3 CC1C(O)CCCC1=C Amb25685563 [0,1,0,1,0,0|2,0,0]=4 13520 B9R1.3 CC1C(O)CCOC1=O Amb24592874 [0,1,0,1,0,0|2,0,0]=4 13521 B9R1.3 CC1CC=CC(=O)C1O Amb24570442 [0,1,0,1,0,0|0,0,2]=4 13522 B9R1.3 CC1CCC=C(C)C1Br Amb25246943 [0,1,0,1,0,0|1,0,1]=4 13523 B9R1.3 CC1CCC=C(C1=O)C Amb17593286 [0,1,0,1,0,0|0,0,1]=3 13524 B9R1.3 CC1CCC=C(Cl)C1=O Amb24380855 [0,1,0,1,0,0|1,0,1]=4 13525 B9R1.3 CC1CCC=C(F)C1=O Amb24736339 [0,1,0,1,0,0|1,0,1]=4 13526 B9R1.3 CC1CCCC(=O)C1=O Amb22043334 [0,1,0,1,0,0|0,0,1]=3 13527 B9R1.3 CC1CCCC(=O)C1Br Amb24355950 [0,1,0,1,0,0|0,0,0]=2 13528 B9R1.3 CC1CCCC(=O)C1Cl Amb25101122 [0,1,0,1,0,0|0,0,0]=2 13529 B9R1.3 CC1CCCC(Br)C1=O Amb25250808 [0,1,0,1,0,0|1,0,1]=4 13530 B9R1.3 CC1CCCC(Br)C1O Amb24601208 [0,1,0,1,0,0|1,0,1]=4 13531 B9R1.3 CC1CCCC(C1=O)Cl Amb17593667 [0,1,0,1,0,0|1,0,1]=4 13532 B9R1.3 CC1CCCC(C1N)C Amb1116609 [0,1,0,1,0,0|1,0,1]=4 13533 B9R1.3 CC1CCCC(C1O)C Amb2227580 [0,1,0,1,0,0|0,0,2]=4 13534 B9R1.3 CC1CCCC(Cl)C1O Amb24539273 [0,1,0,1,0,0|1,0,1]=4 13535 B9R1.3 CC1CCCC(F)C1=O Amb24400707 [0,1,0,1,0,0|1,0,1]=4 13536 B9R1.3 CC1CCCC(F)C1N Amb24650619 [0,1,0,1,0,0|1,0,1]=4 13537 B9R1.3 CC1CCCC(N)C1F Amb24738759 [0,1,0,1,0,0|1,0,1]=4 13538 B9R1.3 CC1CCCC(N)C1N Amb24761483 [0,1,0,1,0,0|1,0,1]=4 13539 B9R1.3 CC1CCCC(O)C1Cl Amb25707552 [0,1,0,1,0,0|0,0,2]=4 13540 B9R1.3 CC1CCCC(O)C1N Amb25377554 [0,1,0,1,0,0|0,0,2]=4 13541 B9R1.3 CC1CCCC(O)C1O Amb25823103 [0,1,0,1,0,0|0,0,2]=4 13542 B9R1.3 CC1CCCC(S)C1C Amb25731166 [0,1,0,1,0,0|0,1,1]=4 13543 B9R1.3 CC1CCC[C@@H](O)[C@H]1O Amb25245925 [0,1,0,1,0,0|0,0,2]=4 13544 B9R1.3 CC1CCNC(=O)C1Cl Amb25339436 [0,1,0,1,0,0|1,0,0]=3 13545 B9R1.3 CC1CCNC(=O)C1N Amb22229171 [0,1,0,1,0,0|1,0,0]=3 13546 B9R1.3 CC1CCNC(=O)N1C Amb25781297 [0,1,0,1,0,0|1,0,0]=3 13547 B9R1.3 CC1CCOC(=O)C1O Amb25369401 [0,1,0,1,0,0|1,0,0]=3 13548 B9R1.3 CC1CCOC(=O)[C@H]1O Amb25315194 [0,1,0,1,0,0|1,0,0]=3 13549 B9R1.3 CC1CCOC(C)C1=O Amb25834282 [0,1,0,1,0,0|1,0,1]=4 13550 B9R1.3 CC1CNCC(=O)N1C Amb25840155 [0,1,0,1,0,0|1,0,0]=3 13551 B9R1.3 CC1CNCC(C)C1=O Amb24351098 [0,1,0,1,0,0|1,0,1]=4 13552 B9R1.3 CC1COCC(C)C1=O Amb22299425 [0,1,0,1,0,0|1,0,1]=4 13553 B9R1.3 CC1NCCC(=O)C1O Amb24618856 [0,1,0,1,0,0|1,0,0]=3 13554 B9R1.3 CC1NCCN(C)C1=O Amb22499042 [0,1,0,1,0,0|2,0,0]=4 13555 B9R1.3 CC1OCCC(=O)C1O Amb24723617 [0,1,0,1,0,0|1,0,0]=3 13556 B9R1.3 CC1[C@H](C)CC=CC1=O Amb25834367 [0,1,0,1,0,0|0,0,2]=4 13557 B9R1.3 CC=1CCCC(=O)C1N Amb25710421 [0,1,0,1,0,0|0,0,2]=4 13558 B9R1.3 CC=1CCCC(C)C1C Amb22231727 [0,1,0,1,0,0|1,0,0]=3 13559 B9R1.3 CC=1CCCC(N)C1C Amb25727692 [0,1,0,1,0,0|2,0,0]=4 13560 B9R1.3 CC=1CCCC(O)C1Br Amb25811521 [0,1,0,1,0,0|2,0,0]=4 13561 B9R1.3 CN1C(=O)CCCC1=O Amb22757472 [0,1,0,1,0,0|1,0,1]=4 13562 B9R1.3 CN1C(Cl)CCCC1=O Amb24479931 [0,1,0,1,0,0|1,0,0]=3 13563 B9R1.3 CN1C(N)CCNC1=O Amb25707367 [0,1,0,1,0,0|2,0,0]=4 13564 B9R1.3 CN1C(O)CCCC1=O Amb25337618 [0,1,0,1,0,0|1,0,0]=3 13565 B9R1.3 CN1CCCC(=O)C1=O Amb24387127 [0,1,0,1,0,0|1,0,1]=4 13566 B9R1.3 CN1CCCC(F)C1=O Amb24478162 [0,1,0,1,0,0|2,0,0]=4 13567 B9R1.3 CN1CCCC(N)C1=O Amb18832622 [0,1,0,1,0,0|2,0,0]=4 13568 B9R1.3 CN1CCCC(N)C1=O Amb23440176 [0,1,0,1,0,0|2,0,0]=4 13569 B9R1.3 CN1CCCN(C)C1=O Amb24054545 [0,1,0,1,0,0|2,0,0]=4 13570 B9R1.3 CN1CCC[C@@H](N)C1=O Amb22745485 [0,1,0,1,0,0|2,0,0]=4 13571 B9R1.3 CN1CCC[C@@H](N)C1=O Amb25709654 [0,1,0,1,0,0|2,0,0]=4 13572 B9R1.3 CN1[C@H](C)CCC[C@H]1C Amb25788769 [0,1,0,1,0,0|1,0,1]=4 13573 B9R1.3 C[C@@H]1C(=O)CCCS1=O Amb25319756 [0,1,0,1,0,0|2,0,0]=4 13574 B9R1.3 C[C@@H]1CCCC(=O)C1Br Amb24726834 [0,1,0,1,0,0|0,0,0]=2 13575 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1Br Amb25211285 [0,1,0,1,0,0|0,0,0]=2 13576 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1C Amb24631628 [0,1,0,1,0,0|0,0,0]=2 13577 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1Cl Amb25238274 [0,1,0,1,0,0|0,0,0]=2 13578 B9R1.3 C[C@@H]1CCCC(C)C1N Amb24524152 [0,1,0,1,0,0|1,0,1]=4 13579 B9R1.3 C[C@@H]1CCC[C@@H](Br)C1=O Amb24582835 [0,1,0,1,0,0|1,0,1]=4 13580 B9R1.3 C[C@@H]1CCC[C@@H](C)C1=C Amb24499561 [0,1,0,1,0,0|1,0,1]=4 13581 B9R1.3 C[C@@H]1CCC[C@@H](C)C1=O Amb25358874 [0,1,0,1,0,0|0,0,1]=3 13582 B9R1.3 C[C@@H]1CCC[C@@H](C)C1N Amb24598857 [0,1,0,1,0,0|1,0,1]=4 13583 B9R1.3 C[C@@H]1CCC[C@@H](Cl)[C@@H]1O Amb25258029 [0,1,0,1,0,0|1,0,1]=4 13584 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1N Amb24515607 [0,1,0,1,0,0|0,0,2]=4 13585 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@H]1C Amb24747627 [0,1,0,1,0,0|0,0,2]=4 13586 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@H]1O Amb25176154 [0,1,0,1,0,0|0,0,2]=4 13587 B9R1.3 C[C@@H]1CCC[C@H](C)C1=C Amb22230413 [0,1,0,1,0,0|1,0,1]=4 13588 B9R1.3 C[C@@H]1CCC[C@H](C)N1N Amb22801186 [0,1,0,1,0,0|1,0,1]=4 13589 B9R1.3 C[C@@H]1CCC[C@H](C)[C@@H]1N Amb25836294 [0,1,0,1,0,0|1,0,1]=4 13590 B9R1.3 C[C@@H]1CCC[C@H](N)[C@@H]1N Amb24604365 [0,1,0,1,0,0|1,0,1]=4 13591 B9R1.3 C[C@@H]1CNCC(=O)N1C Amb23385273 [0,1,0,1,0,0|1,0,0]=3 13592 B9R1.3 C[C@@H]1CSC[C@@H](C)C1=O Amb24617280 [0,1,0,1,0,0|1,0,1]=4 13593 B9R1.3 C[C@@H]1[C@@H](C)CCC[C@H]1C Amb24502189 [0,1,0,1,0,0|1,0,1]=4 13594 B9R1.3 C[C@@H]1[C@@H](C)NCCS1=O Amb24621845 [0,1,0,1,0,0|2,0,0]=4 13595 B9R1.3 C[C@@H]1[C@@H](O)CCCC1=C Amb25346368 [0,1,0,1,0,0|2,0,0]=4 13596 B9R1.3 C[C@@H]1[C@H](C)CCC[C@@H]1C Amb25245256 [0,1,0,1,0,0|1,0,1]=4 13597 B9R1.3 C[C@@H]1[C@H](C)NCCS1=O Amb24560301 [0,1,0,1,0,0|2,0,0]=4 13598 B9R1.3 C[C@H]1CC=CC(=O)[C@H]1O Amb25373144 [0,1,0,1,0,0|0,0,2]=4 13599 B9R1.3 C[C@H]1CCCC(=O)[C@@H]1Br Amb24564319 [0,1,0,1,0,0|0,0,0]=2 13600 B9R1.3 C[C@H]1CCCC(=O)[C@H]1C Amb25179382 [0,1,0,1,0,0|0,0,0]=2 13601 B9R1.3 C[C@H]1CCCC(=O)[C@H]1Cl Amb24545462 [0,1,0,1,0,0|0,0,0]=2 13602 B9R1.3 C[C@H]1CCCC(N)[C@@H]1C Amb24628802 [0,1,0,1,0,0|1,0,1]=4 13603 B9R1.3 C[C@H]1CCC[C@@H](C)[C@@H]1N Amb25146182 [0,1,0,1,0,0|1,0,1]=4 13604 B9R1.3 C[C@H]1CCC[C@@H](Cl)C1=O Amb25374610 [0,1,0,1,0,0|1,0,1]=4 13605 B9R1.3 C[C@H]1CCC[C@H](C)C1=C Amb22231652 [0,1,0,1,0,0|1,0,1]=4 13606 B9R1.3 C[C@H]1CCC[C@H](Cl)C1=O Amb25257959 [0,1,0,1,0,0|1,0,1]=4 13607 B9R1.3 C[C@H]1CCOC(=O)[C@H]1O Amb25239425 [0,1,0,1,0,0|1,0,0]=3 13608 B9R1.3 C[C@H]1CNCC(=O)N1C Amb23385254 [0,1,0,1,0,0|1,0,0]=3 13609 B9R1.3 C[C@H]1CNCC(=O)N1C Amb25758765 [0,1,0,1,0,0|1,0,0]=3 13610 B9R1.3 C[C@H]1[C@@H](O)CCCC1=O Amb24737440 [0,1,0,1,0,0|1,0,0]=3 13611 B9R1.3 C[C@H]1[C@H](C)SCCC1=O Amb25319950 [0,1,0,1,0,0|1,0,0]=3 13612 B9R1.3 C[C@H]1[C@H](N)CCCC1=O Amb24670466 [0,1,0,1,0,0|1,0,0]=3 13613 B9R1.3 C[C@H]1[C@H](O)CCCC1=C Amb24515569 [0,1,0,1,0,0|2,0,0]=4 13614 B9R1.3 NC1C(=O)CCCC1=O Amb24682149 [0,1,0,1,0,0|1,0,1]=4 13615 B9R1.3 NC1C(O)CCNC1=O Amb24529078 [0,1,0,1,0,0|2,0,0]=4 13616 B9R1.3 NC1CCNC(=O)C1O Amb24593871 [0,1,0,1,0,0|2,0,0]=4 13617 B9R1.3 N[C@@H]1[C@@H](O)CCNC1=O Amb25220585 [0,1,0,1,0,0|2,0,0]=4 13618 B9R1.3 O=C1C(C)NCCN1C Amb10607449 [0,1,0,1,0,0|2,0,0]=4 13619 B9R1.3 O=C1C(O)CCCN1C Amb17593360 [0,1,0,1,0,0|2,0,0]=4 13620 B9R1.3 O=C1CCCC(=O)C1Br Amb2459664 [0,1,0,1,0,0|1,0,1]=4 13621 B9R1.3 O=C1CCCC(=O)C1Cl Amb25726716 [0,1,0,1,0,0|1,0,1]=4 13622 B9R1.3 O=C1CCCC(=O)C1F Amb25143046 [0,1,0,1,0,0|1,0,1]=4 13623 B9R1.3 O=C1CCCC(Br)C1Cl Amb25231312 [0,1,0,1,0,0|1,0,0]=3 13624 B9R1.3 O=C1CCCC(Cl)C1=O Amb24340174 [0,1,0,1,0,0|1,0,1]=4 13625 B9R1.3 O=C1CCCC(Cl)C1Cl Amb25147221 [0,1,0,1,0,0|1,0,0]=3 13626 B9R1.3 O=C1CCCC(F)C1Br Amb25840986 [0,1,0,1,0,0|1,0,0]=3 13627 B9R1.3 O=C1CCC[C@@H](Br)[C@@H]1Cl Amb25220218 [0,1,0,1,0,0|1,0,0]=3 13628 B9R1.3 O=C1CCC[C@@H](Cl)[C@@H]1Br Amb25380764 [0,1,0,1,0,0|1,0,0]=3 13629 B9R1.3 OC1C(Cl)CCCC1=O Amb24433119 [0,1,0,1,0,0|1,0,0]=3 13630 B9R1.3 OC1CCCC(=C1C)Cl Amb10552852 [0,1,0,1,0,0|2,0,0]=4 13631 B9R1.3 OC1CCCC(=O)C1Br Amb25216961 [0,1,0,1,0,0|1,0,0]=3 13632 B9R1.3 OC1CCCC(=O)C1Cl Amb25138773 [0,1,0,1,0,0|1,0,0]=3 13633 B9R1.3 OC1CCNC(=O)C1Cl Amb23440466 [0,1,0,1,0,0|2,0,0]=4 13634 B9R1.3 OC1CCNC(=O)C1O Amb24712104 [0,1,0,1,0,0|2,0,0]=4 13635 B9R1.3 OC1CCOC(=O)C1O Amb24735003 [0,1,0,1,0,0|2,0,0]=4 13636 B9R1.3 O[C@@H]1CCCC(=O)[C@@H]1O Amb24706773 [0,1,0,1,0,0|1,0,0]=3 13637 B9R1.3 O[C@@H]1CCCC(=O)[C@H]1Cl Amb24591761 [0,1,0,1,0,0|1,0,0]=3 13638 B9R1.3 O[C@H]1CCCC(=O)[C@H]1O Amb25191514 [0,1,0,1,0,0|1,0,0]=3 13639 B9R1.3 O[C@H]1[C@H](Br)CCCC1=O Amb25210888 [0,1,0,1,0,0|1,0,0]=3 13640 B9R1.5 BrC1CCCCCC1Br Amb17669998 [0,1,0,1,0,0|1,0,1]=4 13641 B9R1.5 Br[C@@H]1CCCCC[C@@H]1Br Amb24425642 [0,1,0,1,0,0|1,0,1]=4 13642 B9R1.5 C=C1CCCCCC1=O Amb24706942 [0,1,0,1,0,0|0,0,1]=3 13643 B9R1.5 C=C1CCCCCC1Cl Amb24559958 [0,1,0,1,0,0|1,0,0]=3 13644 B9R1.5 C=C1CCCCCC1O Amb24475137 [0,1,0,1,0,0|1,0,0]=3 13645 B9R1.5 C=C1CCCCC[C@H]1O Amb25343771 [0,1,0,1,0,0|1,0,0]=3 13646 B9R1.5 CC1=CCCCCC1Cl Amb25146234 [0,1,0,1,0,0|1,0,0]=3 13647 B9R1.5 CC1=CNCCCC1=O Amb24477793 [0,1,0,1,0,0|1,0,1]=4 13648 B9R1.5 CC1CC=CCCC1=O Amb24737313 [0,1,0,1,0,0|0,0,2]=4 13649 B9R1.5 CC1CCCCCC1Br Amb18329569 [0,1,0,1,0,0|1,0,1]=4 13650 B9R1.5 CC1CCCCCC1N Amb18278100 [0,1,0,1,0,0|1,0,1]=4 13651 B9R1.5 CC1CCCCNC1=N Amb24376734 [0,1,0,1,0,0|2,0,0]=4 13652 B9R1.5 CC1CCCCNC1C Amb25830593 [0,1,0,1,0,0|1,0,1]=4 13653 B9R1.5 CC1CCNCCC1=O Amb22263520 [0,1,0,1,0,0|1,0,0]=3 13654 B9R1.5 CC1CCNCCC1=O Amb22886271 [0,1,0,1,0,0|1,0,0]=3 13655 B9R1.5 CC1CCSCCC1=O Amb25092920 [0,1,0,1,0,0|1,0,0]=3 13656 B9R1.5 CC1CNCCCC1=O Amb22886274 [0,1,0,1,0,0|1,0,0]=3 13657 B9R1.5 CC1CNCCCS1=O Amb25121385 [0,1,0,1,0,0|1,0,1]=4 13658 B9R1.5 CC1CSCCNC1=O Amb22642303 [0,1,0,1,0,0|2,0,0]=4 13659 B9R1.5 CC1NCCCNC1=O Amb22496434 [0,1,0,1,0,0|2,0,0]=4 13660 B9R1.5 CC1OCCCCC1=O Amb25825779 [0,1,0,1,0,0|1,0,0]=3 13661 B9R1.5 CC1OCCCNC1=O Amb22886655 [0,1,0,1,0,0|2,0,0]=4 13662 B9R1.5 CC1SCCCNC1=O Amb24451182 [0,1,0,1,0,0|2,0,0]=4 13663 B9R1.5 CC1SCCSCC1=O Amb24647536 [0,1,0,1,0,0|2,0,0]=4 13664 B9R1.5 CN1CCCCCC1=N Amb24716846 [0,1,0,1,0,0|1,0,0]=3 13665 B9R1.5 CN1CCCCNC1=O Amb24477807 [0,1,0,1,0,0|1,0,0]=3 13666 B9R1.5 CN1CCCNCC1=O Amb21960817 [0,1,0,1,0,0|1,0,0]=3 13667 B9R1.5 CN1CCNCCC1=O Amb16231373 [0,1,0,1,0,0|1,0,0]=3 13668 B9R1.5 CN1CCNCCC1=O Amb21959037 [0,1,0,1,0,0|1,0,0]=3 13669 B9R1.5 CN1CNCCCC1=O Amb25255831 [0,1,0,1,0,0|1,0,0]=3 13670 B9R1.5 C[C@@H]1CCCCCC1=O Amb25032177 [0,1,0,1,0,0|0,0,0]=2 13671 B9R1.5 C[C@@H]1CCCCC[C@H]1N Amb25175062 [0,1,0,1,0,0|1,0,1]=4 13672 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [0,1,0,1,0,0|2,0,0]=4 13673 B9R1.5 C[C@H]1CCCCCC1=O Amb24475484 [0,1,0,1,0,0|0,0,0]=2 13674 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [0,1,0,1,0,0|2,0,0]=4 13675 B9R1.5 ClC1CCCCCC1Cl Amb17669999 [0,1,0,1,0,0|1,0,1]=4 13676 B9R1.5 ClN1CCCCCC1=O Amb10572732 [0,1,0,1,0,0|1,0,0]=3 13677 B9R1.5 Cl[C@@H]1CCCCC[C@@H]1Cl Amb25216944 [0,1,0,1,0,0|1,0,1]=4 13678 B9R1.5 Cl[C@@H]1CCCCC[C@H]1Cl Amb24589422 [0,1,0,1,0,0|1,0,1]=4 13679 B9R1.5 Cl[C@H]1CCCCC[C@@H]1Cl Amb25275014 [0,1,0,1,0,0|1,0,1]=4 13680 B9R1.5 FC1CCCCCC1Br Amb24387987 [0,1,0,1,0,0|1,0,1]=4 13681 B9R1.5 NC1CCCCCC1=O Amb18276126 [0,1,0,1,0,0|0,0,0]=2 13682 B9R1.5 NC1CCCCCC1N Amb18832604 [0,1,0,1,0,0|1,0,1]=4 13683 B9R1.5 NC1CCCCNC1=O Amb19958477 [0,1,0,1,0,0|1,0,0]=3 13684 B9R1.5 NC1CNCCNC1=O Amb24476665 [0,1,0,1,0,0|2,0,0]=4 13685 B9R1.5 NC1COCCNC1=O Amb24409830 [0,1,0,1,0,0|2,0,0]=4 13686 B9R1.5 NC1CSCCNC1=O Amb25336468 [0,1,0,1,0,0|2,0,0]=4 13687 B9R1.5 NN1CCCCCC1=O Amb22494978 [0,1,0,1,0,0|1,0,0]=3 13688 B9R1.5 NN1CCCCCC1=O Amb22495331 [0,1,0,1,0,0|1,0,0]=3 13689 B9R1.5 N[C@@H]1CCCCC[C@@H]1N Amb24659857 [0,1,0,1,0,0|1,0,1]=4 13690 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [0,1,0,1,0,0|0,0,2]=4 13691 B9R1.5 N[C@@H]1CCCCC[C@H]1N Amb24546493 [0,1,0,1,0,0|1,0,1]=4 13692 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [0,1,0,1,0,0|0,0,2]=4 13693 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [0,1,0,1,0,0|1,0,0]=3 13694 B9R1.5 N[C@@H]1CSCCNC1=O Amb19374458 [0,1,0,1,0,0|2,0,0]=4 13695 B9R1.5 N[C@H]1CCCCC[C@@H]1N Amb25790654 [0,1,0,1,0,0|1,0,1]=4 13696 B9R1.5 N[C@H]1CCCCC[C@H]1O Amb22270235 [0,1,0,1,0,0|0,0,2]=4 13697 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [0,1,0,1,0,0|1,0,0]=3 13698 B9R1.5 O=C1CCCCC=C1Cl Amb24631236 [0,1,0,1,0,0|0,0,2]=4 13699 B9R1.5 O=C1CCCCC=C1I Amb24478804 [0,1,0,1,0,0|0,0,2]=4 13700 B9R1.5 O=C1CCCCCC1=O Amb17593310 [0,1,0,1,0,0|0,0,1]=3 13701 B9R1.5 O=C1CCCCCC1Br Amb18325296 [0,1,0,1,0,0|0,0,0]=2 13702 B9R1.5 O=C1CCCCCC1F Amb21965071 [0,1,0,1,0,0|0,0,0]=2 13703 B9R1.5 O=C1CCCCC[C@H]1F Amb25318902 [0,1,0,1,0,0|0,0,0]=2 13704 B9R1.5 O=C1CCCCNC1=O Amb24056373 [0,1,0,1,0,0|1,0,1]=4 13705 B9R1.5 O=C1CCCNCC1F Amb22886244 [0,1,0,1,0,0|1,0,0]=3 13706 B9R1.5 O=C1CCCNCC1F Amb25248425 [0,1,0,1,0,0|1,0,0]=3 13707 B9R1.5 O=C1CCNCCC1F Amb22886247 [0,1,0,1,0,0|1,0,0]=3 13708 B9R1.5 O=C1CNCCCC1F Amb22886238 [0,1,0,1,0,0|1,0,0]=3 13709 B9R1.5 O=C1CNCCCC1F Amb25222674 [0,1,0,1,0,0|1,0,0]=3 13710 B9R1.5 O=C1CNCCCN1C Amb15690772 [0,1,0,1,0,0|1,0,0]=3 13711 B9R1.5 O=C1NCCCC[C@H]1N Amb10608775 [0,1,0,1,0,0|1,0,0]=3 13712 B9R1.5 O=C1NCCSC[C@@H]1N Amb10067826 [0,1,0,1,0,0|2,0,0]=4 13713 B9R1.5 O=C1OCCCCC1Br Amb24725884 [0,1,0,1,0,0|1,0,0]=3 13714 B9R1.5 OC1CC=CCCC1=O Amb24357136 [0,1,0,1,0,0|0,0,2]=4 13715 B9R1.5 OC1CCCCCC1=O Amb25284997 [0,1,0,1,0,0|0,0,0]=2 13716 B9R1.5 OC1CCCCCC1Br Amb24480058 [0,1,0,1,0,0|0,0,2]=4 13717 B9R1.5 OC1CCCCCC1O Amb2196454 [0,1,0,1,0,0|0,0,2]=4 13718 B9R1.5 OC1CCCCC[C@H]1F Amb25332433 [0,1,0,1,0,0|0,0,2]=4 13719 B9R1.5 O[C@@H]1CCCCC[C@H]1Cl Amb25252293 [0,1,0,1,0,0|0,0,2]=4 13720 B9R1.5 O[C@@H]1CCCCC[C@H]1O Amb22225422 [0,1,0,1,0,0|0,0,2]=4 13721 B9R1.5 O[C@H]1CCCCC[C@@H]1Br Amb25204581 [0,1,0,1,0,0|0,0,2]=4 13722 B9R1.5 O[C@H]1CCCCC[C@@H]1O Amb22226791 [0,1,0,1,0,0|0,0,2]=4 13723 B9R1.5 O[C@H]1CCCCC[C@H]1O Amb17666644 [0,1,0,1,0,0|0,0,2]=4 13724 B9R1.11 BrCC(=O)N1CCCC1 Amb17327770 [0,1,0,1,0,0|1,0,0]=3 13725 B9R1.11 C#CC(=O)C1CCCC1 Amb22498876 [0,1,0,1,0,0|0,0,1]=3 13726 B9R1.11 C#CC(=O)C1CCCO1 Amb24703684 [0,1,0,1,0,0|1,0,1]=4 13727 B9R1.11 C#CC(=O)C1CSCC1 Amb25279033 [0,1,0,1,0,0|1,0,1]=4 13728 B9R1.11 C#CC(=O)N1CCCC1 Amb24532877 [0,1,0,1,0,0|1,0,1]=4 13729 B9R1.11 C#CC(=O)[C@H]1CCCO1 Amb25092915 [0,1,0,1,0,0|1,0,1]=4 13730 B9R1.11 C=C(CO)C1CCCN1 Amb25211073 [0,1,0,1,0,0|2,0,0]=4 13731 B9R1.11 C=CC(=O)C1CCCC1 Amb25180831 [0,1,0,1,0,0|0,0,1]=3 13732 B9R1.11 C=CC(=O)C1CCCN1 Amb24376988 [0,1,0,1,0,0|1,0,1]=4 13733 B9R1.11 C=CC(=O)C1CCCO1 Amb25139821 [0,1,0,1,0,0|1,0,1]=4 13734 B9R1.11 C=CC(=O)C1CCCS1 Amb24462018 [0,1,0,1,0,0|1,0,1]=4 13735 B9R1.11 C=CC(=O)C1CNCC1 Amb25359839 [0,1,0,1,0,0|1,0,1]=4 13736 B9R1.11 C=CC(=O)C1COCC1 Amb24478661 [0,1,0,1,0,0|1,0,1]=4 13737 B9R1.11 C=CC(=O)C1CSCC1 Amb24393990 [0,1,0,1,0,0|1,0,1]=4 13738 B9R1.11 CC(=NN)C1COCC1 Amb25099194 [0,1,0,1,0,0|2,0,0]=4 13739 B9R1.11 CC(=NO)C1CCCO1 Amb25222498 [0,1,0,1,0,0|1,0,1]=4 13740 B9R1.11 CC(C#N)=C1CCCC1 Amb18642035 [0,1,0,1,0,0|1,0,1]=4 13741 B9R1.11 CC(C#N)C1CCCC1 Amb25714069 [0,1,0,1,0,0|1,0,1]=4 13742 B9R1.11 CC(C=O)=C1CCCC1 Amb18642212 [0,1,0,1,0,0|0,0,1]=3 13743 B9R1.11 CC(C=O)C1CCCC1 Amb20668888 [0,1,0,1,0,0|0,0,1]=3 13744 B9R1.11 CC(C=O)C1CCCO1 Amb18642610 [0,1,0,1,0,0|1,0,1]=4 13745 B9R1.11 CC(C=O)C1CCOC1 Amb24429348 [0,1,0,1,0,0|1,0,1]=4 13746 B9R1.11 CC(C=O)N1CCCC1 Amb24408346 [0,1,0,1,0,0|1,0,1]=4 13747 B9R1.11 CC(CBr)C1CCCC1 Amb24478814 [0,1,0,1,0,0|1,0,1]=4 13748 B9R1.11 CC(CCl)C1CCCC1 Amb25327474 [0,1,0,1,0,0|1,0,1]=4 13749 B9R1.11 CC(CO)=C1CCCC1 Amb24525538 [0,1,0,1,0,0|0,0,2]=4 13750 B9R1.11 CC(NC)C1CCCC1 Amb18962756 [0,1,0,1,0,0|1,0,1]=4 13751 B9R1.11 CC(NN)C1CCCC1 Amb25303294 [0,1,0,1,0,0|1,0,1]=4 13752 B9R1.11 CC(NO)C1CCCC1 Amb24608800 [0,1,0,1,0,0|0,0,2]=4 13753 B9R1.11 CCC(=C)C1CCCN1 Amb23536671 [0,1,0,1,0,0|2,0,0]=4 13754 B9R1.11 CCC(=N)N1CCCC1 Amb25075262 [0,1,0,1,0,0|2,0,0]=4 13755 B9R1.11 CCC(=O)C1=NCCC1 Amb17619574 [0,1,0,1,0,0|1,0,1]=4 13756 B9R1.11 CCC(=O)C1CCC=C1 Amb25094264 [0,1,0,1,0,0|0,0,2]=4 13757 B9R1.11 CCC(=O)C1CCCC1 Amb10607936 [0,1,0,1,0,0|0,0,0]=2 13758 B9R1.11 CCC(=O)C1CCCN1 Amb17231849 [0,1,0,1,0,0|1,0,0]=3 13759 B9R1.11 CCC(=O)C1CCCO1 Amb23590157 [0,1,0,1,0,0|1,0,0]=3 13760 B9R1.11 CCC(=O)C1CCCS1 Amb25756050 [0,1,0,1,0,0|1,0,0]=3 13761 B9R1.11 CCC(=O)C1CNCC1 Amb25313307 [0,1,0,1,0,0|1,0,0]=3 13762 B9R1.11 CCC(=O)C1COCC1 Amb19148917 [0,1,0,1,0,0|1,0,0]=3 13763 B9R1.11 CCC(=O)C1CSCC1 Amb25139897 [0,1,0,1,0,0|1,0,0]=3 13764 B9R1.11 CCC(=O)C1OCCO1 Amb25059671 [0,1,0,1,0,0|2,0,0]=4 13765 B9R1.11 CCC(=O)C=1CCCC1 Amb23558951 [0,1,0,1,0,0|0,0,2]=4 13766 B9R1.11 CCC(=O)N1CNCC1 Amb24670282 [0,1,0,1,0,0|2,0,0]=4 13767 B9R1.11 CCC(Br)C1CCCC1 Amb25316496 [0,1,0,1,0,0|1,0,1]=4 13768 B9R1.11 CCC(C)C1CCCC1 Amb17689395 [0,1,0,1,0,0|1,0,1]=4 13769 B9R1.11 CCC(N)C1CCCC1 Amb18281187 [0,1,0,1,0,0|1,0,1]=4 13770 B9R1.11 CCS(=O)N1CCCC1 Amb25177177 [0,1,0,1,0,0|2,0,0]=4 13771 B9R1.11 CC[C@@H](O)C1CCCC1 Amb25784145 [0,1,0,1,0,0|0,0,2]=4 13772 B9R1.11 CN(C=O)C1CCCC1 Amb17939454 [0,1,0,1,0,0|1,0,0]=3 13773 B9R1.11 CN(C=O)C1CNCC1 Amb24626346 [0,1,0,1,0,0|2,0,0]=4 13774 B9R1.11 CN(C=O)C1COCC1 Amb25741580 [0,1,0,1,0,0|2,0,0]=4 13775 B9R1.11 CN(C=O)C1CSCC1 Amb25347372 [0,1,0,1,0,0|2,0,0]=4 13776 B9R1.11 CNC(=N)C1COCC1 Amb25032106 [0,1,0,1,0,0|2,0,0]=4 13777 B9R1.11 CNC(=O)C1CCCN1 Amb10609065 [0,1,0,1,0,0|1,0,0]=3 13778 B9R1.11 CNC(=O)C1CCCS1 Amb24629729 [0,1,0,1,0,0|1,0,0]=3 13779 B9R1.11 CNC(=O)C1CNCC1 Amb10608170 [0,1,0,1,0,0|1,0,0]=3 13780 B9R1.11 CNC(=O)C1CNCC1 Amb21960149 [0,1,0,1,0,0|1,0,0]=3 13781 B9R1.11 CNC(=O)C1COCC1 Amb25082394 [0,1,0,1,0,0|1,0,0]=3 13782 B9R1.11 CNC(=O)C1SCCS1 Amb25807251 [0,1,0,1,0,0|2,0,0]=4 13783 B9R1.11 CNC(=O)C=1CCCN1 Amb24560713 [0,1,0,1,0,0|1,0,1]=4 13784 B9R1.11 CNC(=O)N1COCC1 Amb25182719 [0,1,0,1,0,0|2,0,0]=4 13785 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb10874670 [0,1,0,1,0,0|1,0,0]=3 13786 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb15740702 [0,1,0,1,0,0|1,0,0]=3 13787 B9R1.11 CNC(=O)[C@@H]1CCCN1 Amb22587500 [0,1,0,1,0,0|1,0,0]=3 13788 B9R1.11 CNC(=O)[C@H]1CCCN1 Amb22232105 [0,1,0,1,0,0|1,0,0]=3 13789 B9R1.11 CNC(=O)[C@H]1CCCN1 Amb22587598 [0,1,0,1,0,0|1,0,0]=3 13790 B9R1.11 COC(=N)C1CCCC1 Amb25713898 [0,1,0,1,0,0|1,0,0]=3 13791 B9R1.11 COC(=N)C1CCCS1 Amb25708928 [0,1,0,1,0,0|2,0,0]=4 13792 B9R1.11 COC(=N)C1COCC1 Amb25702777 [0,1,0,1,0,0|2,0,0]=4 13793 B9R1.11 COC(=O)C1CCC=C1 Amb23456135 [0,1,0,1,0,0|0,0,2]=4 13794 B9R1.11 COC(=O)C1CCC=N1 Amb25106874 [0,1,0,1,0,0|1,0,1]=4 13795 B9R1.11 COC(=O)C1CCCS1 Amb23590656 [0,1,0,1,0,0|1,0,0]=3 13796 B9R1.11 COC(=O)C1CCC[NH2+]1 Amb22045239 [0,1,0,1,0,0|1,0,0]=3 13797 B9R1.11 COC(=O)C1CCN=N1 Amb24062008 [0,1,0,1,0,0|2,0,0]=4 13798 B9R1.11 COC(=O)C1CCNO1 Amb24607719 [0,1,0,1,0,0|2,0,0]=4 13799 B9R1.11 COC(=O)C1COCC1 Amb10610344 [0,1,0,1,0,0|1,0,0]=3 13800 B9R1.11 COC(=O)C1CONC1 Amb24597324 [0,1,0,1,0,0|2,0,0]=4 13801 B9R1.11 COC(=O)C1CSCC1 Amb24598032 [0,1,0,1,0,0|1,0,0]=3 13802 B9R1.11 COC(=O)C1CSCN1 Amb1154599 [0,1,0,1,0,0|2,0,0]=4 13803 B9R1.11 COC(=O)C1[NH2+]CCS1 Amb24113751 [0,1,0,1,0,0|2,0,0]=4 13804 B9R1.11 COC(=O)C=1CCCN1 Amb21964254 [0,1,0,1,0,0|1,0,1]=4 13805 B9R1.11 COC(=O)N1CCCC1 Amb15693435 [0,1,0,1,0,0|1,0,0]=3 13806 B9R1.11 COC(=O)N1CCCN1 Amb25231262 [0,1,0,1,0,0|2,0,0]=4 13807 B9R1.11 COC(=O)N1CNCC1 Amb25197260 [0,1,0,1,0,0|2,0,0]=4 13808 B9R1.11 COC(=O)N1COCC1 Amb25321297 [0,1,0,1,0,0|2,0,0]=4 13809 B9R1.11 COC(=O)N1CSCC1 Amb24676412 [0,1,0,1,0,0|2,0,0]=4 13810 B9R1.11 COC(=O)[C@@H]1CCCO1 Amb25113406 [0,1,0,1,0,0|1,0,0]=3 13811 B9R1.11 COC(=O)[C@@H]1CNCC1 Amb22405890 [0,1,0,1,0,0|1,0,0]=3 13812 B9R1.11 COC(=O)[C@@H]1CNCC1 Amb22744897 [0,1,0,1,0,0|1,0,0]=3 13813 B9R1.11 COC(=O)[C@@H]1COCC1 Amb23439173 [0,1,0,1,0,0|1,0,0]=3 13814 B9R1.11 COC(=O)[C@@H]1COCN1 Amb24680147 [0,1,0,1,0,0|2,0,0]=4 13815 B9R1.11 COC(=O)[C@@H]1NCCS1 Amb25368917 [0,1,0,1,0,0|2,0,0]=4 13816 B9R1.11 COC(=O)[C@H]1CCCN1 Amb10844896 [0,1,0,1,0,0|1,0,0]=3 13817 B9R1.11 COC(=O)[C@H]1CCCS1 Amb24061418 [0,1,0,1,0,0|1,0,0]=3 13818 B9R1.11 COC(=O)[C@H]1CNCC1 Amb20241764 [0,1,0,1,0,0|1,0,0]=3 13819 B9R1.11 COC(=O)[C@H]1CNCC1 Amb22225397 [0,1,0,1,0,0|1,0,0]=3 13820 B9R1.11 COC(=O)[C@H]1CNCC1 Amb22405891 [0,1,0,1,0,0|1,0,0]=3 13821 B9R1.11 CSC(=N)N1CCCC1 Amb24093466 [0,1,0,1,0,0|2,0,0]=4 13822 B9R1.11 F\C(=C/Cl)\C1CCCC1 Amb24339530 [0,1,0,1,0,0|1,0,1]=4 13823 B9R1.11 N=C(CO)N1CCCC1 Amb23514997 [0,1,0,1,0,0|2,0,0]=4 13824 B9R1.11 N=C(CS)N1CCCC1 Amb24084420 [0,1,0,1,0,0|2,0,0]=4 13825 B9R1.11 N=C(NO)C1CCCC1 Amb22733339 [0,1,0,1,0,0|1,0,1]=4 13826 B9R1.11 NC(CBr)C1CCCC1 Amb24523717 [0,1,0,1,0,0|1,0,1]=4 13827 B9R1.11 NC(CN)C1CCCC1 Amb18284364 [0,1,0,1,0,0|1,0,1]=4 13828 B9R1.11 NC(CO)C1CCCC1 Amb18958311 [0,1,0,1,0,0|1,0,1]=4 13829 B9R1.11 NCC(=O)C1CCCC1 Amb18832687 [0,1,0,1,0,0|0,0,0]=2 13830 B9R1.11 NCC(=O)C1CCCO1 Amb24398393 [0,1,0,1,0,0|1,0,0]=3 13831 B9R1.11 NCC(=O)C1CNCC1 Amb18832619 [0,1,0,1,0,0|1,0,0]=3 13832 B9R1.11 NCC(=O)C1COCC1 Amb18832569 [0,1,0,1,0,0|1,0,0]=3 13833 B9R1.11 NCC(=O)N1CCCN1 Amb24105998 [0,1,0,1,0,0|2,0,0]=4 13834 B9R1.11 NCC(=O)N1CCCN1 Amb25821250 [0,1,0,1,0,0|2,0,0]=4 13835 B9R1.11 NCC(=O)N1CCCO1 Amb24481678 [0,1,0,1,0,0|2,0,0]=4 13836 B9R1.11 NCC(=S)N1CCCC1 Amb20243133 [0,1,0,1,0,0|1,1,0]=4 13837 B9R1.11 NCC(C1CCCC1)C Amb17087397 [0,1,0,1,0,0|1,0,1]=4 13838 B9R1.11 NCC(O)C1CCCC1 Amb18959867 [0,1,0,1,0,0|0,0,2]=4 13839 B9R1.11 NCC(O)C1CCCC1 Amb19515470 [0,1,0,1,0,0|0,0,2]=4 13840 B9R1.11 NNC(=O)C1CCCC1 Amb22757358 [0,1,0,1,0,0|1,0,0]=3 13841 B9R1.11 NNC(=O)C1CCCN1 Amb18061830 [0,1,0,1,0,0|2,0,0]=4 13842 B9R1.11 NNC(=O)C1CCCO1 Amb1125370 [0,1,0,1,0,0|2,0,0]=4 13843 B9R1.11 NNC(=O)C1CNCC1 Amb25676353 [0,1,0,1,0,0|2,0,0]=4 13844 B9R1.11 NNC(=O)C1COCC1 Amb19149119 [0,1,0,1,0,0|2,0,0]=4 13845 B9R1.11 NNC(=O)C1CSCC1 Amb24700747 [0,1,0,1,0,0|2,0,0]=4 13846 B9R1.11 NNC(=O)[C@@H]1CCCN1 Amb25304547 [0,1,0,1,0,0|2,0,0]=4 13847 B9R1.11 NNC(=O)[C@@H]1CCCO1 Amb25796517 [0,1,0,1,0,0|2,0,0]=4 13848 B9R1.11 NNC(=O)[C@@H]1CNCC1 Amb24613788 [0,1,0,1,0,0|2,0,0]=4 13849 B9R1.11 NNC(=O)[C@H]1CCCN1 Amb24481597 [0,1,0,1,0,0|2,0,0]=4 13850 B9R1.11 NNC(=O)[C@H]1CCCO1 Amb25221584 [0,1,0,1,0,0|2,0,0]=4 13851 B9R1.11 NOC(=O)C1COCC1 Amb22170066 [0,1,0,1,0,0|2,0,0]=4 13852 B9R1.11 N[C@@H](CO)C1CCCC1 Amb25757877 [0,1,0,1,0,0|1,0,1]=4 13853 B9R1.11 N[C@H](CO)C1CCCC1 Amb25324301 [0,1,0,1,0,0|1,0,1]=4 13854 B9R1.11 N\N=C(/N)\C1CCCC1 Amb17933318 [0,1,0,1,0,0|2,0,0]=4 13855 B9R1.11 O=C(CBr)C1CC=CC1 Amb25032129 [0,1,0,1,0,0|0,0,2]=4 13856 B9R1.11 O=C(CBr)C1CCCC1 Amb19375225 [0,1,0,1,0,0|0,0,0]=2 13857 B9R1.11 O=C(CBr)C1CCCO1 Amb24104046 [0,1,0,1,0,0|1,0,0]=3 13858 B9R1.11 O=C(CBr)C1COCC1 Amb23455014 [0,1,0,1,0,0|1,0,0]=3 13859 B9R1.11 O=C(CBr)N1COCC1 Amb24603263 [0,1,0,1,0,0|2,0,0]=4 13860 B9R1.11 O=C(CCl)C1CCCN1 Amb24120424 [0,1,0,1,0,0|1,0,0]=3 13861 B9R1.11 O=C(CCl)C1CCCO1 Amb24751558 [0,1,0,1,0,0|1,0,0]=3 13862 B9R1.11 O=C(CCl)C1CCCS1 Amb25328071 [0,1,0,1,0,0|1,0,0]=3 13863 B9R1.11 O=C(CCl)C=1CCCC1 Amb24104115 [0,1,0,1,0,0|0,0,2]=4 13864 B9R1.11 O=C(CCl)N1CCCO1 Amb25296633 [0,1,0,1,0,0|2,0,0]=4 13865 B9R1.11 O=C(CCl)N1COCC1 Amb24650049 [0,1,0,1,0,0|2,0,0]=4 13866 B9R1.11 O=C(CCl)S1CNCC1 Amb24582767 [0,1,0,1,0,0|2,0,0]=4 13867 B9R1.11 O=C(CCl)[C@@H]1CCCN1 Amb25086239 [0,1,0,1,0,0|1,0,0]=3 13868 B9R1.11 O=C(CCl)[C@@H]1CCCO1 Amb25251070 [0,1,0,1,0,0|1,0,0]=3 13869 B9R1.11 O=C(CF)C1CCCC1 Amb23571962 [0,1,0,1,0,0|0,0,0]=2 13870 B9R1.11 O=C(CF)C1CCCN1 Amb24084125 [0,1,0,1,0,0|1,0,0]=3 13871 B9R1.11 O=C(CF)C1CCCO1 Amb25830880 [0,1,0,1,0,0|1,0,0]=3 13872 B9R1.11 O=C(CF)N1CCCC1 Amb24084157 [0,1,0,1,0,0|1,0,0]=3 13873 B9R1.11 O=C(CF)[C@@H]1CCCO1 Amb24084144 [0,1,0,1,0,0|1,0,0]=3 13874 B9R1.11 O=CC(=O)C1CCCC1 Amb25290062 [0,1,0,1,0,0|0,0,1]=3 13875 B9R1.11 O=CC(=O)N1CCCC1 Amb18642504 [0,1,0,1,0,0|1,0,1]=4 13876 B9R1.11 O=CC(Br)=C1CCCC1 Amb18650058 [0,1,0,1,0,0|1,0,1]=4 13877 B9R1.11 O=CC(F)=C1CCCC1 Amb25108011 [0,1,0,1,0,0|1,0,1]=4 13878 B9R1.11 O=C[C@@H](Br)C1CCCC1 Amb24387988 [0,1,0,1,0,0|1,0,1]=4 13879 B9R1.11 OC(C=O)C1CCCC1 Amb25731162 [0,1,0,1,0,0|1,0,1]=4 13880 B9R1.11 OCC(=O)N1CCCO1 Amb24615306 [0,1,0,1,0,0|2,0,0]=4 13881 B9R1.11 OCC(F)C1CCCC1 Amb25239531 [0,1,0,1,0,0|1,0,1]=4 13882 B9R1.11 ONC(=O)C1CCCN1 Amb25127054 [0,1,0,1,0,0|2,0,0]=4 13883 B9R1.11 ONC(=O)C1COCC1 Amb24668940 [0,1,0,1,0,0|2,0,0]=4 13884 B9R1.11 ONC(=O)C1CSCC1 Amb24529110 [0,1,0,1,0,0|2,0,0]=4 13885 B9R1.11 ONC(=O)[C@@H]1CCCO1 Amb25225821 [0,1,0,1,0,0|2,0,0]=4 13886 B9R1.11 ONC(=O)[C@H]1CCCN1 Amb24550780 [0,1,0,1,0,0|2,0,0]=4 13887 B9R1.11 O[C@@H](CBr)C1CCCC1 Amb25269300 [0,1,0,1,0,0|0,0,2]=4 13888 B9R1.11 [13CH3][13CH2][13C](=O)C1=NCCC1 Amb17619575 [0,1,0,1,0,0|1,0,1]=4 13889 B9R1.16 C=C1CC1CCCCCl Amb24675977 [0,1,0,1,0,0|1,0,0]=3 13890 B9R1.16 C=C1CC1CCCCO Amb24502368 [0,1,0,1,0,0|1,0,0]=3 13891 B9R1.16 C=C1CN1CCCCO Amb24078337 [0,1,0,1,0,0|2,0,0]=4 13892 B9R1.16 CC1CC1NCCCC Amb19022375 [0,1,0,1,0,0|1,0,1]=4 13893 B9R1.16 CC1OC1CCCCO Amb25221862 [0,1,0,1,0,0|0,0,2]=4 13894 B9R1.16 CC1OC1CNCCC Amb25207703 [0,1,0,1,0,0|0,0,2]=4 13895 B9R1.16 CCCCCC1=CC1=O Amb24553590 [0,1,0,1,0,0|0,0,1]=3 13896 B9R1.16 CCCCCC1CC1O Amb25760737 [0,1,0,1,0,0|0,0,2]=4 13897 B9R1.16 CCCCCC1OC1Cl Amb25690213 [0,1,0,1,0,0|0,0,2]=4 13898 B9R1.16 CCCCC[C@@H]1C[C@@H]1Br Amb25211284 [0,1,0,1,0,0|1,0,1]=4 13899 B9R1.16 CCCCC[C@@H]1C[C@@H]1O Amb25257126 [0,1,0,1,0,0|0,0,2]=4 13900 B9R1.16 CCCCC[C@@H]1C[C@H]1Br Amb24563828 [0,1,0,1,0,0|1,0,1]=4 13901 B9R1.16 CCCCC[C@@H]1C[C@H]1N Amb24100225 [0,1,0,1,0,0|1,0,1]=4 13902 B9R1.16 CCCCC[C@@H]1C[C@H]1O Amb24582386 [0,1,0,1,0,0|0,0,2]=4 13903 B9R1.16 CCCCC[C@H]1C[C@@H]1O Amb25266383 [0,1,0,1,0,0|0,0,2]=4 13904 B9R1.16 CCCCOC1CC1N Amb24477705 [0,1,0,1,0,0|1,0,1]=4 13905 B9R1.16 CCCCO[C@@H]1C[C@H]1Cl Amb24589330 [0,1,0,1,0,0|1,0,1]=4 13906 B9R1.16 CCCCO[C@@H]1C[C@H]1N Amb25366599 [0,1,0,1,0,0|1,0,1]=4 13907 B9R1.16 C[C@@H]1C[C@H]1CCCCBr Amb24558562 [0,1,0,1,0,0|1,0,1]=4 13908 B9R1.17 CCCCC=C1CNC1 Amb24585602 [0,1,0,1,0,0|1,0,1]=4 13909 B9R1.17 CCCCCN1CCC1 Amb25080741 [0,1,0,1,0,0|2,0,0]=4 13910 B9R1.20 CCCCC1CC1CBr Amb25251333 [0,1,0,1,0,0|1,0,1]=4 13911 B9R1.20 CCCCC1OC1CBr Amb24480230 [0,1,0,1,0,0|0,0,2]=4 13912 B9R1.20 CCCCC=1CC1CO Amb25741443 [0,1,0,1,0,0|0,0,2]=4 13913 B9R1.20 CCCC[C@@H]1C[C@@H]1CO Amb25326700 [0,1,0,1,0,0|0,0,2]=4 13914 B9R1.20 CCCC[C@@H]1O[C@@H]1CN Amb25245206 [0,1,0,1,0,0|0,0,2]=4 13915 B9R1.20 CCCC[C@@H]1O[C@@H]1CO Amb25296361 [0,1,0,1,0,0|0,0,2]=4 13916 B9R1.20 CCCC[C@@H]1O[C@H]1C=O Amb24562977 [0,1,0,1,0,0|1,0,1]=4 13917 B9R1.20 CCCC[C@@H]1O[C@H]1CCl Amb24656042 [0,1,0,1,0,0|0,0,2]=4 13918 B9R1.20 CCCC[C@@H]1O[C@H]1CO Amb24745811 [0,1,0,1,0,0|0,0,2]=4 13919 B9R1.20 O=CC1CC1CCCBr Amb25311248 [0,1,0,1,0,0|1,0,1]=4 13920 B9R1.20 O=C[C@@H]1C[C@H]1CCCBr Amb24519366 [0,1,0,1,0,0|1,0,1]=4 13921 B9R1.21 CCC1=NC(CS1)CC Amb25244083 [0,1,0,1,0,0|2,0,0]=4 13922 B9R1.21 CCC1C=C(CS1)C=O Amb18124606 [0,1,0,1,0,0|1,0,1]=4 13923 B9R1.21 CCC1CC(CC1)C#N Amb24426604 [0,1,0,1,0,0|1,0,1]=4 13924 B9R1.21 CCC1CC(CC1)C=O Amb25312233 [0,1,0,1,0,0|0,0,1]=3 13925 B9R1.21 CCC1CC(CC1)NC Amb24718672 [0,1,0,1,0,0|1,0,1]=4 13926 B9R1.21 CCC1CC(CCl)CC1 Amb24479913 [0,1,0,1,0,0|1,0,1]=4 13927 B9R1.21 CCC1CCC(C=O)O1 Amb25790138 [0,1,0,1,0,0|1,0,1]=4 13928 B9R1.21 CCC1CCC(CBr)O1 Amb24427433 [0,1,0,1,0,0|0,0,2]=4 13929 B9R1.21 CCC1CCC(CC)O1 Amb17672310 [0,1,0,1,0,0|0,0,2]=4 13930 B9R1.21 CCC1CCC(CCl)O1 Amb24566214 [0,1,0,1,0,0|0,0,2]=4 13931 B9R1.21 CCC1CCC(CI)O1 Amb25292814 [0,1,0,1,0,0|0,0,2]=4 13932 B9R1.21 CCC1CCC(CO)N1 Amb24404906 [0,1,0,1,0,0|1,0,1]=4 13933 B9R1.21 CCC1CCC(CO)O1 Amb25852850 [0,1,0,1,0,0|0,0,2]=4 13934 B9R1.21 CCC1CN(CC1)C=O Amb24475759 [0,1,0,1,0,0|1,0,0]=3 13935 B9R1.21 CCC1N=C(CO)CO1 Amb25719622 [0,1,0,1,0,0|2,0,0]=4 13936 B9R1.21 CCN1CC(CC1)=NN Amb24501384 [0,1,0,1,0,0|2,0,0]=4 13937 B9R1.21 CCN1CC(CC1)C=O Amb23449544 [0,1,0,1,0,0|1,0,1]=4 13938 B9R1.21 CC[C@@H]1CC[C@H](CC)N1 Amb25269475 [0,1,0,1,0,0|1,0,1]=4 13939 B9R1.21 CC[C@@H]1C[C@H](CO)CC1 Amb25205088 [0,1,0,1,0,0|0,0,2]=4 13940 B9R1.21 CC[C@H]1CC[C@@H](CO)N1 Amb24591178 [0,1,0,1,0,0|1,0,1]=4 13941 B9R1.21 CC[C@H]1CC[C@H](CC)N1 Amb24517035 [0,1,0,1,0,0|1,0,1]=4 13942 B9R1.21 CC[C@H]1COC(CCl)=N1 Amb24738239 [0,1,0,1,0,0|2,0,0]=4 13943 B9R1.21 CC[C@H]1C[C@H](CO)CC1 Amb24719755 [0,1,0,1,0,0|0,0,2]=4 13944 B9R1.21 CNC1CC(CC1)C=O Amb24374756 [0,1,0,1,0,0|1,0,1]=4 13945 B9R1.21 COC1CN(CC1)N=O Amb24102315 [0,1,0,1,0,0|2,0,0]=4 13946 B9R1.21 CSC=1CCC(CO)N1 Amb25266694 [0,1,0,1,0,0|2,0,0]=4 13947 B9R1.21 NCC1CN(CC1)C=O Amb18908291 [0,1,0,1,0,0|2,0,0]=4 13948 B9R1.21 OCC1CN(CC1)C=O Amb24737938 [0,1,0,1,0,0|2,0,0]=4 13949 B9R1.21 OCC=1CCC(CO)C1 Amb24353167 [0,1,0,1,0,0|2,0,0]=4 13950 B9R1.21 ON=C1CC(CCl)CC1 Amb25287955 [0,1,0,1,0,0|1,0,1]=4 13951 B9R1.39 COCCC1NCC1=O Amb24481968 [0,1,0,1,0,0|1,0,0]=3 13952 B9R1.49 C=C1CCCC(=O)CC1 Amb24633527 [0,1,0,1,0,0|0,0,1]=3 13953 B9R1.49 C=C1CCOC(O)CC1 Amb25215779 [0,1,0,1,0,0|2,0,0]=4 13954 B9R1.49 CC1CCC(=O)CC=C1 Amb24340212 [0,1,0,1,0,0|0,0,2]=4 13955 B9R1.49 CC1CCC(C)NCC1 Amb25339633 [0,1,0,1,0,0|1,0,1]=4 13956 B9R1.49 CC1CCCC(=C)CC1 Amb22364866 [0,1,0,1,0,0|1,0,0]=3 13957 B9R1.49 CC1CCCC(Br)CC1 Amb24709251 [0,1,0,1,0,0|1,0,1]=4 13958 B9R1.49 CC1CCCC(N)CC1 Amb25178098 [0,1,0,1,0,0|1,0,1]=4 13959 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,1,0,1,0,0|0,0,2]=4 13960 B9R1.49 CC1CCNC(=N)CC1 Amb24460651 [0,1,0,1,0,0|2,0,0]=4 13961 B9R1.49 CC1CCNC(=S)CC1 Amb25230099 [0,1,0,1,0,0|1,1,0]=4 13962 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,1,0,1,0,0|1,0,0]=3 13963 B9R1.49 CC1CCS(=O)CCN1 Amb24413310 [0,1,0,1,0,0|2,0,0]=4 13964 B9R1.49 CC1CNC(=N)CCC1 Amb25080544 [0,1,0,1,0,0|1,0,0]=3 13965 B9R1.49 CC1CNC(=N)CCS1 Amb25732879 [0,1,0,1,0,0|2,0,0]=4 13966 B9R1.49 CC1CNC(=O)CCN1 Amb22587019 [0,1,0,1,0,0|1,0,0]=3 13967 B9R1.49 CC1CNC(C)CCC1 Amb19148123 [0,1,0,1,0,0|1,0,1]=4 13968 B9R1.49 CC1CNCC(=O)NC1 Amb25372388 [0,1,0,1,0,0|1,0,0]=3 13969 B9R1.49 CC1COC(=O)NCC1 Amb24393355 [0,1,0,1,0,0|1,0,0]=3 13970 B9R1.49 CC1CSCC(=O)CS1 Amb25024961 [0,1,0,1,0,0|1,0,0]=3 13971 B9R1.49 CC1NCCC(=O)NC1 Amb10607813 [0,1,0,1,0,0|1,0,0]=3 13972 B9R1.49 CC=1CCC(Br)CCC1 Amb25775045 [0,1,0,1,0,0|1,0,0]=3 13973 B9R1.49 CC=1CCC(O)CCC1 Amb24532912 [0,1,0,1,0,0|1,0,0]=3 13974 B9R1.49 CC=1CCN(C)CCN1 Amb25046324 [0,1,0,1,0,0|2,0,0]=4 13975 B9R1.49 CN1CCCC(=O)C=C1 Amb25233711 [0,1,0,1,0,0|1,0,1]=4 13976 B9R1.49 CN1CCCC(N)CC1 Amb18832600 [0,1,0,1,0,0|2,0,0]=4 13977 B9R1.49 CN1CCCC(O)CC1 Amb18832552 [0,1,0,1,0,0|2,0,0]=4 13978 B9R1.49 CN1CCCC(O)CC1 Amb22751622 [0,1,0,1,0,0|2,0,0]=4 13979 B9R1.49 CN1CCNC(=O)CC1 Amb21857545 [0,1,0,1,0,0|2,0,0]=4 13980 B9R1.49 CN1CCOC(=O)CC1 Amb25376750 [0,1,0,1,0,0|2,0,0]=4 13981 B9R1.49 CN1CNC(=O)CCC1 Amb25118592 [0,1,0,1,0,0|1,0,0]=3 13982 B9R1.49 C[C@@H]1CCC[C@@H](O)CC1 Amb24623728 [0,1,0,1,0,0|0,0,2]=4 13983 B9R1.49 C[C@@H]1CCC[C@H](O)CC1 Amb24515396 [0,1,0,1,0,0|0,0,2]=4 13984 B9R1.49 C[C@H]1CCCC(=O)C=C1 Amb24513554 [0,1,0,1,0,0|0,0,1]=3 13985 B9R1.49 C[C@H]1CCNC(=O)CC1 Amb25146079 [0,1,0,1,0,0|1,0,0]=3 13986 B9R1.49 C[C@H]1CNC(=N)CCC1 Amb25146115 [0,1,0,1,0,0|1,0,0]=3 13987 B9R1.49 ClC1CCCC(Cl)CC1 Amb22364836 [0,1,0,1,0,0|1,0,1]=4 13988 B9R1.49 Cl[C@@H]1CCC[C@H](Cl)CC1 Amb24479995 [0,1,0,1,0,0|1,0,1]=4 13989 B9R1.49 NC1CCCC(=O)CC1 Amb25259225 [0,1,0,1,0,0|0,0,0]=2 13990 B9R1.49 NC1CCCC(Br)CC1 Amb25078711 [0,1,0,1,0,0|1,0,1]=4 13991 B9R1.49 NC1CCCC(Cl)CC1 Amb24609768 [0,1,0,1,0,0|1,0,1]=4 13992 B9R1.49 NC1CCCC(O)CC1 Amb25713454 [0,1,0,1,0,0|0,0,2]=4 13993 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,1,0,1,0,0|1,0,0]=3 13994 B9R1.49 NC1CCOC(=O)CC1 Amb23598291 [0,1,0,1,0,0|1,0,0]=3 13995 B9R1.49 NC1CNC(=O)CCC1 Amb22230053 [0,1,0,1,0,0|1,0,0]=3 13996 B9R1.49 NC1CNC(=O)COC1 Amb24532819 [0,1,0,1,0,0|2,0,0]=4 13997 B9R1.49 N[C@H]1CCC[C@H](O)CC1 Amb24568295 [0,1,0,1,0,0|0,0,2]=4 13998 B9R1.49 O=C1CCC(=O)NCC1 Amb22490261 [0,1,0,1,0,0|1,0,1]=4 13999 B9R1.49 O=C1CCC(=O)OCC1 Amb25723209 [0,1,0,1,0,0|1,0,1]=4 14000 B9R1.49 O=C1CCC(Br)CCO1 Amb25188931 [0,1,0,1,0,0|1,0,0]=3 14001 B9R1.49 O=C1CCC(Cl)CCO1 Amb24480302 [0,1,0,1,0,0|1,0,0]=3 14002 B9R1.49 O=C1CCCC(=O)CC1 Amb25797316 [0,1,0,1,0,0|0,0,1]=3 14003 B9R1.49 O=C1CCCC(Br)C=C1 Amb25772717 [0,1,0,1,0,0|0,0,2]=4 14004 B9R1.49 O=C1CC[C@@H](Cl)CCO1 Amb24518083 [0,1,0,1,0,0|1,0,0]=3 14005 B9R1.49 O=C1CC[C@H](Cl)CCO1 Amb25123845 [0,1,0,1,0,0|1,0,0]=3 14006 B9R1.49 O=C1CNC(=O)CCC1 Amb25144028 [0,1,0,1,0,0|1,0,1]=4 14007 B9R1.49 OC1CCCC(=O)C=C1 Amb25128891 [0,1,0,1,0,0|0,0,2]=4 14008 B9R1.49 OC1CCCC(O)CC1 Amb25680581 [0,1,0,1,0,0|0,0,2]=4 14009 B9R1.49 OC1CCOC(=O)CC1 Amb23598292 [0,1,0,1,0,0|1,0,0]=3 14010 B9R1.49 OC1CNC(=O)CCC1 Amb22491274 [0,1,0,1,0,0|1,0,0]=3 14011 B9R1.49 O[C@@H]1CCCC(=O)C=C1 Amb25319020 [0,1,0,1,0,0|0,0,2]=4 14012 B9R1.49 O[C@@H]1CCCC(=O)CC1 Amb24689806 [0,1,0,1,0,0|0,0,0]=2 14013 B9R1.49 O[C@@H]1CCC[C@H](O)CC1 Amb24544307 [0,1,0,1,0,0|0,0,2]=4 14014 B9R1.50 BrC=1CCCCCCC1 Amb23590920 [0,1,0,1,0,0|1,0,0]=3 14015 B9R1.50 CC1CCCCCC=C1 Amb22229355 [0,1,0,1,0,0|1,0,1]=4 14016 B9R1.50 CC1CCCCCCC1 Amb22230834 [0,1,0,1,0,0|1,0,1]=4 14017 B9R1.50 CC1CCNCCCN1 Amb18832588 [0,1,0,1,0,0|1,0,1]=4 14018 B9R1.50 CC=1CCCCCCC1 Amb22227979 [0,1,0,1,0,0|1,0,0]=3 14019 B9R1.50 CN1CCCNCCC1 Amb18276963 [0,1,0,1,0,0|2,0,0]=4 14020 B9R1.50 CN1CCNCCCC1 Amb18832595 [0,1,0,1,0,0|2,0,0]=4 14021 B9R1.50 ClC1CCCCCCS1 Amb25102404 [0,1,0,1,0,0|1,0,1]=4 14022 B9R1.50 IC1CCCCCCC1 Amb25314159 [0,1,0,1,0,0|1,0,1]=4 14023 B9R1.50 N=C1CCSCCCN1 Amb25063766 [0,1,0,1,0,0|2,0,0]=4 14024 B9R1.50 NC1CNCCCCC1 Amb24447204 [0,1,0,1,0,0|1,0,1]=4 14025 B9R1.50 NC1CSCCCCC1 Amb25146060 [0,1,0,1,0,0|1,0,1]=4 14026 B9R1.50 NC=1CCCCCCN1 Amb25145969 [0,1,0,1,0,0|1,0,0]=3 14027 B9R1.50 O=C1C=CCCCCN1 Amb24469221 [0,1,0,1,0,0|0,0,2]=4 14028 B9R1.50 O=C1CC=CCCCC1 Amb25767841 [0,1,0,1,0,0|0,0,1]=3 14029 B9R1.50 O=C1CC=CCCOC1 Amb22364797 [0,1,0,1,0,0|0,0,2]=4 14030 B9R1.50 O=C1CCC=CCCN1 Amb24426300 [0,1,0,1,0,0|0,0,2]=4 14031 B9R1.50 O=C1CCCC#CCC1 Amb25741178 [0,1,0,1,0,0|0,0,1]=3 14032 B9R1.50 O=C1CCCC=CCC1 Amb22364753 [0,1,0,1,0,0|0,0,1]=3 14033 B9R1.50 O=C1CCCCC=CN1 Amb24477747 [0,1,0,1,0,0|0,0,2]=4 14034 B9R1.50 O=C1CCCCCC#C1 Amb25741527 [0,1,0,1,0,0|0,0,1]=3 14035 B9R1.50 O=C1CCCCNC=C1 Amb24745434 [0,1,0,1,0,0|0,0,2]=4 14036 B9R1.50 O=C1CCCSCCC1 Amb17593637 [0,1,0,1,0,0|0,0,0]=2 14037 B9R1.50 O=C1CCNCCCN1 Amb22263665 [0,1,0,1,0,0|1,0,0]=3 14038 B9R1.50 O=C1CCNCCCN1 Amb23403551 [0,1,0,1,0,0|1,0,0]=3 14039 B9R1.50 O=C1CCOCCCC1 Amb25032168 [0,1,0,1,0,0|0,0,0]=2 14040 B9R1.50 O=C1CCOCCCN1 Amb24502350 [0,1,0,1,0,0|1,0,0]=3 14041 B9R1.50 O=C1CNCCCCC1 Amb25254886 [0,1,0,1,0,0|0,0,0]=2 14042 B9R1.50 O=C1CNCCCCN1 Amb24622569 [0,1,0,1,0,0|1,0,0]=3 14043 B9R1.50 O=C1CNCCCNC1 Amb25199227 [0,1,0,1,0,0|1,0,0]=3 14044 B9R1.50 O=C1COCCCC=C1 Amb24595828 [0,1,0,1,0,0|0,0,2]=4 14045 B9R1.50 O=C1NCCCCCN1 Amb25146134 [0,1,0,1,0,0|1,0,0]=3 14046 B9R1.50 O=C1NCCCCCO1 Amb24458503 [0,1,0,1,0,0|1,0,0]=3 14047 B9R1.50 OC1CCCOCCC1 Amb24632568 [0,1,0,1,0,0|0,0,2]=4 14048 B9R1.50 OC1CCOCCCC1 Amb25847873 [0,1,0,1,0,0|0,0,2]=4 14049 B9R1.50 OC1COCCCCC1 Amb22364795 [0,1,0,1,0,0|0,0,2]=4 14050 B9R1.50 S=C1CCCCCCN1 Amb25805181 [0,1,0,1,0,0|0,1,0]=3 14051 B9R1.50 S=C1NCCCCCN1 Amb25178097 [0,1,0,1,0,0|1,1,0]=4 14052 B9R1.58 CCCC1CC(CBr)C1 Amb23537353 [0,1,0,1,0,0|1,0,1]=4 14053 B9R1.58 CCCC1CC(CO)C1 Amb23537555 [0,1,0,1,0,0|0,0,2]=4 14054 B9R1.58 CCOC1CC(C1)C=O Amb24470388 [0,1,0,1,0,0|1,0,1]=4 14055 B9R1.60 CCCC1CC1(C)CO Amb24541566 [0,1,0,1,0,0|0,0,2]=4 14056 B9R1.60 CCCC1CC1(O)CN Amb24367560 [0,1,0,1,0,0|0,0,2]=4 14057 B9R1.76 CC=1C(=O)C1CCCC Amb24577793 [0,1,0,1,0,0|0,0,1]=3 14058 B9R1.76 CCCC[C@H]1[C@@H](Br)C1=C Amb25336535 [0,1,0,1,0,0|1,0,0]=3 14059 B9R1.76 CCCC[C@H]1[C@H](Br)C1=C Amb24513655 [0,1,0,1,0,0|1,0,0]=3 14060 B9R1.78 CC1CC1CC(=C)CO Amb25333398 [0,1,0,1,0,0|1,0,0]=3 14061 B9R1.78 CC1CC1CN(C)C#N Amb24646147 [0,1,0,1,0,0|2,0,0]=4 14062 B9R1.78 CC1CC1CN(C)C=O Amb25072554 [0,1,0,1,0,0|1,0,0]=3 14063 B9R1.78 CC1CC1CN(C)CC Amb25345608 [0,1,0,1,0,0|2,0,0]=4 14064 B9R1.78 CC1CC1NC(=N)CC Amb25844315 [0,1,0,1,0,0|2,0,0]=4 14065 B9R1.78 CC1CC1NC(=N)NC Amb25745054 [0,1,0,1,0,0|2,0,0]=4 14066 B9R1.78 CC1CC1NC(=O)CN Amb18285971 [0,1,0,1,0,0|1,0,0]=3 14067 B9R1.78 CC1CC1NC(=O)CO Amb24375769 [0,1,0,1,0,0|1,0,0]=3 14068 B9R1.78 CC1CC1NC(=O)NC Amb24725580 [0,1,0,1,0,0|1,0,0]=3 14069 B9R1.78 CC1CC1NC(=S)NC Amb24441183 [0,1,0,1,0,0|1,1,0]=4 14070 B9R1.78 CNC(=O)NC1CC1N Amb24359501 [0,1,0,1,0,0|2,0,0]=4 14071 B9R1.78 C[C@@H]1C[C@H]1NC(=O)CC Amb24619545 [0,1,0,1,0,0|1,0,0]=3 14072 B9R1.78 C[C@@H]1C[C@H]1NC(=S)NC Amb24706566 [0,1,0,1,0,0|1,1,0]=4 14073 B9R1.78 NC1CC1NC(=O)CN Amb25307039 [0,1,0,1,0,0|2,0,0]=4 14074 B9R1.79 C#CC(=O)CC1CNC1 Amb25807932 [0,1,0,1,0,0|1,0,1]=4 14075 B9R1.79 C#CC(=O)CN1CCC1 Amb25133340 [0,1,0,1,0,0|1,0,1]=4 14076 B9R1.79 C#CC(=O)NC1CCC1 Amb24556686 [0,1,0,1,0,0|1,0,1]=4 14077 B9R1.79 C=C(CBr)CN1CCC1 Amb25796853 [0,1,0,1,0,0|2,0,0]=4 14078 B9R1.79 C=C(CCl)CN1CCC1 Amb24667361 [0,1,0,1,0,0|2,0,0]=4 14079 B9R1.79 C=C(CS)CN1CCC1 Amb25075413 [0,1,0,1,0,0|2,0,0]=4 14080 B9R1.79 C=CC(=O)CC1CCC1 Amb24746067 [0,1,0,1,0,0|0,0,1]=3 14081 B9R1.79 C=CC(=O)CC1CNC1 Amb25774002 [0,1,0,1,0,0|1,0,1]=4 14082 B9R1.79 C=CC(=O)CN1CCC1 Amb25027309 [0,1,0,1,0,0|1,0,1]=4 14083 B9R1.79 CC(CC1CCC1)CCl Amb25235179 [0,1,0,1,0,0|1,0,1]=4 14084 B9R1.79 CC(CC1CCC1)CO Amb24402725 [0,1,0,1,0,0|0,0,2]=4 14085 B9R1.79 CC(CC1CCC1)NN Amb24481749 [0,1,0,1,0,0|1,0,1]=4 14086 B9R1.79 CC(CCl)=CC1CCC1 Amb25731146 [0,1,0,1,0,0|1,0,1]=4 14087 B9R1.79 CC(CN)=CC1CCC1 Amb25838054 [0,1,0,1,0,0|1,0,1]=4 14088 B9R1.79 CCC(=O)C=C1CCC1 Amb25712655 [0,1,0,1,0,0|0,0,2]=4 14089 B9R1.79 CCC(=O)CC1CNC1 Amb25060246 [0,1,0,1,0,0|1,0,0]=3 14090 B9R1.79 CCC(=O)CN1CCC1 Amb25842020 [0,1,0,1,0,0|1,0,0]=3 14091 B9R1.79 CCC(=O)NC1CCC1 Amb25693768 [0,1,0,1,0,0|1,0,0]=3 14092 B9R1.79 CCC(=O)NC1CNC1 Amb24478758 [0,1,0,1,0,0|2,0,0]=4 14093 B9R1.79 CCC(=O)NC1COC1 Amb24419092 [0,1,0,1,0,0|2,0,0]=4 14094 B9R1.79 CCC(=O)OC1CCC1 Amb25851974 [0,1,0,1,0,0|1,0,0]=3 14095 B9R1.79 CCC(=O)OC1CNC1 Amb21956279 [0,1,0,1,0,0|2,0,0]=4 14096 B9R1.79 CCC(=O)OC1COC1 Amb24621121 [0,1,0,1,0,0|2,0,0]=4 14097 B9R1.79 CCC(Cl)CC1CCC1 Amb25296615 [0,1,0,1,0,0|1,0,1]=4 14098 B9R1.79 CCC(N)CC1CCC1 Amb24417311 [0,1,0,1,0,0|1,0,1]=4 14099 B9R1.79 CCC(O)CC1CCC1 Amb24479921 [0,1,0,1,0,0|0,0,2]=4 14100 B9R1.79 CC[C@@H](N)CC1CCC1 Amb24759465 [0,1,0,1,0,0|1,0,1]=4 14101 B9R1.79 CC[C@@H](O)CC1CCC1 Amb24700781 [0,1,0,1,0,0|0,0,2]=4 14102 B9R1.79 CC[C@H](O)CC1CCC1 Amb24481965 [0,1,0,1,0,0|0,0,2]=4 14103 B9R1.79 CN(CC1CCC1)C#N Amb24481700 [0,1,0,1,0,0|2,0,0]=4 14104 B9R1.79 CN(CC1CCN1)C=O Amb25178791 [0,1,0,1,0,0|2,0,0]=4 14105 B9R1.79 CN(CC1CNC1)C=O Amb25325178 [0,1,0,1,0,0|2,0,0]=4 14106 B9R1.79 CNC(=N)CC1CCC1 Amb25126435 [0,1,0,1,0,0|1,0,0]=3 14107 B9R1.79 CNC(=O)C=C1CCC1 Amb24372567 [0,1,0,1,0,0|0,0,2]=4 14108 B9R1.79 CNC(=O)CC1CCC1 Amb25679813 [0,1,0,1,0,0|0,0,0]=2 14109 B9R1.79 CNC(=O)CC1CNC1 Amb25188925 [0,1,0,1,0,0|1,0,0]=3 14110 B9R1.79 CNC(=O)NC1CCC1 Amb25830627 [0,1,0,1,0,0|1,0,0]=3 14111 B9R1.79 CNC(=O)NC1CNC1 Amb25071828 [0,1,0,1,0,0|2,0,0]=4 14112 B9R1.79 COC(=N)CC1CCC1 Amb25728236 [0,1,0,1,0,0|1,0,0]=3 14113 B9R1.79 COC(=N)CN1CCC1 Amb25713970 [0,1,0,1,0,0|2,0,0]=4 14114 B9R1.79 COC(=O)C=C1CCC1 Amb22232619 [0,1,0,1,0,0|0,0,2]=4 14115 B9R1.79 COC(=O)CC1CNC1 Amb21960730 [0,1,0,1,0,0|1,0,0]=3 14116 B9R1.79 COC(=O)CC1CNC1 Amb21962978 [0,1,0,1,0,0|1,0,0]=3 14117 B9R1.79 COC(=O)CC1CNC1 Amb22057369 [0,1,0,1,0,0|1,0,0]=3 14118 B9R1.79 COC(=O)CC1COC1 Amb21960725 [0,1,0,1,0,0|1,0,0]=3 14119 B9R1.79 COC(=O)CN1CCC1 Amb24481984 [0,1,0,1,0,0|1,0,0]=3 14120 B9R1.79 COC(=O)NC1CCC1 Amb24761329 [0,1,0,1,0,0|1,0,0]=3 14121 B9R1.79 NC(CC1CCC1)=NO Amb24479922 [0,1,0,1,0,0|1,0,1]=4 14122 B9R1.79 NC(CC1CCC1)CF Amb25248771 [0,1,0,1,0,0|1,0,1]=4 14123 B9R1.79 NC(CC1CCC1)CO Amb24601442 [0,1,0,1,0,0|1,0,1]=4 14124 B9R1.79 NCC(=O)CC1CCC1 Amb24680522 [0,1,0,1,0,0|0,0,0]=2 14125 B9R1.79 NCC(=O)NC1CCC1 Amb18961312 [0,1,0,1,0,0|1,0,0]=3 14126 B9R1.79 NCC(=O)OC1CCC1 Amb18295938 [0,1,0,1,0,0|1,0,0]=3 14127 B9R1.79 NCC(=O)OC1COC1 Amb23454876 [0,1,0,1,0,0|2,0,0]=4 14128 B9R1.79 NCC(F)CC1CCC1 Amb24566684 [0,1,0,1,0,0|1,0,1]=4 14129 B9R1.79 NN=C(N)CC1CCC1 Amb25339959 [0,1,0,1,0,0|2,0,0]=4 14130 B9R1.79 NNC(=O)CC1CCS1 Amb24615787 [0,1,0,1,0,0|2,0,0]=4 14131 B9R1.79 NNC(=O)NC1CCC1 Amb25686991 [0,1,0,1,0,0|2,0,0]=4 14132 B9R1.79 O=C(CBr)CC1CCC1 Amb24392754 [0,1,0,1,0,0|0,0,0]=2 14133 B9R1.79 O=C(CBr)NC1COC1 Amb24742835 [0,1,0,1,0,0|2,0,0]=4 14134 B9R1.79 O=C(CBr)OC1COC1 Amb23454879 [0,1,0,1,0,0|2,0,0]=4 14135 B9R1.79 O=C(CCl)CC1CCC1 Amb24655482 [0,1,0,1,0,0|0,0,0]=2 14136 B9R1.79 O=C(CCl)OC1CNC1 Amb21956162 [0,1,0,1,0,0|2,0,0]=4 14137 B9R1.79 O=C(CF)NC1CCC1 Amb24377670 [0,1,0,1,0,0|1,0,0]=3 14138 B9R1.79 O=C(CS)NC1CCC1 Amb24478681 [0,1,0,1,0,0|1,0,0]=3 14139 B9R1.79 OC(CC1CCC1)CCl Amb24374081 [0,1,0,1,0,0|0,0,2]=4 14140 B9R1.79 OCC(=O)OC1CCC1 Amb25802506 [0,1,0,1,0,0|1,0,0]=3 14141 B9R1.79 OCC(=O)OC1COC1 Amb24683681 [0,1,0,1,0,0|2,0,0]=4 14142 B9R1.79 OCC(F)CC1CCC1 Amb24518712 [0,1,0,1,0,0|1,0,1]=4 14143 B9R1.79 ONC(=O)CC1CCC1 Amb24641259 [0,1,0,1,0,0|1,0,0]=3 14144 B9R1.79 ONC(=O)CC1CNC1 Amb24478635 [0,1,0,1,0,0|2,0,0]=4 14145 B9R1.80 C#CC(=O)NCC1CC1 Amb25084096 [0,1,0,1,0,0|1,0,1]=4 14146 B9R1.80 C=CC(=O)CNC1CC1 Amb25369017 [0,1,0,1,0,0|1,0,1]=4 14147 B9R1.80 CC(CCC1CC1)=NN Amb25136817 [0,1,0,1,0,0|1,0,0]=3 14148 B9R1.80 CC(CCC1CC1)NC Amb25147173 [0,1,0,1,0,0|1,0,1]=4 14149 B9R1.80 CC(CCC1CO1)CC Amb24595175 [0,1,0,1,0,0|0,0,2]=4 14150 B9R1.80 CC(CN)CCC1CC1 Amb24481956 [0,1,0,1,0,0|1,0,1]=4 14151 B9R1.80 CC(CNC1CC1)=CCl Amb25107187 [0,1,0,1,0,0|2,0,0]=4 14152 B9R1.80 CC(CO)=CCC1CC1 Amb25032203 [0,1,0,1,0,0|0,0,2]=4 14153 B9R1.80 CCC(=N)NCC1CC1 Amb24640000 [0,1,0,1,0,0|2,0,0]=4 14154 B9R1.80 CCC(=O)CCC1CC1 Amb25132591 [0,1,0,1,0,0|0,0,0]=2 14155 B9R1.80 CCC(=O)CNC1CC1 Amb25245788 [0,1,0,1,0,0|1,0,0]=3 14156 B9R1.80 CCC(=O)NCC1CO1 Amb23557368 [0,1,0,1,0,0|2,0,0]=4 14157 B9R1.80 CCC(O)CC=C1CC1 Amb24560230 [0,1,0,1,0,0|1,0,1]=4 14158 B9R1.80 CCC(O)CCC1CC1 Amb25845587 [0,1,0,1,0,0|0,0,2]=4 14159 B9R1.80 CCS(=O)CCC1CC1 Amb24476724 [0,1,0,1,0,0|1,0,0]=3 14160 B9R1.80 CNC(=N)CCC1CC1 Amb24709583 [0,1,0,1,0,0|1,0,0]=3 14161 B9R1.80 CNC(=O)NCC1CC1 Amb25085395 [0,1,0,1,0,0|1,0,0]=3 14162 B9R1.80 COC(=N)CCC1CC1 Amb24606272 [0,1,0,1,0,0|1,0,0]=3 14163 B9R1.80 COC(=O)C#CC1CC1 Amb1036567 [0,1,0,1,0,0|0,0,2]=4 14164 B9R1.80 COC(=O)CCC1CC1 Amb24615342 [0,1,0,1,0,0|0,0,0]=2 14165 B9R1.80 COC(=O)CCC1CO1 Amb25377501 [0,1,0,1,0,0|1,0,0]=3 14166 B9R1.80 COC(=O)CNC1CC1 Amb20622332 [0,1,0,1,0,0|1,0,0]=3 14167 B9R1.80 COC(=O)NCC1CC1 Amb24562243 [0,1,0,1,0,0|1,0,0]=3 14168 B9R1.80 COC(=O)\C=C\C1CC1 Amb20621590 [0,1,0,1,0,0|0,0,2]=4 14169 B9R1.80 NC(CCC1CC1)=NO Amb25848987 [0,1,0,1,0,0|1,0,1]=4 14170 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [0,1,0,1,0,0|1,0,1]=4 14171 B9R1.80 NCC(=O)CCC1CC1 Amb25245782 [0,1,0,1,0,0|0,0,0]=2 14172 B9R1.80 NCC(=O)OCC1CC1 Amb13952550 [0,1,0,1,0,0|1,0,0]=3 14173 B9R1.80 NCC(=O)OCC1CC1 Amb18305119 [0,1,0,1,0,0|1,0,0]=3 14174 B9R1.80 NCC(O)CCC1CC1 Amb25136180 [0,1,0,1,0,0|0,0,2]=4 14175 B9R1.80 NNC(=O)CCC1CC1 Amb25231267 [0,1,0,1,0,0|1,0,0]=3 14176 B9R1.80 O=C(CBr)NCC1CC1 Amb22059289 [0,1,0,1,0,0|1,0,0]=3 14177 B9R1.80 O=C(CBr)OCC1CC1 Amb24392877 [0,1,0,1,0,0|1,0,0]=3 14178 B9R1.80 O=C(CI)NCC1CC1 Amb24660173 [0,1,0,1,0,0|1,0,0]=3 14179 B9R1.80 O=C(C[*])OCC1CO1 Amb22045255 [0,1,0,1,0,0|2,0,0]=4 14180 B9R1.80 O=CC(Br)CCC1CC1 Amb24480149 [0,1,0,1,0,0|1,0,1]=4 14181 B9R1.80 OC(CCC1CC1)C=O Amb25846669 [0,1,0,1,0,0|1,0,1]=4 14182 B9R1.80 OC(CCl)CCC1CC1 Amb24398131 [0,1,0,1,0,0|0,0,2]=4 14183 B9R1.81 CC1CCC1C(=O)CC Amb24614007 [0,1,0,1,0,0|0,0,0]=2 14184 B9R1.81 CC1CCC1C(=O)OC Amb25110041 [0,1,0,1,0,0|0,0,0]=2 14185 B9R1.81 CC1CCC1C(C)NC Amb25285798 [0,1,0,1,0,0|1,0,1]=4 14186 B9R1.81 CC1CCC1C(N)CC Amb24677158 [0,1,0,1,0,0|1,0,1]=4 14187 B9R1.81 CCC(=O)N1CCC1C Amb24466096 [0,1,0,1,0,0|1,0,0]=3 14188 B9R1.81 CN1CCC1C(=O)NN Amb25177619 [0,1,0,1,0,0|2,0,0]=4 14189 B9R1.81 CNC(=O)N1CCC1C Amb24502373 [0,1,0,1,0,0|1,0,0]=3 14190 B9R1.81 CNC(=S)N1CCC1C Amb25297241 [0,1,0,1,0,0|1,1,0]=4 14191 B9R1.81 COC(=O)C1=CCC1C Amb25335471 [0,1,0,1,0,0|0,0,2]=4 14192 B9R1.81 COC(=O)C1CCC1N Amb25363640 [0,1,0,1,0,0|1,0,0]=3 14193 B9R1.81 COC(=O)C1CCC1O Amb24448430 [0,1,0,1,0,0|1,0,0]=3 14194 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb22232595 [0,1,0,1,0,0|1,0,0]=3 14195 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N Amb23439308 [0,1,0,1,0,0|1,0,0]=3 14196 B9R1.81 COC(=O)[C@@H]1CC[C@H]1Cl Amb24635677 [0,1,0,1,0,0|1,0,0]=3 14197 B9R1.81 COC(=O)[C@H]1CC[C@@H]1N Amb25261158 [0,1,0,1,0,0|1,0,0]=3 14198 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Amb22232608 [0,1,0,1,0,0|1,0,0]=3 14199 B9R1.81 COC(=O)[C@H]1NC[C@H]1O Amb24573017 [0,1,0,1,0,0|2,0,0]=4 14200 B9R1.81 C[C@H]1CC[C@H]1C(=O)OC Amb24559896 [0,1,0,1,0,0|0,0,0]=2 14201 B9R1.88 CC(CN)C1CC1CC Amb25365311 [0,1,0,1,0,0|1,0,1]=4 14202 B9R1.88 CCC(=O)[C@@H]1O[C@H]1CC Amb24534297 [0,1,0,1,0,0|1,0,0]=3 14203 B9R1.88 CCC1CC1C(=O)C#C Amb25374204 [0,1,0,1,0,0|0,0,1]=3 14204 B9R1.88 CCC1CC1C(=O)NC Amb25264117 [0,1,0,1,0,0|0,0,0]=2 14205 B9R1.88 CCC1CC1C(=O)OC Amb24601476 [0,1,0,1,0,0|0,0,0]=2 14206 B9R1.88 CC[C@@H]1C[C@H]1C(=O)C=C Amb25335783 [0,1,0,1,0,0|0,0,1]=3 14207 B9R1.88 CC[C@@H]1C[C@H]1C(=O)CN Amb25198853 [0,1,0,1,0,0|0,0,0]=2 14208 B9R1.88 CNC(=O)C1CC1C=C Amb22356831 [0,1,0,1,0,0|0,0,2]=4 14209 B9R1.88 COC(=O)C1CC1C=C Amb24387009 [0,1,0,1,0,0|0,0,2]=4 14210 B9R1.88 COC(=O)C1CC1C=O Amb24480363 [0,1,0,1,0,0|1,0,1]=4 14211 B9R1.88 COC(=O)C1CC1CBr Amb25122701 [0,1,0,1,0,0|1,0,0]=3 14212 B9R1.88 COC(=O)C1CC1CN Amb22011650 [0,1,0,1,0,0|1,0,0]=3 14213 B9R1.88 COC(=O)C1CC1CN Amb22546318 [0,1,0,1,0,0|1,0,0]=3 14214 B9R1.88 COC(=O)C1CC1CO Amb25185377 [0,1,0,1,0,0|1,0,0]=3 14215 B9R1.88 COC(=O)C1OC1CBr Amb25690928 [0,1,0,1,0,0|2,0,0]=4 14216 B9R1.88 COC(=O)[C@@H]1CC1CO Amb25831869 [0,1,0,1,0,0|1,0,0]=3 14217 B9R1.88 COC(=O)[C@@H]1C[C@@H]1C=O Amb24617207 [0,1,0,1,0,0|1,0,1]=4 14218 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CN Amb22900923 [0,1,0,1,0,0|1,0,0]=3 14219 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CO Amb24575289 [0,1,0,1,0,0|1,0,0]=3 14220 B9R1.88 COC(=O)[C@@H]1C[C@H]1C#N Amb24579735 [0,1,0,1,0,0|1,0,1]=4 14221 B9R1.88 COC(=O)[C@@H]1C[C@H]1CN Amb24517267 [0,1,0,1,0,0|1,0,0]=3 14222 B9R1.88 COC(=O)[C@@H]1O[C@H]1CBr Amb25236632 [0,1,0,1,0,0|2,0,0]=4 14223 B9R1.88 COC(=O)[C@@H]1O[C@H]1CO Amb24107515 [0,1,0,1,0,0|2,0,0]=4 14224 B9R1.88 COC(=O)[C@H]1C[C@@H]1C=O Amb24722901 [0,1,0,1,0,0|1,0,1]=4 14225 B9R1.88 NNC(=O)C1CC1CO Amb24576885 [0,1,0,1,0,0|2,0,0]=4 14226 B9R1.88 NNC(=O)[C@@H]1C[C@H]1CO Amb25177034 [0,1,0,1,0,0|2,0,0]=4 14227 B9R1.88 NNC(=O)[C@H]1C[C@H]1CO Amb24598763 [0,1,0,1,0,0|2,0,0]=4 14228 B9R1.89 BrCC1CCCCCC1 Amb19073228 [0,1,0,1,0,0|1,0,1]=4 14229 B9R1.89 BrCC1CCCCCN1 Amb25283719 [0,1,0,1,0,0|1,0,1]=4 14230 B9R1.89 Br[Zn]C1CCCCCC1 Amb22897736 [0,1,0,1,0,0|1,0,1]=4 14231 B9R1.89 C#CC1=CCCCCC1 Amb17689256 [0,1,0,1,0,0|1,0,1]=4 14232 B9R1.89 C#CC1CCCCCC1 Amb25277452 [0,1,0,1,0,0|1,0,1]=4 14233 B9R1.89 C=CC1CCCCCC1 Amb25068667 [0,1,0,1,0,0|1,0,1]=4 14234 B9R1.89 CC=C1CCCCCC1 Amb22230656 [0,1,0,1,0,0|1,0,0]=3 14235 B9R1.89 CCC1CCCCCN1 Amb22055381 [0,1,0,1,0,0|1,0,1]=4 14236 B9R1.89 CCN1CCCCCC1 Amb16231374 [0,1,0,1,0,0|2,0,0]=4 14237 B9R1.89 CNB1CCCCCC1 Amb25267072 [0,1,0,1,0,0|2,0,0]=4 14238 B9R1.89 CNC1CCCCCC1 Amb1106215 [0,1,0,1,0,0|1,0,1]=4 14239 B9R1.89 CNC1CCCCCC1 Amb22587117 [0,1,0,1,0,0|1,0,1]=4 14240 B9R1.89 COC=1NCCCCN1 Amb25260763 [0,1,0,1,0,0|2,0,0]=4 14241 B9R1.89 CSC=1CCCCCN1 Amb24514736 [0,1,0,1,0,0|1,0,0]=3 14242 B9R1.89 C\C=C/1\CCCNCC1 Amb24356914 [0,1,0,1,0,0|2,0,0]=4 14243 B9R1.89 ClC=[N+]1CCCCCC1 Amb25690018 [0,1,0,1,0,0|2,0,0]=4 14244 B9R1.89 ICC1CCCCCO1 Amb22489614 [0,1,0,1,0,0|0,0,2]=4 14245 B9R1.89 NCC1CCCCCC1 Amb22001955 [0,1,0,1,0,0|1,0,1]=4 14246 B9R1.89 NNC1=NCCCCC1 Amb17593334 [0,1,0,1,0,0|2,0,0]=4 14247 B9R1.89 NNC1CCCCCC1 Amb19373178 [0,1,0,1,0,0|1,0,1]=4 14248 B9R1.89 NNC1CCCCCC1 Amb22227928 [0,1,0,1,0,0|1,0,1]=4 14249 B9R1.89 NOC1CCCCCC1 Amb25315377 [0,1,0,1,0,0|0,0,2]=4 14250 B9R1.89 O=C=C1CCCCCC1 Amb24412602 [0,1,0,1,0,0|0,0,0]=2 14251 B9R1.89 O=CC1CCCCCN1 Amb24461226 [0,1,0,1,0,0|1,0,1]=4 14252 B9R1.89 O=CC1CCCOCC1 Amb18832626 [0,1,0,1,0,0|1,0,1]=4 14253 B9R1.89 O=CC1CCCSCC1 Amb18202390 [0,1,0,1,0,0|1,0,1]=4 14254 B9R1.89 O=CN1CCCOCC1 Amb24417075 [0,1,0,1,0,0|2,0,0]=4 14255 B9R1.89 O=CN1CCCSCC1 Amb25760067 [0,1,0,1,0,0|2,0,0]=4 14256 B9R1.89 O=CN1CCNCCC1 Amb1155085 [0,1,0,1,0,0|2,0,0]=4 14257 B9R1.89 O=NN1CCCCCC1 Amb22230749 [0,1,0,1,0,0|1,0,0]=3 14258 B9R1.89 O=NN1CCCNCC1 Amb25162795 [0,1,0,1,0,0|2,0,0]=4 14259 B9R1.89 OCC1CCCCCC1 Amb20240529 [0,1,0,1,0,0|0,0,2]=4 14260 B9R1.89 OCC1CCCCCO1 Amb25687959 [0,1,0,1,0,0|0,0,2]=4 14261 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [0,1,0,1,0,0|1,0,1]=4 14262 B9R1.89 ON=C1CCCNCC1 Amb24598624 [0,1,0,1,0,0|1,0,1]=4 14263 B9R1.89 ON=C1CCCOCC1 Amb25147029 [0,1,0,1,0,0|1,0,1]=4 14264 B9R1.89 ONC1CCCCCC1 Amb25724076 [0,1,0,1,0,0|0,0,2]=4 14265 B9R1.89 O\N=C/1\CCCCCN1 Amb1107240 [0,1,0,1,0,0|1,0,1]=4 14266 B9R1.89 O\N=C\1/CCCCCN1 Amb19664764 [0,1,0,1,0,0|1,0,1]=4 14267 B9R1.89 O\N=C\1/CCCNCC1 Amb17933188 [0,1,0,1,0,0|1,0,1]=4 14268 B9R1.89 SCC1CCCCCN1 Amb24477790 [0,1,0,1,0,0|1,0,1]=4 14269 B9R1.89 [C-]#[N+]C1CCCCCC1 Amb1981029 [0,1,0,1,0,0|1,0,1]=4 14270 B9R1.97 CC[C@@H]1CC[C@@]1(C)CO Amb24620945 [0,1,0,1,0,0|0,0,2]=4 14271 B9R1.97 CC[C@H]1CC[C@@]1(C)CO Amb24719553 [0,1,0,1,0,0|0,0,2]=4 14272 B9R1.99 CCCCCC1(N)CC1 Amb24623686 [0,1,0,1,0,0|1,0,1]=4 14273 B9R1.99 CCCCC[C@]1(C)CO1 Amb25339190 [0,1,0,1,0,0|0,0,2]=4 14274 B9R1.118 CC1(CCCCC1)C#C Amb21963029 [0,1,0,1,0,0|1,0,1]=4 14275 B9R1.118 CC1(CCCCC1)C#N Amb18642140 [0,1,0,1,0,0|1,0,1]=4 14276 B9R1.118 CC1(CCCCC1)C=C Amb24376596 [0,1,0,1,0,0|1,0,1]=4 14277 B9R1.118 CC1(CCCCC1)NN Amb25068508 [0,1,0,1,0,0|1,0,1]=4 14278 B9R1.118 CC1(CCCCO1)C=O Amb24627620 [0,1,0,1,0,0|1,0,1]=4 14279 B9R1.118 CC1(CCOCC1)C=O Amb19516695 [0,1,0,1,0,0|1,0,1]=4 14280 B9R1.118 CC1(CCSCC1)C=O Amb25108539 [0,1,0,1,0,0|1,0,1]=4 14281 B9R1.118 CC1(CN)CCCCC1 Amb20632204 [0,1,0,1,0,0|1,0,1]=4 14282 B9R1.118 CC1(COCCC1)C=O Amb25082506 [0,1,0,1,0,0|1,0,1]=4 14283 B9R1.118 CC1(CS)CCCCC1 Amb24572456 [0,1,0,1,0,0|0,1,1]=4 14284 B9R1.118 CCC1(C)CCCCC1 Amb22227942 [0,1,0,1,0,0|1,0,1]=4 14285 B9R1.118 CCC1(O)CCCCC1 Amb1019962 [0,1,0,1,0,0|0,0,2]=4 14286 B9R1.118 CC[N+]1(C)CCCCC1 Amb22353723 [0,1,0,1,0,0|2,0,0]=4 14287 B9R1.118 CC[Si]1(Cl)CCCCC1 Amb25199763 [0,1,0,1,0,0|1,1,0]=4 14288 B9R1.118 CNC1(C)CCCCC1 Amb18946302 [0,1,0,1,0,0|1,0,1]=4 14289 B9R1.118 ClC1(CBr)CCCCC1 Amb24525178 [0,1,0,1,0,0|1,0,1]=4 14290 B9R1.118 ClCC1(Br)CCCCC1 Amb24631169 [0,1,0,1,0,0|1,0,1]=4 14291 B9R1.118 ClC[Si]1(Cl)CCCCC1 Amb24364537 [0,1,0,1,0,0|1,1,0]=4 14292 B9R1.118 FC1(CCl)CCCCC1 Amb24751621 [0,1,0,1,0,0|1,0,1]=4 14293 B9R1.118 NC1(CCCCC1)C=O Amb25848234 [0,1,0,1,0,0|1,0,1]=4 14294 B9R1.118 NCC1(F)CCCCC1 Amb22174148 [0,1,0,1,0,0|1,0,1]=4 14295 B9R1.118 NCC1(F)CCCCC1 Amb22887010 [0,1,0,1,0,0|1,0,1]=4 14296 B9R1.118 NCC1(N)CCCCC1 Amb2371826 [0,1,0,1,0,0|1,0,1]=4 14297 B9R1.118 NCC1(O)CCCCC1 Amb1108364 [0,1,0,1,0,0|0,0,2]=4 14298 B9R1.118 O=CC1(Br)CCCCC1 Amb17594982 [0,1,0,1,0,0|1,0,1]=4 14299 B9R1.118 O=CC1(C)CCCCC1 Amb10070781 [0,1,0,1,0,0|0,0,1]=3 14300 B9R1.118 O=CC1(Cl)CCCCC1 Amb17593665 [0,1,0,1,0,0|1,0,1]=4 14301 B9R1.118 O=CC1(S)CCCCC1 Amb18124700 [0,1,0,1,0,0|1,0,1]=4 14302 B9R1.118 O=NC1(Br)CCCCC1 Amb25272110 [0,1,0,1,0,0|1,0,1]=4 14303 B9R1.118 OC1(CBr)CCCCC1 Amb23597825 [0,1,0,1,0,0|0,0,2]=4 14304 B9R1.118 OC1(CCCCC1)C=O Amb18642629 [0,1,0,1,0,0|1,0,1]=4 14305 B9R1.118 OC1(CCl)CCCCC1 Amb25348439 [0,1,0,1,0,0|0,0,2]=4 14306 B9R1.118 OCC1(F)CCCCC1 Amb10603424 [0,1,0,1,0,0|1,0,1]=4 14307 B9R1.118 OCC1(N)CCCCC1 Amb10608249 [0,1,0,1,0,0|1,0,1]=4 14308 B9R1.118 OCC1(O)CCCCC1 Amb10552888 [0,1,0,1,0,0|0,0,2]=4 14309 B9R1.118 OCC1(S)CCCCC1 Amb25084707 [0,1,0,1,0,0|0,1,1]=4 14310 B9R1.132 C=C1C(CO)CCC1=O Amb24723765 [0,1,0,1,0,0|1,0,1]=4 14311 B9R1.132 CC1C(Br)CCC1CC Amb25141703 [0,1,0,1,0,0|1,0,1]=4 14312 B9R1.132 CC1C(CCC1=O)C#N Amb22505312 [0,1,0,1,0,0|1,0,1]=4 14313 B9R1.132 CC1C(CCN1C)CC Amb25842243 [0,1,0,1,0,0|2,0,0]=4 14314 B9R1.132 CC1C(CN=C1N)CC Amb25242752 [0,1,0,1,0,0|2,0,0]=4 14315 B9R1.132 CC1C(CNC1=O)CC Amb24395523 [0,1,0,1,0,0|1,0,0]=3 14316 B9R1.132 CC1C(CO)CNC1=O Amb25142911 [0,1,0,1,0,0|2,0,0]=4 14317 B9R1.132 CC1C(O)CCC1CC Amb25682024 [0,1,0,1,0,0|0,0,2]=4 14318 B9R1.132 CC1C(OCC1=O)OC Amb24690537 [0,1,0,1,0,0|2,0,0]=4 14319 B9R1.132 CC1CCC(CC)C1O Amb25306537 [0,1,0,1,0,0|0,0,2]=4 14320 B9R1.132 CC1[C@@H](CCC1=O)C=C Amb25735168 [0,1,0,1,0,0|0,0,2]=4 14321 B9R1.132 CC1[C@@H](CO)CNC1=O Amb24724590 [0,1,0,1,0,0|2,0,0]=4 14322 B9R1.132 CC=1C(=O)CCC1CCl Amb25032248 [0,1,0,1,0,0|1,0,1]=4 14323 B9R1.132 CC=1C(=O)CCC1NC Amb25146177 [0,1,0,1,0,0|1,0,1]=4 14324 B9R1.132 CC=1C(=O)CCC1OC Amb25830515 [0,1,0,1,0,0|1,0,1]=4 14325 B9R1.132 CC=1CCC(OC)C1Br Amb25147063 [0,1,0,1,0,0|2,0,0]=4 14326 B9R1.132 CCC1CCC(=O)C1=C Amb25348574 [0,1,0,1,0,0|0,0,1]=3 14327 B9R1.132 CCC1CCC(=O)C1Br Amb25363275 [0,1,0,1,0,0|0,0,0]=2 14328 B9R1.132 CCC1CCC(O)C1O Amb25780900 [0,1,0,1,0,0|0,0,2]=4 14329 B9R1.132 CCC1CN=C(N)N1C Amb25841373 [0,1,0,1,0,0|2,0,0]=4 14330 B9R1.132 CCC1CNC(=O)C1N Amb25732553 [0,1,0,1,0,0|1,0,0]=3 14331 B9R1.132 CCC1CNC(=O)N1C Amb25834141 [0,1,0,1,0,0|1,0,0]=3 14332 B9R1.132 CCC1NCC(=O)N1C Amb24481723 [0,1,0,1,0,0|1,0,0]=3 14333 B9R1.132 CCN1CCC(=O)C1=O Amb25759125 [0,1,0,1,0,0|1,0,1]=4 14334 B9R1.132 CC[C@@H]1CCC(=O)C1=C Amb25714242 [0,1,0,1,0,0|0,0,1]=3 14335 B9R1.132 CC[C@@H]1CNC(=O)[C@@H]1N Amb24603686 [0,1,0,1,0,0|1,0,0]=3 14336 B9R1.132 CC[C@@H]1COC(=O)N1C Amb25736752 [0,1,0,1,0,0|1,0,0]=3 14337 B9R1.132 CC[C@@H]1ONC(=O)[C@H]1N Amb25745431 [0,1,0,1,0,0|2,0,0]=4 14338 B9R1.132 CC[C@H]1CCC(=O)[C@H]1Br Amb25249103 [0,1,0,1,0,0|0,0,0]=2 14339 B9R1.132 CN1C(CBr)CCC1=O Amb23597461 [0,1,0,1,0,0|1,0,0]=3 14340 B9R1.132 CN1C(CBr)NCC1=O Amb24333058 [0,1,0,1,0,0|2,0,0]=4 14341 B9R1.132 CN1C(CCC1=O)C#C Amb24433849 [0,1,0,1,0,0|0,0,2]=4 14342 B9R1.132 CN1C(CCC1=O)C=C Amb25146894 [0,1,0,1,0,0|0,0,2]=4 14343 B9R1.132 CN1C(CCC1=O)C=O Amb24725330 [0,1,0,1,0,0|1,0,1]=4 14344 B9R1.132 CN1C(CCl)CCC1=O Amb25757771 [0,1,0,1,0,0|1,0,0]=3 14345 B9R1.132 CN1C(CN)CCC1=O Amb22587696 [0,1,0,1,0,0|1,0,0]=3 14346 B9R1.132 CN1C(CO)COC1=O Amb22504497 [0,1,0,1,0,0|2,0,0]=4 14347 B9R1.132 CN1CCC(CO)C1=O Amb22236004 [0,1,0,1,0,0|2,0,0]=4 14348 B9R1.132 CN1[C@@H](CBr)CCC1=O Amb24423803 [0,1,0,1,0,0|1,0,0]=3 14349 B9R1.132 CN1[C@@H](CO)CCC1=O Amb25032258 [0,1,0,1,0,0|1,0,0]=3 14350 B9R1.132 CN1[C@H](CO)CCC1=O Amb25147115 [0,1,0,1,0,0|1,0,0]=3 14351 B9R1.132 CN=C1CCC(=O)N1C Amb24626107 [0,1,0,1,0,0|1,0,1]=4 14352 B9R1.132 CNC1CCN(C)C1=O Amb18945539 [0,1,0,1,0,0|2,0,0]=4 14353 B9R1.132 CO[C@@H]1COC(=O)[C@@H]1O Amb24733177 [0,1,0,1,0,0|2,0,0]=4 14354 B9R1.132 C[C@@H]1[C@@H](CO)NCC1=O Amb25180835 [0,1,0,1,0,0|2,0,0]=4 14355 B9R1.132 C[C@@H]1[C@H](CCC1=O)C#N Amb24625380 [0,1,0,1,0,0|1,0,1]=4 14356 B9R1.132 C[C@@H]1[C@H](CCC1=O)C=C Amb25205219 [0,1,0,1,0,0|0,0,2]=4 14357 B9R1.132 C[C@H]1[C@@H](CCC1=O)C=O Amb25247204 [0,1,0,1,0,0|1,0,1]=4 14358 B9R1.132 C[C@H]1[C@@H](CCC1=O)CBr Amb24595759 [0,1,0,1,0,0|1,0,0]=3 14359 B9R1.132 C[C@H]1[C@@H](CCC1=O)CO Amb24582507 [0,1,0,1,0,0|1,0,0]=3 14360 B9R1.132 C[C@H]1[C@@H](CO)CNC1=O Amb25204711 [0,1,0,1,0,0|2,0,0]=4 14361 B9R1.132 C[C@H]1[C@H](CCC1=O)C=C Amb24598896 [0,1,0,1,0,0|0,0,2]=4 14362 B9R1.132 N[C@H]1[C@H](CS)COC1=O Amb24715941 [0,1,0,1,0,0|2,0,0]=4 14363 B9R1.132 O=C1OCC(CCl)C1Cl Amb24653769 [0,1,0,1,0,0|2,0,0]=4 14364 B9R1.132 ON1C(CBr)CCC1=O Amb24480150 [0,1,0,1,0,0|2,0,0]=4 14365 B9R1.132 O[C@H]1[C@H](COC1=O)CO Amb24733237 [0,1,0,1,0,0|2,0,0]=4 14366 B9R1.135 CC1C(CC1=O)OCC Amb25257374 [0,1,0,1,0,0|1,0,0]=3 14367 B9R1.135 CC1C(CCO)NC1=O Amb25320276 [0,1,0,1,0,0|2,0,0]=4 14368 B9R1.135 CC1C(NC1=O)SCC Amb25250448 [0,1,0,1,0,0|2,0,0]=4 14369 B9R1.135 CC=1C(=O)CC1SCC Amb24367613 [0,1,0,1,0,0|1,0,1]=4 14370 B9R1.135 CCOC1CC(=O)C1Cl Amb25221976 [0,1,0,1,0,0|1,0,0]=3 14371 B9R1.135 CCOC1CC(=O)N1C Amb25346887 [0,1,0,1,0,0|1,0,0]=3 14372 B9R1.135 COCC1NC(=O)C1O Amb25102634 [0,1,0,1,0,0|2,0,0]=4 14373 B9R1.135 C[C@@H]1[C@H](CCO)NC1=O Amb24681501 [0,1,0,1,0,0|2,0,0]=4 14374 B9R1.135 C[C@H]1[C@@H](NC1=O)SCC Amb24670518 [0,1,0,1,0,0|2,0,0]=4 14375 B9R1.202 CC1CCCC1(C)CN Amb24615536 [0,1,0,1,0,0|1,0,1]=4 14376 B9R1.202 CC1CCCC1(N)CO Amb25792492 [0,1,0,1,0,0|1,0,1]=4 14377 B9R1.202 CC1CCCC1(O)CN Amb25146157 [0,1,0,1,0,0|0,0,2]=4 14378 B9R1.202 CC1CCC[Si]1(C)CCl Amb25032093 [0,1,0,1,0,0|1,1,0]=4 14379 B9R1.202 CCC1(O)CCCC1C Amb24474369 [0,1,0,1,0,0|0,0,2]=4 14380 B9R1.202 CNC1(C)CCCC1C Amb25804166 [0,1,0,1,0,0|1,0,1]=4 14381 B9R1.202 C[C@H]1CCC[C@@]1(C)C=O Amb24640291 [0,1,0,1,0,0|0,0,1]=3 14382 B9R1.6 CC(=C)C1CCCCC1 Amb24478631 [0,1,0,1,0,0|1,0,0]=3 14383 B9R1.6 CC(=C)C1CCCCN1 Amb23536631 [0,1,0,1,0,0|1,0,0]=3 14384 B9R1.6 CC(=C)C1CCNCC1 Amb23536711 [0,1,0,1,0,0|1,0,0]=3 14385 B9R1.6 CC(=C)C1CNCCC1 Amb23536695 [0,1,0,1,0,0|1,0,0]=3 14386 B9R1.6 CC(=C)C1OCCCO1 Amb17334098 [0,1,0,1,0,0|2,0,0]=4 14387 B9R1.6 CC(=C1CCNCC1)C Amb16187021 [0,1,0,1,0,0|1,0,1]=4 14388 B9R1.6 CC(=O)C1=CNCCC1 Amb1162825 [0,1,0,1,0,0|0,0,2]=4 14389 B9R1.6 CC(=O)C1=NCCCC1 Amb17607660 [0,1,0,1,0,0|0,0,1]=3 14390 B9R1.6 CC(=O)C1=NCCCS1 Amb25370956 [0,1,0,1,0,0|1,0,1]=4 14391 B9R1.6 CC(=O)C1CCC=CN1 Amb25094747 [0,1,0,1,0,0|0,0,2]=4 14392 B9R1.6 CC(=O)C1CCC=CO1 Amb24650635 [0,1,0,1,0,0|0,0,2]=4 14393 B9R1.6 CC(=O)C1CCCC=C1 Amb17593287 [0,1,0,1,0,0|0,0,1]=3 14394 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [0,1,0,1,0,0|0,0,0]=2 14395 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [0,1,0,1,0,0|0,0,0]=2 14396 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [0,1,0,1,0,0|0,0,0]=2 14397 B9R1.6 CC(=O)C1CCNCC1 Amb10603454 [0,1,0,1,0,0|0,0,0]=2 14398 B9R1.6 CC(=O)C1CCNCC1 Amb19958038 [0,1,0,1,0,0|0,0,0]=2 14399 B9R1.6 CC(=O)C1CCOCC1 Amb16231304 [0,1,0,1,0,0|0,0,0]=2 14400 B9R1.6 CC(=O)C1CCSCC1 Amb24748894 [0,1,0,1,0,0|0,0,0]=2 14401 B9R1.6 CC(=O)C1CN=CCC1 Amb25073951 [0,1,0,1,0,0|0,0,1]=3 14402 B9R1.6 CC(=O)C1CNCCC1 Amb22496258 [0,1,0,1,0,0|0,0,0]=2 14403 B9R1.6 CC(=O)C1CNCCO1 Amb22754664 [0,1,0,1,0,0|1,0,0]=3 14404 B9R1.6 CC(=O)C1CNCCO1 Amb25147230 [0,1,0,1,0,0|1,0,0]=3 14405 B9R1.6 CC(=O)C1CNCCS1 Amb24105963 [0,1,0,1,0,0|1,0,0]=3 14406 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [0,1,0,1,0,0|1,0,0]=3 14407 B9R1.6 CC(=O)C1COCCO1 Amb20669104 [0,1,0,1,0,0|1,0,0]=3 14408 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [0,1,0,1,0,0|1,0,0]=3 14409 B9R1.6 CC(=O)C1CSCCO1 Amb24751439 [0,1,0,1,0,0|1,0,0]=3 14410 B9R1.6 CC(=O)C1OCCCO1 Amb25185294 [0,1,0,1,0,0|1,0,0]=3 14411 B9R1.6 CC(=O)C1SCCCS1 Amb17594050 [0,1,0,1,0,0|1,0,0]=3 14412 B9R1.6 CC(=O)C=1CCCCN1 Amb22054236 [0,1,0,1,0,0|0,0,1]=3 14413 B9R1.6 CC(=O)C=1CNCCC1 Amb24461681 [0,1,0,1,0,0|0,0,2]=4 14414 B9R1.6 CC(=O)C=1CSCCC1 Amb25177639 [0,1,0,1,0,0|0,0,2]=4 14415 B9R1.6 CC(=O)C=1CSCCN1 Amb24620482 [0,1,0,1,0,0|1,0,1]=4 14416 B9R1.6 CC(=O)N1CC=CCC1 Amb25031981 [0,1,0,1,0,0|0,0,2]=4 14417 B9R1.6 CC(=O)N1CC=NCC1 Amb25188901 [0,1,0,1,0,0|1,0,1]=4 14418 B9R1.6 CC(=O)N1CCCCO1 Amb24690936 [0,1,0,1,0,0|1,0,0]=3 14419 B9R1.6 CC(=O)N1CCSCC1 Amb25794047 [0,1,0,1,0,0|1,0,0]=3 14420 B9R1.6 CC(=O)N1CNCCC1 Amb24580642 [0,1,0,1,0,0|1,0,0]=3 14421 B9R1.6 CC(=O)N1COCCC1 Amb25106717 [0,1,0,1,0,0|1,0,0]=3 14422 B9R1.6 CC(=O)[C@H]1CCC=CO1 Amb25349063 [0,1,0,1,0,0|0,0,2]=4 14423 B9R1.6 CC(=O)[C@H]1CCCC=C1 Amb25683968 [0,1,0,1,0,0|0,0,1]=3 14424 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [0,1,0,1,0,0|0,0,0]=2 14425 B9R1.6 CC(Br)C1CCCOC1 Amb25105081 [0,1,0,1,0,0|1,0,1]=4 14426 B9R1.6 CC(Br)C1CCNCC1 Amb25349600 [0,1,0,1,0,0|1,0,1]=4 14427 B9R1.6 CC(C)=C1CNCCC1 Amb24738538 [0,1,0,1,0,0|1,0,1]=4 14428 B9R1.6 CC(C)C1CCNCC1 Amb19148785 [0,1,0,1,0,0|1,0,1]=4 14429 B9R1.6 CC(C)N1CCCCC1 Amb25726475 [0,1,0,1,0,0|1,0,1]=4 14430 B9R1.6 CC(C)[C@@H]1CCCCN1 Amb24671326 [0,1,0,1,0,0|1,0,1]=4 14431 B9R1.6 CC(C)[C@H]1CCCCN1 Amb24417281 [0,1,0,1,0,0|1,0,1]=4 14432 B9R1.6 CC(C)[C@H]1CNCCC1 Amb24745922 [0,1,0,1,0,0|1,0,1]=4 14433 B9R1.6 CC(C1CCCCN1)C Amb2235858 [0,1,0,1,0,0|1,0,1]=4 14434 B9R1.6 CC(C1CCCCN1)C Amb2237211 [0,1,0,1,0,0|1,0,1]=4 14435 B9R1.6 CC(C1CCCNC1)C Amb10607741 [0,1,0,1,0,0|1,0,1]=4 14436 B9R1.6 CC(C1CCCNC1)O Amb17593363 [0,1,0,1,0,0|0,0,2]=4 14437 B9R1.6 CC(C1CCNCC1)C Amb10607748 [0,1,0,1,0,0|1,0,1]=4 14438 B9R1.6 CC(Cl)C1CCCOC1 Amb24604738 [0,1,0,1,0,0|1,0,1]=4 14439 B9R1.6 CC(F)C1CCCCN1 Amb23454847 [0,1,0,1,0,0|1,0,1]=4 14440 B9R1.6 CC(F)C1CCCNC1 Amb23454853 [0,1,0,1,0,0|1,0,1]=4 14441 B9R1.6 CC(F)C1CCNCC1 Amb23454856 [0,1,0,1,0,0|1,0,1]=4 14442 B9R1.6 CC(N)C1CCCCC1 Amb22492354 [0,1,0,1,0,0|1,0,1]=4 14443 B9R1.6 CC(N)C1CCCNC1 Amb18832598 [0,1,0,1,0,0|1,0,1]=4 14444 B9R1.6 CC(N)C1CCCOC1 Amb18832549 [0,1,0,1,0,0|1,0,1]=4 14445 B9R1.6 CC(N)C1CCCSC1 Amb18825995 [0,1,0,1,0,0|1,0,1]=4 14446 B9R1.6 CC(N)C1CCNCC1 Amb18203242 [0,1,0,1,0,0|1,0,1]=4 14447 B9R1.6 CC(N)C1CCOCC1 Amb18832548 [0,1,0,1,0,0|1,0,1]=4 14448 B9R1.6 CC(N)C1CCOCC1 Amb23399781 [0,1,0,1,0,0|1,0,1]=4 14449 B9R1.6 CC(N)C1CCSCC1 Amb18199073 [0,1,0,1,0,0|1,0,1]=4 14450 B9R1.6 CC(N)N1CCCCC1 Amb24105788 [0,1,0,1,0,0|1,0,1]=4 14451 B9R1.6 CC(N1CCCCC1)O Amb10603455 [0,1,0,1,0,0|0,0,2]=4 14452 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [0,1,0,1,0,0|0,0,2]=4 14453 B9R1.6 CC(O)C1CCCCO1 Amb23585663 [0,1,0,1,0,0|0,0,2]=4 14454 B9R1.6 CC(O)C1CCCCS1 Amb23568559 [0,1,0,1,0,0|0,0,2]=4 14455 B9R1.6 CC(O)C1CCCOC1 Amb23590161 [0,1,0,1,0,0|0,0,2]=4 14456 B9R1.6 CC(O)C1CCNCC1 Amb21955698 [0,1,0,1,0,0|0,0,2]=4 14457 B9R1.6 CC(O)C1CCNCC1 Amb22587101 [0,1,0,1,0,0|0,0,2]=4 14458 B9R1.6 CC(O)C1CCNCC1 Amb22899459 [0,1,0,1,0,0|0,0,2]=4 14459 B9R1.6 CC(O)C1CCOCC1 Amb20667854 [0,1,0,1,0,0|0,0,2]=4 14460 B9R1.6 CC(S)C1CCCCN1 Amb25707556 [0,1,0,1,0,0|0,1,1]=4 14461 B9R1.6 CC(S)C1CCNCC1 Amb24427532 [0,1,0,1,0,0|0,1,1]=4 14462 B9R1.6 CN(C)C1CCCCN1 Amb24644194 [0,1,0,1,0,0|2,0,0]=4 14463 B9R1.6 CN(C)C1CCCCO1 Amb22523025 [0,1,0,1,0,0|2,0,0]=4 14464 B9R1.6 CN(C)C1CCOCC1 Amb21858035 [0,1,0,1,0,0|2,0,0]=4 14465 B9R1.6 CN(C)C1CSCCC1 Amb24733478 [0,1,0,1,0,0|2,0,0]=4 14466 B9R1.6 CN(C)[C@@H]1CNCCC1 Amb22230579 [0,1,0,1,0,0|2,0,0]=4 14467 B9R1.6 CN(C)[C@@H]1CNCCC1 Amb22230580 [0,1,0,1,0,0|2,0,0]=4 14468 B9R1.6 CN(C)[C@H]1CNCCC1 Amb22230576 [0,1,0,1,0,0|2,0,0]=4 14469 B9R1.6 CN(C)[C@H]1CNCCC1 Amb22230577 [0,1,0,1,0,0|2,0,0]=4 14470 B9R1.6 CN(N)C1CCCCC1 Amb21954002 [0,1,0,1,0,0|2,0,0]=4 14471 B9R1.6 CN(N)C1CCOCC1 Amb25102035 [0,1,0,1,0,0|2,0,0]=4 14472 B9R1.6 CN(N1CCCCC1)C Amb10558565 [0,1,0,1,0,0|2,0,0]=4 14473 B9R1.6 CS(=O)C1CCNCC1 Amb24656925 [0,1,0,1,0,0|1,0,0]=3 14474 B9R1.6 CS(=O)C1CCOCC1 Amb25682023 [0,1,0,1,0,0|1,0,0]=3 14475 B9R1.6 CS(=O)C1COCCC1 Amb25303295 [0,1,0,1,0,0|1,0,0]=3 14476 B9R1.6 CS(=O)N1CCCCC1 Amb25177400 [0,1,0,1,0,0|1,0,0]=3 14477 B9R1.6 C[C@@H](C1CCCCC1)O Amb13952949 [0,1,0,1,0,0|0,0,2]=4 14478 B9R1.6 C[C@@H](N)C1CCCOC1 Amb25705770 [0,1,0,1,0,0|1,0,1]=4 14479 B9R1.6 C[C@@H](N)C1CCOCC1 Amb23399761 [0,1,0,1,0,0|1,0,1]=4 14480 B9R1.6 C[C@@H](O)C1CCOCC1 Amb25121022 [0,1,0,1,0,0|0,0,2]=4 14481 B9R1.6 C[C@@H](O)[C@H]1CCCCO1 Amb25306509 [0,1,0,1,0,0|0,0,2]=4 14482 B9R1.6 C[C@H](C1CCCCC1)O Amb13952948 [0,1,0,1,0,0|0,0,2]=4 14483 B9R1.6 C[C@H](N)C1CCCOC1 Amb25147114 [0,1,0,1,0,0|1,0,1]=4 14484 B9R1.6 C[C@H](O)C1CCOCC1 Amb25077475 [0,1,0,1,0,0|0,0,2]=4 14485 B9R1.6 C[C@H](O)[C@@H]1CCCCN1 Amb25260768 [0,1,0,1,0,0|0,0,2]=4 14486 B9R1.6 C[C@H](O)[C@H]1CCCCO1 Amb25357465 [0,1,0,1,0,0|0,0,2]=4 14487 B9R1.6 C[SiH](C)C1CCCCC1 Amb22336516 [0,1,0,1,0,0|1,1,0]=4 14488 B9R1.6 ClC(=O)C1CCC=CC1 Amb10844648 [0,1,0,1,0,0|1,0,1]=4 14489 B9R1.6 ClC(=O)C1CCNCC1 Amb17142870 [0,1,0,1,0,0|1,0,0]=3 14490 B9R1.6 ClC(=O)N1CCCCC1 Amb17563099 [0,1,0,1,0,0|1,0,0]=3 14491 B9R1.6 NC(=N)C1CCCCN1 Amb24659758 [0,1,0,1,0,0|2,0,0]=4 14492 B9R1.6 NC(=N)C1CCCCO1 Amb25212338 [0,1,0,1,0,0|2,0,0]=4 14493 B9R1.6 NC(=N)C1CCCCS1 Amb24436193 [0,1,0,1,0,0|2,0,0]=4 14494 B9R1.6 NC(=N)C1CCNCC1 Amb10844869 [0,1,0,1,0,0|2,0,0]=4 14495 B9R1.6 NC(=N)C1CCNCC1 Amb22499003 [0,1,0,1,0,0|2,0,0]=4 14496 B9R1.6 NC(=N)C1CCOCC1 Amb22059100 [0,1,0,1,0,0|2,0,0]=4 14497 B9R1.6 NC(=N)C1COCCC1 Amb24695071 [0,1,0,1,0,0|2,0,0]=4 14498 B9R1.6 NC(=N)N1CCCCC1 Amb10066939 [0,1,0,1,0,0|2,0,0]=4 14499 B9R1.6 NC(=N)N1CCCCC1 Amb16231331 [0,1,0,1,0,0|2,0,0]=4 14500 B9R1.6 NC(=N)N1CCCCC1 Amb16231332 [0,1,0,1,0,0|2,0,0]=4 14501 B9R1.6 NC(=N)N1CCCCC1 Amb1885874 [0,1,0,1,0,0|2,0,0]=4 14502 B9R1.6 NC(=O)C1CCC=CC1 Amb16231370 [0,1,0,1,0,0|1,0,1]=4 14503 B9R1.6 NC(=O)C1CCCC=C1 Amb24623548 [0,1,0,1,0,0|1,0,1]=4 14504 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [0,1,0,1,0,0|1,0,0]=3 14505 B9R1.6 NC(=O)C1CCCNC1 Amb1153860 [0,1,0,1,0,0|1,0,0]=3 14506 B9R1.6 NC(=O)C1CCNCC1 Amb21957241 [0,1,0,1,0,0|1,0,0]=3 14507 B9R1.6 NC(=O)C1CCSCN1 Amb25264861 [0,1,0,1,0,0|2,0,0]=4 14508 B9R1.6 NC(=O)C1CNCCC1 Amb21957039 [0,1,0,1,0,0|1,0,0]=3 14509 B9R1.6 NC(=O)C1CNCCN1 Amb1158016 [0,1,0,1,0,0|2,0,0]=4 14510 B9R1.6 NC(=O)C1CNCCO1 Amb13951857 [0,1,0,1,0,0|2,0,0]=4 14511 B9R1.6 NC(=O)C1CNCCO1 Amb21955746 [0,1,0,1,0,0|2,0,0]=4 14512 B9R1.6 NC(=O)C1CNCCO1 Amb22587273 [0,1,0,1,0,0|2,0,0]=4 14513 B9R1.6 NC(=O)C1CNCCS1 Amb24665974 [0,1,0,1,0,0|2,0,0]=4 14514 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [0,1,0,1,0,0|2,0,0]=4 14515 B9R1.6 NC(=O)C1OCCCO1 Amb24643538 [0,1,0,1,0,0|2,0,0]=4 14516 B9R1.6 NC(=O)N1CCCCC1 Amb1151731 [0,1,0,1,0,0|1,0,0]=3 14517 B9R1.6 NC(=O)N1CCNCC1 Amb1118360 [0,1,0,1,0,0|2,0,0]=4 14518 B9R1.6 NC(=O)[C@@H]1CC=CCC1 Amb24182044 [0,1,0,1,0,0|1,0,1]=4 14519 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [0,1,0,1,0,0|1,0,0]=3 14520 B9R1.6 NC(=O)[C@@H]1CNCCC1 Amb23401436 [0,1,0,1,0,0|1,0,0]=3 14521 B9R1.6 NC(=O)[C@@H]1CNCCC1 Amb23439159 [0,1,0,1,0,0|1,0,0]=3 14522 B9R1.6 NC(=O)[C@@H]1CNCCN1 Amb24183728 [0,1,0,1,0,0|2,0,0]=4 14523 B9R1.6 NC(=O)[C@@H]1COCCN1 Amb24712516 [0,1,0,1,0,0|2,0,0]=4 14524 B9R1.6 NC(=O)[C@H]1CNCCC1 Amb25757310 [0,1,0,1,0,0|1,0,0]=3 14525 B9R1.6 NC(=S)C1CCCCN1 Amb19148045 [0,1,0,1,0,0|1,1,0]=4 14526 B9R1.6 NC(=S)C1CCNCC1 Amb10607493 [0,1,0,1,0,0|1,1,0]=4 14527 B9R1.6 NC(=S)C1COCCC1 Amb20668228 [0,1,0,1,0,0|1,1,0]=4 14528 B9R1.6 NC(=[NH2+])N1CCCCC1 Amb22269904 [0,1,0,1,0,0|2,0,0]=4 14529 B9R1.6 O=C(Br)N1CCCCC1 Amb24089221 [0,1,0,1,0,0|1,0,0]=3 14530 B9R1.6 O=C(Cl)C1CCCCN1 Amb24061326 [0,1,0,1,0,0|1,0,0]=3 14531 B9R1.6 O=C(Cl)C1CNCCO1 Amb24641305 [0,1,0,1,0,0|2,0,0]=4 14532 B9R1.6 O=C(Cl)C1COCCC1 Amb18280558 [0,1,0,1,0,0|1,0,0]=3 14533 B9R1.6 O=C(Cl)C1COCCN1 Amb24738488 [0,1,0,1,0,0|2,0,0]=4 14534 B9R1.6 O=C(Cl)C1COCCO1 Amb18280665 [0,1,0,1,0,0|2,0,0]=4 14535 B9R1.6 O=C(Cl)C1SCCCS1 Amb25097104 [0,1,0,1,0,0|2,0,0]=4 14536 B9R1.6 O=C(Cl)C=1CCCCC1 Amb21961756 [0,1,0,1,0,0|1,0,1]=4 14537 B9R1.6 O=C(Cl)N1CCNCC1 Amb24089213 [0,1,0,1,0,0|2,0,0]=4 14538 B9R1.6 O=C(Cl)N1CCSCC1 Amb25328755 [0,1,0,1,0,0|2,0,0]=4 14539 B9R1.6 O=C(Cl)[C@@H]1CCCCN1 Amb24548250 [0,1,0,1,0,0|1,0,0]=3 14540 B9R1.6 O=C(Cl)[C@H]1CCCCN1 Amb24560223 [0,1,0,1,0,0|1,0,0]=3 14541 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [0,1,0,1,0,0|1,0,0]=3 14542 B9R1.6 O=C(S)N1CCCCC1 Amb24744645 [0,1,0,1,0,0|1,0,0]=3 14543 B9R1.6 O=S(Cl)C1CCCCC1 Amb25305792 [0,1,0,1,0,0|2,0,0]=4 14544 B9R1.6 OC(=O)C1CC=NCC1 Amb24340500 [0,1,0,1,0,0|1,0,1]=4 14545 B9R1.6 OC(=O)C1CCCC=C1 Amb18642396 [0,1,0,1,0,0|1,0,1]=4 14546 B9R1.6 OC(=O)C1CCCC=N1 Amb24346763 [0,1,0,1,0,0|1,0,1]=4 14547 B9R1.6 OC(=O)C1CCCCS1 Amb18202314 [0,1,0,1,0,0|1,0,0]=3 14548 B9R1.6 OC(=O)C1CCCNC1 Amb1151304 [0,1,0,1,0,0|1,0,0]=3 14549 B9R1.6 OC(=O)C1CCCNO1 Amb24672392 [0,1,0,1,0,0|2,0,0]=4 14550 B9R1.6 OC(=O)C1CCCOC1 Amb1102367 [0,1,0,1,0,0|1,0,0]=3 14551 B9R1.6 OC(=O)C1CCCSS1 Amb24480090 [0,1,0,1,0,0|2,0,0]=4 14552 B9R1.6 OC(=O)C1CCSCN1 Amb1102215 [0,1,0,1,0,0|2,0,0]=4 14553 B9R1.6 OC(=O)C1CCSCN1 Amb22284134 [0,1,0,1,0,0|2,0,0]=4 14554 B9R1.6 OC(=O)C1CNCCN1 Amb22490901 [0,1,0,1,0,0|2,0,0]=4 14555 B9R1.6 OC(=O)C1CNCCN1 Amb22490977 [0,1,0,1,0,0|2,0,0]=4 14556 B9R1.6 OC(=O)C1CNCCO1 Amb16232076 [0,1,0,1,0,0|2,0,0]=4 14557 B9R1.6 OC(=O)C1COCCN1 Amb10607157 [0,1,0,1,0,0|2,0,0]=4 14558 B9R1.6 OC(=O)C1CSCCC1 Amb18202321 [0,1,0,1,0,0|1,0,0]=3 14559 B9R1.6 OC(=O)C1CSCCN1 Amb19888398 [0,1,0,1,0,0|2,0,0]=4 14560 B9R1.6 OC(=O)C1CSCCO1 Amb25241709 [0,1,0,1,0,0|2,0,0]=4 14561 B9R1.6 OC(=O)C1CSCCS1 Amb20622962 [0,1,0,1,0,0|2,0,0]=4 14562 B9R1.6 OC(=O)C1CSCSC1 Amb25109235 [0,1,0,1,0,0|2,0,0]=4 14563 B9R1.6 OC(=O)C1NCCCS1 Amb22899084 [0,1,0,1,0,0|2,0,0]=4 14564 B9R1.6 OC(=O)C1OCCCO1 Amb24715581 [0,1,0,1,0,0|2,0,0]=4 14565 B9R1.6 OC(=O)C1SCCCS1 Amb22167283 [0,1,0,1,0,0|2,0,0]=4 14566 B9R1.6 OC(=O)C=1CCCCN1 Amb24597785 [0,1,0,1,0,0|1,0,1]=4 14567 B9R1.6 OC(=O)N1CCCCC1 Amb20242677 [0,1,0,1,0,0|1,0,0]=3 14568 B9R1.6 OC(=O)N1CCNCC1 Amb20621990 [0,1,0,1,0,0|2,0,0]=4 14569 B9R1.6 OC(=O)N1CCOCC1 Amb22491154 [0,1,0,1,0,0|2,0,0]=4 14570 B9R1.6 OC(=O)N1CCSCC1 Amb24099831 [0,1,0,1,0,0|2,0,0]=4 14571 B9R1.6 OC(=O)[C@@H]1CC=CCC1 Amb19131346 [0,1,0,1,0,0|1,0,1]=4 14572 B9R1.6 OC(=O)[C@@H]1CCC=CC1 Amb17611453 [0,1,0,1,0,0|1,0,1]=4 14573 B9R1.6 OC(=O)[C@@H]1CCCC=N1 Amb25349486 [0,1,0,1,0,0|1,0,1]=4 14574 B9R1.6 OC(=O)[C@@H]1CCCCO1 Amb22746821 [0,1,0,1,0,0|1,0,0]=3 14575 B9R1.6 OC(=O)[C@@H]1CCCNC1 Amb16232354 [0,1,0,1,0,0|1,0,0]=3 14576 B9R1.6 OC(=O)[C@@H]1CCCNN1 Amb22747164 [0,1,0,1,0,0|2,0,0]=4 14577 B9R1.6 OC(=O)[C@@H]1CCSCN1 Amb24465168 [0,1,0,1,0,0|2,0,0]=4 14578 B9R1.6 OC(=O)[C@@H]1CNCCN1 Amb22748956 [0,1,0,1,0,0|2,0,0]=4 14579 B9R1.6 OC(=O)[C@@H]1CNCCO1 Amb22737231 [0,1,0,1,0,0|2,0,0]=4 14580 B9R1.6 OC(=O)[C@@H]1COCCC1 Amb24118033 [0,1,0,1,0,0|1,0,0]=3 14581 B9R1.6 OC(=O)[C@@H]1COCCN1 Amb10576585 [0,1,0,1,0,0|2,0,0]=4 14582 B9R1.6 OC(=O)[C@@H]1COCCO1 Amb23438856 [0,1,0,1,0,0|2,0,0]=4 14583 B9R1.6 OC(=O)[C@@H]1CSCCN1 Amb22386830 [0,1,0,1,0,0|2,0,0]=4 14584 B9R1.6 OC(=O)[C@H]1CCSCN1 Amb25773953 [0,1,0,1,0,0|2,0,0]=4 14585 B9R1.6 OC(=O)[C@H]1CNCCN1 Amb20241207 [0,1,0,1,0,0|2,0,0]=4 14586 B9R1.6 OC(=O)[C@H]1CNCCO1 Amb10067023 [0,1,0,1,0,0|2,0,0]=4 14587 B9R1.6 OC(=O)[C@H]1CNCCO1 Amb22737232 [0,1,0,1,0,0|2,0,0]=4 14588 B9R1.6 OC(=O)[C@H]1COCCN1 Amb16232575 [0,1,0,1,0,0|2,0,0]=4 14589 B9R1.6 OP(=O)C1CCCCC1 Amb25327219 [0,1,0,1,0,0|2,0,0]=4 14590 B9R1.6 OP(=O)C1CCNCC1 Amb25315171 [0,1,0,1,0,0|2,0,0]=4 14591 B9R1.6 OS(=O)C1CCCCC1 Amb24603074 [0,1,0,1,0,0|2,0,0]=4 14592 B9R1.6 OS(=O)C1CCOCC1 Amb25026369 [0,1,0,1,0,0|2,0,0]=4 14593 B9R1.6 O[13C](=O)C1CCCCN1 Amb22363349 [0,1,0,1,0,0|1,0,0]=3 14594 B9R1.6 S=C(Cl)N1CCCCC1 Amb24481626 [0,1,0,1,0,0|1,1,0]=4 14595 B9R1.6 SC(=S)C1CCCCC1 Amb24479920 [0,1,0,1,0,0|1,1,0]=4 14596 B9R1.6 SC(=S)C1CCNCC1 Amb25055185 [0,1,0,1,0,0|1,1,0]=4 14597 B9R1.6 SC(=S)N1CCCCC1 Amb19666994 [0,1,0,1,0,0|1,1,0]=4 14598 B9R1.6 [13CH3][13C](=O)C=1CCCCN1 Amb22054237 [0,1,0,1,0,0|0,0,1]=3 14599 B9R1.6 [O-]C(=S)[C@H]1CCCCO1 Amb24382724 [0,1,0,1,0,0|1,0,1]=4 14600 B9R1.6 [O-]S(=O)C1CCCCC1 Amb19893330 [0,1,0,1,0,0|2,0,0]=4 14601 B9R1.6 [O-]S(=O)C1CCOCC1 Amb24332024 [0,1,0,1,0,0|2,0,0]=4 14602 B9R1.6 [O-][N+](=O)C1CCCCC1 Amb10604036 [0,1,0,1,0,0|2,0,0]=4 14603 B9R1.6 [O-][N+](=O)C1CCNCC1 Amb22330560 [0,1,0,1,0,0|2,0,0]=4 14604 B9R1.6 [O-][N+](=O)C1CCOCC1 Amb21960815 [0,1,0,1,0,0|2,0,0]=4 14605 B9R1.6 [O-][N+](=O)C1CNCCC1 Amb24693344 [0,1,0,1,0,0|2,0,0]=4 14606 B9R1.6 [S-]C(=S)N1CCCCC1 Amb19748283 [0,1,0,1,0,0|1,1,0]=4 14607 B9R1.6 [S-]C(=S)N1CCCCC1 Amb22729872 [0,1,0,1,0,0|1,1,0]=4 14608 B9R1.9 C=CCCC1CC(=O)C1 Amb24588920 [0,1,0,1,0,0|0,0,1]=3 14609 B9R1.9 C=CCCC1CC(=O)N1 Amb24524165 [0,1,0,1,0,0|0,0,2]=4 14610 B9R1.9 CC1CC(C1)CNCC Amb23580225 [0,1,0,1,0,0|1,0,1]=4 14611 B9R1.9 CC1CC(C1)NCCC Amb25218930 [0,1,0,1,0,0|1,0,1]=4 14612 B9R1.9 CC1CC(CCCN)C1 Amb23456208 [0,1,0,1,0,0|1,0,1]=4 14613 B9R1.9 CC1CC(CCCO)C1 Amb23456207 [0,1,0,1,0,0|1,0,1]=4 14614 B9R1.9 CCCCC1CC(=O)O1 Amb25202242 [0,1,0,1,0,0|0,0,0]=2 14615 B9R1.9 CCCC[C@@H]1C[C@@H](O)C1 Amb24529089 [0,1,0,1,0,0|0,0,2]=4 14616 B9R1.9 CCCNC1CC(Cl)C1 Amb24758265 [0,1,0,1,0,0|1,0,1]=4 14617 B9R1.9 CCCNC1CC(N)C1 Amb24426950 [0,1,0,1,0,0|1,0,1]=4 14618 B9R1.9 CCCNC1CC(O)C1 Amb24758264 [0,1,0,1,0,0|0,0,2]=4 14619 B9R1.9 CCCOC1CC(=O)C1 Amb24563290 [0,1,0,1,0,0|0,0,0]=2 14620 B9R1.9 CCCOC1CC(Br)C1 Amb25115165 [0,1,0,1,0,0|1,0,1]=4 14621 B9R1.9 CCCOC1CC(Cl)C1 Amb24607826 [0,1,0,1,0,0|1,0,1]=4 14622 B9R1.9 CCCOC1CC(N)C1 Amb24757409 [0,1,0,1,0,0|1,0,1]=4 14623 B9R1.9 CCNCC1CC(Cl)C1 Amb25205196 [0,1,0,1,0,0|1,0,1]=4 14624 B9R1.9 CN1CC(CCCO)C1 Amb24549280 [0,1,0,1,0,0|2,0,0]=4 14625 B9R1.9 CNCCC1CN(C)C1 Amb24695476 [0,1,0,1,0,0|2,0,0]=4 14626 B9R1.9 N#CCCN1CC(=O)C1 Amb24445993 [0,1,0,1,0,0|1,0,1]=4 14627 B9R1.9 OCCSC1CC(=O)N1 Amb25853334 [0,1,0,1,0,0|2,0,0]=4 14628 B9R1.24 CC1(C)CCCC1CO Amb25698070 [0,1,0,1,0,0|1,0,1]=4 14629 B9R1.24 CC1(C)CCC[C@@H]1CN Amb24476773 [0,1,0,1,0,0|1,0,1]=4 14630 B9R1.24 CC1(C)CCC[C@H]1CN Amb24476765 [0,1,0,1,0,0|1,0,1]=4 14631 B9R1.24 CC1(N)CCCC1CO Amb24743154 [0,1,0,1,0,0|1,0,1]=4 14632 B9R1.24 CCC1CCCC1(C)O Amb24457207 [0,1,0,1,0,0|0,0,2]=4 14633 B9R1.24 CCC1CCNC1(C)C Amb18944046 [0,1,0,1,0,0|1,0,1]=4 14634 B9R1.24 CCC1CNCC1(C)O Amb18642714 [0,1,0,1,0,0|0,0,2]=4 14635 B9R1.24 CCN1CCCS1(=O)=O Amb20075620 [0,1,0,1,0,0|2,0,0]=4 14636 B9R1.24 CNC1CCCC1(C)C Amb25680010 [0,1,0,1,0,0|1,0,1]=4 14637 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb24056604 [0,1,0,1,0,0|1,0,1]=4 14638 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb25685488 [0,1,0,1,0,0|1,0,1]=4 14639 B9R1.24 C[C@@]1(O)CCC[C@H]1CO Amb25206321 [0,1,0,1,0,0|0,0,2]=4 14640 B9R1.24 C[C@]1(O)CCC[C@H]1CN Amb24563033 [0,1,0,1,0,0|0,0,2]=4 14641 B9R1.24 C[N+]1(C)CCCC1CO Amb25345378 [0,1,0,1,0,0|2,0,0]=4 14642 B9R1.24 NCC1CCCS1(=O)=O Amb17063302 [0,1,0,1,0,0|2,0,0]=4 14643 B9R1.24 O=S1(=O)CCCC1CBr Amb24446542 [0,1,0,1,0,0|2,0,0]=4 14644 B9R1.24 O=S1(=O)CCCC1CCl Amb25808547 [0,1,0,1,0,0|2,0,0]=4 14645 B9R1.24 OC[C@@H]1CCC[C@]1(C)N Amb1993801 [0,1,0,1,0,0|1,0,1]=4 14646 B9R1.40 CC1(Br)CCCCC1Br Amb25091475 [0,1,0,1,0,0|1,0,1]=4 14647 B9R1.40 CC1(C)CCCCC1Br Amb24340302 [0,1,0,1,0,0|1,0,1]=4 14648 B9R1.40 CC1(C)CCCCC1Cl Amb24635734 [0,1,0,1,0,0|1,0,1]=4 14649 B9R1.40 CC1(C)CCCCC1N Amb18642545 [0,1,0,1,0,0|1,0,1]=4 14650 B9R1.40 CC1(C)CCCCC1O Amb22748701 [0,1,0,1,0,0|1,0,1]=4 14651 B9R1.40 CC1(C)CCCC[C@H]1N Amb24477719 [0,1,0,1,0,0|1,0,1]=4 14652 B9R1.40 CC1(Cl)CCCCC1Br Amb24567107 [0,1,0,1,0,0|1,0,1]=4 14653 B9R1.40 CC1(F)CCCCC1Br Amb25701675 [0,1,0,1,0,0|1,0,1]=4 14654 B9R1.40 CC1(F)CCCCC1O Amb25676651 [0,1,0,1,0,0|1,0,1]=4 14655 B9R1.40 CC1(N)CCCCC1N Amb24480309 [0,1,0,1,0,0|1,0,1]=4 14656 B9R1.40 CC1(O)CCCCC1Br Amb24480133 [0,1,0,1,0,0|0,0,2]=4 14657 B9R1.40 CC1(O)CCCCC1N Amb25709525 [0,1,0,1,0,0|0,0,2]=4 14658 B9R1.40 CC1CCCCC1(C)C Amb22227673 [0,1,0,1,0,0|1,0,1]=4 14659 B9R1.40 CC1CCNCC1(C)C Amb25091675 [0,1,0,1,0,0|1,0,1]=4 14660 B9R1.40 CC1CNCCC1(C)C Amb25727683 [0,1,0,1,0,0|1,0,1]=4 14661 B9R1.40 CC1CNCCC1(C)O Amb22886361 [0,1,0,1,0,0|0,0,2]=4 14662 B9R1.40 CC1CNCCC1(C)O Amb24480321 [0,1,0,1,0,0|0,0,2]=4 14663 B9R1.40 CC1CNCCS1(=O)=O Amb19374621 [0,1,0,1,0,0|2,0,0]=4 14664 B9R1.40 C[C@@H]1CCCCC1(C)N Amb24477704 [0,1,0,1,0,0|1,0,1]=4 14665 B9R1.40 C[C@@H]1CCCC[C@@]1(C)N Amb25174496 [0,1,0,1,0,0|1,0,1]=4 14666 B9R1.40 C[C@@H]1CCCC[C@]1(C)N Amb24549933 [0,1,0,1,0,0|1,0,1]=4 14667 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O Amb22886386 [0,1,0,1,0,0|0,0,2]=4 14668 B9R1.40 C[C@@H]1CCNC[C@]1(C)O Amb22886385 [0,1,0,1,0,0|0,0,2]=4 14669 B9R1.40 C[C@@H]1CCNC[C@]1(C)O Amb24573524 [0,1,0,1,0,0|0,0,2]=4 14670 B9R1.40 C[C@@H]1CNCC[C@]1(C)O Amb25025153 [0,1,0,1,0,0|0,0,2]=4 14671 B9R1.40 C[C@@]1(Br)CCCC[C@H]1O Amb25176127 [0,1,0,1,0,0|1,0,1]=4 14672 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1O Amb17844354 [0,1,0,1,0,0|1,0,1]=4 14673 B9R1.40 C[C@@]1(Cl)CCCC[C@H]1Cl Amb25287109 [0,1,0,1,0,0|1,0,1]=4 14674 B9R1.40 C[C@@]1(N)CCCC[C@@H]1N Amb25264096 [0,1,0,1,0,0|1,0,1]=4 14675 B9R1.40 C[C@@]1(N)CCCC[C@H]1O Amb24744684 [0,1,0,1,0,0|1,0,1]=4 14676 B9R1.40 C[C@@]1(O)CCCC[C@@H]1O Amb17844355 [0,1,0,1,0,0|0,0,2]=4 14677 B9R1.40 C[C@@]1(O)CCCC[C@H]1N Amb24382560 [0,1,0,1,0,0|0,0,2]=4 14678 B9R1.40 C[C@@]1(O)CCCC[C@H]1O Amb25176382 [0,1,0,1,0,0|0,0,2]=4 14679 B9R1.40 C[C@]1(Br)CCCC[C@@H]1Cl Amb25176615 [0,1,0,1,0,0|1,0,1]=4 14680 B9R1.40 C[C@]1(Cl)CCCC[C@@H]1Br Amb25218852 [0,1,0,1,0,0|1,0,1]=4 14681 B9R1.40 C[C@]1(F)CCCC[C@H]1O Amb24582074 [0,1,0,1,0,0|1,0,1]=4 14682 B9R1.40 C[C@]1(O)CCCCC1Cl Amb24480007 [0,1,0,1,0,0|0,0,2]=4 14683 B9R1.40 C[C@]1(O)CCCC[C@@H]1N Amb25293517 [0,1,0,1,0,0|0,0,2]=4 14684 B9R1.40 C[C@]1(O)CCCC[C@H]1Br Amb24595012 [0,1,0,1,0,0|0,0,2]=4 14685 B9R1.40 C[C@]1(O)CCCC[C@H]1O Amb25285065 [0,1,0,1,0,0|0,0,2]=4 14686 B9R1.40 C[Si]1(C)CCCC[C@@H]1O Amb24413730 [0,1,0,1,0,0|1,1,0]=4 14687 B9R1.40 ClC1CCCCC1(C)O Amb17593706 [0,1,0,1,0,0|0,0,2]=4 14688 B9R1.46 CC(C)CNC1CC1C Amb18298107 [0,1,0,1,0,0|1,0,1]=4 14689 B9R1.46 CC(C)NCC1CC1C Amb19148279 [0,1,0,1,0,0|1,0,1]=4 14690 B9R1.46 CC1CC1C#CC(O)=O Amb24390173 [0,1,0,1,0,0|1,0,1]=4 14691 B9R1.46 CC1CC1CNC(C)=O Amb25851867 [0,1,0,1,0,0|0,0,0]=2 14692 B9R1.46 CC1CC1CNC(N)=N Amb25716226 [0,1,0,1,0,0|2,0,0]=4 14693 B9R1.46 CC1CC1CNC(N)=O Amb25185082 [0,1,0,1,0,0|1,0,0]=3 14694 B9R1.46 CC1CC1CNC(N)=S Amb25847200 [0,1,0,1,0,0|1,1,0]=4 14695 B9R1.46 CC1CC1NCC(=C)Br Amb18990743 [0,1,0,1,0,0|1,0,1]=4 14696 B9R1.46 CC1CC1NCC(=C)Cl Amb18990744 [0,1,0,1,0,0|1,0,1]=4 14697 B9R1.46 CC1CC1NCC(C)=C Amb18990737 [0,1,0,1,0,0|1,0,0]=3 14698 B9R1.46 CC1CC1NCC(C)N Amb25765193 [0,1,0,1,0,0|1,0,1]=4 14699 B9R1.46 CC1CC1NCC(C)O Amb25139772 [0,1,0,1,0,0|0,0,2]=4 14700 B9R1.46 CC1CC1NCC(N)=O Amb18990531 [0,1,0,1,0,0|1,0,0]=3 14701 B9R1.46 CC1CC1NCC(O)=O Amb18993215 [0,1,0,1,0,0|1,0,0]=3 14702 B9R1.46 CC1CC1NC[C@@H](C)N Amb25129062 [0,1,0,1,0,0|1,0,1]=4 14703 B9R1.46 CC1CC1NC[C@@H](C)O Amb24644247 [0,1,0,1,0,0|0,0,2]=4 14704 B9R1.46 CC1OC1\C=C\C(C)=O Amb25116313 [0,1,0,1,0,0|0,0,2]=4 14705 B9R1.46 C[C@@H]1C[C@@H]1CCC(C)=O Amb25834668 [0,1,0,1,0,0|0,0,0]=2 14706 B9R1.46 C[C@@H]1C[C@H]1CCC(C)=O Amb25163844 [0,1,0,1,0,0|0,0,0]=2 14707 B9R1.46 C[C@@H]1O[C@@H]1\C=C\C(C)=O Amb24576022 [0,1,0,1,0,0|0,0,2]=4 14708 B9R1.56 CCCC1NCC1(C)C Amb25686958 [0,1,0,1,0,0|1,0,1]=4 14709 B9R1.67 CC(=C)C[C@H]1SC[C@H]1O Amb24541579 [0,1,0,1,0,0|2,0,0]=4 14710 B9R1.67 CC(=O)CC1CCC1=O Amb24434546 [0,1,0,1,0,0|0,0,1]=3 14711 B9R1.67 CC(=O)CN1CCC1=O Amb24566627 [0,1,0,1,0,0|1,0,1]=4 14712 B9R1.67 CC(=O)C[C@@H]1CC[C@@H]1F Amb24440447 [0,1,0,1,0,0|0,0,0]=2 14713 B9R1.67 CC(=O)C[C@H]1CC[C@H]1F Amb25246392 [0,1,0,1,0,0|0,0,0]=2 14714 B9R1.67 CC(=O)NC1CCC1=O Amb22896798 [0,1,0,1,0,0|1,0,1]=4 14715 B9R1.67 CC(=O)N[C@@H]1CC[C@H]1O Amb25297958 [0,1,0,1,0,0|1,0,0]=3 14716 B9R1.67 CC(=O)OC1CCC1Br Amb24529040 [0,1,0,1,0,0|1,0,0]=3 14717 B9R1.67 CC(=O)OC1CCC1Cl Amb24480103 [0,1,0,1,0,0|1,0,0]=3 14718 B9R1.67 CC(=O)OC1CCC1N Amb25064702 [0,1,0,1,0,0|1,0,0]=3 14719 B9R1.67 CC(=O)OC1CCC1O Amb25740537 [0,1,0,1,0,0|1,0,0]=3 14720 B9R1.67 CC(=O)O[C@H]1CC[C@@H]1Br Amb24519430 [0,1,0,1,0,0|1,0,0]=3 14721 B9R1.67 CC(=O)O[C@H]1CC[C@@H]1Cl Amb24586951 [0,1,0,1,0,0|1,0,0]=3 14722 B9R1.67 CC(=O)\C=C/1\CCC1F Amb24352112 [0,1,0,1,0,0|0,0,2]=4 14723 B9R1.67 CC(C)CC1CCC1N Amb24715445 [0,1,0,1,0,0|1,0,1]=4 14724 B9R1.67 CC(C)NC1CCC1C Amb25331759 [0,1,0,1,0,0|1,0,1]=4 14725 B9R1.67 CC(N)CC1CCN1C Amb24651442 [0,1,0,1,0,0|1,0,1]=4 14726 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [0,1,0,1,0,0|1,0,0]=3 14727 B9R1.67 CC1CCN1CC(C)N Amb24443529 [0,1,0,1,0,0|1,0,1]=4 14728 B9R1.67 CN(C)CC1CCC1O Amb25781641 [0,1,0,1,0,0|2,0,0]=4 14729 B9R1.67 CN(C)C[C@@H]1CCC1O Amb24475829 [0,1,0,1,0,0|2,0,0]=4 14730 B9R1.67 N[C@H]1CC[C@@H]1CC(O)=O Amb24700074 [0,1,0,1,0,0|1,0,0]=3 14731 B9R1.77 CC1(C)CC1CCCO Amb24675490 [0,1,0,1,0,0|1,0,1]=4 14732 B9R1.77 CC1(C)C[C@@H]1CCCBr Amb22745871 [0,1,0,1,0,0|1,0,1]=4 14733 B9R1.77 CC1(O)CC1CCCO Amb24362727 [0,1,0,1,0,0|0,0,2]=4 14734 B9R1.77 CCCNC1CC1(C)C Amb18294322 [0,1,0,1,0,0|1,0,1]=4 14735 B9R1.77 CCNCC1CC1(C)C Amb18300529 [0,1,0,1,0,0|1,0,1]=4 14736 B9R1.77 C[C@@]1(O)C[C@@H]1CCCO Amb24698634 [0,1,0,1,0,0|0,0,2]=4 14737 B9R1.77 C[C@@]1(O)C[C@H]1CCCBr Amb25173061 [0,1,0,1,0,0|0,0,2]=4 14738 B9R1.83 BrCCCCCC1CO1 Amb25759075 [0,1,0,1,0,0|0,0,2]=4 14739 B9R1.83 CCCCCCC1CO1 Amb17771533 [0,1,0,1,0,0|0,0,2]=4 14740 B9R1.83 CCCCCC[C@@H]1CO1 Amb22225139 [0,1,0,1,0,0|0,0,2]=4 14741 B9R1.83 CCCCCC[C@H]1CO1 Amb24529260 [0,1,0,1,0,0|0,0,2]=4 14742 B9R1.83 CCCCCC[C@H]1CS1 Amb22367053 [0,1,0,1,0,0|0,1,1]=4 14743 B9R1.83 CCCCOC[C@@H]1CO1 Amb16185838 [0,1,0,1,0,0|0,0,2]=4 14744 B9R1.83 CCCCSCC1CC1 Amb25284080 [0,1,0,1,0,0|1,0,1]=4 14745 B9R1.83 CCCCSC[C@@H]1CO1 Amb25688021 [0,1,0,1,0,0|0,0,2]=4 14746 B9R1.83 CCCOCCC1CO1 Amb25066444 [0,1,0,1,0,0|0,0,2]=4 14747 B9R1.83 CCNCCCC1CC1 Amb25147174 [0,1,0,1,0,0|1,0,1]=4 14748 B9R1.83 CCSCCCC1CO1 Amb24619566 [0,1,0,1,0,0|0,0,2]=4 14749 B9R1.83 NCCCCCN1CC1 Amb24078338 [0,1,0,1,0,0|2,0,0]=4 14750 B9R1.84 C=C(Br)CNC1CCC1 Amb18990432 [0,1,0,1,0,0|1,0,1]=4 14751 B9R1.84 C=C(Cl)CNC1CCC1 Amb18990433 [0,1,0,1,0,0|1,0,1]=4 14752 B9R1.84 CC(=C)CCN1CCC1 Amb24711091 [0,1,0,1,0,0|1,0,0]=3 14753 B9R1.84 CC(=C)CNC1CCC1 Amb18298086 [0,1,0,1,0,0|1,0,0]=3 14754 B9R1.84 CC(=C)CNC1CSC1 Amb25194623 [0,1,0,1,0,0|2,0,0]=4 14755 B9R1.84 CC(=C)COC1CNC1 Amb22011761 [0,1,0,1,0,0|2,0,0]=4 14756 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [0,1,0,1,0,0|0,0,0]=2 14757 B9R1.84 CC(=O)CCC=1CCC1 Amb25358814 [0,1,0,1,0,0|0,0,1]=3 14758 B9R1.84 CC(=O)CSC1CCC1 Amb24481902 [0,1,0,1,0,0|0,0,0]=2 14759 B9R1.84 CC(=O)CSC1COC1 Amb25853147 [0,1,0,1,0,0|1,0,0]=3 14760 B9R1.84 CC(=O)\C=C\C1CCC1 Amb22494067 [0,1,0,1,0,0|0,0,1]=3 14761 B9R1.84 CC(C)=NOC1CCC1 Amb24481899 [0,1,0,1,0,0|2,0,0]=4 14762 B9R1.84 CC(C)CCC1CNC1 Amb25115363 [0,1,0,1,0,0|1,0,1]=4 14763 B9R1.84 CC(C)CNC1CCC1 Amb18989307 [0,1,0,1,0,0|1,0,1]=4 14764 B9R1.84 CC(C)SCC1CCC1 Amb24431720 [0,1,0,1,0,0|1,0,1]=4 14765 B9R1.84 CC(Cl)CCC1CCC1 Amb25334999 [0,1,0,1,0,0|1,0,1]=4 14766 B9R1.84 CC(N)CCC1CCO1 Amb25352168 [0,1,0,1,0,0|1,0,1]=4 14767 B9R1.84 CC(N)CCC1CCS1 Amb25376457 [0,1,0,1,0,0|1,0,1]=4 14768 B9R1.84 CC(N)CCC1CNC1 Amb25223521 [0,1,0,1,0,0|1,0,1]=4 14769 B9R1.84 CC(N)CNC1CCC1 Amb18990486 [0,1,0,1,0,0|1,0,1]=4 14770 B9R1.84 CC(N)COC1CCC1 Amb18989557 [0,1,0,1,0,0|1,0,1]=4 14771 B9R1.84 CC(N)CSC1CCC1 Amb24685575 [0,1,0,1,0,0|1,0,1]=4 14772 B9R1.84 CC(O)CCC1CSC1 Amb25377027 [0,1,0,1,0,0|0,0,2]=4 14773 B9R1.84 CC(O)CCN1CCC1 Amb24645974 [0,1,0,1,0,0|0,0,2]=4 14774 B9R1.84 CC(O)CNC1CCC1 Amb18989413 [0,1,0,1,0,0|0,0,2]=4 14775 B9R1.84 CN(C)CCC1CCC1 Amb24562487 [0,1,0,1,0,0|2,0,0]=4 14776 B9R1.84 CN(C)CCC1CNC1 Amb25789636 [0,1,0,1,0,0|2,0,0]=4 14777 B9R1.84 CS(=O)CCC1CNC1 Amb25844183 [0,1,0,1,0,0|1,0,0]=3 14778 B9R1.84 C[C@@H](N)CNC1CCC1 Amb25050269 [0,1,0,1,0,0|1,0,1]=4 14779 B9R1.84 C[C@H](N)CNC1CCC1 Amb24413158 [0,1,0,1,0,0|1,0,1]=4 14780 B9R1.84 C[C@H](N)COC1CCC1 Amb25032163 [0,1,0,1,0,0|1,0,1]=4 14781 B9R1.84 C[C@H](O)CNC1CCC1 Amb24481590 [0,1,0,1,0,0|0,0,2]=4 14782 B9R1.84 NC(=N)NCC1CCC1 Amb24594164 [0,1,0,1,0,0|2,0,0]=4 14783 B9R1.84 NC(=O)CCC1CNC1 Amb24627864 [0,1,0,1,0,0|1,0,0]=3 14784 B9R1.84 NC(=O)CCN1CCC1 Amb25081700 [0,1,0,1,0,0|1,0,0]=3 14785 B9R1.84 NC(=O)CNC1CCC1 Amb18989288 [0,1,0,1,0,0|1,0,0]=3 14786 B9R1.84 NC(=O)COC1CCC1 Amb24714151 [0,1,0,1,0,0|1,0,0]=3 14787 B9R1.84 NC(=O)COC1CNC1 Amb20623915 [0,1,0,1,0,0|2,0,0]=4 14788 B9R1.84 NC(=O)COC1CNC1 Amb22059197 [0,1,0,1,0,0|2,0,0]=4 14789 B9R1.84 NC(=O)NOC1CCC1 Amb25295666 [0,1,0,1,0,0|2,0,0]=4 14790 B9R1.84 NC(=O)OCC1CCC1 Amb24642121 [0,1,0,1,0,0|1,0,0]=3 14791 B9R1.84 NC(=S)CCN1CCC1 Amb25769922 [0,1,0,1,0,0|1,1,0]=4 14792 B9R1.84 NC(=S)COC1CCC1 Amb25266184 [0,1,0,1,0,0|1,1,0]=4 14793 B9R1.84 O=C(Cl)OCC1CCC1 Amb24551352 [0,1,0,1,0,0|1,0,0]=3 14794 B9R1.84 O=S(Cl)CCC1CCC1 Amb25179912 [0,1,0,1,0,0|2,0,0]=4 14795 B9R1.84 OC(=O)C=CC1CCC1 Amb20624021 [0,1,0,1,0,0|1,0,1]=4 14796 B9R1.84 OC(=O)CCN1CCC1 Amb22292346 [0,1,0,1,0,0|1,0,0]=3 14797 B9R1.84 OC(=O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,0]=3 14798 B9R1.84 OC(=O)CNC1CNC1 Amb25254651 [0,1,0,1,0,0|2,0,0]=4 14799 B9R1.84 OC(=O)CNC1COC1 Amb22737320 [0,1,0,1,0,0|2,0,0]=4 14800 B9R1.84 OC(=O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|1,0,0]=3 14801 B9R1.84 OC(=O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|2,0,0]=4 14802 B9R1.84 OC(=O)COC1COC1 Amb24539538 [0,1,0,1,0,0|2,0,0]=4 14803 B9R1.84 OC(=O)CSC1CCC1 Amb24439698 [0,1,0,1,0,0|1,0,0]=3 14804 B9R1.84 OC(=O)CSC1CNC1 Amb24759226 [0,1,0,1,0,0|2,0,0]=4 14805 B9R1.84 OC(=O)CSC1CSC1 Amb24569012 [0,1,0,1,0,0|2,0,0]=4 14806 B9R1.84 [O-][N+](=O)CCC1CCC1 Amb15692934 [0,1,0,1,0,0|2,0,0]=4 14807 B9R1.85 C=C(Br)CNCC1CC1 Amb19005216 [0,1,0,1,0,0|1,0,1]=4 14808 B9R1.85 C=C(Br)COCC1CC1 Amb25047572 [0,1,0,1,0,0|1,0,1]=4 14809 B9R1.85 C=C(Br)CSCC1CC1 Amb24529083 [0,1,0,1,0,0|1,0,1]=4 14810 B9R1.85 C=C(Cl)CNCC1CC1 Amb18303258 [0,1,0,1,0,0|1,0,1]=4 14811 B9R1.85 CC(=C)CCNC1CC1 Amb18523840 [0,1,0,1,0,0|1,0,0]=3 14812 B9R1.85 CC(=C)CONC1CC1 Amb25235040 [0,1,0,1,0,0|2,0,0]=4 14813 B9R1.85 CC(=O)C#CCC1CC1 Amb24357190 [0,1,0,1,0,0|0,0,1]=3 14814 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [0,1,0,1,0,0|0,0,0]=2 14815 B9R1.85 CC(=O)CCNC1CC1 Amb24377194 [0,1,0,1,0,0|0,0,0]=2 14816 B9R1.85 CC(=O)NCCC1CC1 Amb25749460 [0,1,0,1,0,0|0,0,0]=2 14817 B9R1.85 CC(=O)OCCC1CC1 Amb25091905 [0,1,0,1,0,0|0,0,0]=2 14818 B9R1.85 CC(=O)\C=N\NC1CC1 Amb25043847 [0,1,0,1,0,0|1,0,1]=4 14819 B9R1.85 CC(C)=CCNC1CC1 Amb24568220 [0,1,0,1,0,0|1,0,1]=4 14820 B9R1.85 CC(C)=NNCC1CC1 Amb24481901 [0,1,0,1,0,0|2,0,0]=4 14821 B9R1.85 CC(C)NCCC1CC1 Amb19018994 [0,1,0,1,0,0|1,0,1]=4 14822 B9R1.85 CC(CCNC1CC1)C Amb1113142 [0,1,0,1,0,0|1,0,1]=4 14823 B9R1.85 CC(Cl)CNCC1CC1 Amb24532127 [0,1,0,1,0,0|1,0,1]=4 14824 B9R1.85 CC(N)CCNC1CC1 Amb19007235 [0,1,0,1,0,0|1,0,1]=4 14825 B9R1.85 CC(N)CNCC1CC1 Amb19009744 [0,1,0,1,0,0|1,0,1]=4 14826 B9R1.85 CC(O)CCNC1CC1 Amb24693766 [0,1,0,1,0,0|0,0,2]=4 14827 B9R1.85 CC(O)CSCC1CC1 Amb24524245 [0,1,0,1,0,0|0,0,2]=4 14828 B9R1.85 CN(C)CCNC1CC1 Amb24271095 [0,1,0,1,0,0|2,0,0]=4 14829 B9R1.85 CN(N)CCCC1CC1 Amb24569030 [0,1,0,1,0,0|2,0,0]=4 14830 B9R1.85 CS(=O)CCCC1CO1 Amb25284396 [0,1,0,1,0,0|1,0,0]=3 14831 B9R1.85 C[C@@H](N)COCC1CC1 Amb25032162 [0,1,0,1,0,0|1,0,1]=4 14832 B9R1.85 C[C@@H](O)CCNC1CC1 Amb25191935 [0,1,0,1,0,0|0,0,2]=4 14833 B9R1.85 C[C@@H](O)COCC1CC1 Amb24711074 [0,1,0,1,0,0|0,0,2]=4 14834 B9R1.85 C[C@H](N)COCC1CC1 Amb24712175 [0,1,0,1,0,0|1,0,1]=4 14835 B9R1.85 C[C@H](O)CNCC1CC1 Amb25781762 [0,1,0,1,0,0|0,0,2]=4 14836 B9R1.85 NC(=N)NCCC1CC1 Amb24360276 [0,1,0,1,0,0|2,0,0]=4 14837 B9R1.85 NC(=O)COCC1CC1 Amb19411503 [0,1,0,1,0,0|1,0,0]=3 14838 B9R1.85 NC(=O)CONC1CC1 Amb24456756 [0,1,0,1,0,0|2,0,0]=4 14839 B9R1.85 NC(=O)CSC[C@@H]1CO1 Amb25098193 [0,1,0,1,0,0|2,0,0]=4 14840 B9R1.85 NC(=O)CSC[C@H]1CO1 Amb24395150 [0,1,0,1,0,0|2,0,0]=4 14841 B9R1.85 NC(=O)NCCC1CC1 Amb24478666 [0,1,0,1,0,0|1,0,0]=3 14842 B9R1.85 NC(=S)CCNC1CC1 Amb17231993 [0,1,0,1,0,0|1,1,0]=4 14843 B9R1.85 NC(=S)NCCC1CC1 Amb24495275 [0,1,0,1,0,0|1,1,0]=4 14844 B9R1.85 OC(=O)C#CCC1CC1 Amb25147203 [0,1,0,1,0,0|1,0,1]=4 14845 B9R1.85 OC(=O)CCCC1CC1 Amb18832629 [0,1,0,1,0,0|1,0,0]=3 14846 B9R1.85 OC(=O)CCC[C@H]1CO1 Amb24427275 [0,1,0,1,0,0|1,0,0]=3 14847 B9R1.85 OC(=O)CCNC1CC1 Amb1106410 [0,1,0,1,0,0|1,0,0]=3 14848 B9R1.85 OC(=O)CCSC1CC1 Amb25221891 [0,1,0,1,0,0|1,0,0]=3 14849 B9R1.96 CC(=O)C1CCC1C#N Amb25188967 [0,1,0,1,0,0|0,0,1]=3 14850 B9R1.96 CC(=O)[C@H]1CC[C@@H]1C#N Amb25370614 [0,1,0,1,0,0|0,0,1]=3 14851 B9R1.96 CC(C)C1CCC1CN Amb25213009 [0,1,0,1,0,0|1,0,1]=4 14852 B9R1.96 CC(C)C1CCC1NC Amb24476721 [0,1,0,1,0,0|1,0,1]=4 14853 B9R1.96 CC(C)N1CCC1CC Amb24687246 [0,1,0,1,0,0|1,0,1]=4 14854 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [0,1,0,1,0,0|1,0,0]=3 14855 B9R1.96 CCN1CCC1C(O)=O Amb22011877 [0,1,0,1,0,0|1,0,0]=3 14856 B9R1.96 CCN1CC[C@@H]1C(O)=O Amb24634744 [0,1,0,1,0,0|1,0,0]=3 14857 B9R1.96 CCN1CC[C@H]1C(O)=O Amb25347394 [0,1,0,1,0,0|1,0,0]=3 14858 B9R1.96 CN(C)C1CCC1CN Amb25679830 [0,1,0,1,0,0|2,0,0]=4 14859 B9R1.96 CN(C)C1CCC1CO Amb25783398 [0,1,0,1,0,0|2,0,0]=4 14860 B9R1.96 CNC1CCC1C(O)=O Amb25340658 [0,1,0,1,0,0|1,0,0]=3 14861 B9R1.96 CSC1CCC1C(O)=O Amb25118114 [0,1,0,1,0,0|1,0,0]=3 14862 B9R1.96 NC(=O)[C@@H]1CC[C@H]1C#N Amb25224355 [0,1,0,1,0,0|1,0,1]=4 14863 B9R1.96 NC(=O)[C@H]1CC[C@H]1C#N Amb25175059 [0,1,0,1,0,0|1,0,1]=4 14864 B9R1.96 NCC1CCC1C(O)=O Amb25269589 [0,1,0,1,0,0|1,0,0]=3 14865 B9R1.96 NC[C@H]1CC[C@H]1C(O)=O Amb24579352 [0,1,0,1,0,0|1,0,0]=3 14866 B9R1.96 OC(=O)C1CCC1C=O Amb25302625 [0,1,0,1,0,0|1,0,1]=4 14867 B9R1.96 OC(=O)C1CCC1CF Amb20667674 [0,1,0,1,0,0|1,0,0]=3 14868 B9R1.96 OCC1CCC1C(O)=O Amb24340315 [0,1,0,1,0,0|1,0,0]=3 14869 B9R1.96 OCC1CCN1C(O)=O Amb22756926 [0,1,0,1,0,0|2,0,0]=4 14870 B9R1.96 ONC1CCC1C(O)=O Amb24471809 [0,1,0,1,0,0|2,0,0]=4 14871 B9R1.96 [O-]C(=O)[C@H]1CC[C@H]1CO Amb25176734 [0,1,0,1,0,0|1,0,0]=3 14872 B9R1.148 CC1(C)CCCCCN1 Amb18832660 [0,1,0,1,0,0|1,0,1]=4 14873 B9R1.148 CC1(C)CCCNCC1 Amb18832664 [0,1,0,1,0,0|1,0,1]=4 14874 B9R1.148 CC1(C)CNCCCC1 Amb24611736 [0,1,0,1,0,0|1,0,1]=4 14875 B9R1.148 CC1(F)CCCNCC1 Amb22886292 [0,1,0,1,0,0|1,0,1]=4 14876 B9R1.148 CC1(F)CNCCCC1 Amb22886308 [0,1,0,1,0,0|1,0,1]=4 14877 B9R1.148 CC1(F)CNCCCC1 Amb24672176 [0,1,0,1,0,0|1,0,1]=4 14878 B9R1.148 CC1(N)CCCCCC1 Amb13952349 [0,1,0,1,0,0|1,0,1]=4 14879 B9R1.148 CC1(O)CCCNCC1 Amb19516809 [0,1,0,1,0,0|0,0,2]=4 14880 B9R1.148 CC1(O)CCCNCC1 Amb22886914 [0,1,0,1,0,0|0,0,2]=4 14881 B9R1.148 CC1(O)CCCOCC1 Amb20669018 [0,1,0,1,0,0|0,0,2]=4 14882 B9R1.148 CC1(O)CNCCCC1 Amb22886278 [0,1,0,1,0,0|0,0,2]=4 14883 B9R1.148 C[Si]1(C)CCCNCC1 Amb25275491 [0,1,0,1,0,0|1,1,0]=4 14884 B9R1.148 NC1(N)CCCCCC1 Amb24427215 [0,1,0,1,0,0|1,0,1]=4 14885 B9R1.148 O=S1(=O)CCCNCC1 Amb19299932 [0,1,0,1,0,0|2,0,0]=4 14886 B9R1.148 O=S1(=O)CCCNCC1 Amb21960984 [0,1,0,1,0,0|2,0,0]=4 14887 B9R1.148 O=S1(=O)CCNCCC1 Amb10610583 [0,1,0,1,0,0|2,0,0]=4 14888 B9R1.23 CC1=CC(CC1O)CO Amb24392318 [0,1,0,1,0,0|2,0,0]=4 14889 B9R1.23 CC1=C[C@@H](C[C@@H]1O)CO Amb24622432 [0,1,0,1,0,0|2,0,0]=4 14890 B9R1.23 CC1=C[C@@H](C[C@H]1O)CO Amb25236028 [0,1,0,1,0,0|2,0,0]=4 14891 B9R1.23 CC1CC(CBr)SC1=O Amb25701798 [0,1,0,1,0,0|2,0,0]=4 14892 B9R1.23 CC1CC(CC)NC1=O Amb20623299 [0,1,0,1,0,0|1,0,0]=3 14893 B9R1.23 CC1CC(CCl)OC1=O Amb25090247 [0,1,0,1,0,0|2,0,0]=4 14894 B9R1.23 CC1CC(CN)OC1=O Amb24480327 [0,1,0,1,0,0|2,0,0]=4 14895 B9R1.23 CC1CC(CO)OC1=O Amb24371209 [0,1,0,1,0,0|2,0,0]=4 14896 B9R1.23 CC1CC(NC1=O)OC Amb24545577 [0,1,0,1,0,0|2,0,0]=4 14897 B9R1.23 CC1NC(CC1O)CC Amb23453816 [0,1,0,1,0,0|1,0,1]=4 14898 B9R1.23 CCC1CC(=O)C(=O)C1 Amb25838664 [0,1,0,1,0,0|0,0,1]=3 14899 B9R1.23 CCC1CC(=O)C(O)=C1 Amb25706973 [0,1,0,1,0,0|0,0,2]=4 14900 B9R1.23 CCC1CC(Br)C(=O)O1 Amb25839843 [0,1,0,1,0,0|1,0,0]=3 14901 B9R1.23 CCC1CC(O)C(=O)N1 Amb24426760 [0,1,0,1,0,0|1,0,0]=3 14902 B9R1.23 CCC1N=C(C(S1)C)C Amb15691844 [0,1,0,1,0,0|2,0,0]=4 14903 B9R1.23 CCC=1CC(=O)C(O)C1 Amb24522759 [0,1,0,1,0,0|0,0,2]=4 14904 B9R1.23 CCN1CC(C)C(=O)C1 Amb20667767 [0,1,0,1,0,0|1,0,0]=3 14905 B9R1.23 CC[C@@H]1C[C@H](N)C(=O)O1 Amb25163624 [0,1,0,1,0,0|1,0,0]=3 14906 B9R1.23 CC[C@@H]1OC(=O)[C@H](F)S1 Amb25054175 [0,1,0,1,0,0|2,0,0]=4 14907 B9R1.23 CC[C@H]1OC(=O)[C@@H](F)S1 Amb24514953 [0,1,0,1,0,0|2,0,0]=4 14908 B9R1.23 CC[C@H]1OC([C@@H](C1)C)C Amb10604665 [0,1,0,1,0,0|0,0,2]=4 14909 B9R1.23 CN1CC(CN)CC1=O Amb22587624 [0,1,0,1,0,0|2,0,0]=4 14910 B9R1.23 CNC1CC(=O)N(C)C1 Amb25142512 [0,1,0,1,0,0|2,0,0]=4 14911 B9R1.23 C[C@@H]1C[C@@H](CBr)OC1=O Amb25323016 [0,1,0,1,0,0|2,0,0]=4 14912 B9R1.23 C[C@@H]1C[C@@H](CO)NC1=O Amb25340422 [0,1,0,1,0,0|2,0,0]=4 14913 B9R1.23 C[C@@H]1C[C@@H](CO)OC1=O Amb24612854 [0,1,0,1,0,0|2,0,0]=4 14914 B9R1.23 C[C@@H]1C[C@H](CO)OC1=O Amb24672472 [0,1,0,1,0,0|2,0,0]=4 14915 B9R1.23 C[C@H]1CC(CO)OC1=O Amb25078626 [0,1,0,1,0,0|2,0,0]=4 14916 B9R1.23 C[C@H]1C[C@@H](CBr)OC1=O Amb24597367 [0,1,0,1,0,0|2,0,0]=4 14917 B9R1.23 C[C@H]1C[C@@H](CCl)NC1=O Amb24515072 [0,1,0,1,0,0|2,0,0]=4 14918 B9R1.23 C[C@H]1C[C@@H](CN)OC1=O Amb25326754 [0,1,0,1,0,0|2,0,0]=4 14919 B9R1.23 C[C@H]1O[C@H](CC1=O)CI Amb25320067 [0,1,0,1,0,0|2,0,0]=4 14920 B9R1.23 ClCC1CC(Cl)C(=O)O1 Amb17940400 [0,1,0,1,0,0|2,0,0]=4 14921 B9R1.23 NC1CC(CF)NC1=O Amb25716850 [0,1,0,1,0,0|2,0,0]=4 14922 B9R1.23 NC1CC(CO)NC1=O Amb25124342 [0,1,0,1,0,0|2,0,0]=4 14923 B9R1.23 NC1CC(CO)OC1=O Amb18642829 [0,1,0,1,0,0|2,0,0]=4 14924 B9R1.23 NCC1CC(Br)C(=O)O1 Amb25272231 [0,1,0,1,0,0|2,0,0]=4 14925 B9R1.23 N[C@@H]1C[C@@H](CO)NC1=O Amb24645846 [0,1,0,1,0,0|2,0,0]=4 14926 B9R1.23 N[C@@H]1C[C@@H](CO)OC1=O Amb25327262 [0,1,0,1,0,0|2,0,0]=4 14927 B9R1.23 N[C@H]1CC(CO)OC1=O Amb25771995 [0,1,0,1,0,0|2,0,0]=4 14928 B9R1.23 N[C@H]1C[C@@H](CO)NC1=O Amb24561327 [0,1,0,1,0,0|2,0,0]=4 14929 B9R1.23 N[C@H]1C[C@H](CO)OC1=O Amb24567157 [0,1,0,1,0,0|2,0,0]=4 14930 B9R1.23 O=C1OC(CBr)CC1Cl Amb24654717 [0,1,0,1,0,0|2,0,0]=4 14931 B9R1.23 O=C1OC(CI)CC1F Amb24412098 [0,1,0,1,0,0|2,0,0]=4 14932 B9R1.23 O=C1O[C@H](C[C@@H]1Cl)CCl Amb24580694 [0,1,0,1,0,0|2,0,0]=4 14933 B9R1.23 O=C1O[C@H](C[C@H]1Cl)CCl Amb24515094 [0,1,0,1,0,0|2,0,0]=4 14934 B9R1.23 OCC1CC(=O)N(C1)C Amb10607401 [0,1,0,1,0,0|2,0,0]=4 14935 B9R1.23 OC[C@@H]1C[C@@H](F)C(=O)N1 Amb24680941 [0,1,0,1,0,0|2,0,0]=4 14936 B9R1.23 O[C@@H]1C[C@H](CCl)OC1=O Amb25213067 [0,1,0,1,0,0|2,0,0]=4 14937 B9R1.23 O[C@@H]1C[C@H](CO)OC1=O Amb25324131 [0,1,0,1,0,0|2,0,0]=4 14938 B9R1.35 CC(=C)C1CCC(O)O1 Amb24379966 [0,1,0,1,0,0|2,0,0]=4 14939 B9R1.35 CC(=C)[C@@H]1CC(=O)CC1 Amb25712704 [0,1,0,1,0,0|0,0,1]=3 14940 B9R1.35 CC(=C)[C@@H]1CCC(=O)N1 Amb25142143 [0,1,0,1,0,0|1,0,1]=4 14941 B9R1.35 CC(=C)[C@@H]1CC[C@@H](O)C1 Amb24688273 [0,1,0,1,0,0|1,0,0]=3 14942 B9R1.35 CC(=C)[C@H]1CC[C@@H](O)C1 Amb25235646 [0,1,0,1,0,0|1,0,0]=3 14943 B9R1.35 CC(=C)[C@H]1CC[C@H](O)C1 Amb25357163 [0,1,0,1,0,0|1,0,0]=3 14944 B9R1.35 CC(=O)C1=NC(C)CS1 Amb24520538 [0,1,0,1,0,0|1,0,1]=4 14945 B9R1.35 CC(=O)C1CC(=O)CC1 Amb24423910 [0,1,0,1,0,0|0,0,1]=3 14946 B9R1.35 CC(=O)C1CC(=O)CS1 Amb24061575 [0,1,0,1,0,0|1,0,1]=4 14947 B9R1.35 CC(=O)C1CC(Br)CO1 Amb24391544 [0,1,0,1,0,0|1,0,0]=3 14948 B9R1.35 CC(=O)C1CC(O)C=C1 Amb25350260 [0,1,0,1,0,0|0,0,2]=4 14949 B9R1.35 CC(=O)C1CCC(=O)N1 Amb24432249 [0,1,0,1,0,0|1,0,1]=4 14950 B9R1.35 CC(=O)C1CCC(Cl)C1 Amb24064130 [0,1,0,1,0,0|0,0,0]=2 14951 B9R1.35 CC(=O)C1CCC(O)C1 Amb24364135 [0,1,0,1,0,0|0,0,0]=2 14952 B9R1.35 CC(=O)C=1CC(O)CC1 Amb25134091 [0,1,0,1,0,0|0,0,2]=4 14953 B9R1.35 CC(=O)C=1CCC(Br)C1 Amb25299441 [0,1,0,1,0,0|0,0,2]=4 14954 B9R1.35 CC(=O)C=1CC[C@H](C)C1 Amb24689488 [0,1,0,1,0,0|0,0,1]=3 14955 B9R1.35 CC(=O)N1CC(=O)CC1 Amb18832698 [0,1,0,1,0,0|1,0,1]=4 14956 B9R1.35 CC(=O)N1CC(Br)CC1 Amb21861126 [0,1,0,1,0,0|1,0,0]=3 14957 B9R1.35 CC(=O)N1CC(Cl)CC1 Amb21861140 [0,1,0,1,0,0|1,0,0]=3 14958 B9R1.35 CC(=O)N1CC(I)CC1 Amb21861147 [0,1,0,1,0,0|1,0,0]=3 14959 B9R1.35 CC(=O)N1CC(N)CC1 Amb20669217 [0,1,0,1,0,0|1,0,0]=3 14960 B9R1.35 CC(=O)N1CC(O)CC1 Amb20622704 [0,1,0,1,0,0|1,0,0]=3 14961 B9R1.35 CC(=O)N1CC(O)CO1 Amb24372186 [0,1,0,1,0,0|2,0,0]=4 14962 B9R1.35 CC(=O)N1CC(S)CN1 Amb24099494 [0,1,0,1,0,0|2,0,0]=4 14963 B9R1.35 CC(=O)N1CCC(N)C1 Amb17739841 [0,1,0,1,0,0|1,0,0]=3 14964 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [0,1,0,1,0,0|1,0,0]=3 14965 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [0,1,0,1,0,0|1,0,0]=3 14966 B9R1.35 CC(=O)N1C[C@@H](Br)CC1 Amb22227522 [0,1,0,1,0,0|1,0,0]=3 14967 B9R1.35 CC(=O)N1C[C@@H](Cl)CC1 Amb22227524 [0,1,0,1,0,0|1,0,0]=3 14968 B9R1.35 CC(=O)N1C[C@@H](I)CC1 Amb22227531 [0,1,0,1,0,0|1,0,0]=3 14969 B9R1.35 CC(=O)N1C[C@@H](N)CC1 Amb19890016 [0,1,0,1,0,0|1,0,0]=3 14970 B9R1.35 CC(=O)N1C[C@@H](N)CC1 Amb22227520 [0,1,0,1,0,0|1,0,0]=3 14971 B9R1.35 CC(=O)N1C[C@H](Br)CC1 Amb22227483 [0,1,0,1,0,0|1,0,0]=3 14972 B9R1.35 CC(=O)N1C[C@H](Cl)CC1 Amb22227481 [0,1,0,1,0,0|1,0,0]=3 14973 B9R1.35 CC(=O)N1C[C@H](I)CC1 Amb22227495 [0,1,0,1,0,0|1,0,0]=3 14974 B9R1.35 CC(=O)N1C[C@H](N)CC1 Amb19891343 [0,1,0,1,0,0|1,0,0]=3 14975 B9R1.35 CC(=O)N1C[C@H](N)CC1 Amb22227487 [0,1,0,1,0,0|1,0,0]=3 14976 B9R1.35 CC(=O)[C@@H]1CC(=O)OC1 Amb18832647 [0,1,0,1,0,0|1,0,1]=4 14977 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [0,1,0,1,0,0|1,0,1]=4 14978 B9R1.35 CC(=O)[C@@H]1C[C@H](O)C=C1 Amb25061613 [0,1,0,1,0,0|0,0,2]=4 14979 B9R1.35 CC(=O)[C@H]1CC(=O)CC1 Amb24407171 [0,1,0,1,0,0|0,0,1]=3 14980 B9R1.35 CC(=O)[C@H]1CC(=O)OC1 Amb24390313 [0,1,0,1,0,0|1,0,1]=4 14981 B9R1.35 CC(=O)[C@H]1CCC(=O)O1 Amb24524212 [0,1,0,1,0,0|1,0,1]=4 14982 B9R1.35 CC(Br)C1CCC(=O)O1 Amb25074658 [0,1,0,1,0,0|1,0,0]=3 14983 B9R1.35 CC(C)=C1CC(=O)CC1 Amb25370822 [0,1,0,1,0,0|0,0,2]=4 14984 B9R1.35 CC(C)C1CC(=O)CC1 Amb25147190 [0,1,0,1,0,0|0,0,0]=2 14985 B9R1.35 CC(C)C1CC(=O)CO1 Amb25851479 [0,1,0,1,0,0|1,0,0]=3 14986 B9R1.35 CC(C)C1CC(=O)CS1 Amb25263073 [0,1,0,1,0,0|1,0,0]=3 14987 B9R1.35 CC(C)C1CC(=O)NC1 Amb19305356 [0,1,0,1,0,0|1,0,0]=3 14988 B9R1.35 CC(C)C1CC(=O)NN1 Amb24071475 [0,1,0,1,0,0|2,0,0]=4 14989 B9R1.35 CC(C)C1CC(Br)CC1 Amb25265598 [0,1,0,1,0,0|1,0,1]=4 14990 B9R1.35 CC(C)C1CC(C)CC1 Amb24729232 [0,1,0,1,0,0|1,0,1]=4 14991 B9R1.35 CC(C)C1CC(Cl)CC1 Amb24703782 [0,1,0,1,0,0|1,0,1]=4 14992 B9R1.35 CC(C)C1CC(O)CC1 Amb25795756 [0,1,0,1,0,0|0,0,2]=4 14993 B9R1.35 CC(C)C1CC=C(C)N1 Amb24376657 [0,1,0,1,0,0|1,0,1]=4 14994 B9R1.35 CC(C)C1CCC(=O)N1 Amb24120594 [0,1,0,1,0,0|1,0,0]=3 14995 B9R1.35 CC(C)C1CCC(C)N1 Amb24376459 [0,1,0,1,0,0|1,0,1]=4 14996 B9R1.35 CC(C)C1CN(N)CC1 Amb25334150 [0,1,0,1,0,0|2,0,0]=4 14997 B9R1.35 CC(C)N1CC(=O)CC1 Amb22587607 [0,1,0,1,0,0|1,0,0]=3 14998 B9R1.35 CC(C)[C@@H]1CC(=O)C=C1 Amb25712979 [0,1,0,1,0,0|0,0,2]=4 14999 B9R1.35 CC(C)[C@@H]1CCC(=O)N1 Amb24476688 [0,1,0,1,0,0|1,0,0]=3 15000 B9R1.35 CC(C)[C@@H]1C[C@H](N)CC1 Amb24676670 [0,1,0,1,0,0|1,0,1]=4 15001 B9R1.35 CC(C)[C@H]1CC(=O)NC1 Amb24446919 [0,1,0,1,0,0|1,0,0]=3 15002 B9R1.35 CC(C)[C@H]1CNC(=O)N1 Amb25679662 [0,1,0,1,0,0|2,0,0]=4 15003 B9R1.35 CC(C)[C@H]1CNC(=O)O1 Amb25770277 [0,1,0,1,0,0|2,0,0]=4 15004 B9R1.35 CC(C)[C@H]1CSC(=O)N1 Amb25804129 [0,1,0,1,0,0|2,0,0]=4 15005 B9R1.35 CC(C)[C@H]1C[C@@H](O)CC1 Amb24661016 [0,1,0,1,0,0|0,0,2]=4 15006 B9R1.35 CC(C1CNC(=O)N1)C Amb17506854 [0,1,0,1,0,0|2,0,0]=4 15007 B9R1.35 CC(C1COC(=O)N1)C Amb10071773 [0,1,0,1,0,0|2,0,0]=4 15008 B9R1.35 CC(Cl)C1CCC(=O)O1 Amb25060676 [0,1,0,1,0,0|1,0,0]=3 15009 B9R1.35 CC(N)C1CC(=O)NC1 Amb24456534 [0,1,0,1,0,0|1,0,0]=3 15010 B9R1.35 CC(N)C1CCC(=O)O1 Amb24477799 [0,1,0,1,0,0|1,0,0]=3 15011 B9R1.35 CC(N)C1CN(C)CC1 Amb18832585 [0,1,0,1,0,0|2,0,0]=4 15012 B9R1.35 CC(O)C1CC(=O)CS1 Amb25087194 [0,1,0,1,0,0|1,0,0]=3 15013 B9R1.35 CC(O)C1CC(=O)OC1 Amb25739837 [0,1,0,1,0,0|1,0,0]=3 15014 B9R1.35 CC(O)C1CC(=O)SC1 Amb24703668 [0,1,0,1,0,0|1,0,0]=3 15015 B9R1.35 CC(O)C1CC=C(C)C1 Amb24352254 [0,1,0,1,0,0|1,0,1]=4 15016 B9R1.35 CC(O)C1CCC(=O)N1 Amb24386014 [0,1,0,1,0,0|1,0,0]=3 15017 B9R1.35 CC(O)C1CCN(N)C1 Amb25085911 [0,1,0,1,0,0|2,0,0]=4 15018 B9R1.35 CC(O)C1CN(C)CC1 Amb24730933 [0,1,0,1,0,0|2,0,0]=4 15019 B9R1.35 CC(O)C1COC(=O)O1 Amb24592152 [0,1,0,1,0,0|2,0,0]=4 15020 B9R1.35 CC1CC(CC1)C(N)=N Amb25825672 [0,1,0,1,0,0|2,0,0]=4 15021 B9R1.35 CC1CC(CC1)C(N)=O Amb24763749 [0,1,0,1,0,0|1,0,0]=3 15022 B9R1.35 CC1CC(CC1)C(N)=S Amb25140648 [0,1,0,1,0,0|1,1,0]=4 15023 B9R1.35 CC1CC(CC1)C(O)=O Amb18642624 [0,1,0,1,0,0|1,0,0]=3 15024 B9R1.35 CC1CC(CN1)C(O)=O Amb18832566 [0,1,0,1,0,0|2,0,0]=4 15025 B9R1.35 CC1CC(CO1)C(=O)Cl Amb25832627 [0,1,0,1,0,0|2,0,0]=4 15026 B9R1.35 CC1CCC(=C1)C(O)=O Amb18642397 [0,1,0,1,0,0|1,0,1]=4 15027 B9R1.35 CC1CCC(C1)C(C)=O Amb25077503 [0,1,0,1,0,0|0,0,0]=2 15028 B9R1.35 CC1CCC(C1)C(C)Br Amb25278682 [0,1,0,1,0,0|1,0,1]=4 15029 B9R1.35 CC1CCC(C1)C(C)Cl Amb24478815 [0,1,0,1,0,0|1,0,1]=4 15030 B9R1.35 CC1CCC(C1)C(C)N Amb25742195 [0,1,0,1,0,0|1,0,1]=4 15031 B9R1.35 CC1CCC(C1)C(C)O Amb24447243 [0,1,0,1,0,0|0,0,2]=4 15032 B9R1.35 CC1CCC(C1)N(C)C Amb24706502 [0,1,0,1,0,0|2,0,0]=4 15033 B9R1.35 CC1CCC(C1)[C@@H](C)N Amb25147002 [0,1,0,1,0,0|1,0,1]=4 15034 B9R1.35 CC1CCC(N1)C(N)=O Amb18642667 [0,1,0,1,0,0|1,0,0]=3 15035 B9R1.35 CC1CCC(N1)C(O)=O Amb18832572 [0,1,0,1,0,0|1,0,0]=3 15036 B9R1.35 CC1CCC(O1)C(=O)O Amb17593370 [0,1,0,1,0,0|1,0,0]=3 15037 B9R1.35 CC1CCC(O1)C(C)=O Amb24580538 [0,1,0,1,0,0|0,0,0]=2 15038 B9R1.35 CC1CCC(O1)C(C)N Amb25162831 [0,1,0,1,0,0|0,0,2]=4 15039 B9R1.35 CC1CCC(O1)[C@@H](C)N Amb25248223 [0,1,0,1,0,0|0,0,2]=4 15040 B9R1.35 CC1CCC(O1)[C@@H](C)O Amb24561971 [0,1,0,1,0,0|0,0,2]=4 15041 B9R1.35 CC1CCC(S1)C(O)=O Amb25719281 [0,1,0,1,0,0|1,0,0]=3 15042 B9R1.35 CC1CCC([NH2+]1)C(O)=O Amb22372047 [0,1,0,1,0,0|1,0,0]=3 15043 B9R1.35 CC1CC[C@@H](N1)C(O)=O Amb22748252 [0,1,0,1,0,0|1,0,0]=3 15044 B9R1.35 CC1CC[C@H](N1)C(N)=O Amb24696154 [0,1,0,1,0,0|1,0,0]=3 15045 B9R1.35 CC1CN(CC1)C(C)=N Amb25055962 [0,1,0,1,0,0|2,0,0]=4 15046 B9R1.35 CC1CN(CC1)C(N)=O Amb25692037 [0,1,0,1,0,0|2,0,0]=4 15047 B9R1.35 CC1CNC(O1)C(O)=O Amb25737834 [0,1,0,1,0,0|2,0,0]=4 15048 B9R1.35 CC1CSC(S1)C(C)=O Amb24676738 [0,1,0,1,0,0|1,0,0]=3 15049 B9R1.35 CC1CSC(S1)C(O)=O Amb24608602 [0,1,0,1,0,0|2,0,0]=4 15050 B9R1.35 CC1N[C@@H](CS1)C(=O)O Amb16203706 [0,1,0,1,0,0|2,0,0]=4 15051 B9R1.35 CC=1CCC(N1)C(O)=O Amb23438203 [0,1,0,1,0,0|1,0,1]=4 15052 B9R1.35 CC=1CCC([NH+]1)C(O)=O Amb22372048 [0,1,0,1,0,0|1,0,1]=4 15053 B9R1.35 CN(C)C1CC(=O)CC1 Amb24445836 [0,1,0,1,0,0|1,0,0]=3 15054 B9R1.35 CN(C)C1CCC(N)C1 Amb18063142 [0,1,0,1,0,0|2,0,0]=4 15055 B9R1.35 CN(C)C1CCC(O)C1 Amb25311037 [0,1,0,1,0,0|2,0,0]=4 15056 B9R1.35 CN(C)[C@@H]1CC[C@@H](O)C1 Amb25338336 [0,1,0,1,0,0|2,0,0]=4 15057 B9R1.35 CN(C)[C@@H]1CC[C@H](O)C1 Amb24516012 [0,1,0,1,0,0|2,0,0]=4 15058 B9R1.35 CN1CC(CC1)C(N)=O Amb25144200 [0,1,0,1,0,0|2,0,0]=4 15059 B9R1.35 CN1CCC(N1)C(O)=O Amb25854311 [0,1,0,1,0,0|2,0,0]=4 15060 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22746030 [0,1,0,1,0,0|2,0,0]=4 15061 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22756448 [0,1,0,1,0,0|2,0,0]=4 15062 B9R1.35 CS(=O)C1CC(=O)CC1 Amb25147151 [0,1,0,1,0,0|1,0,0]=3 15063 B9R1.35 CS(=O)N1CC(O)CC1 Amb24738289 [0,1,0,1,0,0|2,0,0]=4 15064 B9R1.35 CS(=O)N1C[C@@H](N)CC1 Amb24608552 [0,1,0,1,0,0|2,0,0]=4 15065 B9R1.35 CS(=O)N1C[C@H](O)CC1 Amb24663060 [0,1,0,1,0,0|2,0,0]=4 15066 B9R1.35 C[C@@H](N)[C@@H]1CC(=O)NC1 Amb25251199 [0,1,0,1,0,0|1,0,0]=3 15067 B9R1.35 C[C@@H](O)C=1CCC(=O)C1 Amb25093670 [0,1,0,1,0,0|0,0,2]=4 15068 B9R1.35 C[C@@H](O)[C@@H]1CC(=O)NC1 Amb25251245 [0,1,0,1,0,0|1,0,0]=3 15069 B9R1.35 C[C@@H](O)[C@@H]1CCC(=O)N1 Amb25305303 [0,1,0,1,0,0|1,0,0]=3 15070 B9R1.35 C[C@@H](O)[C@H]1CC(=O)OC1 Amb25215452 [0,1,0,1,0,0|1,0,0]=3 15071 B9R1.35 C[C@@H]1CC[C@@H](C1)C(=O)O Amb10843961 [0,1,0,1,0,0|1,0,0]=3 15072 B9R1.35 C[C@@H]1CC[C@@H](N1)C(N)=O Amb24572556 [0,1,0,1,0,0|1,0,0]=3 15073 B9R1.35 C[C@@H]1CC[C@@H](N1)C(O)=O Amb24399449 [0,1,0,1,0,0|1,0,0]=3 15074 B9R1.35 C[C@@H]1CC[C@@H](O1)C(O)=O Amb22886534 [0,1,0,1,0,0|1,0,0]=3 15075 B9R1.35 C[C@@H]1CS[C@H](S1)C(=O)Cl Amb25110654 [0,1,0,1,0,0|2,0,0]=4 15076 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb19887682 [0,1,0,1,0,0|2,0,0]=4 15077 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb23439040 [0,1,0,1,0,0|2,0,0]=4 15078 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22008683 [0,1,0,1,0,0|2,0,0]=4 15079 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22752452 [0,1,0,1,0,0|2,0,0]=4 15080 B9R1.35 C[C@@H]1N[C@H](CS1)C(O)=O Amb25294278 [0,1,0,1,0,0|2,0,0]=4 15081 B9R1.35 C[C@H](N)[C@@H]1CCC(=O)O1 Amb24514821 [0,1,0,1,0,0|1,0,0]=3 15082 B9R1.35 C[C@H](O)C=1CCC(=O)C1 Amb24722795 [0,1,0,1,0,0|0,0,2]=4 15083 B9R1.35 C[C@H](O)[C@@H]1CCC(=O)O1 Amb25240058 [0,1,0,1,0,0|1,0,0]=3 15084 B9R1.35 C[C@H](O)[C@H]1CCC(=O)O1 Amb25236263 [0,1,0,1,0,0|1,0,0]=3 15085 B9R1.35 C[C@H]1CC[C@@H](N1)C(O)=O Amb25260830 [0,1,0,1,0,0|1,0,0]=3 15086 B9R1.35 C[C@H]1CC[C@H](C1)C(=O)O Amb10843955 [0,1,0,1,0,0|1,0,0]=3 15087 B9R1.35 C[C@H]1CC[C@H](N1)C(O)=O Amb24598417 [0,1,0,1,0,0|1,0,0]=3 15088 B9R1.35 C[C@H]1CC[C@H](O1)C(C)Cl Amb24745723 [0,1,0,1,0,0|0,0,2]=4 15089 B9R1.35 C[C@H]1CC[C@H](O1)C(O)=O Amb24651587 [0,1,0,1,0,0|1,0,0]=3 15090 B9R1.35 C[C@H]1C[C@@H](CC1)C(N)=O Amb24612116 [0,1,0,1,0,0|1,0,0]=3 15091 B9R1.35 C[C@H]1C[C@@H](NC1)C(O)=O Amb24752952 [0,1,0,1,0,0|2,0,0]=4 15092 B9R1.35 C[C@H]1C[C@H](CN1)C(O)=O Amb24715999 [0,1,0,1,0,0|2,0,0]=4 15093 B9R1.35 C[C@H]1C[C@H](NC1)C(O)=O Amb19888348 [0,1,0,1,0,0|2,0,0]=4 15094 B9R1.35 C[C@H]1N[C@@H](CS1)C(O)=O Amb25347352 [0,1,0,1,0,0|2,0,0]=4 15095 B9R1.35 C[C@H]1O[C@H](CS1)C(O)=O Amb24625718 [0,1,0,1,0,0|2,0,0]=4 15096 B9R1.35 NC(=O)C1CC(CN1)O Amb1152420 [0,1,0,1,0,0|2,0,0]=4 15097 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,1,0,1,0,0|2,0,0]=4 15098 B9R1.35 NC(=O)C1CCC(O)C1 Amb25230928 [0,1,0,1,0,0|1,0,0]=3 15099 B9R1.35 NC(=O)N1CC(O)CC1 Amb24635585 [0,1,0,1,0,0|2,0,0]=4 15100 B9R1.35 NC(=O)N1C[C@@H](O)CC1 Amb24478790 [0,1,0,1,0,0|2,0,0]=4 15101 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,1,0,1,0,0|2,0,0]=4 15102 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22748232 [0,1,0,1,0,0|2,0,0]=4 15103 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [0,1,0,1,0,0|1,0,0]=3 15104 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F Amb10808100 [0,1,0,1,0,0|2,0,0]=4 15105 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,1,0,1,0,0|2,0,0]=4 15106 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,1,0,1,0,0|2,0,0]=4 15107 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,1,0,1,0,0|2,0,0]=4 15108 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb22745753 [0,1,0,1,0,0|2,0,0]=4 15109 B9R1.35 NC(=O)[C@H]1C[C@@H](F)CN1 Amb25256284 [0,1,0,1,0,0|2,0,0]=4 15110 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24575802 [0,1,0,1,0,0|2,0,0]=4 15111 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,1,0,1,0,0|2,0,0]=4 15112 B9R1.35 NC1CC(NC1)C(=O)O Amb10608922 [0,1,0,1,0,0|2,0,0]=4 15113 B9R1.35 NC1CC(OC1)C(O)=O Amb18642828 [0,1,0,1,0,0|2,0,0]=4 15114 B9R1.35 NC1CC(SC1)C(O)=O Amb18831415 [0,1,0,1,0,0|2,0,0]=4 15115 B9R1.35 NC1CCC(C1)C(=O)O Amb10066880 [0,1,0,1,0,0|1,0,0]=3 15116 B9R1.35 NC1CCC(C1)C(N)=O Amb25104222 [0,1,0,1,0,0|1,0,0]=3 15117 B9R1.35 NC1CN(CC1)C(N)=O Amb18943828 [0,1,0,1,0,0|2,0,0]=4 15118 B9R1.35 NC1CN(CC1)C(N)=O Amb19373727 [0,1,0,1,0,0|2,0,0]=4 15119 B9R1.35 NC1CSC(C1)C(N)=O Amb24638225 [0,1,0,1,0,0|2,0,0]=4 15120 B9R1.35 N[C@@H]1CC(CC1)C(O)=O Amb25700807 [0,1,0,1,0,0|1,0,0]=3 15121 B9R1.35 N[C@@H]1CC[C@@H](C1)C(N)=O Amb25321319 [0,1,0,1,0,0|1,0,0]=3 15122 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O Amb10066881 [0,1,0,1,0,0|1,0,0]=3 15123 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O Amb10070446 [0,1,0,1,0,0|2,0,0]=4 15124 B9R1.35 N[C@@H]1C[C@@H](CC1)C(O)=O Amb22746692 [0,1,0,1,0,0|1,0,0]=3 15125 B9R1.35 N[C@@H]1C[C@@H](NC1)C(O)=O Amb22008702 [0,1,0,1,0,0|2,0,0]=4 15126 B9R1.35 N[C@@H]1C[C@@H](OC1)C(O)=O Amb24548389 [0,1,0,1,0,0|2,0,0]=4 15127 B9R1.35 N[C@@H]1C[C@H](CC1)C(O)=O Amb22756038 [0,1,0,1,0,0|1,0,0]=3 15128 B9R1.35 N[C@@H]1C[C@H](NC1)C(=O)O Amb10603131 [0,1,0,1,0,0|2,0,0]=4 15129 B9R1.35 N[C@@H]1C[C@H](NC1)C(O)=O Amb22224945 [0,1,0,1,0,0|2,0,0]=4 15130 B9R1.35 N[C@@H]1C[C@H](OC1)C(O)=O Amb24117069 [0,1,0,1,0,0|2,0,0]=4 15131 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O Amb10066883 [0,1,0,1,0,0|1,0,0]=3 15132 B9R1.35 N[C@H]1CN(CC1)C(N)=O Amb25688167 [0,1,0,1,0,0|2,0,0]=4 15133 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O Amb10070445 [0,1,0,1,0,0|2,0,0]=4 15134 B9R1.35 N[C@H]1C[C@@H](NC1)C(O)=O Amb19515889 [0,1,0,1,0,0|2,0,0]=4 15135 B9R1.35 N[C@H]1C[C@@H](OC1)C(O)=O Amb25691536 [0,1,0,1,0,0|2,0,0]=4 15136 B9R1.35 N[C@H]1C[C@H](NC1)C(=O)O Amb10603136 [0,1,0,1,0,0|2,0,0]=4 15137 B9R1.35 N[C@H]1C[C@H](NC1)C(O)=O Amb22386834 [0,1,0,1,0,0|2,0,0]=4 15138 B9R1.35 N[C@H]1C[C@H](OC1)C(O)=O Amb25799075 [0,1,0,1,0,0|2,0,0]=4 15139 B9R1.35 O=C(Cl)C1CC(Cl)CC1 Amb24707520 [0,1,0,1,0,0|1,0,0]=3 15140 B9R1.35 O=C(Cl)C1CCC(F)C1 Amb25071689 [0,1,0,1,0,0|1,0,0]=3 15141 B9R1.35 O=C1CC(CN1)C(F)F Amb24681385 [0,1,0,1,0,0|2,0,0]=4 15142 B9R1.35 O=C1CCC(C1)C(=O)Cl Amb25282784 [0,1,0,1,0,0|1,0,1]=4 15143 B9R1.35 O=C1CCC(N1)C(F)F Amb23437767 [0,1,0,1,0,0|2,0,0]=4 15144 B9R1.35 O=C1CC[C@@H](N1)C(F)F Amb19148413 [0,1,0,1,0,0|2,0,0]=4 15145 B9R1.35 O=C1CC[C@H](N1)C(F)F Amb25336383 [0,1,0,1,0,0|2,0,0]=4 15146 B9R1.35 OC(=O)C1CC(Br)CN1 Amb25239348 [0,1,0,1,0,0|2,0,0]=4 15147 B9R1.35 OC(=O)C1CC(CN1)F Amb10608925 [0,1,0,1,0,0|2,0,0]=4 15148 B9R1.35 OC(=O)C1CC(CN1)S Amb10608928 [0,1,0,1,0,0|2,0,0]=4 15149 B9R1.35 OC(=O)C1CCC(F)C1 Amb22886545 [0,1,0,1,0,0|1,0,0]=3 15150 B9R1.35 OC(=O)C1CCC(F)N1 Amb24423850 [0,1,0,1,0,0|2,0,0]=4 15151 B9R1.35 OC(=O)C1CCC(I)C1 Amb23456141 [0,1,0,1,0,0|1,0,0]=3 15152 B9R1.35 OC(=O)C1C[C@H](F)CN1 Amb24598689 [0,1,0,1,0,0|2,0,0]=4 15153 B9R1.35 OC(=O)[C@@H]1CC(=O)CC1 Amb22746923 [0,1,0,1,0,0|1,0,1]=4 15154 B9R1.35 OC(=O)[C@@H]1CC(F)CN1 Amb25123838 [0,1,0,1,0,0|2,0,0]=4 15155 B9R1.35 OC(=O)[C@@H]1CCC(F)N1 Amb25032254 [0,1,0,1,0,0|2,0,0]=4 15156 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)Br Amb10603137 [0,1,0,1,0,0|2,0,0]=4 15157 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)F Amb10603139 [0,1,0,1,0,0|2,0,0]=4 15158 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)I Amb10603140 [0,1,0,1,0,0|2,0,0]=4 15159 B9R1.35 OC(=O)[C@@H]1C[C@@H](Cl)CN1 Amb24582915 [0,1,0,1,0,0|2,0,0]=4 15160 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,1,0,1,0,0|2,0,0]=4 15161 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb25245369 [0,1,0,1,0,0|2,0,0]=4 15162 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)Br Amb10603132 [0,1,0,1,0,0|2,0,0]=4 15163 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)F Amb16232298 [0,1,0,1,0,0|2,0,0]=4 15164 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)I Amb10603134 [0,1,0,1,0,0|2,0,0]=4 15165 B9R1.35 OC(=O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,1,0,1,0,0|2,0,0]=4 15166 B9R1.35 OC(=O)[C@H]1C[C@@H](CN1)F Amb10067741 [0,1,0,1,0,0|2,0,0]=4 15167 B9R1.35 OC(=O)[C@H]1C[C@H](CN1)F Amb10839999 [0,1,0,1,0,0|2,0,0]=4 15168 B9R1.35 OC1CCC(C1)C(O)=O Amb21963572 [0,1,0,1,0,0|1,0,0]=3 15169 B9R1.35 OC1CN(CC1)C(=O)Cl Amb25740939 [0,1,0,1,0,0|2,0,0]=4 15170 B9R1.35 OC1CNC(C1)C(=O)O Amb1151287 [0,1,0,1,0,0|2,0,0]=4 15171 B9R1.35 OC1CN[C@@H](C1)C(O)=O Amb25743296 [0,1,0,1,0,0|2,0,0]=4 15172 B9R1.35 OC1COC(C1)C(O)=O Amb18642869 [0,1,0,1,0,0|2,0,0]=4 15173 B9R1.35 O[C@@H]1CC[C@@H](C1)C(O)=O Amb22746073 [0,1,0,1,0,0|1,0,0]=3 15174 B9R1.35 O[C@@H]1CC[C@H](C1)C(O)=O Amb22746558 [0,1,0,1,0,0|1,0,0]=3 15175 B9R1.35 O[C@@H]1CC[C@H](N1)C(O)=O Amb24515622 [0,1,0,1,0,0|2,0,0]=4 15176 B9R1.35 O[C@@H]1CNC(C1)C(O)=O Amb25118054 [0,1,0,1,0,0|2,0,0]=4 15177 B9R1.35 O[C@@H]1CN[C@@H](C1)C(O)=O Amb22748218 [0,1,0,1,0,0|2,0,0]=4 15178 B9R1.35 O[C@@H]1CN[C@H](C1)C(=O)O Amb16230723 [0,1,0,1,0,0|2,0,0]=4 15179 B9R1.35 O[C@@H]1CO[C@@H](C1)C(O)=O Amb24501449 [0,1,0,1,0,0|2,0,0]=4 15180 B9R1.35 O[C@@H]1CO[C@H](C1)C(O)=O Amb24501448 [0,1,0,1,0,0|2,0,0]=4 15181 B9R1.35 O[C@@H]1C[C@H](NC1)C(=O)Cl Amb25174893 [0,1,0,1,0,0|2,0,0]=4 15182 B9R1.35 O[C@H]1CNC(C1)C(O)=O Amb24682710 [0,1,0,1,0,0|2,0,0]=4 15183 B9R1.35 O[C@H]1CN[C@@H](C1)C(=O)O Amb1994991 [0,1,0,1,0,0|2,0,0]=4 15184 B9R1.35 O[C@H]1C[C@@H](NC1)C(=O)Cl Amb25175003 [0,1,0,1,0,0|2,0,0]=4 15185 B9R1.45 CC(=O)C(=O)C1CC1C Amb25775771 [0,1,0,1,0,0|0,0,1]=3 15186 B9R1.45 CC(C)C(N)C1CC1C Amb25281536 [0,1,0,1,0,0|1,0,1]=4 15187 B9R1.45 CC(C1CC1C)C(C)=O Amb24529060 [0,1,0,1,0,0|0,0,0]=2 15188 B9R1.45 CC(C1CC1C)C(O)=O Amb25708709 [0,1,0,1,0,0|1,0,0]=3 15189 B9R1.45 CC1CC1C(=O)C(O)=O Amb24760671 [0,1,0,1,0,0|1,0,1]=4 15190 B9R1.45 CC1CC1C(N)C(C)=C Amb24478683 [0,1,0,1,0,0|1,0,0]=3 15191 B9R1.45 CC1CC1C(O)C(C)=C Amb25300998 [0,1,0,1,0,0|1,0,0]=3 15192 B9R1.45 NC([C@H]1C[C@@H]1N)C(O)=O Amb25245366 [0,1,0,1,0,0|2,0,0]=4 15193 B9R1.69 CC1=CC(=O)CCC1C Amb25128835 [0,1,0,1,0,0|0,0,2]=4 15194 B9R1.69 CC1=CC(=O)CCC1O Amb24519337 [0,1,0,1,0,0|0,0,2]=4 15195 B9R1.69 CC1=CC(C)CCC1=O Amb25829538 [0,1,0,1,0,0|1,0,1]=4 15196 B9R1.69 CC1=CC(O)CCC1O Amb25687764 [0,1,0,1,0,0|2,0,0]=4 15197 B9R1.69 CC1=CC[C@@H](C)CC1=O Amb25749539 [0,1,0,1,0,0|0,0,2]=4 15198 B9R1.69 CC1=NC(=O)CCC1C Amb24070883 [0,1,0,1,0,0|1,0,1]=4 15199 B9R1.69 CC1C=NC(C)CC1=O Amb24748168 [0,1,0,1,0,0|1,0,1]=4 15200 B9R1.69 CC1CC(=O)C(=O)CC1 Amb25735257 [0,1,0,1,0,0|0,0,1]=3 15201 B9R1.69 CC1CC(=O)C(Br)CO1 Amb25139539 [0,1,0,1,0,0|1,0,0]=3 15202 B9R1.69 CC1CC(=O)C(C)CC1 Amb22228357 [0,1,0,1,0,0|0,0,0]=2 15203 B9R1.69 CC1CC(=O)C(N)CC1 Amb25291675 [0,1,0,1,0,0|0,0,0]=2 15204 B9R1.69 CC1CC(=O)C=CC1O Amb24650285 [0,1,0,1,0,0|0,0,2]=4 15205 B9R1.69 CC1CC(=O)CCC1C Amb22732216 [0,1,0,1,0,0|0,0,0]=2 15206 B9R1.69 CC1CC(=O)CCC1Cl Amb24391486 [0,1,0,1,0,0|0,0,0]=2 15207 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,1,0,1,0,0|0,0,0]=2 15208 B9R1.69 CC1CC(=O)CCN1C Amb19148128 [0,1,0,1,0,0|1,0,0]=3 15209 B9R1.69 CC1CC(=O)N(O)CC1 Amb25146341 [0,1,0,1,0,0|1,0,0]=3 15210 B9R1.69 CC1CC(=O)NCC1N Amb24496285 [0,1,0,1,0,0|1,0,0]=3 15211 B9R1.69 CC1CC(Br)C(C)CC1 Amb25050773 [0,1,0,1,0,0|1,0,1]=4 15212 B9R1.69 CC1CC(Br)CCC1C Amb25838066 [0,1,0,1,0,0|1,0,1]=4 15213 B9R1.69 CC1CC(C)C(Br)CC1 Amb18329561 [0,1,0,1,0,0|1,0,1]=4 15214 B9R1.69 CC1CC(C)C(N)CC1 Amb19515132 [0,1,0,1,0,0|1,0,1]=4 15215 B9R1.69 CC1CC(Cl)C(Cl)CC1 Amb24381205 [0,1,0,1,0,0|1,0,1]=4 15216 B9R1.69 CC1CC(I)CCC1C Amb25147178 [0,1,0,1,0,0|1,0,1]=4 15217 B9R1.69 CC1CC(N)C(N)CC1 Amb18832603 [0,1,0,1,0,0|1,0,1]=4 15218 B9R1.69 CC1CC(N)CCC1C Amb25188919 [0,1,0,1,0,0|1,0,1]=4 15219 B9R1.69 CC1CC(N)CCC1O Amb24624100 [0,1,0,1,0,0|1,0,1]=4 15220 B9R1.69 CC1CC(O)CCC1O Amb24726092 [0,1,0,1,0,0|0,0,2]=4 15221 B9R1.69 CC1CC(S)C(C)CC1 Amb25296681 [0,1,0,1,0,0|0,1,1]=4 15222 B9R1.69 CC1CCC(=C)CC1Br Amb24635906 [0,1,0,1,0,0|2,0,0]=4 15223 B9R1.69 CC1CCC(=C)CC1O Amb25333669 [0,1,0,1,0,0|2,0,0]=4 15224 B9R1.69 CC1CCC(=O)C(=C)C1 Amb25686144 [0,1,0,1,0,0|1,0,1]=4 15225 B9R1.69 CC1CCC(=O)C(=O)N1 Amb24745568 [0,1,0,1,0,0|1,0,1]=4 15226 B9R1.69 CC1CCC(=O)C(=O)O1 Amb24621712 [0,1,0,1,0,0|1,0,1]=4 15227 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,1,0,1,0,0|1,0,1]=4 15228 B9R1.69 CC1CCC(=O)CC1Br Amb24398782 [0,1,0,1,0,0|1,0,0]=3 15229 B9R1.69 CC1CCC(=O)CN1C Amb25792971 [0,1,0,1,0,0|1,0,0]=3 15230 B9R1.69 CC1CCC(Br)C(Cl)C1 Amb24456535 [0,1,0,1,0,0|1,0,1]=4 15231 B9R1.69 CC1CCC(C(C1)N)C Amb2099453 [0,1,0,1,0,0|1,0,1]=4 15232 B9R1.69 CC1CCC(C)=CC1C Amb25048711 [0,1,0,1,0,0|1,0,0]=3 15233 B9R1.69 CC1CCC(C)=CC1O Amb25056479 [0,1,0,1,0,0|2,0,0]=4 15234 B9R1.69 CC1CCC(C)NC1=O Amb25692572 [0,1,0,1,0,0|1,0,0]=3 15235 B9R1.69 CC1CCC(Cl)C(Cl)=C1 Amb25830121 [0,1,0,1,0,0|1,0,1]=4 15236 B9R1.69 CC1CCC(Cl)C(O)=C1 Amb25288245 [0,1,0,1,0,0|0,0,2]=4 15237 B9R1.69 CC1CCC(N)C(=O)O1 Amb24563967 [0,1,0,1,0,0|1,0,0]=3 15238 B9R1.69 CC1CCC(N)C(C)N1 Amb24654514 [0,1,0,1,0,0|1,0,1]=4 15239 B9R1.69 CC1CCC(O)C(=O)N1 Amb24427022 [0,1,0,1,0,0|1,0,0]=3 15240 B9R1.69 CC1CCC(O)C(C)=C1 Amb25741483 [0,1,0,1,0,0|1,0,0]=3 15241 B9R1.69 CC1CCC(O)C(C)N1 Amb25145975 [0,1,0,1,0,0|1,0,1]=4 15242 B9R1.69 CC1CCC(O)C(C)O1 Amb25842535 [0,1,0,1,0,0|0,0,2]=4 15243 B9R1.69 CC1CCC(O)C(N)=N1 Amb24062560 [0,1,0,1,0,0|2,0,0]=4 15244 B9R1.69 CC1CCC(O)C(N)C1 Amb18832563 [0,1,0,1,0,0|1,0,1]=4 15245 B9R1.69 CC1CCC(O)C(O)C1 Amb17939305 [0,1,0,1,0,0|0,0,2]=4 15246 B9R1.69 CC1CCC(O)OC1=O Amb25306421 [0,1,0,1,0,0|2,0,0]=4 15247 B9R1.69 CC1CN(C)CCC1Cl Amb25214912 [0,1,0,1,0,0|2,0,0]=4 15248 B9R1.69 CC1CN(C)CCC1N Amb22756868 [0,1,0,1,0,0|2,0,0]=4 15249 B9R1.69 CC1CN(C)CCC1S Amb24435312 [0,1,0,1,0,0|2,0,0]=4 15250 B9R1.69 CC1CN(C)CC[C@H]1O Amb25136838 [0,1,0,1,0,0|2,0,0]=4 15251 B9R1.69 CC1CN(N)CCC1O Amb25043238 [0,1,0,1,0,0|2,0,0]=4 15252 B9R1.69 CC1CNC(=O)CC1C Amb25124566 [0,1,0,1,0,0|1,0,0]=3 15253 B9R1.69 CC1CNC(C)CS1=O Amb25350071 [0,1,0,1,0,0|2,0,0]=4 15254 B9R1.69 CC1COC(=O)CC1O Amb25781910 [0,1,0,1,0,0|2,0,0]=4 15255 B9R1.69 CC1COC(C)CC1=O Amb22750432 [0,1,0,1,0,0|1,0,0]=3 15256 B9R1.69 CC1CS(=O)CCN1C Amb25079038 [0,1,0,1,0,0|2,0,0]=4 15257 B9R1.69 CC1C[C@@H](N)C(C)CC1 Amb25708996 [0,1,0,1,0,0|1,0,1]=4 15258 B9R1.69 CC1C[C@@H](N)[C@@H](N)CC1 Amb24579402 [0,1,0,1,0,0|1,0,1]=4 15259 B9R1.69 CC1C[C@@H](N)[C@H](N)CC1 Amb25324219 [0,1,0,1,0,0|1,0,1]=4 15260 B9R1.69 CC1C[C@@H](O)[C@@H](O)CC1 Amb25241376 [0,1,0,1,0,0|0,0,2]=4 15261 B9R1.69 CC1C[C@@H](O)[C@H](O)CC1 Amb25175409 [0,1,0,1,0,0|0,0,2]=4 15262 B9R1.69 CC1C[C@@H](S)[C@H](O)CC1 Amb25266569 [0,1,0,1,0,0|0,1,1]=4 15263 B9R1.69 CC1C[C@H](O)[C@@H](O)CC1 Amb25240222 [0,1,0,1,0,0|0,0,2]=4 15264 B9R1.69 CC1NC(=O)C(Br)CN1 Amb25833047 [0,1,0,1,0,0|2,0,0]=4 15265 B9R1.69 CC1NC(=O)CCC1N Amb25276175 [0,1,0,1,0,0|1,0,0]=3 15266 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,1,0,1,0,0|1,0,0]=3 15267 B9R1.69 CC1NC(=O)NCC1Br Amb24675323 [0,1,0,1,0,0|2,0,0]=4 15268 B9R1.69 CC1NCC(C)N=C1C Amb24085509 [0,1,0,1,0,0|2,0,0]=4 15269 B9R1.69 CC1NCC(C)NC1=O Amb18642668 [0,1,0,1,0,0|2,0,0]=4 15270 B9R1.69 CC1OC(=O)CCC1O Amb24524239 [0,1,0,1,0,0|1,0,0]=3 15271 B9R1.69 CC1OCC(C)NC1=O Amb25695880 [0,1,0,1,0,0|2,0,0]=4 15272 B9R1.69 CC1SCC(=O)NC1C Amb24655776 [0,1,0,1,0,0|2,0,0]=4 15273 B9R1.69 CC1SCC(C)NC1=O Amb25301976 [0,1,0,1,0,0|2,0,0]=4 15274 B9R1.69 CC1SCC(Cl)CC1=O Amb25804028 [0,1,0,1,0,0|2,0,0]=4 15275 B9R1.69 CC=1CCC(Cl)C(=O)C1 Amb25059200 [0,1,0,1,0,0|0,0,2]=4 15276 B9R1.69 CC=1CCC(O)C(O)C1 Amb25680660 [0,1,0,1,0,0|2,0,0]=4 15277 B9R1.69 CC=1CC[C@@H](O)C(=O)C1 Amb24422729 [0,1,0,1,0,0|0,0,2]=4 15278 B9R1.69 CC=1CC[C@H](O)[C@@H](O)C1 Amb25246920 [0,1,0,1,0,0|2,0,0]=4 15279 B9R1.69 CN1CC(=O)CCC1=O Amb23555663 [0,1,0,1,0,0|1,0,1]=4 15280 B9R1.69 CN1CCC(=O)CC1Cl Amb22496675 [0,1,0,1,0,0|2,0,0]=4 15281 B9R1.69 CN1CCC(C(C1)C)N Amb13951888 [0,1,0,1,0,0|2,0,0]=4 15282 B9R1.69 CN1CCC(N)CC1=O Amb21857737 [0,1,0,1,0,0|2,0,0]=4 15283 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1C Amb22231666 [0,1,0,1,0,0|0,0,0]=2 15284 B9R1.69 C[C@@H]1CC(=O)[C@@H](Br)CC1 Amb23592295 [0,1,0,1,0,0|0,0,0]=2 15285 B9R1.69 C[C@@H]1CC(=O)[C@@H](C)CC1 Amb24619935 [0,1,0,1,0,0|0,0,0]=2 15286 B9R1.69 C[C@@H]1CC(=O)[C@H](Cl)CC1 Amb24694008 [0,1,0,1,0,0|0,0,0]=2 15287 B9R1.69 C[C@@H]1CC(N)=NC[C@H]1O Amb24068474 [0,1,0,1,0,0|2,0,0]=4 15288 B9R1.69 C[C@@H]1CC(N)C(N)CC1 Amb24531869 [0,1,0,1,0,0|1,0,1]=4 15289 B9R1.69 C[C@@H]1CC(O)CC[C@@H]1C Amb25215758 [0,1,0,1,0,0|0,0,2]=4 15290 B9R1.69 C[C@@H]1CCC(=C)C[C@H]1O Amb24666635 [0,1,0,1,0,0|2,0,0]=4 15291 B9R1.69 C[C@@H]1CCC(C)=C[C@H]1O Amb25206333 [0,1,0,1,0,0|2,0,0]=4 15292 B9R1.69 C[C@@H]1CC[C@@H](N)[C@H](C)O1 Amb24514973 [0,1,0,1,0,0|0,0,2]=4 15293 B9R1.69 C[C@@H]1CC[C@@H](O)C(=O)N1 Amb25175096 [0,1,0,1,0,0|1,0,0]=3 15294 B9R1.69 C[C@@H]1CC[C@@H](O)CC1=C Amb25332175 [0,1,0,1,0,0|2,0,0]=4 15295 B9R1.69 C[C@@H]1CC[C@@H](O)CC1=O Amb24602949 [0,1,0,1,0,0|1,0,0]=3 15296 B9R1.69 C[C@@H]1CC[C@H](O)CC1=O Amb25205775 [0,1,0,1,0,0|1,0,0]=3 15297 B9R1.69 C[C@@H]1CC[C@H](O)[C@H](C)N1 Amb24516976 [0,1,0,1,0,0|1,0,1]=4 15298 B9R1.69 C[C@@H]1CN(C)CC[C@H]1N Amb22756869 [0,1,0,1,0,0|2,0,0]=4 15299 B9R1.69 C[C@@H]1CN[C@@H](C)CC1=O Amb24612412 [0,1,0,1,0,0|1,0,0]=3 15300 B9R1.69 C[C@@H]1C[C@@H](C)[C@@H](O)CC1 Amb24520434 [0,1,0,1,0,0|1,0,1]=4 15301 B9R1.69 C[C@@H]1C[C@@H](C)[C@H](O)CC1 Amb25315496 [0,1,0,1,0,0|1,0,1]=4 15302 B9R1.69 C[C@@H]1C[C@@H](Cl)[C@@H](C)CC1 Amb24634142 [0,1,0,1,0,0|1,0,1]=4 15303 B9R1.69 C[C@@H]1C[C@@H](N)CC[C@H]1O Amb24573275 [0,1,0,1,0,0|1,0,1]=4 15304 B9R1.69 C[C@@H]1C[C@@H](N)[C@H](C)CC1 Amb24601128 [0,1,0,1,0,0|1,0,1]=4 15305 B9R1.69 C[C@@H]1C[C@@H](O)CC[C@H]1C Amb24705627 [0,1,0,1,0,0|0,0,2]=4 15306 B9R1.69 C[C@@H]1C[C@@H](O)[C@@H](C)CC1 Amb25276352 [0,1,0,1,0,0|0,0,2]=4 15307 B9R1.69 C[C@@H]1C[C@@H](O)[C@@H](O)CC1 Amb24515640 [0,1,0,1,0,0|0,0,2]=4 15308 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](C)CC1 Amb24589067 [0,1,0,1,0,0|0,0,2]=4 15309 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](O)CC1 Amb25258757 [0,1,0,1,0,0|0,0,2]=4 15310 B9R1.69 C[C@@H]1C[C@H](C)[C@@H](C)CC1 Amb22801520 [0,1,0,1,0,0|1,0,1]=4 15311 B9R1.69 C[C@@H]1C[C@H](C)[C@H](N)CC1 Amb24612173 [0,1,0,1,0,0|1,0,1]=4 15312 B9R1.69 C[C@@H]1C[C@H](N)[C@H](C)CC1 Amb24540834 [0,1,0,1,0,0|1,0,1]=4 15313 B9R1.69 C[C@@H]1C[C@H](O)[C@H](C)CC1 Amb25239717 [0,1,0,1,0,0|0,0,2]=4 15314 B9R1.69 C[C@@H]1NC(=O)CC[C@@H]1O Amb25081565 [0,1,0,1,0,0|1,0,0]=3 15315 B9R1.69 C[C@@H]1NC(=O)CC[C@H]1N Amb24100133 [0,1,0,1,0,0|1,0,0]=3 15316 B9R1.69 C[C@@H]1NC(=O)CC[C@H]1O Amb24710524 [0,1,0,1,0,0|1,0,0]=3 15317 B9R1.69 C[C@@H]1NC[C@@H](C)NC1=O Amb22587597 [0,1,0,1,0,0|2,0,0]=4 15318 B9R1.69 C[C@@H]1NC[C@H](C)NC1=O Amb22587599 [0,1,0,1,0,0|2,0,0]=4 15319 B9R1.69 C[C@@H]1NC[C@H](C)NC1=O Amb23385307 [0,1,0,1,0,0|2,0,0]=4 15320 B9R1.69 C[C@@H]1OC(=O)NC[C@H]1Br Amb24571741 [0,1,0,1,0,0|2,0,0]=4 15321 B9R1.69 C[C@@H]1OC(=O)NC[C@H]1C Amb24679479 [0,1,0,1,0,0|2,0,0]=4 15322 B9R1.69 C[C@H]1CC(=C)[C@@H](C)CC1 Amb24603024 [0,1,0,1,0,0|1,0,0]=3 15323 B9R1.69 C[C@H]1CC(=O)C(Br)CC1 Amb25774507 [0,1,0,1,0,0|0,0,0]=2 15324 B9R1.69 C[C@H]1CC(=O)C(F)CC1 Amb24690818 [0,1,0,1,0,0|0,0,0]=2 15325 B9R1.69 C[C@H]1CC(=O)CC[C@@H]1O Amb25202720 [0,1,0,1,0,0|0,0,0]=2 15326 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,1,0,1,0,0|0,0,0]=2 15327 B9R1.69 C[C@H]1CC(=O)[C@H](Br)CC1 Amb25366783 [0,1,0,1,0,0|0,0,0]=2 15328 B9R1.69 C[C@H]1CCC(=O)CS1=O Amb25782562 [0,1,0,1,0,0|2,0,0]=4 15329 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1Cl Amb25179045 [0,1,0,1,0,0|1,0,0]=3 15330 B9R1.69 C[C@H]1CCC(=O)C[C@H]1Br Amb25178854 [0,1,0,1,0,0|1,0,0]=3 15331 B9R1.69 C[C@H]1CCC(=O)C[C@H]1Cl Amb25179044 [0,1,0,1,0,0|1,0,0]=3 15332 B9R1.69 C[C@H]1CCC(C)=CC1O Amb24340096 [0,1,0,1,0,0|2,0,0]=4 15333 B9R1.69 C[C@H]1CCC(C)=C[C@H]1O Amb24733593 [0,1,0,1,0,0|2,0,0]=4 15334 B9R1.69 C[C@H]1CCC(N)C(=O)N1 Amb25378397 [0,1,0,1,0,0|1,0,0]=3 15335 B9R1.69 C[C@H]1CC[C@H](O)CC1=O Amb24512547 [0,1,0,1,0,0|1,0,0]=3 15336 B9R1.69 C[C@H]1CN(C)CC[C@@H]1O Amb24683746 [0,1,0,1,0,0|2,0,0]=4 15337 B9R1.69 C[C@H]1COC(=O)C[C@H]1O Amb24516166 [0,1,0,1,0,0|2,0,0]=4 15338 B9R1.69 C[C@H]1C[C@@H](C)[C@H](O)CC1 Amb25258776 [0,1,0,1,0,0|1,0,1]=4 15339 B9R1.69 C[C@H]1C[C@@H](N)[C@H](C)CC1 Amb24577949 [0,1,0,1,0,0|1,0,1]=4 15340 B9R1.69 C[C@H]1C[C@@H](N)[C@H](N)CC1 Amb24578419 [0,1,0,1,0,0|1,0,1]=4 15341 B9R1.69 C[C@H]1C[C@@H](O)CC[C@H]1O Amb24515361 [0,1,0,1,0,0|0,0,2]=4 15342 B9R1.69 C[C@H]1C[C@@H](S)[C@H](O)CC1 Amb24520438 [0,1,0,1,0,0|0,1,1]=4 15343 B9R1.69 C[C@H]1C[C@H](C)[C@@H](C)CC1 Amb24565013 [0,1,0,1,0,0|1,0,1]=4 15344 B9R1.69 C[C@H]1C[C@H](C)[C@H](O)CC1 Amb25234825 [0,1,0,1,0,0|1,0,1]=4 15345 B9R1.69 C[C@H]1C[C@H](N)CC[C@@H]1O Amb24669791 [0,1,0,1,0,0|1,0,1]=4 15346 B9R1.69 C[C@H]1C[C@H](N)[C@H](N)CC1 Amb24515053 [0,1,0,1,0,0|1,0,1]=4 15347 B9R1.69 C[C@H]1C[C@H](O)CC[C@H]1C Amb24620750 [0,1,0,1,0,0|0,0,2]=4 15348 B9R1.69 C[C@H]1NC(=O)CC[C@H]1N Amb24622058 [0,1,0,1,0,0|1,0,0]=3 15349 B9R1.69 C[C@H]1NC(=O)CC[C@H]1O Amb24598792 [0,1,0,1,0,0|1,0,0]=3 15350 B9R1.69 C[C@H]1NC[C@@H](C)NC1=O Amb22587536 [0,1,0,1,0,0|2,0,0]=4 15351 B9R1.69 C[C@H]1NC[C@@H](C)NC1=O Amb23385259 [0,1,0,1,0,0|2,0,0]=4 15352 B9R1.69 C[C@H]1NC[C@H](C)NC1=O Amb22587547 [0,1,0,1,0,0|2,0,0]=4 15353 B9R1.69 C[C@H]1NC[C@H](C)NC1=O Amb23385266 [0,1,0,1,0,0|2,0,0]=4 15354 B9R1.69 C[C@H]1OC(=O)CCC1=O Amb25749526 [0,1,0,1,0,0|1,0,1]=4 15355 B9R1.69 C[C@H]1OC(=O)CC[C@@H]1O Amb25350343 [0,1,0,1,0,0|1,0,0]=3 15356 B9R1.69 C[C@H]1OC[C@H](C)NC1=O Amb24515066 [0,1,0,1,0,0|2,0,0]=4 15357 B9R1.69 O=C1CC(=O)C(Br)CC1 Amb25234901 [0,1,0,1,0,0|1,0,1]=4 15358 B9R1.69 O=C1CC(Br)C(=O)CC1 Amb25775016 [0,1,0,1,0,0|1,0,1]=4 15359 B9R1.69 O=C1CC(Br)C(F)CN1 Amb25823142 [0,1,0,1,0,0|2,0,0]=4 15360 B9R1.69 O=C1CC(Cl)C(=O)CC1 Amb24452362 [0,1,0,1,0,0|1,0,1]=4 15361 B9R1.69 OC1CC(=O)CCC1O Amb24384658 [0,1,0,1,0,0|1,0,0]=3 15362 B9R1.69 OC1CCC(C(C1)C)C Amb10844787 [0,1,0,1,0,0|0,0,2]=4 15363 B9R1.69 OC1CNC(=O)CC1O Amb25090826 [0,1,0,1,0,0|2,0,0]=4 15364 B9R1.69 OC1COC(=O)CC1O Amb25057673 [0,1,0,1,0,0|2,0,0]=4 15365 B9R1.69 O[C@@H]1CNC(=O)C[C@@H]1O Amb24517387 [0,1,0,1,0,0|2,0,0]=4 15366 B9R1.69 O[C@H]1CNC(=O)C[C@H]1O Amb25211306 [0,1,0,1,0,0|2,0,0]=4 15367 B9R1.93 CC(=C)C1(C)CC1CO Amb25306505 [0,1,0,1,0,0|2,0,0]=4 15368 B9R1.93 CC(=O)C1(Br)CC1CO Amb24593916 [0,1,0,1,0,0|1,0,0]=3 15369 B9R1.93 CC(=O)C1(C)CC1C=C Amb24454412 [0,1,0,1,0,0|0,0,2]=4 15370 B9R1.93 CC(=O)[C@]1(C)C[C@H]1C=C Amb24511499 [0,1,0,1,0,0|0,0,2]=4 15371 B9R1.93 CC(C)C1(O)CC1CC Amb25256380 [0,1,0,1,0,0|1,0,1]=4 15372 B9R1.93 CC1(CC1CN)C(O)=O Amb24550226 [0,1,0,1,0,0|2,0,0]=4 15373 B9R1.93 CC1(CC1CO)C(O)=O Amb24559345 [0,1,0,1,0,0|2,0,0]=4 15374 B9R1.93 CCC1CC1(C)C(C)=O Amb24443160 [0,1,0,1,0,0|0,0,0]=2 15375 B9R1.93 CCC1CC1(N)C(O)=O Amb24655862 [0,1,0,1,0,0|1,0,0]=3 15376 B9R1.93 CCC1OC1(C)C(C)=O Amb25073390 [0,1,0,1,0,0|1,0,0]=3 15377 B9R1.93 CCC1OC1(C)C(O)=O Amb25843946 [0,1,0,1,0,0|2,0,0]=4 15378 B9R1.93 CC[C@@H]1CC1(N)C(O)=O Amb25104706 [0,1,0,1,0,0|1,0,0]=3 15379 B9R1.93 CC[C@@H]1C[C@@]1(C)C(C)=O Amb24564910 [0,1,0,1,0,0|0,0,0]=2 15380 B9R1.93 CC[C@@H]1C[C@@]1(N)C(O)=O Amb23452849 [0,1,0,1,0,0|1,0,0]=3 15381 B9R1.93 CC[C@@H]1C[C@@]1(O)C(O)=O Amb25377855 [0,1,0,1,0,0|1,0,0]=3 15382 B9R1.93 CC[C@@H]1C[C@]1(N)C(O)=O Amb23452884 [0,1,0,1,0,0|1,0,0]=3 15383 B9R1.93 CC[C@@H]1O[C@@]1(C)C(C)=O Amb24760756 [0,1,0,1,0,0|1,0,0]=3 15384 B9R1.93 C[C@]1(C[C@@H]1CN)C(O)=O Amb25339704 [0,1,0,1,0,0|2,0,0]=4 15385 B9R1.93 NC1(CC1CO)C(O)=O Amb25828351 [0,1,0,1,0,0|2,0,0]=4 15386 B9R1.93 NC[C@@H]1C[C@@]1(N)C(O)=O Amb24763621 [0,1,0,1,0,0|2,0,0]=4 15387 B9R1.93 N[C@@]1(C[C@H]1CO)C(O)=O Amb25101898 [0,1,0,1,0,0|2,0,0]=4 15388 B9R1.93 N[C@]1(C[C@@H]1CO)C(O)=O Amb24581240 [0,1,0,1,0,0|2,0,0]=4 15389 B9R1.93 OC(=O)C1(Cl)CC1CCl Amb24404084 [0,1,0,1,0,0|2,0,0]=4 15390 B9R1.95 CC(=O)C=1CC(CC)C1 Amb24495314 [0,1,0,1,0,0|0,0,1]=3 15391 B9R1.95 CC(=O)N1CC(CCl)C1 Amb25332330 [0,1,0,1,0,0|2,0,0]=4 15392 B9R1.95 CCC1CC(=C1)C(O)=O Amb25238748 [0,1,0,1,0,0|1,0,1]=4 15393 B9R1.95 CCC1CC(C1)C(=O)Cl Amb25791521 [0,1,0,1,0,0|1,0,0]=3 15394 B9R1.95 CCC1CC(C1)C(C)=O Amb25046444 [0,1,0,1,0,0|0,0,0]=2 15395 B9R1.95 CCC1CC(C1)C(N)=O Amb25690385 [0,1,0,1,0,0|1,0,0]=3 15396 B9R1.95 CCC1CC(C1)C(O)=O Amb23456004 [0,1,0,1,0,0|1,0,0]=3 15397 B9R1.95 CCN1CC(C1)C(O)=O Amb24117130 [0,1,0,1,0,0|2,0,0]=4 15398 B9R1.95 CC[C@@H]1C[C@@H](C1)C(O)=O Amb25129624 [0,1,0,1,0,0|1,0,0]=3 15399 B9R1.95 CNC1CC(C1)C(O)=O Amb20622656 [0,1,0,1,0,0|2,0,0]=4 15400 B9R1.95 CNC1CN(C1)C(C)=O Amb23598676 [0,1,0,1,0,0|2,0,0]=4 15401 B9R1.95 COC1CC(C1)C(C)=O Amb24595933 [0,1,0,1,0,0|1,0,0]=3 15402 B9R1.95 CO[C@@H]1C[C@@H](C1)C(O)=O Amb23440276 [0,1,0,1,0,0|2,0,0]=4 15403 B9R1.95 CO[C@@H]1C[C@H](C1)C(O)=O Amb23440277 [0,1,0,1,0,0|2,0,0]=4 15404 B9R1.95 OC(=O)C1CC(CBr)C1 Amb19958667 [0,1,0,1,0,0|2,0,0]=4 15405 B9R1.95 OC(=O)[C@H]1C[C@@H](CBr)C1 Amb25116147 [0,1,0,1,0,0|2,0,0]=4 15406 B9R1.95 OCC1CC(C1)C(O)=O Amb22002175 [0,1,0,1,0,0|2,0,0]=4 15407 B9R1.95 OC[C@@H]1C[C@@H](N1)C(O)=O Amb24556421 [0,1,0,1,0,0|2,0,0]=4 15408 B9R1.100 CC(CCCC)C1CC1 Amb25286937 [0,1,0,1,0,0|1,0,1]=4 15409 B9R1.100 CC(CCCC)C1CO1 Amb25141603 [0,1,0,1,0,0|0,0,2]=4 15410 B9R1.100 CCCC[C@H](O)[C@@H]1CO1 Amb25176377 [0,1,0,1,0,0|0,0,2]=4 15411 B9R1.106 CC1CCC(N)C1(C)C Amb23589636 [0,1,0,1,0,0|1,0,1]=4 15412 B9R1.106 CC1CCC(O)C1(C)O Amb24353595 [0,1,0,1,0,0|0,0,2]=4 15413 B9R1.106 CC1CCC(S1(=O)=O)C Amb2548476 [0,1,0,1,0,0|2,0,0]=4 15414 B9R1.110 CC(=C)C(N)C1CCC1 Amb25726126 [0,1,0,1,0,0|1,0,0]=3 15415 B9R1.110 CC(=O)C(=O)N1CCC1 Amb25173997 [0,1,0,1,0,0|1,0,1]=4 15416 B9R1.110 CC(=O)C(N)C1CCC1 Amb25062195 [0,1,0,1,0,0|0,0,0]=2 15417 B9R1.110 CC(=O)N(C)C1CNC1 Amb21960866 [0,1,0,1,0,0|2,0,0]=4 15418 B9R1.110 CC(C(=O)O)C1CCC1 Amb17087517 [0,1,0,1,0,0|1,0,0]=3 15419 B9R1.110 CC(C(N)=O)N1CCC1 Amb25857238 [0,1,0,1,0,0|2,0,0]=4 15420 B9R1.110 CC(C(O)=O)N1CCC1 Amb24178905 [0,1,0,1,0,0|2,0,0]=4 15421 B9R1.110 CC(C)C(Br)C1CCC1 Amb24437914 [0,1,0,1,0,0|1,0,1]=4 15422 B9R1.110 CC(C)[C@@H](N)C1CCC1 Amb25347793 [0,1,0,1,0,0|1,0,1]=4 15423 B9R1.110 CC(C)[C@H](N)C1CCC1 Amb24477881 [0,1,0,1,0,0|1,0,1]=4 15424 B9R1.110 CC(C1CCC1)C(C)Br Amb24694430 [0,1,0,1,0,0|1,0,1]=4 15425 B9R1.110 CC(C1CCC1)C(C)N Amb25079483 [0,1,0,1,0,0|1,0,1]=4 15426 B9R1.110 CC(C1CCC1)C(C)O Amb24481851 [0,1,0,1,0,0|0,0,2]=4 15427 B9R1.110 CC(C1CCC1)C(N)=N Amb23590267 [0,1,0,1,0,0|2,0,0]=4 15428 B9R1.110 CC(C1CNC1)C(C)=O Amb24673466 [0,1,0,1,0,0|1,0,0]=3 15429 B9R1.110 CC(C1CSC1)C(O)=O Amb25200790 [0,1,0,1,0,0|2,0,0]=4 15430 B9R1.110 C[C@@H](C1CCC1)C(O)=O Amb22748271 [0,1,0,1,0,0|1,0,0]=3 15431 B9R1.110 C[C@@H](O)[C@@H](N)C1CCC1 Amb24514875 [0,1,0,1,0,0|0,0,2]=4 15432 B9R1.110 C[C@H](C1CCC1)C(O)=O Amb24360449 [0,1,0,1,0,0|1,0,0]=3 15433 B9R1.110 C[C@H](O)[C@H](N)C1CCC1 Amb25245251 [0,1,0,1,0,0|0,0,2]=4 15434 B9R1.110 NC(C1CCC1)C(O)=O Amb19149365 [0,1,0,1,0,0|1,0,0]=3 15435 B9R1.110 NC(C1CCC1)C(O)=O Amb21858491 [0,1,0,1,0,0|1,0,0]=3 15436 B9R1.110 NC(C1CCC1)P(O)=O Amb25721258 [0,1,0,1,0,0|2,0,0]=4 15437 B9R1.110 NC(C1CCO1)C(N)=O Amb25364480 [0,1,0,1,0,0|2,0,0]=4 15438 B9R1.110 NC(C1COC1)C(O)=O Amb22405987 [0,1,0,1,0,0|2,0,0]=4 15439 B9R1.110 NC(C1CSC1)C(N)=O Amb25287406 [0,1,0,1,0,0|2,0,0]=4 15440 B9R1.110 N[C@@H](C1CCC1)C(N)=O Amb24476623 [0,1,0,1,0,0|1,0,0]=3 15441 B9R1.110 N[C@@H](C1COC1)C(O)=O Amb22737551 [0,1,0,1,0,0|2,0,0]=4 15442 B9R1.110 N[C@H](C1COC1)C(O)=O Amb22737550 [0,1,0,1,0,0|2,0,0]=4 15443 B9R1.110 O=C(Cl)C(Br)C1CCC1 Amb24598080 [0,1,0,1,0,0|1,0,0]=3 15444 B9R1.110 O=C(Cl)C(Cl)C1CCC1 Amb25362548 [0,1,0,1,0,0|1,0,0]=3 15445 B9R1.110 OC(=O)C(=O)C1CCC1 Amb19958875 [0,1,0,1,0,0|1,0,1]=4 15446 B9R1.110 OC(=O)C(F)C1CNC1 Amb25110697 [0,1,0,1,0,0|2,0,0]=4 15447 B9R1.110 OC(C1CCC1)C(O)=O Amb24426901 [0,1,0,1,0,0|1,0,0]=3 15448 B9R1.110 OC(C1CNC1)C(O)=O Amb24339989 [0,1,0,1,0,0|2,0,0]=4 15449 B9R1.110 OC(C1CSC1)C(O)=O Amb24759238 [0,1,0,1,0,0|2,0,0]=4 15450 B9R1.112 C=C(CC1CC1)C(O)=O Amb24700361 [0,1,0,1,0,0|1,0,1]=4 15451 B9R1.112 CC(=C)C(=O)CC1CC1 Amb24586261 [0,1,0,1,0,0|1,0,1]=4 15452 B9R1.112 CC(=C)C(O)CC1CC1 Amb25313698 [0,1,0,1,0,0|1,0,0]=3 15453 B9R1.112 CC(=CC1CC1)C(C)=O Amb25327173 [0,1,0,1,0,0|0,0,2]=4 15454 B9R1.112 CC(=N)N(C)CC1CC1 Amb25055961 [0,1,0,1,0,0|2,0,0]=4 15455 B9R1.112 CC(=O)C(C)C=C1CC1 Amb25053035 [0,1,0,1,0,0|0,0,2]=4 15456 B9R1.112 CC(=O)N(C)CC1CC1 Amb25060737 [0,1,0,1,0,0|1,0,0]=3 15457 B9R1.112 CC(C)C(Cl)CC1CC1 Amb25853089 [0,1,0,1,0,0|1,0,1]=4 15458 B9R1.112 CC(C)C(N)CC1CC1 Amb18832659 [0,1,0,1,0,0|1,0,1]=4 15459 B9R1.112 CC(C)C(O)CC1CC1 Amb25147206 [0,1,0,1,0,0|1,0,1]=4 15460 B9R1.112 CC(C)[C@@H](N)CC1CC1 Amb24477894 [0,1,0,1,0,0|1,0,1]=4 15461 B9R1.112 CC(CC1CC1)C(C)=O Amb25188950 [0,1,0,1,0,0|0,0,0]=2 15462 B9R1.112 CC(CC1CC1)C(C)Br Amb25076324 [0,1,0,1,0,0|1,0,1]=4 15463 B9R1.112 CC(CC1CC1)C(C)Cl Amb24481751 [0,1,0,1,0,0|1,0,1]=4 15464 B9R1.112 CC(CC1CC1)C(C)O Amb24429505 [0,1,0,1,0,0|0,0,2]=4 15465 B9R1.112 CC(NC1CC1)C(C)=O Amb25119978 [0,1,0,1,0,0|1,0,0]=3 15466 B9R1.112 CC(SC1CC1)C(O)=O Amb25337757 [0,1,0,1,0,0|2,0,0]=4 15467 B9R1.112 C[C@@H](NC1CC1)C(O)=O Amb24398132 [0,1,0,1,0,0|2,0,0]=4 15468 B9R1.112 NC(CC1CC1)C(N)=O Amb25767604 [0,1,0,1,0,0|1,0,0]=3 15469 B9R1.112 NC(CC1CC1)C(O)=O Amb23399727 [0,1,0,1,0,0|1,0,0]=3 15470 B9R1.112 NC(CC1CO1)C(O)=O Amb25800055 [0,1,0,1,0,0|2,0,0]=4 15471 B9R1.112 N[C@@H](CC1CC1)C(N)=O Amb25317927 [0,1,0,1,0,0|1,0,0]=3 15472 B9R1.112 N[C@@H](CC1CC1)C(O)=O Amb24329024 [0,1,0,1,0,0|1,0,0]=3 15473 B9R1.112 N[C@@H](CC1CO1)C(O)=O Amb25709170 [0,1,0,1,0,0|2,0,0]=4 15474 B9R1.112 N[C@H](CC1CC1)C(N)=O Amb24410138 [0,1,0,1,0,0|1,0,0]=3 15475 B9R1.112 O=C(C(=O)C)NC1CC1 Amb17399817 [0,1,0,1,0,0|1,0,1]=4 15476 B9R1.112 OC(=O)C(=O)CC1CC1 Amb18988329 [0,1,0,1,0,0|1,0,1]=4 15477 B9R1.112 OC(=O)C(S)CC1CC1 Amb18296302 [0,1,0,1,0,0|1,0,0]=3 15478 B9R1.112 OC(=O)[C@H](Br)CC1CC1 Amb24480301 [0,1,0,1,0,0|1,0,0]=3 15479 B9R1.112 OC(CC1CC1)C(O)=O Amb25082516 [0,1,0,1,0,0|1,0,0]=3 15480 B9R1.112 O[C@@H](CC1CC1)C(O)=O Amb23401512 [0,1,0,1,0,0|1,0,0]=3 15481 B9R1.159 CC(=O)C1(C)CCC1=O Amb25050231 [0,1,0,1,0,0|1,0,1]=4 15482 B9R1.159 CC(C)C1(O)CCC1C Amb25285882 [0,1,0,1,0,0|1,0,1]=4 15483 B9R1.159 CC1CCC1(N)C(N)=O Amb24391671 [0,1,0,1,0,0|1,0,0]=3 15484 B9R1.159 CC1CCC1(N)C(O)=O Amb23456072 [0,1,0,1,0,0|1,0,0]=3 15485 B9R1.159 C[C@@H]1CC[C@]1(N)C(O)=O Amb24586126 [0,1,0,1,0,0|1,0,0]=3 15486 B9R1.159 C[C@H]1CC[C@@]1(C)C(O)=O Amb24575030 [0,1,0,1,0,0|1,0,0]=3 15487 B9R1.159 NC1(CCC1F)C(O)=O Amb25223441 [0,1,0,1,0,0|2,0,0]=4 15488 B9R1.159 N[C@@H]1CC[C@]1(N)C(O)=O Amb25233319 [0,1,0,1,0,0|2,0,0]=4 15489 B9R1.159 N[C@@]1(CC[C@H]1O)C(O)=O Amb25313173 [0,1,0,1,0,0|2,0,0]=4 15490 B9R1.159 OC1CCC1(O)C(O)=O Amb24477886 [0,1,0,1,0,0|2,0,0]=4 15491 B9R1.163 CC(=C)C1(C)CCCN1 Amb25304722 [0,1,0,1,0,0|2,0,0]=4 15492 B9R1.163 CC(=C)C1(O)CNCC1 Amb24638502 [0,1,0,1,0,0|2,0,0]=4 15493 B9R1.163 CC(=C)C1(O)CSCC1 Amb25188959 [0,1,0,1,0,0|2,0,0]=4 15494 B9R1.163 CC(=O)C1(C)CCCC1 Amb17593318 [0,1,0,1,0,0|0,0,0]=2 15495 B9R1.163 CC(=O)C1(C)CCCN1 Amb25789427 [0,1,0,1,0,0|1,0,0]=3 15496 B9R1.163 CC(=O)C1(C)CCCO1 Amb24332633 [0,1,0,1,0,0|1,0,0]=3 15497 B9R1.163 CC(=O)C1(C)CCCS1 Amb25188952 [0,1,0,1,0,0|1,0,0]=3 15498 B9R1.163 CC(=O)C1(C)CNCC1 Amb25698020 [0,1,0,1,0,0|1,0,0]=3 15499 B9R1.163 CC(=O)C1(C)NCCS1 Amb24105966 [0,1,0,1,0,0|2,0,0]=4 15500 B9R1.163 CC(=O)C1(C)OCCS1 Amb25188965 [0,1,0,1,0,0|2,0,0]=4 15501 B9R1.163 CC(=O)C1(N)CCCC1 Amb1091405 [0,1,0,1,0,0|0,0,0]=2 15502 B9R1.163 CC(=O)C1(N)CCCC1 Amb22283948 [0,1,0,1,0,0|0,0,0]=2 15503 B9R1.163 CC(=O)C1(N)COCC1 Amb24427660 [0,1,0,1,0,0|1,0,0]=3 15504 B9R1.163 CC(=O)C1(O)CCC=C1 Amb25773397 [0,1,0,1,0,0|0,0,2]=4 15505 B9R1.163 CC(=O)C1(O)CCCC1 Amb17593345 [0,1,0,1,0,0|0,0,0]=2 15506 B9R1.163 CC(=O)[C@@]1(C)CCN=N1 Amb25713607 [0,1,0,1,0,0|2,0,0]=4 15507 B9R1.163 CC(Br)C1(O)CCCC1 Amb25275216 [0,1,0,1,0,0|1,0,1]=4 15508 B9R1.163 CC(N)C1(C)CCCC1 Amb24587997 [0,1,0,1,0,0|1,0,1]=4 15509 B9R1.163 CC(N)C1(O)CCCC1 Amb25145994 [0,1,0,1,0,0|1,0,1]=4 15510 B9R1.163 CC(O)C1(N)CCCC1 Amb18832559 [0,1,0,1,0,0|0,0,2]=4 15511 B9R1.163 CC(O)C1(O)CCCC1 Amb25370976 [0,1,0,1,0,0|0,0,2]=4 15512 B9R1.163 CC1(CCCC1)C(=O)Cl Amb24476587 [0,1,0,1,0,0|1,0,0]=3 15513 B9R1.163 CC1(CCCN1)C(N)=O Amb20061427 [0,1,0,1,0,0|2,0,0]=4 15514 B9R1.163 CC1(CCCN1)C(N)=O Amb21960323 [0,1,0,1,0,0|2,0,0]=4 15515 B9R1.163 CC1(CCCN1)C(O)=O Amb22587331 [0,1,0,1,0,0|2,0,0]=4 15516 B9R1.163 CC1(CCCO1)C(N)=O Amb25313257 [0,1,0,1,0,0|2,0,0]=4 15517 B9R1.163 CC1(CCCS1)C(O)=O Amb20623191 [0,1,0,1,0,0|2,0,0]=4 15518 B9R1.163 CC1(CNCC1)C(O)=O Amb20634439 [0,1,0,1,0,0|2,0,0]=4 15519 B9R1.163 CC1(COCC1)C(N)=O Amb25821700 [0,1,0,1,0,0|2,0,0]=4 15520 B9R1.163 CC1(COCC1)C(O)=O Amb18280535 [0,1,0,1,0,0|2,0,0]=4 15521 B9R1.163 C[C@@]1(CCCN1)C(N)=O Amb25146194 [0,1,0,1,0,0|2,0,0]=4 15522 B9R1.163 C[C@@]1(CCCN1)C(O)=O Amb22406107 [0,1,0,1,0,0|2,0,0]=4 15523 B9R1.163 C[C@@]1(CCCO1)C(O)=O Amb24117235 [0,1,0,1,0,0|2,0,0]=4 15524 B9R1.163 C[C@H](N)C1(O)CCCC1 Amb25230607 [0,1,0,1,0,0|1,0,1]=4 15525 B9R1.163 C[C@H](O)C1(C)CCCC1 Amb24335527 [0,1,0,1,0,0|0,0,2]=4 15526 B9R1.163 C[C@]1(CCCN1)C(N)=O Amb24410858 [0,1,0,1,0,0|2,0,0]=4 15527 B9R1.163 C[C@]1(CCCN1)C(O)=O Amb22405952 [0,1,0,1,0,0|2,0,0]=4 15528 B9R1.163 C[C@]1(CNCC1)C(O)=O Amb24346794 [0,1,0,1,0,0|2,0,0]=4 15529 B9R1.163 NC(=N)C1(N)CCCC1 Amb25260496 [0,1,0,1,0,0|2,0,0]=4 15530 B9R1.163 NC(=O)C1(F)CNCC1 Amb24759688 [0,1,0,1,0,0|2,0,0]=4 15531 B9R1.163 NC(=O)C1(F)COCC1 Amb24705109 [0,1,0,1,0,0|2,0,0]=4 15532 B9R1.163 NC(=O)C1(N)CCCC1 Amb19265774 [0,1,0,1,0,0|1,0,0]=3 15533 B9R1.163 NC(=O)C1(N)COCC1 Amb25835775 [0,1,0,1,0,0|2,0,0]=4 15534 B9R1.163 NC(=O)C1(N)CSCC1 Amb18279185 [0,1,0,1,0,0|2,0,0]=4 15535 B9R1.163 NC(=O)C1(O)CCCC1 Amb24116816 [0,1,0,1,0,0|1,0,0]=3 15536 B9R1.163 NC(=O)C1(O)CNCC1 Amb23515119 [0,1,0,1,0,0|2,0,0]=4 15537 B9R1.163 NC(=O)C1(O)COCC1 Amb25325741 [0,1,0,1,0,0|2,0,0]=4 15538 B9R1.163 NC(=O)C1(O)CSCC1 Amb24116837 [0,1,0,1,0,0|2,0,0]=4 15539 B9R1.163 NC(=S)C1(N)CCCC1 Amb19374908 [0,1,0,1,0,0|1,1,0]=4 15540 B9R1.163 NC1(CCCC1)P(O)=O Amb24561449 [0,1,0,1,0,0|2,0,0]=4 15541 B9R1.163 NC1(CNCC1)C(O)=O Amb22490624 [0,1,0,1,0,0|2,0,0]=4 15542 B9R1.163 NC1(COCC1)C(O)=O Amb22274600 [0,1,0,1,0,0|2,0,0]=4 15543 B9R1.163 NC1(CSCC1)C(O)=O Amb22274058 [0,1,0,1,0,0|2,0,0]=4 15544 B9R1.163 N[C@@]1(COCC1)C(O)=O Amb20241211 [0,1,0,1,0,0|2,0,0]=4 15545 B9R1.163 N[C@]1(COCC1)C(O)=O Amb20241209 [0,1,0,1,0,0|2,0,0]=4 15546 B9R1.163 N[C@]1(CSCC1)C(O)=O Amb24476636 [0,1,0,1,0,0|2,0,0]=4 15547 B9R1.163 O=C(Cl)C1(Cl)CCCC1 Amb25106802 [0,1,0,1,0,0|1,0,0]=3 15548 B9R1.163 OC(=O)C1(Br)CCCC1 Amb17595053 [0,1,0,1,0,0|1,0,0]=3 15549 B9R1.163 OC(=O)C1(C)CCCN1 Amb15701407 [0,1,0,1,0,0|2,0,0]=4 15550 B9R1.163 OC(=O)C1(C)CCCO1 Amb1088877 [0,1,0,1,0,0|2,0,0]=4 15551 B9R1.163 OC(=O)C1(F)CNCC1 Amb24120613 [0,1,0,1,0,0|2,0,0]=4 15552 B9R1.163 OC(=O)C1(F)COCC1 Amb24420228 [0,1,0,1,0,0|2,0,0]=4 15553 B9R1.163 OC(=O)C1(F)CSCC1 Amb24541152 [0,1,0,1,0,0|2,0,0]=4 15554 B9R1.163 OC(=O)C1(N)CCCC1 Amb1838882 [0,1,0,1,0,0|1,0,0]=3 15555 B9R1.163 OC(=O)C1(N)COCC1 Amb16232669 [0,1,0,1,0,0|2,0,0]=4 15556 B9R1.163 OC(=O)C1(O)CCCC1 Amb1159211 [0,1,0,1,0,0|1,0,0]=3 15557 B9R1.163 OC(=O)C1(O)CNCC1 Amb22500918 [0,1,0,1,0,0|2,0,0]=4 15558 B9R1.163 OC(=O)C1(O)CNCC1 Amb22899772 [0,1,0,1,0,0|2,0,0]=4 15559 B9R1.163 OC(=O)C1(O)CSCC1 Amb18944714 [0,1,0,1,0,0|2,0,0]=4 15560 B9R1.163 OC(=O)[C@@]1(F)CCCN1 Amb22748241 [0,1,0,1,0,0|2,0,0]=4 15561 B9R1.163 OC(=O)[C@]1(C)CCCN1 Amb10603262 [0,1,0,1,0,0|2,0,0]=4 15562 B9R1.163 OC(=O)[C@]1(O)COCC1 Amb24389865 [0,1,0,1,0,0|2,0,0]=4 15563 B9R1.163 [2H]C1(CCCN1)C(O)=O Amb22367354 [0,1,0,1,0,0|2,0,0]=4 15564 B9R1.163 [NH3+]C1(CNCC1)C([O-])=O Amb22231944 [0,1,0,1,0,0|2,0,0]=4 15565 B9R1.163 [NH3+]C1(C[NH2+]CC1)C(O)=O Amb22583868 [0,1,0,1,0,0|2,0,0]=4 15566 B9R1.191 CC1(CCCO)CC1=C Amb25080051 [0,1,0,1,0,0|2,0,0]=4 15567 B9R1.191 CCCCC1(C)CC1N Amb25026339 [0,1,0,1,0,0|1,0,1]=4 15568 B9R1.191 CCCCC1(N)CC1C Amb24464185 [0,1,0,1,0,0|1,0,1]=4 15569 B9R1.191 CCCCC1(O)CC1C Amb25691921 [0,1,0,1,0,0|1,0,1]=4 15570 B9R1.10 CC1(C)CCC(Cl)CC1 Amb25793589 [0,1,0,1,0,0|1,0,1]=4 15571 B9R1.10 CC1(C)CCC(N)CC1 Amb19334953 [0,1,0,1,0,0|1,0,1]=4 15572 B9R1.10 CC1(C)CCC(N)CC1 Amb20241201 [0,1,0,1,0,0|1,0,1]=4 15573 B9R1.10 CC1(F)CCC(N)CC1 Amb25829401 [0,1,0,1,0,0|1,0,1]=4 15574 B9R1.10 CC1(I)CCC(I)CC1 Amb25722119 [0,1,0,1,0,0|1,0,1]=4 15575 B9R1.10 CC1(N)CCC(F)CC1 Amb23456112 [0,1,0,1,0,0|1,0,1]=4 15576 B9R1.10 CC1(N)CCC(O)CC1 Amb23589778 [0,1,0,1,0,0|1,0,1]=4 15577 B9R1.10 CC1(O)CCC(Cl)CC1 Amb25764391 [0,1,0,1,0,0|0,0,2]=4 15578 B9R1.10 CC1(O)CCC(F)CC1 Amb25201884 [0,1,0,1,0,0|0,0,2]=4 15579 B9R1.10 CC1(O)CCC(N)CC1 Amb20624019 [0,1,0,1,0,0|0,0,2]=4 15580 B9R1.10 CC1(O)CCC(N)CC1 Amb22755958 [0,1,0,1,0,0|0,0,2]=4 15581 B9R1.10 CC1(O)CCC(O)CC1 Amb25674827 [0,1,0,1,0,0|0,0,2]=4 15582 B9R1.10 CC1CCC(C)(C)CC1 Amb22227677 [0,1,0,1,0,0|1,0,1]=4 15583 B9R1.10 CC1CCC(C)(Cl)CC1 Amb25301789 [0,1,0,1,0,0|1,0,1]=4 15584 B9R1.10 CC1CCC(CC1)(C)N Amb13952177 [0,1,0,1,0,0|1,0,1]=4 15585 B9R1.10 C[C@@H]1CC[C@](C)(O)CC1 Amb24593240 [0,1,0,1,0,0|0,0,2]=4 15586 B9R1.10 C[C@@]1(N)CC[C@@H](O)CC1 Amb23440251 [0,1,0,1,0,0|1,0,1]=4 15587 B9R1.10 C[C@@]1(N)CC[C@H](O)CC1 Amb23440250 [0,1,0,1,0,0|1,0,1]=4 15588 B9R1.10 C[C@@]1(O)CC[C@@H](Cl)CC1 Amb24634123 [0,1,0,1,0,0|0,0,2]=4 15589 B9R1.10 C[C@@]1(O)CC[C@@H](N)CC1 Amb22886178 [0,1,0,1,0,0|0,0,2]=4 15590 B9R1.10 C[C@@]1(O)CC[C@H](N)CC1 Amb22746430 [0,1,0,1,0,0|0,0,2]=4 15591 B9R1.10 C[C@]1(N)CC[C@@H](O)CC1 Amb24645739 [0,1,0,1,0,0|1,0,1]=4 15592 B9R1.10 C[C@]1(O)CC[C@@H](Cl)CC1 Amb24726842 [0,1,0,1,0,0|0,0,2]=4 15593 B9R1.10 C[C@]1(O)CC[C@@H](O)CC1 Amb24643905 [0,1,0,1,0,0|0,0,2]=4 15594 B9R1.10 C[N+]1(C)CCC(O)CC1 Amb24117819 [0,1,0,1,0,0|2,0,0]=4 15595 B9R1.10 C[Si]1(C)CCC(O)CC1 Amb25689164 [0,1,0,1,0,0|1,1,0]=4 15596 B9R1.10 O=S1(=O)CCC(Br)CC1 Amb20667734 [0,1,0,1,0,0|2,0,0]=4 15597 B9R1.10 O=S1(=O)CCC(Cl)CC1 Amb18180187 [0,1,0,1,0,0|2,0,0]=4 15598 B9R1.10 O=S1(=O)CCC(I)CC1 Amb20668982 [0,1,0,1,0,0|2,0,0]=4 15599 B9R1.10 O=S1(=O)CCC(S)CC1 Amb18792731 [0,1,0,1,0,0|2,0,0]=4 15600 B9R1.10 OC1CCS(=O)(=O)CC1 Amb10608457 [0,1,0,1,0,0|2,0,0]=4 15601 B9R1.55 CC(=O)C1=C[C@@H](C)[C@H]1C Amb24722820 [0,1,0,1,0,0|0,0,2]=4 15602 B9R1.55 CC(=O)C1CC(Cl)C1Cl Amb25689885 [0,1,0,1,0,0|1,0,0]=3 15603 B9R1.55 CC(=O)[C@@H]1C[C@@H](Cl)[C@@H]1Cl Amb24552931 [0,1,0,1,0,0|1,0,0]=3 15604 B9R1.55 CC1C(CC1C)C(C)=O Amb24476715 [0,1,0,1,0,0|0,0,0]=2 15605 B9R1.55 CC1C(CC1C)C(C)Cl Amb24677386 [0,1,0,1,0,0|1,0,1]=4 15606 B9R1.55 CC1C(CC1C)C(C)N Amb24549218 [0,1,0,1,0,0|1,0,1]=4 15607 B9R1.55 CC1C(CC1C)C(O)=O Amb23456159 [0,1,0,1,0,0|1,0,0]=3 15608 B9R1.55 C[C@@H]1C[C@@H](C(=O)Cl)N1C Amb25336470 [0,1,0,1,0,0|2,0,0]=4 15609 B9R1.55 C[C@@H]1C[C@@H](C(O)=O)N1C Amb24683087 [0,1,0,1,0,0|2,0,0]=4 15610 B9R1.55 C[C@H]1[C@@H](C[C@H]1C)C(O)=O Amb24745807 [0,1,0,1,0,0|1,0,0]=3 15611 B9R1.55 C[C@H]1[C@H](C[C@@H]1C)C(O)=O Amb24629706 [0,1,0,1,0,0|1,0,0]=3 15612 B9R1.55 N[C@@H]1[C@H](C[C@@H]1O)C(O)=O Amb24514844 [0,1,0,1,0,0|2,0,0]=4 15613 B9R1.82 CC(CC)C1CC(N)C1 Amb24439574 [0,1,0,1,0,0|1,0,1]=4 15614 B9R1.82 CC(CO)C1CC(=O)N1 Amb24598373 [0,1,0,1,0,0|2,0,0]=4 15615 B9R1.82 CC1CC(C1)C(Br)CC Amb24532900 [0,1,0,1,0,0|1,0,1]=4 15616 B9R1.82 CC1CC(C1)C(Cl)CC Amb24405704 [0,1,0,1,0,0|1,0,1]=4 15617 B9R1.82 CC1CC(C1)C(O)CC Amb23590269 [0,1,0,1,0,0|1,0,1]=4 15618 B9R1.82 CCC(=O)N1CC(=O)C1 Amb25357455 [0,1,0,1,0,0|1,0,1]=4 15619 B9R1.82 CCC(Cl)C1CC(=O)O1 Amb24433017 [0,1,0,1,0,0|1,0,0]=3 15620 B9R1.82 CCC(N)C1CN(C)C1 Amb25178792 [0,1,0,1,0,0|2,0,0]=4 15621 B9R1.82 CCC(O)C1CC(=O)O1 Amb24420833 [0,1,0,1,0,0|1,0,0]=3 15622 B9R1.82 CCS(=O)C1CC(=O)N1 Amb25709576 [0,1,0,1,0,0|2,0,0]=4 15623 B9R1.82 CNC(=O)C1CC(=O)C1 Amb23512862 [0,1,0,1,0,0|1,0,1]=4 15624 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,1,0,1,0,0|1,0,1]=4 15625 B9R1.82 C[C@@H](CO)[C@H]1CC(=O)O1 Amb24675614 [0,1,0,1,0,0|2,0,0]=4 15626 B9R1.82 C[C@H](CO)[C@@H]1CC(=O)N1 Amb24517111 [0,1,0,1,0,0|2,0,0]=4 15627 B9R1.82 NC(CO)C1CC(=O)N1 Amb24573644 [0,1,0,1,0,0|2,0,0]=4 15628 B9R1.121 CC1(C)CCC1(O)CC Amb24689751 [0,1,0,1,0,0|1,0,1]=4 15629 B9R1.125 CC1(CC(=O)CC1)C#N Amb24722939 [0,1,0,1,0,0|1,0,1]=4 15630 B9R1.125 CC1(CC(=O)CC1)C=C Amb25718906 [0,1,0,1,0,0|0,0,2]=4 15631 B9R1.125 CC1(CCl)CNC(=O)C1 Amb24384917 [0,1,0,1,0,0|2,0,0]=4 15632 B9R1.125 CC1(CN)CCC(=O)N1 Amb25253003 [0,1,0,1,0,0|2,0,0]=4 15633 B9R1.125 CC1(CN)CNC(=O)C1 Amb24677517 [0,1,0,1,0,0|2,0,0]=4 15634 B9R1.125 CC1(CO)CCC(=O)N1 Amb25796503 [0,1,0,1,0,0|2,0,0]=4 15635 B9R1.125 CC1(CO)CCC(=O)O1 Amb24424055 [0,1,0,1,0,0|2,0,0]=4 15636 B9R1.125 CC1(CO)CNC(=O)C1 Amb22546426 [0,1,0,1,0,0|2,0,0]=4 15637 B9R1.125 CC1(CO)COC(=O)C1 Amb24748377 [0,1,0,1,0,0|2,0,0]=4 15638 B9R1.125 CCC1(C)CC(=O)CC1 Amb24706768 [0,1,0,1,0,0|0,0,0]=2 15639 B9R1.125 CCC1(C)CC(N)CC1 Amb25222348 [0,1,0,1,0,0|1,0,1]=4 15640 B9R1.125 CCC1(C)CC(O)CC1 Amb25109111 [0,1,0,1,0,0|0,0,2]=4 15641 B9R1.125 CCC1(C)CNC(=O)C1 Amb24655544 [0,1,0,1,0,0|1,0,0]=3 15642 B9R1.125 CCC1(C)CNC(=O)O1 Amb25228455 [0,1,0,1,0,0|2,0,0]=4 15643 B9R1.125 CCC1(C)COC(=S)C1 Amb25300753 [0,1,0,1,0,0|1,1,0]=4 15644 B9R1.125 CCC1(C)CSC(=S)C1 Amb24481780 [0,1,0,1,0,0|1,1,0]=4 15645 B9R1.125 CCC1(C)N=C(C)CS1 Amb24394922 [0,1,0,1,0,0|2,0,0]=4 15646 B9R1.125 CCC1(C)NC(=O)CS1 Amb24452202 [0,1,0,1,0,0|2,0,0]=4 15647 B9R1.125 CCC1(O)CC(C)CC1 Amb25132617 [0,1,0,1,0,0|1,0,1]=4 15648 B9R1.125 CCC1(O)CN(C)CC1 Amb25272053 [0,1,0,1,0,0|2,0,0]=4 15649 B9R1.125 CC[C@@]1(C)CCC(=O)N1 Amb24356520 [0,1,0,1,0,0|1,0,0]=3 15650 B9R1.125 CC[C@@]1(C)COC(=O)N1 Amb24587770 [0,1,0,1,0,0|2,0,0]=4 15651 B9R1.125 CC[C@]1(C)CC(=O)CC1 Amb25706157 [0,1,0,1,0,0|0,0,0]=2 15652 B9R1.125 CC[C@]1(C)COC(=O)N1 Amb25253542 [0,1,0,1,0,0|2,0,0]=4 15653 B9R1.125 C[C@@]1(CBr)CCC(=O)O1 Amb24480303 [0,1,0,1,0,0|2,0,0]=4 15654 B9R1.125 C[C@]1(CBr)CCC(=O)O1 Amb24425525 [0,1,0,1,0,0|2,0,0]=4 15655 B9R1.125 OCC1(O)COC(=O)C1 Amb25271493 [0,1,0,1,0,0|2,0,0]=4 15656 B9R1.127 CC(=O)C1CC1(C)CCl Amb25141665 [0,1,0,1,0,0|1,0,0]=3 15657 B9R1.127 CC(=O)C1CC1(Cl)C=C Amb25320101 [0,1,0,1,0,0|0,0,2]=4 15658 B9R1.127 CC(=O)C1OC1(C)CCl Amb24670937 [0,1,0,1,0,0|2,0,0]=4 15659 B9R1.127 CC(=O)C1OC1(C)CO Amb24662478 [0,1,0,1,0,0|2,0,0]=4 15660 B9R1.127 CC(C)C1CC1(N)CC Amb24666864 [0,1,0,1,0,0|1,0,1]=4 15661 B9R1.127 CC(N)C1CC1(C)CC Amb24615986 [0,1,0,1,0,0|1,0,1]=4 15662 B9R1.127 CC1(CC1C(O)=O)CO Amb24529046 [0,1,0,1,0,0|2,0,0]=4 15663 B9R1.127 CCC1(C)CC1C(N)=O Amb24377068 [0,1,0,1,0,0|1,0,0]=3 15664 B9R1.127 CCC1(C)CC1C(O)=O Amb18285802 [0,1,0,1,0,0|1,0,0]=3 15665 B9R1.127 C[C@@]1(CN)C[C@H]1C(O)=O Amb24517240 [0,1,0,1,0,0|2,0,0]=4 15666 B9R1.127 OC[C@@]1(Cl)C[C@H]1C(O)=O Amb24511974 [0,1,0,1,0,0|2,0,0]=4 15667 B9R1.127 OC[C@]1(Cl)C[C@H]1C(O)=O Amb25201489 [0,1,0,1,0,0|2,0,0]=4 15668 B9R1.133 CCC1CC(C)(N)CC1 Amb24623045 [0,1,0,1,0,0|1,0,1]=4 15669 B9R1.133 CCC1CC(C)(O)CC1 Amb25147188 [0,1,0,1,0,0|0,0,2]=4 15670 B9R1.133 CCC1CCS(=O)(=O)O1 Amb25174070 [0,1,0,1,0,0|2,0,0]=4 15671 B9R1.133 CNC1CCS(=O)(=O)C1 Amb1152562 [0,1,0,1,0,0|2,0,0]=4 15672 B9R1.133 CNC1CCS(=O)(=O)C1 Amb1290363 [0,1,0,1,0,0|2,0,0]=4 15673 B9R1.133 CNC1CC[S+](=O)(C1)[O-] Amb10237058 [0,1,0,1,0,0|2,0,0]=4 15674 B9R1.133 CSC1CCS(=O)(=O)C1 Amb2548452 [0,1,0,1,0,0|2,0,0]=4 15675 B9R1.133 ClCC1CC[S+](=O)(C1)[O-] Amb10238774 [0,1,0,1,0,0|2,0,0]=4 15676 B9R1.133 NCC1CS(=O)(=O)CC1 Amb19204939 [0,1,0,1,0,0|2,0,0]=4 15677 B9R1.133 O=S1(=O)CC(CBr)CC1 Amb25321623 [0,1,0,1,0,0|2,0,0]=4 15678 B9R1.133 O=S1(=O)CC(CS)CC1 Amb18062508 [0,1,0,1,0,0|2,0,0]=4 15679 B9R1.133 OCC1CCS(=O)(=O)C1 Amb2548453 [0,1,0,1,0,0|2,0,0]=4 15680 B9R1.138 CC1C(Br)CCC1(C)C Amb25066678 [0,1,0,1,0,0|1,0,1]=4 15681 B9R1.138 CC1C(Br)CCS1(=O)=O Amb24416488 [0,1,0,1,0,0|2,0,0]=4 15682 B9R1.138 CC1C(N)CCC1(C)C Amb24585686 [0,1,0,1,0,0|1,0,1]=4 15683 B9R1.138 C[C@@H]1[C@@H](N)CCS1(=O)=O Amb24560825 [0,1,0,1,0,0|2,0,0]=4 15684 B9R1.147 CC(=N)NCC1(C)CC1 Amb24404061 [0,1,0,1,0,0|2,0,0]=4 15685 B9R1.147 CC(=O)CCC1(O)CC1 Amb25278414 [0,1,0,1,0,0|0,0,0]=2 15686 B9R1.147 CC(C)CCC1(N)CC1 Amb18523798 [0,1,0,1,0,0|1,0,1]=4 15687 B9R1.147 CC(C)CCC1(O)CC1 Amb24642189 [0,1,0,1,0,0|1,0,1]=4 15688 B9R1.147 CC1(CNC(N)=O)CC1 Amb24733644 [0,1,0,1,0,0|2,0,0]=4 15689 B9R1.147 CN(C)CCC1(N)CC1 Amb18203237 [0,1,0,1,0,0|2,0,0]=4 15690 B9R1.147 CN(C)CCC1(O)CC1 Amb24615987 [0,1,0,1,0,0|2,0,0]=4 15691 B9R1.147 NC(=O)CCC1(N)CC1 Amb24756880 [0,1,0,1,0,0|1,0,0]=3 15692 B9R1.147 NC1(CCC(O)=O)CC1 Amb18832570 [0,1,0,1,0,0|1,0,0]=3 15693 B9R1.147 NC1(CCS(=O)=O)CC1 Amb25212533 [0,1,0,1,0,0|2,0,0]=4 15694 B9R1.185 CCC(Br)C1CC1(C)C Amb24547979 [0,1,0,1,0,0|1,0,1]=4 15695 B9R1.185 CC[C@@H](N)C1CC1(C)C Amb24717390 [0,1,0,1,0,0|1,0,1]=4 15696 B9R1.185 CC[C@H](N)C1CC1(C)C Amb25126483 [0,1,0,1,0,0|1,0,1]=4 15697 B9R1.185 CC[C@H](O)C1CC1(C)C Amb25849671 [0,1,0,1,0,0|1,0,1]=4 15698 B9R1.19 CC(N)(F)C1CCCC1 Amb25320358 [0,1,0,1,0,0|1,0,1]=4 15699 B9R1.19 CS(=O)(=O)C1CCCC1 Amb25229798 [0,1,0,1,0,0|1,0,0]=3 15700 B9R1.19 CS(=O)(=O)C1CNCC1 Amb21963335 [0,1,0,1,0,0|2,0,0]=4 15701 B9R1.19 CS(=O)(=O)[C@@H]1CNCC1 Amb20671396 [0,1,0,1,0,0|2,0,0]=4 15702 B9R1.19 CS(=O)(=O)[C@@H]1CNCC1 Amb22405888 [0,1,0,1,0,0|2,0,0]=4 15703 B9R1.19 CS(=O)(=O)[C@H]1CNCC1 Amb20671397 [0,1,0,1,0,0|2,0,0]=4 15704 B9R1.19 CS(=O)(=O)[C@H]1CNCC1 Amb22405887 [0,1,0,1,0,0|2,0,0]=4 15705 B9R1.19 O=S(=O)(Br)C1CCCC1 Amb23555500 [0,1,0,1,0,0|2,0,0]=4 15706 B9R1.19 OP(O)(=O)C1CCCC1 Amb24617217 [0,1,0,1,0,0|2,0,0]=4 15707 B9R1.19 OS(=O)(=O)C1CCCC1 Amb24615046 [0,1,0,1,0,0|2,0,0]=4 15708 B9R1.47 CC1CC1CS(=O)(=O)Cl Amb25709771 [0,1,0,1,0,0|2,0,0]=4 15709 B9R1.47 CC1CC1CS(N)(=O)=O Amb25342147 [0,1,0,1,0,0|2,0,0]=4 15710 B9R1.68 CC1CCC1S(=O)(=O)Cl Amb24532584 [0,1,0,1,0,0|2,0,0]=4 15711 B9R1.68 CC1CCC1S(N)(=O)=O Amb25833817 [0,1,0,1,0,0|2,0,0]=4 15712 B9R1.87 CCC1CC1S(=O)(=O)Cl Amb24116962 [0,1,0,1,0,0|2,0,0]=4 15713 B9R1.87 CS(=O)(=O)C1CC1CN Amb23453034 [0,1,0,1,0,0|2,0,0]=4 15714 B9R1.87 CS(=O)(=O)C1CC1CO Amb23453033 [0,1,0,1,0,0|2,0,0]=4 15715 B9R1.114 CS(=O)(=O)CC1CCN1 Amb23453022 [0,1,0,1,0,0|2,0,0]=4 15716 B9R1.114 CS(=O)(=O)CC1CNC1 Amb22496457 [0,1,0,1,0,0|2,0,0]=4 15717 B9R1.114 CS(=O)(=O)NC1CCC1 Amb25118044 [0,1,0,1,0,0|2,0,0]=4 15718 B9R1.114 CS(=O)(=O)OC1CCC1 Amb25267592 [0,1,0,1,0,0|2,0,0]=4 15719 B9R1.114 NS(=O)(=O)CC1CCC1 Amb22059636 [0,1,0,1,0,0|2,0,0]=4 15720 B9R1.114 O=S(=O)(Cl)CC1CCC1 Amb22001639 [0,1,0,1,0,0|2,0,0]=4 15721 B9R1.115 CC(C)(O)CCC1CC1 Amb25777764 [0,1,0,1,0,0|0,0,2]=4 15722 B9R1.115 CS(=O)(=O)CCC1CO1 Amb24361854 [0,1,0,1,0,0|2,0,0]=4 15723 B9R1.115 NS(=O)(=O)CCC1CC1 Amb24478680 [0,1,0,1,0,0|2,0,0]=4 15724 B9R1.115 O=S(=O)(Br)CCC1CC1 Amb25042976 [0,1,0,1,0,0|2,0,0]=4 15725 B9R1.115 O=S(=O)(Cl)CCC1CC1 Amb22059472 [0,1,0,1,0,0|2,0,0]=4 15726 B9R1.150 CC1(C)CCCC1(C)N Amb24568711 [0,1,0,1,0,0|1,0,1]=4 15727 B9R1.161 CC(=C)[C@@H]1C[C@@H]1C(O)=O Amb24514832 [0,1,0,1,0,0|1,0,1]=4 15728 B9R1.161 CC(=O)C1C=C1C(C)C Amb24722808 [0,1,0,1,0,0|0,0,2]=4 15729 B9R1.161 CC(=O)C1CC1C(=C)Cl Amb24340211 [0,1,0,1,0,0|0,0,2]=4 15730 B9R1.161 CC(=O)C1CC1[N+]([O-])=O Amb24332026 [0,1,0,1,0,0|2,0,0]=4 15731 B9R1.161 CC(=O)C1C[C@H]1C(C)=O Amb25319021 [0,1,0,1,0,0|0,0,1]=3 15732 B9R1.161 CC(=O)C1OC1C(C)=C Amb24520738 [0,1,0,1,0,0|1,0,1]=4 15733 B9R1.161 CC(=O)[C@H]1O[C@H]1C(C)=C Amb25163815 [0,1,0,1,0,0|1,0,1]=4 15734 B9R1.161 CC(C)C1CC1C(O)=O Amb18285139 [0,1,0,1,0,0|1,0,0]=3 15735 B9R1.161 CC(C)[C@@H]1C[C@@H]1C(C)=O Amb24610096 [0,1,0,1,0,0|0,0,0]=2 15736 B9R1.161 CC(C)[C@@H]1C[C@H]1C(C)=O Amb24621711 [0,1,0,1,0,0|0,0,0]=2 15737 B9R1.161 CC(C)[C@@H]1O[C@@H]1C(O)=O Amb24546994 [0,1,0,1,0,0|2,0,0]=4 15738 B9R1.161 CC(C)[C@H]1O[C@@H]1C(C)=O Amb25204929 [0,1,0,1,0,0|1,0,0]=3 15739 B9R1.161 CC(C)[C@H]1O[C@@H]1C(O)=O Amb25229035 [0,1,0,1,0,0|2,0,0]=4 15740 B9R1.161 CC(O)C1OC1C(O)=O Amb25227852 [0,1,0,1,0,0|2,0,0]=4 15741 B9R1.161 C[C@@H](O)[C@H]1O[C@@H]1C(O)=O Amb25224671 [0,1,0,1,0,0|2,0,0]=4 15742 B9R1.161 C[C@H](O)[C@@H]1O[C@@H]1C(O)=O Amb25368573 [0,1,0,1,0,0|2,0,0]=4 15743 B9R1.161 OC(=O)C1CC1C(F)F Amb25338314 [0,1,0,1,0,0|2,0,0]=4 15744 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(F)F Amb24654017 [0,1,0,1,0,0|2,0,0]=4 15745 B9R1.161 OC(=O)[C@H]1C[C@@H]1C(F)F Amb25360822 [0,1,0,1,0,0|2,0,0]=4 15746 B9R1.166 CC(=O)C1CCC1(C)F Amb24582230 [0,1,0,1,0,0|0,0,0]=2 15747 B9R1.166 CC(=O)C1CCS1(=O)=O Amb25189242 [0,1,0,1,0,0|2,0,0]=4 15748 B9R1.166 CC(=O)N1CCC1(C)C Amb24481904 [0,1,0,1,0,0|1,0,0]=3 15749 B9R1.166 CC(O)C1CCC1(C)C Amb24518053 [0,1,0,1,0,0|0,0,2]=4 15750 B9R1.166 CC1(C)CCC1C(O)=O Amb25032090 [0,1,0,1,0,0|1,0,0]=3 15751 B9R1.166 CC1(C)CCN1C(N)=O Amb24354806 [0,1,0,1,0,0|2,0,0]=4 15752 B9R1.166 CC1(C)CNC1C(O)=O Amb24117326 [0,1,0,1,0,0|2,0,0]=4 15753 B9R1.166 NC(=O)C1CCC1(F)F Amb25355623 [0,1,0,1,0,0|2,0,0]=4 15754 B9R1.166 OC(=O)C1CCC1(F)F Amb24452747 [0,1,0,1,0,0|2,0,0]=4 15755 B9R1.170 CC(=O)CC1CC1(C)C Amb24722807 [0,1,0,1,0,0|0,0,0]=2 15756 B9R1.170 CC(=O)CC1CC1(F)F Amb25370357 [0,1,0,1,0,0|1,0,0]=3 15757 B9R1.170 CC(=O)NC1CC1(C)C Amb25237099 [0,1,0,1,0,0|1,0,0]=3 15758 B9R1.170 CC(C)CC1CC1(C)N Amb24728670 [0,1,0,1,0,0|1,0,1]=4 15759 B9R1.170 CC1(C)CC1CC(O)=O Amb25145962 [0,1,0,1,0,0|1,0,0]=3 15760 B9R1.170 CC1(C)CC1NC(N)=O Amb25800580 [0,1,0,1,0,0|2,0,0]=4 15761 B9R1.170 CC1(C)O[C@H]1CC(O)=O Amb25719083 [0,1,0,1,0,0|2,0,0]=4 15762 B9R1.170 CS(=O)CC1CC1(Cl)Cl Amb25125418 [0,1,0,1,0,0|2,0,0]=4 15763 B9R1.170 NC(=O)CC1CC1(F)F Amb24393874 [0,1,0,1,0,0|2,0,0]=4 15764 B9R1.170 OC(=O)CC1CC1(F)F Amb22411507 [0,1,0,1,0,0|2,0,0]=4 15765 B9R2.18 CC1C2CNC(=O)C21 Amb24516348 [0,0,0,2,0,0|1,0,0]=3 15766 B9R2.18 CC1[C@H]2[C@H](O)CC[C@H]21 Amb25235724 [0,0,0,2,0,0|0,0,2]=4 15767 B9R2.20 BrC1CC[C@@H]2CC[C@@H]21 Amb25237428 [0,0,0,2,0,0|1,0,1]=4 15768 B9R2.20 ClC1CCC2CCC21 Amb24483261 [0,0,0,2,0,0|1,0,1]=4 15769 B9R2.20 N[C@@H]1CC[C@@H]2CC[C@@H]21 Amb24580671 [0,0,0,2,0,0|1,0,1]=4 15770 B9R2.20 N[C@@H]1CC[C@H]2CC[C@H]21 Amb24621875 [0,0,0,2,0,0|1,0,1]=4 15771 B9R2.20 O=C1C=CC2CCC12 Amb22365116 [0,0,0,2,0,0|0,0,2]=4 15772 B9R2.20 O=C1C=C[C@@H]2CC[C@H]12 Amb25373394 [0,0,0,2,0,0|0,0,2]=4 15773 B9R2.20 O=C1CC[C@H]2C=C[C@@H]12 Amb25319526 [0,0,0,2,0,0|0,0,2]=4 15774 B9R2.20 O=C1NCC2CCC12 Amb24121240 [0,0,0,2,0,0|1,0,0]=3 15775 B9R2.20 OC1CCC2CCC21 Amb24395686 [0,0,0,2,0,0|0,0,2]=4 15776 B9R2.20 OC1CC[C@@H]2CC[C@@H]21 Amb24642457 [0,0,0,2,0,0|0,0,2]=4 15777 B9R2.31 CC1C2CC1CC2N Amb25311011 [0,0,0,2,0,0|1,0,1]=4 15778 B9R2.31 C[C@@H]1[C@@H]2C[C@H]1CC2=O Amb24588878 [0,0,0,2,0,0|0,0,0]=2 15779 B9R2.31 C[C@H]1[C@@H]2C[C@H]1C[C@@H]2N Amb24527781 [0,0,0,2,0,0|1,0,1]=4 15780 B9R2.31 C[C@H]1[C@@H]2C[C@H]1C[C@H]2O Amb24550216 [0,0,0,2,0,0|0,0,2]=4 15781 B9R2.31 O=C1CC2CC1C2Cl Amb24753521 [0,0,0,2,0,0|1,0,0]=3 15782 B9R2.33 BrC1CC2CCC2C1 Amb24419943 [0,0,0,2,0,0|1,0,1]=4 15783 B9R2.33 NC1CC2CCC2C1 Amb24696800 [0,0,0,2,0,0|1,0,1]=4 15784 B9R2.33 O=C1C[C@@H]2C=C[C@@H]2C1 Amb25320137 [0,0,0,2,0,0|0,0,2]=4 15785 B9R2.33 O=C1C[C@@H]2CC[C@H]2C1 Amb24614774 [0,0,0,2,0,0|0,0,0]=2 15786 B9R2.33 O=C1C[C@H]2CC[C@@H]2C1 Amb24724072 [0,0,0,2,0,0|0,0,0]=2 15787 B9R2.39 BrC1=CC2CC1CC2 Amb21856638 [0,0,0,2,0,0|1,0,1]=4 15788 B9R2.39 BrC1C[C@@H]2C[C@H]1CC2 Amb24598753 [0,0,0,2,0,0|1,0,1]=4 15789 B9R2.39 Br[C@@H]1CC2CC1CC2 Amb22800320 [0,0,0,2,0,0|1,0,1]=4 15790 B9R2.39 Br[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb24512105 [0,0,0,2,0,0|1,0,1]=4 15791 B9R2.39 Br[C@H]1CC2CC1CC2 Amb22337809 [0,0,0,2,0,0|1,0,1]=4 15792 B9R2.39 Br[C@H]1C[C@@H]2C[C@H]1CC2 Amb25259275 [0,0,0,2,0,0|1,0,1]=4 15793 B9R2.39 Br[C@H]1C[C@H]2C[C@@H]1CC2 Amb25378969 [0,0,0,2,0,0|1,0,1]=4 15794 B9R2.39 C1C2NCC1OC2=O Amb15692521 [0,0,0,2,0,0|2,0,0]=4 15795 B9R2.39 CC1=CC2CC1CC2 Amb25246974 [0,0,0,2,0,0|1,0,0]=3 15796 B9R2.39 CC1NC2CC1CC2 Amb18203385 [0,0,0,2,0,0|1,0,1]=4 15797 B9R2.39 C[C@@H]1CN2CC[C@@H]1O2 Amb24574991 [0,0,0,2,0,0|1,0,1]=4 15798 B9R2.39 C[C@H]1C[C@@H]2CC[C@H]1O2 Amb24586711 [0,0,0,2,0,0|0,0,2]=4 15799 B9R2.39 ClC1CC2CC1CC2 Amb22360712 [0,0,0,2,0,0|1,0,1]=4 15800 B9R2.39 ClC1C[C@@H]2C[C@H]1CC2 Amb24655099 [0,0,0,2,0,0|1,0,1]=4 15801 B9R2.39 Cl[C@@H]1CC2CC1CC2 Amb25721561 [0,0,0,2,0,0|1,0,1]=4 15802 B9R2.39 Cl[C@@H]1CC2C[C@H]1CC2 Amb22801514 [0,0,0,2,0,0|1,0,1]=4 15803 B9R2.39 Cl[C@@H]1C[C@H]2C[C@@H]1CC2 Amb24616847 [0,0,0,2,0,0|1,0,1]=4 15804 B9R2.39 Cl[C@H]1CC2CC1CC2 Amb24398324 [0,0,0,2,0,0|1,0,1]=4 15805 B9R2.39 Cl[C@H]1C[C@H]2C[C@@H]1CC2 Amb24565762 [0,0,0,2,0,0|1,0,1]=4 15806 B9R2.39 NC1CC2CC1CC2 Amb10607816 [0,0,0,2,0,0|1,0,1]=4 15807 B9R2.39 NC1CC2CC1CC2 Amb19374620 [0,0,0,2,0,0|1,0,1]=4 15808 B9R2.39 NC1C[C@H]2C[C@@H]1CC2 Amb25260433 [0,0,0,2,0,0|1,0,1]=4 15809 B9R2.39 NN1CC2CC1CC2 Amb18641715 [0,0,0,2,0,0|2,0,0]=4 15810 B9R2.39 N[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb25338378 [0,0,0,2,0,0|1,0,1]=4 15811 B9R2.39 N[C@@H]1C[C@@H]2C[C@H]1CC2 Amb24181889 [0,0,0,2,0,0|1,0,1]=4 15812 B9R2.39 N[C@@H]1C[C@H]2C[C@@H]1CC2 Amb22745923 [0,0,0,2,0,0|1,0,1]=4 15813 B9R2.39 N[C@@H]1C[C@H]2C[C@@H]1CC2 Amb22757963 [0,0,0,2,0,0|1,0,1]=4 15814 B9R2.39 N[C@@H]1C[C@H]2C[C@H]1CC2 Amb25219162 [0,0,0,2,0,0|1,0,1]=4 15815 B9R2.39 N[C@H]1CC2C[C@H]1CC2 Amb25305786 [0,0,0,2,0,0|1,0,1]=4 15816 B9R2.39 O=C1CC2CC1CN2 Amb24376697 [0,0,0,2,0,0|1,0,0]=3 15817 B9R2.39 O=C1CC2CCC1O2 Amb25322815 [0,0,0,2,0,0|1,0,0]=3 15818 B9R2.39 O=C1CC2COC1C2 Amb24734169 [0,0,0,2,0,0|1,0,0]=3 15819 B9R2.39 O=C1CN2CC1CC2 Amb10067112 [0,0,0,2,0,0|1,0,0]=3 15820 B9R2.39 O=C1CN2CC1CC2 Amb20171539 [0,0,0,2,0,0|1,0,0]=3 15821 B9R2.39 O=C1C[C@@H]2CC[C@H]1N2 Amb25259133 [0,0,0,2,0,0|1,0,0]=3 15822 B9R2.39 O=C1C[C@@H]2CC[C@H]1O2 Amb25233773 [0,0,0,2,0,0|1,0,0]=3 15823 B9R2.39 O=C1C[C@@H]2C[C@@H]1CC2 Amb25205819 [0,0,0,2,0,0|0,0,0]=2 15824 B9R2.39 O=C1C[C@@H]2C[C@H]1C=C2 Amb25061616 [0,0,0,2,0,0|0,0,2]=4 15825 B9R2.39 O=C1C[C@@H]2C[C@H]1CC2 Amb24583541 [0,0,0,2,0,0|0,0,0]=2 15826 B9R2.39 O=C1C[C@H]2CO[C@@H]1C2 Amb24571771 [0,0,0,2,0,0|1,0,0]=3 15827 B9R2.39 O=C1C[C@H]2C[C@H]1C=C2 Amb24721721 [0,0,0,2,0,0|0,0,2]=4 15828 B9R2.39 O=C1NC2CC1CC2 Amb20623082 [0,0,0,2,0,0|1,0,0]=3 15829 B9R2.39 O=C1NC2CNC1C2 Amb18641690 [0,0,0,2,0,0|2,0,0]=4 15830 B9R2.39 O=C1NC2COC1C2 Amb24547028 [0,0,0,2,0,0|2,0,0]=4 15831 B9R2.39 O=C1NC2CSC1C2 Amb25204131 [0,0,0,2,0,0|2,0,0]=4 15832 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 Amb22587593 [0,0,0,2,0,0|2,0,0]=4 15833 B9R2.39 O=C1N[C@H]2CC1CC2 Amb25857407 [0,0,0,2,0,0|1,0,0]=3 15834 B9R2.39 O=C1N[C@H]2C[C@@H]1CC2 Amb25174368 [0,0,0,2,0,0|1,0,0]=3 15835 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 Amb19516242 [0,0,0,2,0,0|2,0,0]=4 15836 B9R2.39 O=C1O[C@H]2CN[C@@H]1C2 Amb24629670 [0,0,0,2,0,0|2,0,0]=4 15837 B9R2.39 O=S1CC2CC1CN2 Amb25806028 [0,0,0,2,0,0|2,0,0]=4 15838 B9R2.39 O=S1C[C@@H]2C[C@H]1CN2 Amb24560813 [0,0,0,2,0,0|2,0,0]=4 15839 B9R2.39 OC1C[C@@H]2C[C@H]1CC2 Amb24556818 [0,0,0,2,0,0|0,0,2]=4 15840 B9R2.39 ON1CC2CC1CC2 Amb25376585 [0,0,0,2,0,0|1,0,1]=4 15841 B9R2.39 O[C@@H]1CC2CC1CC2 Amb22363271 [0,0,0,2,0,0|0,0,2]=4 15842 B9R2.39 O[C@@H]1CC2C[C@H]1CC2 Amb25266771 [0,0,0,2,0,0|0,0,2]=4 15843 B9R2.39 O[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb25176323 [0,0,0,2,0,0|0,0,2]=4 15844 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CC2 Amb10844941 [0,0,0,2,0,0|0,0,2]=4 15845 B9R2.39 O[C@@H]1C[C@H]2C[C@@H]1CC2 Amb22744882 [0,0,0,2,0,0|0,0,2]=4 15846 B9R2.39 O[C@H]1CC2CC1CC2 Amb25759926 [0,0,0,2,0,0|0,0,2]=4 15847 B9R2.39 O[C@H]1C[C@@H]2C[C@@H]1CC2 Amb25204244 [0,0,0,2,0,0|0,0,2]=4 15848 B9R2.39 O[C@H]1C[C@H]2C[C@@H]1CC2 Amb24567063 [0,0,0,2,0,0|0,0,2]=4 15849 B9R2.39 SC1CC2CC1CC2 Amb25359572 [0,0,0,2,0,0|0,1,1]=4 15850 B9R2.47 CC[C@@H]1C[C@H]2C[C@H]2N1 Amb25247181 [0,0,0,2,0,0|1,0,1]=4 15851 B9R2.54 CC1C2CC(O)CC21 Amb24705654 [0,0,0,2,0,0|0,0,2]=4 15852 B9R2.54 C[C@@H]1[C@@H]2CC(=O)C[C@@H]21 Amb24602923 [0,0,0,2,0,0|0,0,0]=2 15853 B9R2.54 C[C@@H]1[C@H]2CC(=O)C[C@H]21 Amb24645439 [0,0,0,2,0,0|0,0,0]=2 15854 B9R2.68 C1C2CCC1CCN2 Amb18641674 [0,0,0,2,0,0|1,0,1]=4 15855 B9R2.68 C1CC2CCC(C1)N2 Amb10610725 [0,0,0,2,0,0|1,0,1]=4 15856 B9R2.68 C1CCC2CCC1N2 Amb19374849 [0,0,0,2,0,0|1,0,1]=4 15857 B9R2.68 C1CCC2CCC1O2 Amb22364980 [0,0,0,2,0,0|0,0,2]=4 15858 B9R2.68 C1CC[C@@H]2CC[C@@H]1N2 Amb22405871 [0,0,0,2,0,0|1,0,1]=4 15859 B9R2.68 C1CC[C@H]2CC[C@@H]1N2 Amb22735874 [0,0,0,2,0,0|1,0,1]=4 15860 B9R2.68 C1N[C@@H]2C[C@H]1CCC2 Amb23385228 [0,0,0,2,0,0|1,0,1]=4 15861 B9R2.68 C1N[C@H]2C[C@@H]1CCC2 Amb24606188 [0,0,0,2,0,0|1,0,1]=4 15862 B9R2.68 C1ON2CC1CCC2 Amb24333259 [0,0,0,2,0,0|1,0,1]=4 15863 B9R2.68 C1ON2C[C@@H]1CCC2 Amb25760706 [0,0,0,2,0,0|1,0,1]=4 15864 B9R2.68 C1[C@@H]2CCCN1CC2 Amb25046164 [0,0,0,2,0,0|2,0,0]=4 15865 B9R2.68 C1[C@@H]2CC[C@H]1CCN2 Amb24738443 [0,0,0,2,0,0|1,0,1]=4 15866 B9R2.110 BrC12CC(CC1)CC2 Amb24564459 [0,0,0,2,0,0|1,0,1]=4 15867 B9R2.110 NC12CC(CC1)CC2 Amb18641659 [0,0,0,2,0,0|1,0,1]=4 15868 B9R2.110 OC12CC(CC1)CC2 Amb22235809 [0,0,0,2,0,0|0,0,2]=4 15869 B9R2.139 C=C1CC2(CC1)CC2 Amb24483142 [0,0,0,2,0,0|1,0,0]=3 15870 B9R2.139 CC1CCC2(CC2)N1 Amb18203382 [0,0,0,2,0,0|1,0,1]=4 15871 B9R2.139 O=C1CC2(CO1)CC2 Amb25662215 [0,0,0,2,0,0|1,0,0]=3 15872 B9R2.139 O=C1CCC2(N1)CC2 Amb16186647 [0,0,0,2,0,0|1,0,0]=3 15873 B9R2.139 O=C1NC2(CN1)CC2 Amb24482030 [0,0,0,2,0,0|2,0,0]=4 15874 B9R2.139 O=C1NC2(CO1)CC2 Amb24572471 [0,0,0,2,0,0|2,0,0]=4 15875 B9R2.139 O=C1NCC2(CC2)O1 Amb25789822 [0,0,0,2,0,0|2,0,0]=4 15876 B9R2.8 NC1C[C@@H]2C[C@H](C1)C2 Amb24533837 [0,0,0,2,0,0|1,0,1]=4 15877 B9R2.8 O=C1CC2CC(C1)C2 Amb25706934 [0,0,0,2,0,0|0,0,0]=2 15878 B9R2.8 O=C1NC2CC(C2)O1 Amb24524286 [0,0,0,2,0,0|2,0,0]=4 15879 B9R2.8 OC1CC2CC(C1)C2 Amb24719737 [0,0,0,2,0,0|0,0,2]=4 15880 B9R2.13 CC12CCCC1(C)O2 Amb24602744 [0,0,0,2,0,0|0,0,2]=4 15881 B9R2.21 CC1CCC2C(C1)O2 Amb1141335 [0,0,0,2,0,0|0,0,2]=4 15882 B9R2.21 O=C1CC2OC2CC1 Amb24408509 [0,0,0,2,0,0|1,0,0]=3 15883 B9R2.21 O=C1C[C@@H]2C[C@H]2CC1 Amb25294409 [0,0,0,2,0,0|0,0,0]=2 15884 B9R2.21 O=C1N[C@H]2C[C@H]2CO1 Amb24630201 [0,0,0,2,0,0|2,0,0]=4 15885 B9R2.21 OC1CC2CC2CC1 Amb25169523 [0,0,0,2,0,0|0,0,2]=4 15886 B9R2.21 OC1C[C@@H]2C[C@H]2CC1 Amb25307522 [0,0,0,2,0,0|0,0,2]=4 15887 B9R2.21 O[C@@H]1C[C@H]2C[C@H]2CC1 Amb25288224 [0,0,0,2,0,0|0,0,2]=4 15888 B9R2.21 O[C@H]1C[C@@H]2C[C@@H]2CC1 Amb25024733 [0,0,0,2,0,0|0,0,2]=4 15889 B9R2.21 O[C@H]1C[C@H]2C[C@H]2CC1 Amb24556801 [0,0,0,2,0,0|0,0,2]=4 15890 B9R2.25 CC1=CC(=O)C2CC12 Amb25833652 [0,0,0,2,0,0|0,0,2]=4 15891 B9R2.25 C[C@@H]1CC(=O)[C@H]2O[C@H]21 Amb25348559 [0,0,0,2,0,0|1,0,0]=3 15892 B9R2.25 OC1OC(=O)C2CC21 Amb25809854 [0,0,0,2,0,0|2,0,0]=4 15893 B9R2.25 O[C@H]1CC(=O)[C@H]2O[C@H]21 Amb24626593 [0,0,0,2,0,0|2,0,0]=4 15894 B9R2.29 OC1CC2NC(=O)C21 Amb25272666 [0,0,0,2,0,0|2,0,0]=4 15895 B9R2.38 CC12CC(=C)CC1O2 Amb24678178 [0,0,0,2,0,0|2,0,0]=4 15896 B9R2.38 CC12CC1CC(=O)C2 Amb24357249 [0,0,0,2,0,0|0,0,0]=2 15897 B9R2.38 NC12CC1NC(=O)C2 Amb25848870 [0,0,0,2,0,0|2,0,0]=4 15898 B9R2.109 C=C1CCCC2CC12 Amb25790226 [0,0,0,2,0,0|1,0,0]=3 15899 B9R2.109 Cl[C@@H]1CCC[C@H]2C[C@H]21 Amb25347145 [0,0,0,2,0,0|1,0,1]=4 15900 B9R2.109 Cl[C@H]1CCC[C@H]2C[C@H]21 Amb25272786 [0,0,0,2,0,0|1,0,1]=4 15901 B9R2.109 NC1CCCC2CC21 Amb19375082 [0,0,0,2,0,0|1,0,1]=4 15902 B9R2.109 N[C@@H]1CCC[C@H]2C[C@H]21 Amb24516528 [0,0,0,2,0,0|1,0,1]=4 15903 B9R2.109 O=C1CCCC2=NC21 Amb25714348 [0,0,0,2,0,0|1,0,1]=4 15904 B9R2.109 O=C1CCCC2C1C2 Amb17593139 [0,0,0,2,0,0|0,0,0]=2 15905 B9R2.109 O=C1CCCC2OC12 Amb20671097 [0,0,0,2,0,0|1,0,0]=3 15906 B9R2.109 O=C1CCC[C@@H]2C[C@@H]12 Amb24512517 [0,0,0,2,0,0|0,0,0]=2 15907 B9R2.109 O=C1CCC[C@@H]2O[C@@H]12 Amb25373140 [0,0,0,2,0,0|1,0,0]=3 15908 B9R2.109 O=C1CCC[C@@H]2O[C@H]12 Amb24631684 [0,0,0,2,0,0|1,0,0]=3 15909 B9R2.109 O=C1CCC[C@H]2C[C@@H]12 Amb24723004 [0,0,0,2,0,0|0,0,0]=2 15910 B9R2.109 O=C1CCC[C@H]2O[C@@H]12 Amb25252262 [0,0,0,2,0,0|1,0,0]=3 15911 B9R2.109 O=C1CCOC2CC12 Amb25729127 [0,0,0,2,0,0|1,0,0]=3 15912 B9R2.109 O=C1NCCC2CC12 Amb25717930 [0,0,0,2,0,0|1,0,0]=3 15913 B9R2.109 O=C1NCCC2OC12 Amb25790016 [0,0,0,2,0,0|2,0,0]=4 15914 B9R2.109 O=C1NCC[C@H]2O[C@@H]12 Amb24579393 [0,0,0,2,0,0|2,0,0]=4 15915 B9R2.109 O[C@H]1CCCC2C[C@H]21 Amb25175056 [0,0,0,2,0,0|0,0,2]=4 15916 B9R2.7 N[C@H]1C[C@H]2CCC[C@H]21 Amb25245225 [0,0,0,2,0,0|1,0,1]=4 15917 B9R2.7 O=C1CC2CCCC12 Amb25106047 [0,0,0,2,0,0|0,0,0]=2 15918 B9R2.7 O=C1CC2COCC12 Amb25347436 [0,0,0,2,0,0|1,0,0]=3 15919 B9R2.7 O=C1C[C@@H]2C=CC[C@H]12 Amb22735988 [0,0,0,2,0,0|0,0,2]=4 15920 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [0,0,0,2,0,0|1,0,0]=3 15921 B9R2.7 O=C1C[C@@H]2[C@H]1CC=C2 Amb15692795 [0,0,0,2,0,0|0,0,2]=4 15922 B9R2.7 O=C1C[C@H]2COC[C@@H]12 Amb24610180 [0,0,0,2,0,0|1,0,0]=3 15923 B9R2.7 O=C1C[C@H]2OCC[C@@H]12 Amb25216213 [0,0,0,2,0,0|1,0,0]=3 15924 B9R2.7 O=C1NC2CCNC12 Amb24398777 [0,0,0,2,0,0|2,0,0]=4 15925 B9R2.7 O=C1NC2OCCC12 Amb24481565 [0,0,0,2,0,0|2,0,0]=4 15926 B9R2.7 O=C1N[C@@H]2CCC[C@H]12 Amb25278653 [0,0,0,2,0,0|1,0,0]=3 15927 B9R2.7 OC1CC2CCCC21 Amb24474223 [0,0,0,2,0,0|0,0,2]=4 15928 B9R2.7 O[C@H]1C[C@@H]2CCC[C@@H]21 Amb24542287 [0,0,0,2,0,0|0,0,2]=4 15929 B9R2.41 NC1CC(C1)C2CC2 Amb24759247 [0,0,0,2,0,0|1,0,1]=4 15930 B9R2.41 O=C1CC(C1)C2CC2 Amb25370879 [0,0,0,2,0,0|0,0,0]=2 15931 B9R2.41 OC1CC(C1)C2CC2 Amb24679999 [0,0,0,2,0,0|0,0,2]=4 15932 B9R2.138 BrC1CC2(C1)CCC2 Amb24750047 [0,0,0,2,0,0|1,0,1]=4 15933 B9R2.138 CN1CC2(C1)CCC2 Amb25281100 [0,0,0,2,0,0|2,0,0]=4 15934 B9R2.138 NC1CC2(C1)CCC2 Amb22642157 [0,0,0,2,0,0|1,0,1]=4 15935 B9R2.138 NC1CC2(C1)CCC2 Amb24183370 [0,0,0,2,0,0|1,0,1]=4 15936 B9R2.138 O=C1CC2(C1)CCC2 Amb20668529 [0,0,0,2,0,0|0,0,0]=2 15937 B9R2.138 O=C1CC2(CCC2)N1 Amb19149093 [0,0,0,2,0,0|1,0,0]=3 15938 B9R2.138 O=C1CC2(CNC2)C1 Amb25747338 [0,0,0,2,0,0|1,0,0]=3 15939 B9R2.138 O=C1CC2(CNC2)N1 Amb25119349 [0,0,0,2,0,0|2,0,0]=4 15940 B9R2.138 O=C1CC2(COC2)C1 Amb22406126 [0,0,0,2,0,0|1,0,0]=3 15941 B9R2.138 O=C1CC2(COC2)N1 Amb24592907 [0,0,0,2,0,0|2,0,0]=4 15942 B9R2.138 O=C1CC2(CSC2)C1 Amb22406070 [0,0,0,2,0,0|1,0,0]=3 15943 B9R2.138 O=S1CC2(CNC2)C1 Amb25169338 [0,0,0,2,0,0|2,0,0]=4 15944 B9R2.138 OC1CC2(C1)CCC2 Amb25113635 [0,0,0,2,0,0|0,0,2]=4 15945 B9R2.1 NC1CC12CCCC2 Amb17605510 [0,0,0,2,0,0|1,0,1]=4 15946 B9R2.144 NC(=O)C12CC1CC2 Amb25678261 [0,0,0,2,0,0|1,0,0]=3 15947 B9R2.148 CC(=O)[C@@H]1[C@H]2CC[C@H]21 Amb24708035 [0,0,0,2,0,0|0,0,0]=2 15948 B9R2.148 CN(C)[C@@H]1[C@H]2CC[C@H]21 Amb25199846 [0,0,0,2,0,0|2,0,0]=4 15949 B9R2.148 OC(=O)C1C2CCC21 Amb24350799 [0,0,0,2,0,0|1,0,0]=3 15950 B9R2.148 OC(=O)[C@@H]1[C@@H]2CC[C@@H]21 Amb24568902 [0,0,0,2,0,0|1,0,0]=3 15951 B9R2.150 CC(=O)[C@@H]1C[C@@H]2C[C@@H]21 Amb25179150 [0,0,0,2,0,0|0,0,0]=2 15952 B9R2.150 OC(=O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|1,0,0]=3 15953 B9R2.150 OC(=O)C1NC2CC12 Amb25376606 [0,0,0,2,0,0|2,0,0]=4 15954 B9R2.6 CC12CCCCC1O2 Amb17939278 [0,0,0,2,0,0|0,0,2]=4 15955 B9R2.6 NC12CC1CCCC2 Amb25137276 [0,0,0,2,0,0|1,0,1]=4 15956 B9R2.44 C=C1CC12CC2CBr Amb24693981 [0,0,0,2,0,0|2,0,0]=4 15957 B9R2.44 C=C1C[C@]12C[C@H]2CO Amb24533853 [0,0,0,2,0,0|2,0,0]=4 15958 B9R2.52 C1C2NCCCCC21 Amb18203388 [0,0,0,2,0,0|1,0,1]=4 15959 B9R2.52 C1CCC2C(CC1)N2 Amb10609123 [0,0,0,2,0,0|1,0,1]=4 15960 B9R2.52 C1CCC2C(CC1)O2 Amb1134987 [0,0,0,2,0,0|0,0,2]=4 15961 B9R2.108 NC1CC1C2CCC2 Amb24483254 [0,0,0,2,0,0|1,0,1]=4 15962 B9R2.108 N[C@@H]1C[C@H]1C2CCC2 Amb24581403 [0,0,0,2,0,0|1,0,1]=4 15963 B9R2.123 BrC1C2CCCCC21 Amb22001016 [0,0,0,2,0,0|1,0,1]=4 15964 B9R2.123 Br[C@@H]1[C@H]2CCCC[C@H]21 Amb25279388 [0,0,0,2,0,0|1,0,1]=4 15965 B9R2.123 CC1C2CCCCC21 Amb22365158 [0,0,0,2,0,0|1,0,1]=4 15966 B9R2.123 CN1C2CCCCC12 Amb22167171 [0,0,0,2,0,0|2,0,0]=4 15967 B9R2.123 ClC1C2CCCCC21 Amb25337704 [0,0,0,2,0,0|1,0,1]=4 15968 B9R2.123 ClC1[C@H]2CCCC[C@H]21 Amb24483271 [0,0,0,2,0,0|1,0,1]=4 15969 B9R2.123 Cl[C@@H]1[C@H]2CCCC[C@H]21 Amb24440860 [0,0,0,2,0,0|1,0,1]=4 15970 B9R2.123 NC1C2CCCCC21 Amb20623881 [0,0,0,2,0,0|1,0,1]=4 15971 B9R2.123 N[C@@H]1[C@@H]2CCCC[C@@H]21 Amb25117564 [0,0,0,2,0,0|1,0,1]=4 15972 B9R2.123 N[C@@H]1[C@H]2CCCC[C@H]21 Amb25113495 [0,0,0,2,0,0|1,0,1]=4 15973 B9R2.123 O=C1C2CCCCC12 Amb24689511 [0,0,0,2,0,0|0,0,0]=2 15974 B9R2.123 OC1C2C1CCCC2 Amb17593167 [0,0,0,2,0,0|0,0,2]=4 15975 B9R2.123 O[C@@H]1[C@@H]2CCCC[C@@H]21 Amb24543995 [0,0,0,2,0,0|0,0,2]=4 15976 B9R2.123 O[C@@H]1[C@H]2CCCC[C@H]21 Amb25042742 [0,0,0,2,0,0|0,0,2]=4 15977 B9R2.5 CC1CCCC12CO2 Amb24533573 [0,0,0,2,0,0|0,0,2]=4 15978 B9R2.120 CC1(O)CCC2CC12 Amb25696393 [0,0,0,2,0,0|0,0,2]=4 15979 B9R2.93 CC1(N)CC1C2CC2 Amb24574387 [0,0,0,2,0,0|1,0,1]=4 15980 B9R2.147 OC(=O)C1[C@@H]2C[C@H]1C2 Amb24409084 [0,0,0,2,0,0|1,0,0]=3 15981 B9R2.143 CC(=O)C1CC12CC2 Amb24725286 [0,0,0,2,0,0|0,0,0]=2 15982 B9R2.143 CC(N)C1CC12CC2 Amb24604193 [0,0,0,2,0,0|1,0,1]=4 15983 B9R2.143 C[C@@H](O)[C@@H]1CC12CC2 Amb25345029 [0,0,0,2,0,0|0,0,2]=4 15984 B9R2.143 C[C@H](O)[C@@H]1CC12CC2 Amb25266779 [0,0,0,2,0,0|0,0,2]=4 15985 B9R2.174 C1CC12CCCCC2 Amb22231454 [0,0,0,2,0,0|1,0,1]=4 15986 B9R2.174 C1NC12CCCCC2 Amb24117848 [0,0,0,2,0,0|1,0,1]=4