0 B6R0.4 BC(=O)OCCCl Amb25199831 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.4 BrCCC=C(F)F Amb10839379 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.4 BrCCCN(C)C Amb10603677 [0,0,0,0,0,0|4,0,0]=4 3 B6R0.4 C#CCCB(O)O Amb25328251 [0,0,0,0,0,0|1,0,3]=4 4 B6R0.4 C#CCCC(N)=O Amb18636026 [0,0,0,0,0,0|1,0,2]=3 5 B6R0.4 C#CCCC([O-])=O Amb22232009 [0,0,0,0,0,0|0,0,3]=3 6 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [0,0,0,0,0,0|0,0,4]=4 7 B6R0.4 C=C(Br)CCC=O Amb18645745 [0,0,0,0,0,0|3,0,1]=4 8 B6R0.4 C=C(Cl)CCC=O Amb24525208 [0,0,0,0,0,0|3,0,1]=4 9 B6R0.4 C=C(Cl)CCCBr Amb25811643 [0,0,0,0,0,0|3,0,0]=3 10 B6R0.4 C=C(Cl)CCCCl Amb24635037 [0,0,0,0,0,0|3,0,0]=3 11 B6R0.4 C=C(Cl)SCCCl Amb24410320 [0,0,0,0,0,0|4,0,0]=4 12 B6R0.4 C=C(F)CCCO Amb25811029 [0,0,0,0,0,0|3,0,0]=3 13 B6R0.4 C=C(I)CCCN Amb24581029 [0,0,0,0,0,0|3,0,0]=3 14 B6R0.4 C=CC#CC(O)=O Amb24479724 [0,0,0,0,0,0|0,0,4]=4 15 B6R0.4 C=CCCB(O)O Amb10067042 [0,0,0,0,0,0|1,0,3]=4 16 B6R0.4 C=CCCC(N)=N Amb25326954 [0,0,0,0,0,0|2,0,2]=4 17 B6R0.4 C=CCCS([O-])=O Amb25680826 [0,0,0,0,0,0|1,0,3]=4 18 B6R0.4 C=CCC[N+]([O-])=O Amb22490976 [0,0,0,0,0,0|1,0,3]=4 19 B6R0.4 C=CCSC(=O)Cl Amb22231425 [0,0,0,0,0,0|2,0,2]=4 20 B6R0.4 C=COCC(N)=O Amb25075789 [0,0,0,0,0,0|2,0,2]=4 21 B6R0.4 C=NCCC(O)=O Amb24480865 [0,0,0,0,0,0|1,0,1]=2 22 B6R0.4 CC#CCC(C)O Amb25747033 [0,0,0,0,0,0|1,0,3]=4 23 B6R0.4 CC#CCC(N)=O Amb24761404 [0,0,0,0,0,0|1,0,2]=3 24 B6R0.4 CC#CCC(O)=O Amb17939740 [0,0,0,0,0,0|0,0,2]=2 25 B6R0.4 CC#CCS([O-])=O Amb25810301 [0,0,0,0,0,0|1,0,3]=4 26 B6R0.4 CC#CC[C@@H](C)O Amb25284470 [0,0,0,0,0,0|1,0,3]=4 27 B6R0.4 CC#CC[C@H](C)O Amb24507482 [0,0,0,0,0,0|1,0,3]=4 28 B6R0.4 CC(=C)CCC#C Amb18634222 [0,0,0,0,0,0|2,0,2]=4 29 B6R0.4 CC(=C)CCC=C Amb22228883 [0,0,0,0,0,0|2,0,2]=4 30 B6R0.4 CC(=C)CCC=O Amb18120891 [0,0,0,0,0,0|3,0,1]=4 31 B6R0.4 CC(=C)CCCBr Amb22886717 [0,0,0,0,0,0|3,0,0]=3 32 B6R0.4 CC(=C)CCCCl Amb24089299 [0,0,0,0,0,0|3,0,0]=3 33 B6R0.4 CC(=C)CCCN Amb24761452 [0,0,0,0,0,0|3,0,0]=3 34 B6R0.4 CC(=C)CCCO Amb22886814 [0,0,0,0,0,0|3,0,0]=3 35 B6R0.4 CC(=C)CCNN Amb25745941 [0,0,0,0,0,0|4,0,0]=4 36 B6R0.4 CC(=C)NCCO Amb25127040 [0,0,0,0,0,0|4,0,0]=4 37 B6R0.4 CC(=N)OCCCl Amb25063085 [0,0,0,0,0,0|4,0,0]=4 38 B6R0.4 CC(=O)C#CCCl Amb24427329 [0,0,0,0,0,0|2,0,2]=4 39 B6R0.4 CC(=O)CC=C=C Amb25746318 [0,0,0,0,0,0|1,0,3]=4 40 B6R0.4 CC(=O)CC=NO Amb25024487 [0,0,0,0,0,0|3,0,1]=4 41 B6R0.4 CC(=O)CCC=O Amb18639597 [0,0,0,0,0,0|2,0,1]=3 42 B6R0.4 CC(=O)CCC=S Amb25662155 [0,0,0,0,0,0|2,0,1]=3 43 B6R0.4 CC(=O)CCCF Amb25068187 [0,0,0,0,0,0|2,0,0]=2 44 B6R0.4 CC(=O)CCCI Amb25346994 [0,0,0,0,0,0|2,0,0]=2 45 B6R0.4 CC(=O)CCCN Amb18121547 [0,0,0,0,0,0|2,0,0]=2 46 B6R0.4 CC(=O)CCON Amb25186994 [0,0,0,0,0,0|3,0,0]=3 47 B6R0.4 CC(=O)CN=[N+]=[N-] Amb18114476 [0,0,0,0,0,0|4,0,0]=4 48 B6R0.4 CC(=O)CNC=O Amb23442787 [0,0,0,0,0,0|3,0,1]=4 49 B6R0.4 CC(=O)COC=O Amb24736861 [0,0,0,0,0,0|3,0,1]=4 50 B6R0.4 CC(=O)CSC=C Amb24479150 [0,0,0,0,0,0|2,0,2]=4 51 B6R0.4 CC(=O)C\C=C/Cl Amb25276014 [0,0,0,0,0,0|2,0,2]=4 52 B6R0.4 CC(=O)C\C=C\Cl Amb25094325 [0,0,0,0,0,0|2,0,2]=4 53 B6R0.4 CC(=O)C\C=N/O Amb25066399 [0,0,0,0,0,0|3,0,1]=4 54 B6R0.4 CC(=O)N=CCO Amb24420730 [0,0,0,0,0,0|3,0,1]=4 55 B6R0.4 CC(=O)NCC#C Amb20623038 [0,0,0,0,0,0|2,0,2]=4 56 B6R0.4 CC(=O)NCC=O Amb25757509 [0,0,0,0,0,0|3,0,1]=4 57 B6R0.4 CC(=O)NCCF Amb25832238 [0,0,0,0,0,0|3,0,0]=3 58 B6R0.4 CC(=O)NCCI Amb25761166 [0,0,0,0,0,0|3,0,0]=3 59 B6R0.4 CC(=O)NCCN Amb1218225 [0,0,0,0,0,0|3,0,0]=3 60 B6R0.4 CC(=O)NCCS Amb22230992 [0,0,0,0,0,0|3,0,0]=3 61 B6R0.4 CC(=O)NNCCl Amb24532146 [0,0,0,0,0,0|4,0,0]=4 62 B6R0.4 CC(=O)OCCF Amb25123333 [0,0,0,0,0,0|3,0,0]=3 63 B6R0.4 CC(=O)OCCI Amb17673987 [0,0,0,0,0,0|3,0,0]=3 64 B6R0.4 CC(=O)OCCN Amb18121947 [0,0,0,0,0,0|3,0,0]=3 65 B6R0.4 CC(=O)OCCP Amb25810695 [0,0,0,0,0,0|3,0,0]=3 66 B6R0.4 CC(=O)SCC=C Amb24531624 [0,0,0,0,0,0|2,0,2]=4 67 B6R0.4 CC(=O)SCCBr Amb24608039 [0,0,0,0,0,0|3,0,0]=3 68 B6R0.4 CC(=O)SCCCl Amb24746776 [0,0,0,0,0,0|3,0,0]=3 69 B6R0.4 CC(=O)SCCN Amb21953963 [0,0,0,0,0,0|3,0,0]=3 70 B6R0.4 CC(=O)SCCN Amb22011516 [0,0,0,0,0,0|3,0,0]=3 71 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [0,0,0,0,0,0|2,0,2]=4 72 B6R0.4 CC(=O)\C=C\CO Amb24414835 [0,0,0,0,0,0|2,0,2]=4 73 B6R0.4 CC(=S)NCCO Amb25747406 [0,0,0,0,0,0|3,1,0]=4 74 B6R0.4 CC(Br)=CCCO Amb24734140 [0,0,0,0,0,0|3,0,1]=4 75 B6R0.4 CC(Br)CCCN Amb25680649 [0,0,0,0,0,0|3,0,1]=4 76 B6R0.4 CC(Br)CCCS Amb25238249 [0,0,0,0,0,0|3,0,1]=4 77 B6R0.4 CC(C)=CCCI Amb22395000 [0,0,0,0,0,0|3,0,1]=4 78 B6R0.4 CC(C)=CCCN Amb18962494 [0,0,0,0,0,0|3,0,1]=4 79 B6R0.4 CC(C)=CCCO Amb22002283 [0,0,0,0,0,0|3,0,1]=4 80 B6R0.4 CC(C)=NCCN Amb24479886 [0,0,0,0,0,0|4,0,0]=4 81 B6R0.4 CC(Cl)=CCCBr Amb24479000 [0,0,0,0,0,0|3,0,1]=4 82 B6R0.4 CC(Cl)CCCBr Amb24479119 [0,0,0,0,0,0|3,0,1]=4 83 B6R0.4 CC(Cl)CCCCl Amb19516004 [0,0,0,0,0,0|3,0,1]=4 84 B6R0.4 CC(Cl)CCCN Amb24479883 [0,0,0,0,0,0|3,0,1]=4 85 B6R0.4 CC(F)CCCN Amb25127855 [0,0,0,0,0,0|3,0,1]=4 86 B6R0.4 CC(I)=CCCN Amb25663209 [0,0,0,0,0,0|3,0,1]=4 87 B6R0.4 CC(I)CCCO Amb25302406 [0,0,0,0,0,0|3,0,1]=4 88 B6R0.4 CC(N)=NCCO Amb25083393 [0,0,0,0,0,0|4,0,0]=4 89 B6R0.4 CC(N)CCCBr Amb24635757 [0,0,0,0,0,0|3,0,1]=4 90 B6R0.4 CC(N)CCCCl Amb24454593 [0,0,0,0,0,0|3,0,1]=4 91 B6R0.4 CC(N)CCCN Amb22168271 [0,0,0,0,0,0|3,0,1]=4 92 B6R0.4 CC(O)CCC=C Amb22059013 [0,0,0,0,0,0|1,0,3]=4 93 B6R0.4 CC(O)CCCCl Amb22270232 [0,0,0,0,0,0|2,0,1]=3 94 B6R0.4 CC(O)CCCF Amb24385806 [0,0,0,0,0,0|2,0,1]=3 95 B6R0.4 CC(O)CCCO Amb22227752 [0,0,0,0,0,0|2,0,1]=3 96 B6R0.4 CC(O)CCCS Amb25219256 [0,0,0,0,0,0|2,0,1]=3 97 B6R0.4 CC(O)CCNN Amb24447142 [0,0,0,0,0,0|3,0,1]=4 98 B6R0.4 CC(O)CNCO Amb25727260 [0,0,0,0,0,0|3,0,1]=4 99 B6R0.4 CC(O)OCCCl Amb24523748 [0,0,0,0,0,0|3,0,1]=4 100 B6R0.4 CC(O)OCCS Amb25313392 [0,0,0,0,0,0|3,0,1]=4 101 B6R0.4 CC(S)CCCO Amb24412207 [0,0,0,0,0,0|2,1,1]=4 102 B6R0.4 CC=C=CC(=O)O Amb17593065 [0,0,0,0,0,0|0,0,3]=3 103 B6R0.4 CC=NCC(C)O Amb25213778 [0,0,0,0,0,0|2,0,2]=4 104 B6R0.4 CC=NNC(N)=O Amb24351023 [0,0,0,0,0,0|3,0,1]=4 105 B6R0.4 CCC#CC(=O)Cl Amb25857496 [0,0,0,0,0,0|1,0,2]=3 106 B6R0.4 CCC#CC(N)=O Amb25255265 [0,0,0,0,0,0|1,0,2]=3 107 B6R0.4 CCC=CB(O)O Amb24078362 [0,0,0,0,0,0|1,0,3]=4 108 B6R0.4 CCC=CC(C)=O Amb22731698 [0,0,0,0,0,0|1,0,2]=3 109 B6R0.4 CCCC=C(F)F Amb10840483 [0,0,0,0,0,0|2,0,1]=3 110 B6R0.4 CCCCB(Cl)Cl Amb22230362 [0,0,0,0,0,0|3,0,0]=3 111 B6R0.4 CCCCB(O)O Amb2447142 [0,0,0,0,0,0|1,0,1]=2 112 B6R0.4 CCCCC(=C)Br Amb22583744 [0,0,0,0,0,0|2,0,0]=2 113 B6R0.4 CCCCC(=N)N Amb10066937 [0,0,0,0,0,0|2,0,0]=2 114 B6R0.4 CCCCC(=O)Br Amb22730323 [0,0,0,0,0,0|1,0,0]=1 115 B6R0.4 CCCCC(Br)Br Amb25784787 [0,0,0,0,0,0|2,0,1]=3 116 B6R0.4 CCCCC(C)Cl Amb22228753 [0,0,0,0,0,0|2,0,1]=3 117 B6R0.4 CCCCC(C)F Amb24350567 [0,0,0,0,0,0|2,0,1]=3 118 B6R0.4 CCCCC(C)I Amb17673919 [0,0,0,0,0,0|2,0,1]=3 119 B6R0.4 CCCCC(I)I Amb25186537 [0,0,0,0,0,0|2,0,1]=3 120 B6R0.4 CCCCC(N)O Amb24479887 [0,0,0,0,0,0|1,0,1]=2 121 B6R0.4 CCCCC(O)=S Amb24682342 [0,0,0,0,0,0|0,1,0]=1 122 B6R0.4 CCCCC(O)O Amb24687253 [0,0,0,0,0,0|0,0,2]=2 123 B6R0.4 CCCCC(O)S Amb24480485 [0,0,0,0,0,0|0,1,1]=2 124 B6R0.4 CCCCC([O-])=O Amb19879370 [0,0,0,0,0,0|0,0,1]=1 125 B6R0.4 CCCCC([O-])=O Amb22056343 [0,0,0,0,0,0|0,0,1]=1 126 B6R0.4 CCCCC([O-])=O Amb22729192 [0,0,0,0,0,0|0,0,1]=1 127 B6R0.4 CCCCC([O-])=O Amb22731639 [0,0,0,0,0,0|0,0,1]=1 128 B6R0.4 CCCCN(C)N Amb22730468 [0,0,0,0,0,0|3,0,0]=3 129 B6R0.4 CCCCP(Cl)Cl Amb25051489 [0,0,0,0,0,0|3,0,0]=3 130 B6R0.4 CCCCS(=O)Cl Amb24551332 [0,0,0,0,0,0|2,0,0]=2 131 B6R0.4 CCCCS([O-])=O Amb19889352 [0,0,0,0,0,0|1,0,1]=2 132 B6R0.4 CCCC[13C](O)=O Amb22367454 [0,0,0,0,0,0|0,0,0]=0 133 B6R0.4 CCCC[C@@H](C)Br Amb25146346 [0,0,0,0,0,0|2,0,1]=3 134 B6R0.4 CCCC[C@@H](C)I Amb25785621 [0,0,0,0,0,0|2,0,1]=3 135 B6R0.4 CCCC[C@@H](C)N Amb20242479 [0,0,0,0,0,0|2,0,1]=3 136 B6R0.4 CCCC[C@@H](C)O Amb19929139 [0,0,0,0,0,0|1,0,1]=2 137 B6R0.4 CCCC[C@H](C)Br Amb25374601 [0,0,0,0,0,0|2,0,1]=3 138 B6R0.4 CCCC[C@H](C)N Amb20242478 [0,0,0,0,0,0|2,0,1]=3 139 B6R0.4 CCCC[Sn](=O)S Amb22730994 [0,0,0,0,0,0|1,1,0]=2 140 B6R0.4 CCCC[Sn](O)=O Amb22336393 [0,0,0,0,0,0|1,0,0]=1 141 B6R0.4 CCCNC(=N)N Amb10844865 [0,0,0,0,0,0|3,0,0]=3 142 B6R0.4 CCCNC(=N)N Amb16206147 [0,0,0,0,0,0|3,0,0]=3 143 B6R0.4 CCCNC(=O)Cl Amb25688616 [0,0,0,0,0,0|2,0,0]=2 144 B6R0.4 CCCNC(=O)N Amb1152241 [0,0,0,0,0,0|2,0,0]=2 145 B6R0.4 CCCNC(=S)N Amb1152085 [0,0,0,0,0,0|2,1,0]=3 146 B6R0.4 CCCNC(C)=S Amb25742111 [0,0,0,0,0,0|2,1,0]=3 147 B6R0.4 CCCNC(C)O Amb25821613 [0,0,0,0,0,0|2,0,1]=3 148 B6R0.4 CCCNC(N)=N Amb20667746 [0,0,0,0,0,0|3,0,0]=3 149 B6R0.4 CCCNC(O)=S Amb25302945 [0,0,0,0,0,0|1,1,0]=2 150 B6R0.4 CCCNN(C)C Amb25791383 [0,0,0,0,0,0|4,0,0]=4 151 B6R0.4 CCCNS(C)=O Amb25024775 [0,0,0,0,0,0|3,0,0]=3 152 B6R0.4 CCCN[N+]([O-])=O Amb21953652 [0,0,0,0,0,0|2,0,1]=3 153 B6R0.4 CCCOC(=O)Cl Amb10604123 [0,0,0,0,0,0|2,0,0]=2 154 B6R0.4 CCCOC(N)=S Amb24382119 [0,0,0,0,0,0|2,1,0]=3 155 B6R0.4 CCCOC([S-])=S Amb22334111 [0,0,0,0,0,0|1,2,0]=3 156 B6R0.4 CCCOP(O)=O Amb25366595 [0,0,0,0,0,0|2,0,0]=2 157 B6R0.4 CCCO[N+]([O-])=O Amb22732564 [0,0,0,0,0,0|2,0,1]=3 158 B6R0.4 CCCSC(C)=O Amb22043301 [0,0,0,0,0,0|2,0,0]=2 159 B6R0.4 CCCSC(C)Cl Amb24478992 [0,0,0,0,0,0|3,0,1]=4 160 B6R0.4 CCCSC(N)=N Amb20676008 [0,0,0,0,0,0|3,0,0]=3 161 B6R0.4 CCCSC(N)=N Amb23482968 [0,0,0,0,0,0|3,0,0]=3 162 B6R0.4 CCCSC(N)=S Amb24349580 [0,0,0,0,0,0|2,1,0]=3 163 B6R0.4 CCNC=C(C)C Amb25224644 [0,0,0,0,0,0|3,0,1]=4 164 B6R0.4 CCNCC(=C)Br Amb18969562 [0,0,0,0,0,0|3,0,0]=3 165 B6R0.4 CCNCC(=C)Cl Amb18289297 [0,0,0,0,0,0|3,0,0]=3 166 B6R0.4 CCNCC(=O)N Amb1128676 [0,0,0,0,0,0|2,0,0]=2 167 B6R0.4 CCNCC(=O)O Amb10609667 [0,0,0,0,0,0|1,0,0]=1 168 B6R0.4 CCNCC(=S)N Amb17231834 [0,0,0,0,0,0|2,1,0]=3 169 B6R0.4 CCNCC(C)=O Amb24545893 [0,0,0,0,0,0|2,0,0]=2 170 B6R0.4 CCNCC(C)Cl Amb25759481 [0,0,0,0,0,0|3,0,1]=4 171 B6R0.4 CCNCC(C)F Amb24743616 [0,0,0,0,0,0|3,0,1]=4 172 B6R0.4 CCNCC(C)N Amb18299415 [0,0,0,0,0,0|3,0,1]=4 173 B6R0.4 CCNCC(C)S Amb18640729 [0,0,0,0,0,0|2,1,1]=4 174 B6R0.4 CCNCC(Cl)Cl Amb24479799 [0,0,0,0,0,0|3,0,1]=4 175 B6R0.4 CCNCC(F)F Amb22896471 [0,0,0,0,0,0|3,0,1]=4 176 B6R0.4 CCNC[C@H](C)N Amb24720969 [0,0,0,0,0,0|3,0,1]=4 177 B6R0.4 CCNC[C@H](C)O Amb25785620 [0,0,0,0,0,0|2,0,1]=3 178 B6R0.4 CCNNC(N)=S Amb19148042 [0,0,0,0,0,0|3,1,0]=4 179 B6R0.4 CCN\N=C(\C)/N Amb24479322 [0,0,0,0,0,0|4,0,0]=4 180 B6R0.4 CCOCB(O)O Amb25356792 [0,0,0,0,0,0|2,0,1]=3 181 B6R0.4 CCOCC(=C)Br Amb24673237 [0,0,0,0,0,0|3,0,0]=3 182 B6R0.4 CCOCC(C)=C Amb25761593 [0,0,0,0,0,0|3,0,0]=3 183 B6R0.4 CCOCC(C)C Amb17673917 [0,0,0,0,0,0|3,0,1]=4 184 B6R0.4 CCOCC(C)Cl Amb24429086 [0,0,0,0,0,0|3,0,1]=4 185 B6R0.4 CCOCC(N)=N Amb19890012 [0,0,0,0,0,0|3,0,0]=3 186 B6R0.4 CCOCC(N)C Amb10610346 [0,0,0,0,0,0|3,0,1]=4 187 B6R0.4 CCOCC(N)C Amb1133021 [0,0,0,0,0,0|3,0,1]=4 188 B6R0.4 CCOC[C@@H](C)N Amb18016634 [0,0,0,0,0,0|3,0,1]=4 189 B6R0.4 CCOC[C@@H](N)C Amb17061642 [0,0,0,0,0,0|3,0,1]=4 190 B6R0.4 CCOC[C@H](C)O Amb25067464 [0,0,0,0,0,0|2,0,1]=3 191 B6R0.4 CCON=C(C)N Amb25046559 [0,0,0,0,0,0|4,0,0]=4 192 B6R0.4 CCONC(C)=O Amb22230675 [0,0,0,0,0,0|3,0,0]=3 193 B6R0.4 CCONC(N)=N Amb25783705 [0,0,0,0,0,0|4,0,0]=4 194 B6R0.4 CCSCC(=O)O Amb1125185 [0,0,0,0,0,0|1,0,0]=1 195 B6R0.4 CCSCC(C)Br Amb25108973 [0,0,0,0,0,0|3,0,1]=4 196 B6R0.4 CCSCC(C)C Amb22230686 [0,0,0,0,0,0|3,0,1]=4 197 B6R0.4 CCSCC(C)N Amb19149261 [0,0,0,0,0,0|3,0,1]=4 198 B6R0.4 CCSCC(C)O Amb24458211 [0,0,0,0,0,0|2,0,1]=3 199 B6R0.4 CCSCC(N)=O Amb24420234 [0,0,0,0,0,0|2,0,0]=2 200 B6R0.4 CCSC[C@H](C)O Amb25220206 [0,0,0,0,0,0|2,0,1]=3 201 B6R0.4 CCSNC(N)=O Amb24479375 [0,0,0,0,0,0|3,0,0]=3 202 B6R0.4 CC\C=C/C(O)=O Amb22230421 [0,0,0,0,0,0|0,0,2]=2 203 B6R0.4 CC\C=C\B(O)O Amb17610159 [0,0,0,0,0,0|1,0,3]=4 204 B6R0.4 CC\C=C\C(N)=N Amb24699380 [0,0,0,0,0,0|2,0,2]=4 205 B6R0.4 CC\C=C\C(N)=O Amb25770876 [0,0,0,0,0,0|1,0,2]=3 206 B6R0.4 CC\C=C\[N+]([O-])=O Amb25190046 [0,0,0,0,0,0|1,0,3]=4 207 B6R0.4 CC\C=N\C(N)=O Amb24479183 [0,0,0,0,0,0|2,0,1]=3 208 B6R0.4 CN(C)CCCF Amb25719076 [0,0,0,0,0,0|4,0,0]=4 209 B6R0.4 CN(C)CCCS Amb24078629 [0,0,0,0,0,0|4,0,0]=4 210 B6R0.4 CN(N)CCCN Amb18640289 [0,0,0,0,0,0|4,0,0]=4 211 B6R0.4 CN(N)CCCO Amb25236057 [0,0,0,0,0,0|4,0,0]=4 212 B6R0.4 CN=C=CC(C)=O Amb25233778 [0,0,0,0,0,0|2,0,2]=4 213 B6R0.4 CN=CCC(C)=O Amb25261368 [0,0,0,0,0,0|2,0,1]=3 214 B6R0.4 CN=CNC(N)=O Amb24561634 [0,0,0,0,0,0|3,0,1]=4 215 B6R0.4 CNCC=C(C)C Amb18121215 [0,0,0,0,0,0|3,0,1]=4 216 B6R0.4 CNCC=C(Cl)Cl Amb25844485 [0,0,0,0,0,0|3,0,1]=4 217 B6R0.4 CNCCC(=O)O Amb10609760 [0,0,0,0,0,0|1,0,0]=1 218 B6R0.4 CNCCC(=S)N Amb17231833 [0,0,0,0,0,0|2,1,0]=3 219 B6R0.4 CNCCC(C)=C Amb18993045 [0,0,0,0,0,0|3,0,0]=3 220 B6R0.4 CNCCC(C)=O Amb24560306 [0,0,0,0,0,0|2,0,0]=2 221 B6R0.4 CNCCC(C)Br Amb25718866 [0,0,0,0,0,0|3,0,1]=4 222 B6R0.4 CNCCC(C)C Amb10609494 [0,0,0,0,0,0|3,0,1]=4 223 B6R0.4 CNCCC(C)C Amb1114399 [0,0,0,0,0,0|3,0,1]=4 224 B6R0.4 CNCCC(C)Cl Amb24479264 [0,0,0,0,0,0|3,0,1]=4 225 B6R0.4 CNCCC(C)N Amb18288833 [0,0,0,0,0,0|3,0,1]=4 226 B6R0.4 CNCCC(N)=O Amb19959913 [0,0,0,0,0,0|2,0,0]=2 227 B6R0.4 CNCCC(O)C Amb17569889 [0,0,0,0,0,0|2,0,1]=3 228 B6R0.4 CNCCN(C)C Amb19958398 [0,0,0,0,0,0|4,0,0]=4 229 B6R0.4 CNCCN(C)C Amb20621873 [0,0,0,0,0,0|4,0,0]=4 230 B6R0.4 CNCCN(C)N Amb18122212 [0,0,0,0,0,0|4,0,0]=4 231 B6R0.4 CNCCS(C)=O Amb21984676 [0,0,0,0,0,0|3,0,0]=3 232 B6R0.4 CNCC[C@H](C)N Amb25825236 [0,0,0,0,0,0|3,0,1]=4 233 B6R0.4 CNC\C=C(\C)/Cl Amb25041057 [0,0,0,0,0,0|3,0,1]=4 234 B6R0.4 CNN=CC(C)=O Amb24481082 [0,0,0,0,0,0|3,0,1]=4 235 B6R0.4 CNNCC(N)=O Amb25773971 [0,0,0,0,0,0|3,0,0]=3 236 B6R0.4 CNNCC(O)=O Amb21929288 [0,0,0,0,0,0|2,0,0]=2 237 B6R0.4 CNOCC(C)=C Amb25235106 [0,0,0,0,0,0|4,0,0]=4 238 B6R0.4 CNOCC(O)=O Amb25104714 [0,0,0,0,0,0|2,0,0]=2 239 B6R0.4 CN\C=C/C(C)=O Amb24646447 [0,0,0,0,0,0|2,0,2]=4 240 B6R0.4 CN\C=C\C(=O)C Amb17593076 [0,0,0,0,0,0|2,0,2]=4 241 B6R0.4 CN\C=C\C(N)=O Amb24621805 [0,0,0,0,0,0|2,0,2]=4 242 B6R0.4 COCCC(C)Br Amb18805533 [0,0,0,0,0,0|3,0,1]=4 243 B6R0.4 COCCC(C)O Amb20621489 [0,0,0,0,0,0|2,0,1]=3 244 B6R0.4 COCCC(Cl)Cl Amb24415061 [0,0,0,0,0,0|3,0,1]=4 245 B6R0.4 COCCC(N)O Amb25727188 [0,0,0,0,0,0|2,0,1]=3 246 B6R0.4 COCCC(O)Br Amb20242943 [0,0,0,0,0,0|2,0,1]=3 247 B6R0.4 COCCN(=O)=O Amb24126452 [0,0,0,0,0,0|2,0,1]=3 248 B6R0.4 COCCN(C)C Amb16231530 [0,0,0,0,0,0|4,0,0]=4 249 B6R0.4 COCCN(C)N Amb25326276 [0,0,0,0,0,0|4,0,0]=4 250 B6R0.4 COCNC(C)=O Amb24659843 [0,0,0,0,0,0|3,0,0]=3 251 B6R0.4 COCNC(N)=O Amb25744350 [0,0,0,0,0,0|3,0,0]=3 252 B6R0.4 CON=CC(C)=O Amb25236948 [0,0,0,0,0,0|3,0,1]=4 253 B6R0.4 CON=CC(N)=O Amb24719410 [0,0,0,0,0,0|3,0,1]=4 254 B6R0.4 CON=CC(O)=O Amb25292253 [0,0,0,0,0,0|2,0,1]=3 255 B6R0.4 CONCC(C)=C Amb24479610 [0,0,0,0,0,0|4,0,0]=4 256 B6R0.4 CONC[C@H](C)O Amb25721782 [0,0,0,0,0,0|3,0,1]=4 257 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [0,0,0,0,0,0|2,0,2]=4 258 B6R0.4 CO\C=C\C(O)=O Amb18121767 [0,0,0,0,0,0|1,0,2]=3 259 B6R0.4 CO\N=C\C(=O)O Amb10976081 [0,0,0,0,0,0|2,0,1]=3 260 B6R0.4 CO\N=C\C(N)=O Amb24663668 [0,0,0,0,0,0|3,0,1]=4 261 B6R0.4 CP(=O)OCCO Amb25221445 [0,0,0,0,0,0|4,0,0]=4 262 B6R0.4 CP(O)OCCN Amb25127648 [0,0,0,0,0,0|4,0,0]=4 263 B6R0.4 CS(=O)CCC#N Amb18641926 [0,0,0,0,0,0|3,0,1]=4 264 B6R0.4 CS(=O)CCCBr Amb24365916 [0,0,0,0,0,0|3,0,0]=3 265 B6R0.4 CS(=O)CCCN Amb18974527 [0,0,0,0,0,0|3,0,0]=3 266 B6R0.4 CS(=O)CCNN Amb25810588 [0,0,0,0,0,0|4,0,0]=4 267 B6R0.4 CS(=O)CCON Amb25368924 [0,0,0,0,0,0|4,0,0]=4 268 B6R0.4 CS(=O)NCCI Amb24662928 [0,0,0,0,0,0|4,0,0]=4 269 B6R0.4 CSC#CC(N)=O Amb24479847 [0,0,0,0,0,0|2,0,2]=4 270 B6R0.4 CSCCC(=S)N Amb17307559 [0,0,0,0,0,0|2,1,0]=3 271 B6R0.4 CSCCC(C)F Amb25853953 [0,0,0,0,0,0|3,0,1]=4 272 B6R0.4 CSCCC(C)N Amb19515505 [0,0,0,0,0,0|3,0,1]=4 273 B6R0.4 CSCCC(Cl)Cl Amb24333252 [0,0,0,0,0,0|3,0,1]=4 274 B6R0.4 CSCCC(N)=N Amb19373501 [0,0,0,0,0,0|3,0,0]=3 275 B6R0.4 CSCCC(N)=N Amb19516878 [0,0,0,0,0,0|3,0,0]=3 276 B6R0.4 CSCCC(N)=O Amb24479809 [0,0,0,0,0,0|2,0,0]=2 277 B6R0.4 CSCCN(=O)=O Amb24179458 [0,0,0,0,0,0|2,0,1]=3 278 B6R0.4 CSCCN(C)C Amb24611721 [0,0,0,0,0,0|4,0,0]=4 279 B6R0.4 CSCNC(C)=O Amb24561383 [0,0,0,0,0,0|3,0,0]=3 280 B6R0.4 CSCNC(N)=O Amb24612362 [0,0,0,0,0,0|3,0,0]=3 281 B6R0.4 CSCOC(C)=O Amb19884027 [0,0,0,0,0,0|3,0,0]=3 282 B6R0.4 CSSCC(N)=O Amb24480454 [0,0,0,0,0,0|3,0,0]=3 283 B6R0.4 CSSCC(O)=O Amb25378801 [0,0,0,0,0,0|2,0,0]=2 284 B6R0.4 CS\C=C\C(C)=O Amb25768455 [0,0,0,0,0,0|2,0,2]=4 285 B6R0.4 CS\C=C\C(N)=O Amb24507669 [0,0,0,0,0,0|2,0,2]=4 286 B6R0.4 CS\C=C\C(O)=O Amb18641964 [0,0,0,0,0,0|1,0,2]=3 287 B6R0.4 C[C@@H](O)CCC#N Amb24644182 [0,0,0,0,0,0|2,0,2]=4 288 B6R0.4 C[C@@H](O)CCC=C Amb19929324 [0,0,0,0,0,0|1,0,3]=4 289 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [0,0,0,0,0,0|2,0,1]=3 290 B6R0.4 C[C@@H](O)CCCN Amb24479875 [0,0,0,0,0,0|2,0,1]=3 291 B6R0.4 C[C@@H](O)CCCS Amb25794939 [0,0,0,0,0,0|2,0,1]=3 292 B6R0.4 C[C@H](Cl)CCCO Amb24525158 [0,0,0,0,0,0|3,0,1]=4 293 B6R0.4 C[C@H](O)CCC=C Amb22226511 [0,0,0,0,0,0|1,0,3]=4 294 B6R0.4 C[C@H](O)CCCCl Amb22348392 [0,0,0,0,0,0|2,0,1]=3 295 B6R0.4 C[Si](=O)CCCN Amb22351702 [0,0,0,0,0,0|2,1,0]=3 296 B6R0.4 C\C(\Br)=C\CCCl Amb25374563 [0,0,0,0,0,0|3,0,1]=4 297 B6R0.4 C\C=C/CC(C)=O Amb25723218 [0,0,0,0,0,0|1,0,2]=3 298 B6R0.4 C\C=C/CC(O)=O Amb25692581 [0,0,0,0,0,0|0,0,2]=2 299 B6R0.4 C\C=C\CC(C)=O Amb24359011 [0,0,0,0,0,0|1,0,2]=3 300 B6R0.4 C\C=C\CC(C)O Amb24480541 [0,0,0,0,0,0|1,0,3]=4 301 B6R0.4 C\C=C\CC(N)=N Amb25176208 [0,0,0,0,0,0|2,0,2]=4 302 B6R0.4 C\C=C\CC(N)=S Amb24401512 [0,0,0,0,0,0|1,1,2]=4 303 B6R0.4 C\C=C\CC(O)O Amb25803009 [0,0,0,0,0,0|0,0,4]=4 304 B6R0.4 C\C=C\NC(N)=O Amb25340023 [0,0,0,0,0,0|2,0,2]=4 305 B6R0.4 C\C=N\CC(O)=O Amb24618330 [0,0,0,0,0,0|1,0,1]=2 306 B6R0.4 ClC(=O)OCC#C Amb13777322 [0,0,0,0,0,0|2,0,2]=4 307 B6R0.4 ClCCCB(Cl)Cl Amb25146540 [0,0,0,0,0,0|4,0,0]=4 308 B6R0.4 ClCCCC(=O)N Amb1138237 [0,0,0,0,0,0|2,0,0]=2 309 B6R0.4 ClCCCC(Cl)Cl Amb25343250 [0,0,0,0,0,0|3,0,1]=4 310 B6R0.4 ClCCCN(Cl)Cl Amb24737855 [0,0,0,0,0,0|4,0,0]=4 311 B6R0.4 ClCCCP(Cl)Cl Amb24739886 [0,0,0,0,0,0|4,0,0]=4 312 B6R0.4 ClCCN=C(Cl)Cl Amb24428506 [0,0,0,0,0,0|4,0,0]=4 313 B6R0.4 FC(=S)SCCCl Amb24763368 [0,0,0,0,0,0|3,1,0]=4 314 B6R0.4 FC(F)=CCCCl Amb19895470 [0,0,0,0,0,0|3,0,1]=4 315 B6R0.4 FC(F)=CCCI Amb24694158 [0,0,0,0,0,0|3,0,1]=4 316 B6R0.4 FCCCC(=O)O Amb17593104 [0,0,0,0,0,0|1,0,0]=1 317 B6R0.4 N#CCCB(O)O Amb25781253 [0,0,0,0,0,0|2,0,2]=4 318 B6R0.4 N#CCCC(=O)C Amb17334046 [0,0,0,0,0,0|2,0,1]=3 319 B6R0.4 N#CCCC(=O)Cl Amb25106570 [0,0,0,0,0,0|2,0,1]=3 320 B6R0.4 N#CCCC(=S)Cl Amb16232250 [0,0,0,0,0,0|2,1,1]=4 321 B6R0.4 N#CCNC(=O)S Amb25025696 [0,0,0,0,0,0|2,1,1]=4 322 B6R0.4 N#CCOC(=O)Cl Amb25079539 [0,0,0,0,0,0|3,0,1]=4 323 B6R0.4 N#CNCC(O)=O Amb25173813 [0,0,0,0,0,0|2,0,1]=3 324 B6R0.4 N#CSCC(O)=O Amb24480976 [0,0,0,0,0,0|2,0,1]=3 325 B6R0.4 N#C\C=C\C(O)=O Amb25853809 [0,0,0,0,0,0|1,0,3]=4 326 B6R0.4 N=CNCC(O)=O Amb24670244 [0,0,0,0,0,0|2,0,1]=3 327 B6R0.4 NC(=N)NCCCl Amb25026257 [0,0,0,0,0,0|4,0,0]=4 328 B6R0.4 NC(=N)NCCF Amb24479817 [0,0,0,0,0,0|4,0,0]=4 329 B6R0.4 NC(=N)NCCO Amb16231403 [0,0,0,0,0,0|4,0,0]=4 330 B6R0.4 NC(=N)NCCO Amb24271072 [0,0,0,0,0,0|4,0,0]=4 331 B6R0.4 NC(=N)NCCS Amb22362676 [0,0,0,0,0,0|4,0,0]=4 332 B6R0.4 NC(=N)NCCS |$1/2 [0,0,0,0,0,0|4,0,0]=4 333 B6R0.4 NC(=N)OCCO Amb24764250 [0,0,0,0,0,0|4,0,0]=4 334 B6R0.4 NC(=N)SCCBr Amb25792105 [0,0,0,0,0,0|4,0,0]=4 335 B6R0.4 NC(=N)SCCO Amb1160204 [0,0,0,0,0,0|4,0,0]=4 336 B6R0.4 NC(=O)CC=NO Amb24605273 [0,0,0,0,0,0|3,0,1]=4 337 B6R0.4 NC(=O)CCCBr Amb25779163 [0,0,0,0,0,0|2,0,0]=2 338 B6R0.4 NC(=O)CCCO Amb20623438 [0,0,0,0,0,0|2,0,0]=2 339 B6R0.4 NC(=O)CNC#N Amb25348370 [0,0,0,0,0,0|3,0,1]=4 340 B6R0.4 NC(=O)CNC=O Amb25770889 [0,0,0,0,0,0|3,0,1]=4 341 B6R0.4 NC(=O)CSC#N Amb24378114 [0,0,0,0,0,0|3,0,1]=4 342 B6R0.4 NC(=O)CSCCl Amb25135617 [0,0,0,0,0,0|3,0,0]=3 343 B6R0.4 NC(=O)NCC#N Amb20622301 [0,0,0,0,0,0|3,0,1]=4 344 B6R0.4 NC(=O)NCCO Amb1146041 [0,0,0,0,0,0|3,0,0]=3 345 B6R0.4 NC(=O)NCN=O Amb22490284 [0,0,0,0,0,0|4,0,0]=4 346 B6R0.4 NC(=O)OCC#N Amb24682691 [0,0,0,0,0,0|3,0,1]=4 347 B6R0.4 NC(=O)OCC=O Amb24446581 [0,0,0,0,0,0|3,0,1]=4 348 B6R0.4 NC(=O)OCCBr Amb25145573 [0,0,0,0,0,0|3,0,0]=3 349 B6R0.4 NC(=O)OCCO Amb20623788 [0,0,0,0,0,0|3,0,0]=3 350 B6R0.4 NC(=O)SCC#N Amb24479908 [0,0,0,0,0,0|3,0,1]=4 351 B6R0.4 NC(=O)\C=C\CBr Amb25109131 [0,0,0,0,0,0|2,0,2]=4 352 B6R0.4 NC(=O)\C=C\CCl Amb25328319 [0,0,0,0,0,0|2,0,2]=4 353 B6R0.4 NC(=S)CCC#N Amb24507608 [0,0,0,0,0,0|2,1,1]=4 354 B6R0.4 NC(=S)CCC=N Amb24681956 [0,0,0,0,0,0|2,1,1]=4 355 B6R0.4 NC(=S)CCCF Amb24667655 [0,0,0,0,0,0|2,1,0]=3 356 B6R0.4 NC(=S)NCCO Amb19515723 [0,0,0,0,0,0|3,1,0]=4 357 B6R0.4 NC(=S)NCCS Amb19374848 [0,0,0,0,0,0|3,1,0]=4 358 B6R0.4 NC(=S)OCCO Amb24581246 [0,0,0,0,0,0|3,1,0]=4 359 B6R0.4 NC(N)=NCCO Amb19374418 [0,0,0,0,0,0|4,0,0]=4 360 B6R0.4 NC(N)=NCCS Amb25127300 [0,0,0,0,0,0|4,0,0]=4 361 B6R0.4 NCC#CC(O)=O Amb25703096 [0,0,0,0,0,0|1,0,2]=3 362 B6R0.4 NCCC=C(Cl)Cl Amb24479884 [0,0,0,0,0,0|3,0,1]=4 363 B6R0.4 NCCC=C(F)F Amb25837048 [0,0,0,0,0,0|3,0,1]=4 364 B6R0.4 NCCCC(=O)Cl Amb1935063 [0,0,0,0,0,0|2,0,0]=2 365 B6R0.4 NCCCC(=O)N Amb2099583 [0,0,0,0,0,0|2,0,0]=2 366 B6R0.4 NCCCC(=O)O Amb1935210 [0,0,0,0,0,0|1,0,0]=1 367 B6R0.4 NCCCC(C)C Amb1136518 [0,0,0,0,0,0|3,0,1]=4 368 B6R0.4 NCCCC(C)C Amb13952127 [0,0,0,0,0,0|3,0,1]=4 369 B6R0.4 NCCCC(Cl)=O Amb17801145 [0,0,0,0,0,0|2,0,0]=2 370 B6R0.4 NCCCC(F)F Amb20670479 [0,0,0,0,0,0|3,0,1]=4 371 B6R0.4 NCCCC(N)=S Amb24479598 [0,0,0,0,0,0|2,1,0]=3 372 B6R0.4 NCCCC(N)O Amb25063002 [0,0,0,0,0,0|2,0,1]=3 373 B6R0.4 NCCCP(O)=O Amb22370049 [0,0,0,0,0,0|2,0,0]=2 374 B6R0.4 NCCCS(=O)=O Amb24427014 [0,0,0,0,0,0|2,0,1]=3 375 B6R0.4 NCCCS(O)=O Amb25185942 [0,0,0,0,0,0|2,0,0]=2 376 B6R0.4 NCCC[N+]([O-])=O Amb18833132 [0,0,0,0,0,0|2,0,1]=3 377 B6R0.4 NCCNC(N)=O Amb19374121 [0,0,0,0,0,0|3,0,0]=3 378 B6R0.4 NCCNC(N)=S Amb20619929 [0,0,0,0,0,0|3,1,0]=4 379 B6R0.4 NCCN[N+]([O-])=O Amb25088882 [0,0,0,0,0,0|3,0,1]=4 380 B6R0.4 NCCOC(N)=N Amb25368790 [0,0,0,0,0,0|4,0,0]=4 381 B6R0.4 NCCOC(N)=O Amb22059480 [0,0,0,0,0,0|3,0,0]=3 382 B6R0.4 NCCOC(N)=O Amb24271076 [0,0,0,0,0,0|3,0,0]=3 383 B6R0.4 NCCOS(O)=O Amb25843211 [0,0,0,0,0,0|3,0,0]=3 384 B6R0.4 NCCO[N+]([O-])=O Amb22732697 [0,0,0,0,0,0|3,0,1]=4 385 B6R0.4 NCCSC(=N)N Amb1146037 [0,0,0,0,0,0|4,0,0]=4 386 B6R0.4 NCCSC(=N)N Amb16232991 [0,0,0,0,0,0|4,0,0]=4 387 B6R0.4 NCCSC(N)=N Amb20246833 [0,0,0,0,0,0|4,0,0]=4 388 B6R0.4 NCCSC(N)=S Amb25368175 [0,0,0,0,0,0|3,1,0]=4 389 B6R0.4 NC\C=C/C(O)=O Amb24117018 [0,0,0,0,0,0|1,0,2]=3 390 B6R0.4 NC\C=C/P(O)=O Amb22011758 [0,0,0,0,0,0|2,0,2]=4 391 B6R0.4 NC\C=C\C(O)=O Amb18639655 [0,0,0,0,0,0|1,0,2]=3 392 B6R0.4 NC\C=C\C(O)=O Amb24325004 [0,0,0,0,0,0|1,0,2]=3 393 B6R0.4 NC\C=C\P(O)=O Amb25136979 [0,0,0,0,0,0|2,0,2]=4 394 B6R0.4 NNCCC(N)=O Amb24406769 [0,0,0,0,0,0|3,0,0]=3 395 B6R0.4 NN\C=C\C(O)=O Amb25849332 [0,0,0,0,0,0|2,0,2]=4 396 B6R0.4 NOCCC(=O)O Amb17569891 [0,0,0,0,0,0|2,0,0]=2 397 B6R0.4 O=C(Br)CCCBr Amb25724818 [0,0,0,0,0,0|2,0,0]=2 398 B6R0.4 O=C(Br)CCCCl Amb25146320 [0,0,0,0,0,0|2,0,0]=2 399 B6R0.4 O=C(Cl)C\C=C\Cl Amb24531407 [0,0,0,0,0,0|2,0,2]=4 400 B6R0.4 O=C(Cl)NCCCl Amb24479815 [0,0,0,0,0,0|3,0,0]=3 401 B6R0.4 O=C(Cl)OCCF Amb21618836 [0,0,0,0,0,0|3,0,0]=3 402 B6R0.4 O=C(Cl)SCCCl Amb25272444 [0,0,0,0,0,0|3,0,0]=3 403 B6R0.4 O=C(Cl)\C=C\CBr Amb25747116 [0,0,0,0,0,0|2,0,2]=4 404 B6R0.4 O=C(Cl)\C=C\CCl Amb24531479 [0,0,0,0,0,0|2,0,2]=4 405 B6R0.4 O=C(S)CCCCl Amb24683280 [0,0,0,0,0,0|1,1,0]=2 406 B6R0.4 O=CCCC(O)C Amb17593090 [0,0,0,0,0,0|2,0,2]=4 407 B6R0.4 O=CCOC(=O)C Amb10070247 [0,0,0,0,0,0|3,0,1]=4 408 B6R0.4 O=CNCC(=O)O Amb1911508 [0,0,0,0,0,0|2,0,1]=3 409 B6R0.4 O=S(Cl)CCCCl Amb25791632 [0,0,0,0,0,0|3,0,0]=3 410 B6R0.4 OB(O)CCCBr Amb24480413 [0,0,0,0,0,0|2,0,1]=3 411 B6R0.4 OC(=O)CCC=O Amb17673897 [0,0,0,0,0,0|1,0,1]=2 412 B6R0.4 OC(=O)CCCI Amb22295911 [0,0,0,0,0,0|1,0,0]=1 413 B6R0.4 OC(=O)CCCP Amb24717184 [0,0,0,0,0,0|1,0,0]=1 414 B6R0.4 OC(=O)CCNCl Amb24437846 [0,0,0,0,0,0|2,0,0]=2 415 B6R0.4 OC(=O)CN=C=S Amb25024397 [0,0,0,0,0,0|2,0,1]=3 416 B6R0.4 OC(=O)CSN=O Amb24368923 [0,0,0,0,0,0|3,0,0]=3 417 B6R0.4 OC(=O)C\C=C\Br Amb24511491 [0,0,0,0,0,0|1,0,2]=3 418 B6R0.4 OC(=O)C\C=C\Cl Amb25111871 [0,0,0,0,0,0|1,0,2]=3 419 B6R0.4 OC(=O)C\C=C\I Amb24507704 [0,0,0,0,0,0|1,0,2]=3 420 B6R0.4 OC(=O)\C=C/OI Amb24418427 [0,0,0,0,0,0|2,0,2]=4 421 B6R0.4 OC(=O)\C=C\CBr Amb18646194 [0,0,0,0,0,0|1,0,2]=3 422 B6R0.4 OC(=O)\C=C\CCl Amb23399655 [0,0,0,0,0,0|1,0,2]=3 423 B6R0.4 OC(=O)\C=C\CF Amb24117236 [0,0,0,0,0,0|1,0,2]=3 424 B6R0.4 OC(=O)\C=C\CI Amb25350297 [0,0,0,0,0,0|1,0,2]=3 425 B6R0.4 OC(=O)\C=C\CS Amb18285239 [0,0,0,0,0,0|1,0,2]=3 426 B6R0.4 OC(=O)\C=C\I=O Amb25075597 [0,0,0,0,0,0|2,0,2]=4 427 B6R0.4 OC(=O)\C=C\OI Amb24655000 [0,0,0,0,0,0|2,0,2]=4 428 B6R0.4 OC(O)OCCCl Amb24079935 [0,0,0,0,0,0|2,0,2]=4 429 B6R0.4 OCC#CC(O)=O Amb22002375 [0,0,0,0,0,0|1,0,2]=3 430 B6R0.4 OCCC=C(Cl)Cl Amb17593563 [0,0,0,0,0,0|3,0,1]=4 431 B6R0.4 OCCC=C(F)F Amb25325725 [0,0,0,0,0,0|3,0,1]=4 432 B6R0.4 OCCCC(=O)O Amb17615189 [0,0,0,0,0,0|1,0,0]=1 433 B6R0.4 OCCCC(Cl)Cl Amb25811607 [0,0,0,0,0,0|3,0,1]=4 434 B6R0.4 OCCCC(N)C Amb17569888 [0,0,0,0,0,0|3,0,1]=4 435 B6R0.4 OCCCC(O)=O Amb18640332 [0,0,0,0,0,0|1,0,0]=1 436 B6R0.4 OCCCC(O)O Amb22802459 [0,0,0,0,0,0|1,0,2]=3 437 B6R0.4 OCCNC(S)=S Amb24677548 [0,0,0,0,0,0|2,2,0]=4 438 B6R0.4 OCCNS(O)=O Amb25283153 [0,0,0,0,0,0|3,0,0]=3 439 B6R0.4 OCCOC(=O)S Amb25106059 [0,0,0,0,0,0|2,1,0]=3 440 B6R0.4 OCCOC([S-])=S Amb25846944 [0,0,0,0,0,0|2,2,0]=4 441 B6R0.4 OCCOP(O)=O Amb25739645 [0,0,0,0,0,0|3,0,0]=3 442 B6R0.4 OCCOS(=O)=O Amb24686082 [0,0,0,0,0,0|3,0,1]=4 443 B6R0.4 OCCOS(O)=O Amb17942859 [0,0,0,0,0,0|3,0,0]=3 444 B6R0.4 OCCSC(S)=S Amb25762072 [0,0,0,0,0,0|2,2,0]=4 445 B6R0.4 ON=NCC(O)=O Amb25204101 [0,0,0,0,0,0|3,0,0]=3 446 B6R0.4 ON\C=C\C(O)=O Amb25058383 [0,0,0,0,0,0|2,0,2]=4 447 B6R0.4 OP(=O)OCCCl Amb24479734 [0,0,0,0,0,0|3,0,0]=3 448 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [0,0,0,0,0,0|1,0,0]=1 449 B6R0.4 SCCCC(=O)O Amb16185429 [0,0,0,0,0,0|1,0,0]=1 450 B6R0.4 SCCNC(=N)N Amb10067175 [0,0,0,0,0,0|4,0,0]=4 451 B6R0.4 [C-]#[N+]CCC(N)=O Amb24411954 [0,0,0,0,0,0|2,0,1]=3 452 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [0,0,0,0,0,0|3,0,0]=3 453 B6R0.4 [O-]C(=O)OCCBr Amb24394548 [0,0,0,0,0,0|2,0,1]=3 454 B6R0.4 [O-][N+](=O)CCC=O Amb24052990 [0,0,0,0,0,0|2,0,2]=4 455 B6R0.4 [O-][N+](=O)CCCCl Amb25267487 [0,0,0,0,0,0|2,0,1]=3 456 B6R0.4 [O-][N+](=O)CCCF Amb25234942 [0,0,0,0,0,0|2,0,1]=3 457 B6R0.4 [O-][N+](=O)CCCO Amb20247690 [0,0,0,0,0,0|2,0,1]=3 458 B6R0.4 [O-][N+](=O)NCCO Amb17618377 [0,0,0,0,0,0|3,0,1]=4 459 B5R0.1 BC(=O)NCC Amb22343194 [1,0,0,0,0,0|2,0,0]=3 460 B5R0.1 C/C=C/C(C)=O Amb17940030 [1,0,0,0,0,0|1,0,2]=4 461 B5R0.1 C=C(Br)CCBr Amb25827098 [1,0,0,0,0,0|3,0,0]=4 462 B5R0.1 C=C(Br)CCN Amb23512022 [1,0,0,0,0,0|3,0,0]=4 463 B5R0.1 C=C(Cl)CCCl Amb24636781 [1,0,0,0,0,0|3,0,0]=4 464 B5R0.1 C=C(F)CCO Amb25747437 [1,0,0,0,0,0|3,0,0]=4 465 B5R0.1 C=C(I)CCCl Amb24349789 [1,0,0,0,0,0|3,0,0]=4 466 B5R0.1 C=C(I)CCN Amb24756665 [1,0,0,0,0,0|3,0,0]=4 467 B5R0.1 C=C=CC(O)=O Amb24391957 [1,0,0,0,0,0|0,0,3]=4 468 B5R0.1 CC#CC(=O)C Amb17593016 [1,0,0,0,0,0|1,0,2]=4 469 B5R0.1 CC#CC(=O)N Amb10552409 [1,0,0,0,0,0|1,0,2]=4 470 B5R0.1 CC(=C)CCBr Amb21857866 [1,0,0,0,0,0|3,0,0]=4 471 B5R0.1 CC(=C)CCN Amb17673481 [1,0,0,0,0,0|3,0,0]=4 472 B5R0.1 CC(=O)CC#C Amb17673302 [1,0,0,0,0,0|1,0,2]=4 473 B5R0.1 CC(=O)CC#N Amb1102132 [1,0,0,0,0,0|2,0,1]=4 474 B5R0.1 CC(=O)CC#N Amb22274239 [1,0,0,0,0,0|2,0,1]=4 475 B5R0.1 CC(=O)CC=O Amb17666764 [1,0,0,0,0,0|2,0,1]=4 476 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,0,0,0,0|2,0,0]=3 477 B5R0.1 CC(=O)CCN Amb10067110 [1,0,0,0,0,0|2,0,0]=3 478 B5R0.1 CC(=O)CCN Amb18632933 [1,0,0,0,0,0|2,0,0]=3 479 B5R0.1 CC(=O)CN=O Amb24645582 [1,0,0,0,0,0|3,0,0]=4 480 B5R0.1 CC(=O)CON Amb25128844 [1,0,0,0,0,0|3,0,0]=4 481 B5R0.1 CC(=O)CSCl Amb24631131 [1,0,0,0,0,0|3,0,0]=4 482 B5R0.1 CC(=O)NCCl Amb25790034 [1,0,0,0,0,0|3,0,0]=4 483 B5R0.1 CC(=O)NCS Amb25124326 [1,0,0,0,0,0|3,0,0]=4 484 B5R0.1 CC(=O)OCCl Amb17673336 [1,0,0,0,0,0|3,0,0]=4 485 B5R0.1 CC(=O)OCI Amb25226851 [1,0,0,0,0,0|3,0,0]=4 486 B5R0.1 CC(=O)OCN Amb24359000 [1,0,0,0,0,0|3,0,0]=4 487 B5R0.1 CC(=O)SCBr Amb25349900 [1,0,0,0,0,0|3,0,0]=4 488 B5R0.1 CC(O)CCCl Amb24551052 [1,0,0,0,0,0|2,0,1]=4 489 B5R0.1 CC(O)CCO Amb22227721 [1,0,0,0,0,0|2,0,1]=4 490 B5R0.1 CC(O)CCO Amb22232248 [1,0,0,0,0,0|2,0,1]=4 491 B5R0.1 CC(O)CCS Amb22359316 [1,0,0,0,0,0|2,0,1]=4 492 B5R0.1 CC=CC(C)=O Amb24061083 [1,0,0,0,0,0|1,0,2]=4 493 B5R0.1 CCC=C(C)C Amb22336412 [1,0,0,0,0,0|2,0,1]=4 494 B5R0.1 CCC=C(F)F Amb10839842 [1,0,0,0,0,0|2,0,1]=4 495 B5R0.1 CCCB(O)O Amb2447105 [1,0,0,0,0,0|1,0,1]=3 496 B5R0.1 CCCC(=C)Br Amb22583743 [1,0,0,0,0,0|2,0,0]=3 497 B5R0.1 CCCC(=N)N Amb10610381 [1,0,0,0,0,0|2,0,0]=3 498 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|1,0,0]=2 499 B5R0.1 CCCC(=S)Cl Amb24626931 [1,0,0,0,0,0|1,1,0]=3 500 B5R0.1 CCCC(C)F Amb22008011 [1,0,0,0,0,0|2,0,1]=4 501 B5R0.1 CCCC(C)I Amb17939400 [1,0,0,0,0,0|2,0,1]=4 502 B5R0.1 CCCC(Cl)Cl Amb25062516 [1,0,0,0,0,0|2,0,1]=4 503 B5R0.1 CCCC(F)Cl Amb25065258 [1,0,0,0,0,0|2,0,1]=4 504 B5R0.1 CCCC(N)C Amb10609075 [1,0,0,0,0,0|2,0,1]=4 505 B5R0.1 CCCC(N)O Amb25147414 [1,0,0,0,0,0|1,0,1]=3 506 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|0,1,0]=2 507 B5R0.1 CCCC(O)Br Amb25106743 [1,0,0,0,0,0|1,0,1]=3 508 B5R0.1 CCCC(O)Cl Amb22552567 [1,0,0,0,0,0|1,0,1]=3 509 B5R0.1 CCCC([O-])=O Amb17772223 [1,0,0,0,0,0|0,0,1]=2 510 B5R0.1 CCCC([O-])=O Amb22732283 [1,0,0,0,0,0|0,0,1]=2 511 B5R0.1 CCCC([O-])=O Amb22732651 [1,0,0,0,0,0|0,0,1]=2 512 B5R0.1 CCCN(C)C Amb22336514 [1,0,0,0,0,0|3,0,0]=4 513 B5R0.1 CCCN(C)C Amb22733186 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 CCCN(C)N Amb24587192 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 CCCN(C)O Amb25024622 [1,0,0,0,0,0|2,0,0]=3 516 B5R0.1 CCCP(Cl)Cl Amb22053969 [1,0,0,0,0,0|3,0,0]=4 517 B5R0.1 CCCS(=O)Cl Amb25025566 [1,0,0,0,0,0|2,0,0]=3 518 B5R0.1 CCCS(N)=O Amb24733579 [1,0,0,0,0,0|2,0,0]=3 519 B5R0.1 CCCS(O)=O Amb24615072 [1,0,0,0,0,0|1,0,0]=2 520 B5R0.1 CCCS([O-])=O Amb19929119 [1,0,0,0,0,0|1,0,1]=3 521 B5R0.1 CCC[13C](O)=O Amb22337992 [1,0,0,0,0,0|0,0,0]=1 522 B5R0.1 CCC[13C](O)=O Amb22338339 [1,0,0,0,0,0|0,0,0]=1 523 B5R0.1 CCC[C@@H](C)Br Amb24373894 [1,0,0,0,0,0|2,0,1]=4 524 B5R0.1 CCC[C@@H](C)Cl Amb24711432 [1,0,0,0,0,0|2,0,1]=4 525 B5R0.1 CCC[C@@H](C)I Amb24432363 [1,0,0,0,0,0|2,0,1]=4 526 B5R0.1 CCC[C@@H](C)N Amb22898992 [1,0,0,0,0,0|2,0,1]=4 527 B5R0.1 CCC[C@@H](C)N Amb23439500 [1,0,0,0,0,0|2,0,1]=4 528 B5R0.1 CCC[C@H](C)I Amb25237438 [1,0,0,0,0,0|2,0,1]=4 529 B5R0.1 CCC[C@H](C)N Amb21618754 [1,0,0,0,0,0|2,0,1]=4 530 B5R0.1 CCNC(=O)Br Amb24563760 [1,0,0,0,0,0|2,0,0]=3 531 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|2,0,0]=3 532 B5R0.1 CCNC(=S)Cl Amb25063250 [1,0,0,0,0,0|2,1,0]=4 533 B5R0.1 CCNC(C)=N Amb25246070 [1,0,0,0,0,0|3,0,0]=4 534 B5R0.1 CCNC(C)=S Amb24580999 [1,0,0,0,0,0|2,1,0]=4 535 B5R0.1 CCNC(N)=N Amb21964689 [1,0,0,0,0,0|3,0,0]=4 536 B5R0.1 CCNC(N)=N Amb22053912 [1,0,0,0,0,0|3,0,0]=4 537 B5R0.1 CCNC(N)=N Amb22168156 [1,0,0,0,0,0|3,0,0]=4 538 B5R0.1 CCNC(N)=[NH2+] Amb22734753 [1,0,0,0,0,0|3,0,0]=4 539 B5R0.1 CCNC(O)=S Amb24612743 [1,0,0,0,0,0|1,1,0]=3 540 B5R0.1 CCOC(=C)Cl Amb25768135 [1,0,0,0,0,0|3,0,0]=4 541 B5R0.1 CCOC(=N)N Amb16231402 [1,0,0,0,0,0|3,0,0]=4 542 B5R0.1 CCOC(=S)N Amb10241338 [1,0,0,0,0,0|2,1,0]=4 543 B5R0.1 CCOC(C)=S Amb22047276 [1,0,0,0,0,0|2,1,0]=4 544 B5R0.1 CCOC(O)O Amb24749789 [1,0,0,0,0,0|1,0,2]=4 545 B5R0.1 CCOC(S)=S Amb17938960 [1,0,0,0,0,0|1,2,0]=4 546 B5R0.1 CCOC(S)=S Amb22274286 [1,0,0,0,0,0|1,2,0]=4 547 B5R0.1 CCOC([13CH3])=O Amb22363103 [1,0,0,0,0,0|2,0,0]=3 548 B5R0.1 CCOC([S-])=S Amb22729921 [1,0,0,0,0,0|1,2,0]=4 549 B5R0.1 CCOP(=O)=O Amb25808749 [1,0,0,0,0,0|2,0,1]=4 550 B5R0.1 CCOP(=O)S Amb24540781 [1,0,0,0,0,0|2,1,0]=4 551 B5R0.1 CCOP(C)=O Amb17673512 [1,0,0,0,0,0|3,0,0]=4 552 B5R0.1 CCOP(O)=O Amb22360741 [1,0,0,0,0,0|2,0,0]=3 553 B5R0.1 CCOP(O)O Amb25348821 [1,0,0,0,0,0|2,0,1]=4 554 B5R0.1 CCOP([O-])=O Amb22731647 [1,0,0,0,0,0|2,0,1]=4 555 B5R0.1 CCOS(=O)Cl Amb25239825 [1,0,0,0,0,0|3,0,0]=4 556 B5R0.1 CCO[13C](C)=O Amb22363160 [1,0,0,0,0,0|2,0,0]=3 557 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [1,0,0,0,0,0|2,0,0]=3 558 B5R0.1 CCO[14C](N)=O Amb22732757 [1,0,0,0,0,0|2,0,0]=3 559 B5R0.1 CCO[N+]([O-])=O Amb22732543 [1,0,0,0,0,0|2,0,1]=4 560 B5R0.1 CCSC(=N)N Amb16205363 [1,0,0,0,0,0|3,0,0]=4 561 B5R0.1 CCSC(=N)[NH3+] Amb24113877 [1,0,0,0,0,0|3,0,0]=4 562 B5R0.1 CCSC(N)=O Amb24394612 [1,0,0,0,0,0|2,0,0]=3 563 B5R0.1 CCSC(O)O Amb25788582 [1,0,0,0,0,0|1,0,2]=4 564 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [1,0,0,0,0,0|0,0,0]=1 565 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [1,0,0,0,0,0|0,0,1]=2 566 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [1,0,0,0,0,0|0,0,0]=1 567 B5R0.1 CC[O+]=C(N)N Amb22492446 [1,0,0,0,0,0|3,0,0]=4 568 B5R0.1 CN(O)CCO Amb25234570 [1,0,0,0,0,0|3,0,0]=4 569 B5R0.1 CN=CC(C)=O Amb25746654 [1,0,0,0,0,0|2,0,1]=4 570 B5R0.1 CNCC(=C)Br Amb18950247 [1,0,0,0,0,0|3,0,0]=4 571 B5R0.1 CNCC(=C)Cl Amb18281327 [1,0,0,0,0,0|3,0,0]=4 572 B5R0.1 CNCC(=O)C Amb17621974 [1,0,0,0,0,0|2,0,0]=3 573 B5R0.1 CNCC(=O)N Amb10610205 [1,0,0,0,0,0|2,0,0]=3 574 B5R0.1 CNCC(=S)N Amb17231807 [1,0,0,0,0,0|2,1,0]=4 575 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|2,0,0]=3 576 B5R0.1 CNCC([O-])=O Amb20246714 [1,0,0,0,0,0|1,0,1]=3 577 B5R0.1 CNCP(O)=O Amb24478116 [1,0,0,0,0,0|2,0,0]=3 578 B5R0.1 CNOC(C)=O Amb24323679 [1,0,0,0,0,0|3,0,0]=4 579 B5R0.1 CNOC(C)=O Amb24629247 [1,0,0,0,0,0|3,0,0]=4 580 B5R0.1 COCC(=C)Br Amb25361496 [1,0,0,0,0,0|3,0,0]=4 581 B5R0.1 COCC(=O)Br Amb25282928 [1,0,0,0,0,0|2,0,0]=3 582 B5R0.1 COCC(=O)N Amb1153776 [1,0,0,0,0,0|2,0,0]=3 583 B5R0.1 COCC(C)=S Amb25108516 [1,0,0,0,0,0|2,1,0]=4 584 B5R0.1 CONC(=O)N Amb2417193 [1,0,0,0,0,0|3,0,0]=4 585 B5R0.1 CONC(C)=O Amb25046114 [1,0,0,0,0,0|3,0,0]=4 586 B5R0.1 CS(=O)CCCl Amb24116979 [1,0,0,0,0,0|3,0,0]=4 587 B5R0.1 CS(=O)CCN Amb19889121 [1,0,0,0,0,0|3,0,0]=4 588 B5R0.1 CS(=O)CCN Amb20248083 [1,0,0,0,0,0|3,0,0]=4 589 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|2,0,0]=3 590 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|1,0,0]=2 591 B5R0.1 CSCC(=S)N Amb17503394 [1,0,0,0,0,0|2,1,0]=4 592 B5R0.1 CSCC(C)=C Amb20671946 [1,0,0,0,0,0|3,0,0]=4 593 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|2,0,0]=3 594 B5R0.1 CSCC(C)O Amb20622311 [1,0,0,0,0,0|2,0,1]=4 595 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|2,0,0]=3 596 B5R0.1 CSCS(C)=O Amb22045140 [1,0,0,0,0,0|3,0,0]=4 597 B5R0.1 CSC[C@@H](C)O Amb24408899 [1,0,0,0,0,0|2,0,1]=4 598 B5R0.1 CSC[C@H](C)O Amb24699036 [1,0,0,0,0,0|2,0,1]=4 599 B5R0.1 CSNC(C)=O Amb22500292 [1,0,0,0,0,0|3,0,0]=4 600 B5R0.1 CSNC(N)=O Amb25810134 [1,0,0,0,0,0|3,0,0]=4 601 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [1,0,0,0,0,0|0,0,1]=2 602 B5R0.1 C[C@@H](O)CCCl Amb24565032 [1,0,0,0,0,0|2,0,1]=4 603 B5R0.1 C[C@@H](O)CCN Amb22736702 [1,0,0,0,0,0|2,0,1]=4 604 B5R0.1 C[C@H](O)CCI Amb24675161 [1,0,0,0,0,0|2,0,1]=4 605 B5R0.1 C[C@H](O)CCN Amb22736705 [1,0,0,0,0,0|2,0,1]=4 606 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,0,0,0,0|1,0,2]=4 607 B5R0.1 C\C=C\C([O-])=O Amb22231404 [1,0,0,0,0,0|0,0,3]=4 608 B5R0.1 ClC(=O)CC#N Amb17593096 [1,0,0,0,0,0|2,0,1]=4 609 B5R0.1 N#CCC(O)=O Amb20247050 [1,0,0,0,0,0|1,0,1]=3 610 B5R0.1 N#CCS(O)=O Amb25232047 [1,0,0,0,0,0|2,0,1]=4 611 B5R0.1 N#C[13CH2][13C]([O-])=O Amb22054790 [1,0,0,0,0,0|1,0,2]=4 612 B5R0.1 NC(=N)CCCl Amb25839424 [1,0,0,0,0,0|3,0,0]=4 613 B5R0.1 NC(=N)CCS Amb25126101 [1,0,0,0,0,0|3,0,0]=4 614 B5R0.1 NC(=O)CC=C Amb17610156 [1,0,0,0,0,0|1,0,2]=4 615 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|2,0,1]=4 616 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,0,0,0,0|2,0,0]=3 617 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,0,0,0,0|2,0,0]=3 618 B5R0.1 NC(=O)CNO Amb25199017 [1,0,0,0,0,0|3,0,0]=4 619 B5R0.1 NC(=O)NCCl Amb25130799 [1,0,0,0,0,0|3,0,0]=4 620 B5R0.1 NC(=O)NCO Amb17674341 [1,0,0,0,0,0|3,0,0]=4 621 B5R0.1 NC(=O)OCCl Amb24681219 [1,0,0,0,0,0|3,0,0]=4 622 B5R0.1 NC(=O)OCI Amb25146422 [1,0,0,0,0,0|3,0,0]=4 623 B5R0.1 NC(=O)OCO Amb25662384 [1,0,0,0,0,0|3,0,0]=4 624 B5R0.1 NC(=S)CCS Amb17503271 [1,0,0,0,0,0|2,1,0]=4 625 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,0,0,0,0|2,0,0]=3 626 B5R0.1 NCCC(=O)N Amb1137251 [1,0,0,0,0,0|2,0,0]=3 627 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|1,0,0]=2 628 B5R0.1 NCCC(N)=S Amb18523221 [1,0,0,0,0,0|2,1,0]=4 629 B5R0.1 NCCC(N)O Amb24657290 [1,0,0,0,0,0|2,0,1]=4 630 B5R0.1 NCCP(O)=O Amb22168066 [1,0,0,0,0,0|2,0,0]=3 631 B5R0.1 NCCS(=O)=O Amb25744074 [1,0,0,0,0,0|2,0,1]=4 632 B5R0.1 NCC[N+]([O-])=O Amb18203119 [1,0,0,0,0,0|2,0,1]=4 633 B5R0.1 NCOP(O)=O Amb24333271 [1,0,0,0,0,0|3,0,0]=4 634 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|2,0,0]=3 635 B5R0.1 NOCC(N)=O Amb22059481 [1,0,0,0,0,0|3,0,0]=4 636 B5R0.1 NS(=O)CCCl Amb24407159 [1,0,0,0,0,0|3,0,0]=4 637 B5R0.1 N[C@H](O)CCO Amb24421109 [1,0,0,0,0,0|2,0,1]=4 638 B5R0.1 N\N=C\C(O)=O Amb25703365 [1,0,0,0,0,0|2,0,1]=4 639 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,0,0,0,0|2,0,0]=3 640 B5R0.1 O=C(Br)CCCl Amb24474527 [1,0,0,0,0,0|2,0,0]=3 641 B5R0.1 O=C(F)NCF Amb24478456 [1,0,0,0,0,0|3,0,0]=4 642 B5R0.1 O=C(I)CCCl Amb25146462 [1,0,0,0,0,0|2,0,0]=3 643 B5R0.1 O=S(Cl)CCBr Amb24563387 [1,0,0,0,0,0|3,0,0]=4 644 B5R0.1 OC(=O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 645 B5R0.1 OC(=O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 646 B5R0.1 OC(=O)C#CI Amb25274128 [1,0,0,0,0,0|1,0,2]=4 647 B5R0.1 OC(=O)C=C=O Amb24671304 [1,0,0,0,0,0|1,0,2]=4 648 B5R0.1 OC(=O)CC=O Amb22169407 [1,0,0,0,0,0|1,0,1]=3 649 B5R0.1 OC(=O)CCF Amb10603694 [1,0,0,0,0,0|1,0,0]=2 650 B5R0.1 OC(=O)CI=O Amb25146428 [1,0,0,0,0,0|2,0,0]=3 651 B5R0.1 OC(=O)CNBr Amb25053433 [1,0,0,0,0,0|2,0,0]=3 652 B5R0.1 OC(=O)CNCl Amb24653229 [1,0,0,0,0,0|2,0,0]=3 653 B5R0.1 OC(=O)CNI Amb25216175 [1,0,0,0,0,0|2,0,0]=3 654 B5R0.1 OC(=O)CSCl Amb24597301 [1,0,0,0,0,0|2,0,0]=3 655 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [1,0,0,0,0,0|2,0,0]=3 656 B5R0.1 OC(=O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,2]=4 657 B5R0.1 OC(=O)\C=C\F Amb24417763 [1,0,0,0,0,0|1,0,2]=4 658 B5R0.1 OC(=O)\C=C\I Amb20242758 [1,0,0,0,0,0|1,0,2]=4 659 B5R0.1 OC(O)CCS Amb25746150 [1,0,0,0,0,0|1,0,2]=4 660 B5R0.1 OCCS(=O)=O Amb24474283 [1,0,0,0,0,0|2,0,1]=4 661 B5R0.1 OCOP(O)=O Amb24333194 [1,0,0,0,0,0|3,0,0]=4 662 B5R0.1 OCOS(O)=O Amb25106091 [1,0,0,0,0,0|3,0,0]=4 663 B5R0.1 ON=CC(O)=O Amb25046587 [1,0,0,0,0,0|2,0,1]=4 664 B5R0.1 ONCC(O)=O Amb24120360 [1,0,0,0,0,0|2,0,0]=3 665 B5R0.1 OP(=O)CC=O Amb25706451 [1,0,0,0,0,0|2,0,1]=4 666 B5R0.1 OP(=O)CCBr Amb24634095 [1,0,0,0,0,0|2,0,0]=3 667 B5R0.1 OP(=O)CCCl Amb24465178 [1,0,0,0,0,0|2,0,0]=3 668 B5R0.1 O\N=C/C(=O)O Amb10601571 [1,0,0,0,0,0|2,0,1]=4 669 B5R0.1 O\N=C\C(O)=O Amb20671938 [1,0,0,0,0,0|2,0,1]=4 670 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [1,0,0,0,0,0|0,0,1]=2 671 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [1,0,0,0,0,0|0,0,1]=2 672 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [1,0,0,0,0,0|0,0,1]=2 673 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [1,0,0,0,0,0|1,0,0]=2 674 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [1,0,0,0,0,0|1,0,0]=2 675 B5R0.1 [2H]C(=O)OCC Amb22336312 [1,0,0,0,0,0|2,0,0]=3 676 B5R0.1 [N-]=[N+]=CC(O)=O Amb24333367 [1,0,0,0,0,0|2,0,1]=4 677 B5R0.1 [O-]C(=O)CCBr Amb22229633 [1,0,0,0,0,0|1,0,1]=3 678 B5R0.1 [O-]C(=O)CCCl Amb10604124 [1,0,0,0,0,0|1,0,1]=3 679 B5R0.1 [O-]C(=O)CCCl Amb22051669 [1,0,0,0,0,0|1,0,1]=3 680 B5R0.1 [O-]C(=O)CCO Amb22055495 [1,0,0,0,0,0|1,0,1]=3 681 B5R0.1 [O-]S(=O)CCBr Amb24442971 [1,0,0,0,0,0|2,0,1]=4 682 B5R0.1 [O-][N+](=O)CCF Amb17674352 [1,0,0,0,0,0|2,0,1]=4 683 B5R0.1 [S-]C(=S)OCC Amb10789364 [1,0,0,0,0,0|1,2,0]=4 684 B5R0.2 BCCCCN Amb24745748 [1,0,0,0,0,0|2,0,1]=4 685 B5R0.2 BSCCCC Amb25339480 [1,0,0,0,0,0|2,0,0]=3 686 B5R0.2 BrCCCC#C Amb17610060 [1,0,0,0,0,0|2,0,1]=4 687 B5R0.2 BrCCN=C=O Amb17194090 [1,0,0,0,0,0|2,0,1]=4 688 B5R0.2 BrCCOCC Amb1158671 [1,0,0,0,0,0|2,0,1]=4 689 B5R0.2 Br\C=C\CCBr Amb25663040 [1,0,0,0,0,0|2,0,1]=4 690 B5R0.2 C#CCCCI Amb25843530 [1,0,0,0,0,0|2,0,1]=4 691 B5R0.2 C#CCCCN Amb18962495 [1,0,0,0,0,0|2,0,1]=4 692 B5R0.2 C#CCCCN Amb22886202 [1,0,0,0,0,0|2,0,1]=4 693 B5R0.2 C#CCCCS Amb24333394 [1,0,0,0,0,0|2,0,1]=4 694 B5R0.2 C=CCCC#C Amb18117518 [1,0,0,0,0,0|1,0,2]=4 695 B5R0.2 C=CCCC#N Amb10605750 [1,0,0,0,0,0|2,0,1]=4 696 B5R0.2 C=CCCCCl Amb22229585 [1,0,0,0,0,0|2,0,0]=3 697 B5R0.2 C=CCCCF Amb25689705 [1,0,0,0,0,0|2,0,0]=3 698 B5R0.2 C=CCCCI Amb25278794 [1,0,0,0,0,0|2,0,0]=3 699 B5R0.2 C=CCCCN Amb18299670 [1,0,0,0,0,0|2,0,0]=3 700 B5R0.2 C=CCCCN Amb22001451 [1,0,0,0,0,0|2,0,0]=3 701 B5R0.2 C=CCCNN Amb25747040 [1,0,0,0,0,0|3,0,0]=4 702 B5R0.2 C=CCCON Amb22233632 [1,0,0,0,0,0|3,0,0]=4 703 B5R0.2 C=CCCON Amb22896384 [1,0,0,0,0,0|3,0,0]=4 704 B5R0.2 C=CCC[Mg]Br Amb22338020 [1,0,0,0,0,0|3,0,0]=4 705 B5R0.2 C=CCC[Zn]Br Amb22000510 [1,0,0,0,0,0|3,0,0]=4 706 B5R0.2 C=CCOC=O Amb22051694 [1,0,0,0,0,0|1,0,2]=4 707 B5R0.2 C=CCOCO Amb25115933 [1,0,0,0,0,0|3,0,0]=4 708 B5R0.2 C=CCSCBr Amb25232617 [1,0,0,0,0,0|3,0,0]=4 709 B5R0.2 C=CCSCCl Amb25859631 [1,0,0,0,0,0|3,0,0]=4 710 B5R0.2 C=CNCCO Amb24380906 [1,0,0,0,0,0|3,0,0]=4 711 B5R0.2 C=CSCCN Amb25147236 [1,0,0,0,0,0|3,0,0]=4 712 B5R0.2 CC#CCC=C Amb24528352 [1,0,0,0,0,0|1,0,2]=4 713 B5R0.2 CC=CCCN Amb19374038 [1,0,0,0,0,0|2,0,1]=4 714 B5R0.2 CCC#CC=C Amb24333935 [1,0,0,0,0,0|1,0,2]=4 715 B5R0.2 CCC#CC=O Amb25663194 [1,0,0,0,0,0|0,0,2]=3 716 B5R0.2 CCC/C=C/Br Amb17673688 [1,0,0,0,0,0|1,0,1]=3 717 B5R0.2 CCCC#CBr Amb24648680 [1,0,0,0,0,0|1,0,2]=4 718 B5R0.2 CCCC#CI Amb22733682 [1,0,0,0,0,0|1,0,2]=4 719 B5R0.2 CCCCC=C Amb22338530 [1,0,0,0,0,0|1,0,0]=2 720 B5R0.2 CCCCCC Amb2447471 [1,0,0,0,0,0|1,0,1]=3 721 B5R0.2 CCCCCF Amb10838686 [1,0,0,0,0,0|1,0,1]=3 722 B5R0.2 CCCCC[13CH3] Amb22353529 [1,0,0,0,0,0|1,0,1]=3 723 B5R0.2 CCCCC[Mg+] Amb22045757 [1,0,0,0,0,0|1,0,1]=3 724 B5R0.2 CCCCC[SiH3] Amb19893989 [1,0,0,0,0,0|1,0,1]=3 725 B5R0.2 CCCCNN Amb1105203 [1,0,0,0,0,0|2,0,0]=3 726 B5R0.2 CCCCNN Amb22230363 [1,0,0,0,0,0|2,0,0]=3 727 B5R0.2 CCCCNN Amb22732372 [1,0,0,0,0,0|2,0,0]=3 728 B5R0.2 CCCCNO Amb24686451 [1,0,0,0,0,0|1,0,0]=2 729 B5R0.2 CCCCON Amb17101066 [1,0,0,0,0,0|2,0,0]=3 730 B5R0.2 CCCCO[2H] Amb16185547 [1,0,0,0,0,0|2,0,0]=3 731 B5R0.2 CCCCS[Na] Amb22360783 [1,0,0,0,0,0|2,0,0]=3 732 B5R0.2 CCCC[Hg]Cl Amb22366548 [1,0,0,0,0,0|2,0,0]=3 733 B5R0.2 CCCC[Mg]Br Amb17666637 [1,0,0,0,0,0|2,0,0]=3 734 B5R0.2 CCCC[Zn]Br Amb22000415 [1,0,0,0,0,0|2,0,0]=3 735 B5R0.2 CCCN=C=O Amb22338287 [1,0,0,0,0,0|1,0,1]=3 736 B5R0.2 CCCN=[N+]=[N-] Amb25811439 [1,0,0,0,0,0|3,0,0]=4 737 B5R0.2 CCCNC#N Amb25801573 [1,0,0,0,0,0|2,0,1]=4 738 B5R0.2 CCCNCO Amb25746089 [1,0,0,0,0,0|1,0,1]=3 739 B5R0.2 CCCOC=C Amb17940706 [1,0,0,0,0,0|2,0,0]=3 740 B5R0.2 CCCOCBr Amb25351883 [1,0,0,0,0,0|2,0,1]=4 741 B5R0.2 CCCOCC Amb17673668 [1,0,0,0,0,0|2,0,1]=4 742 B5R0.2 CCCOCCl Amb22002403 [1,0,0,0,0,0|2,0,1]=4 743 B5R0.2 CCCON=O Amb22732190 [1,0,0,0,0,0|2,0,0]=3 744 B5R0.2 CCCONC Amb25109607 [1,0,0,0,0,0|3,0,0]=4 745 B5R0.2 CCCSCO Amb24466323 [1,0,0,0,0,0|1,0,1]=3 746 B5R0.2 CCC\C=C\Cl Amb25026521 [1,0,0,0,0,0|1,0,1]=3 747 B5R0.2 CCC\C=C\I Amb24333664 [1,0,0,0,0,0|1,0,1]=3 748 B5R0.2 CCN=NCO Amb25146368 [1,0,0,0,0,0|2,0,1]=4 749 B5R0.2 CCNCC#C Amb10610192 [1,0,0,0,0,0|2,0,1]=4 750 B5R0.2 CCNCC=C Amb13951161 [1,0,0,0,0,0|2,0,0]=3 751 B5R0.2 CCNCCN Amb22284539 [1,0,0,0,0,0|2,0,1]=4 752 B5R0.2 CCNCCO Amb19372818 [1,0,0,0,0,0|1,0,1]=3 753 B5R0.2 CCNCCO Amb22284537 [1,0,0,0,0,0|1,0,1]=3 754 B5R0.2 CCNCCS Amb18640505 [1,0,0,0,0,0|1,1,1]=4 755 B5R0.2 CCNCN=O Amb24382131 [1,0,0,0,0,0|2,0,0]=3 756 B5R0.2 CCNN=CN Amb24461199 [1,0,0,0,0,0|3,0,0]=4 757 B5R0.2 CCO/C=C/Cl Amb17689421 [1,0,0,0,0,0|2,0,1]=4 758 B5R0.2 CCOCC#C Amb17673317 [1,0,0,0,0,0|2,0,1]=4 759 B5R0.2 CCOCCI Amb25117446 [1,0,0,0,0,0|2,0,1]=4 760 B5R0.2 CCOCCN Amb21954038 [1,0,0,0,0,0|2,0,1]=4 761 B5R0.2 CCO\C=C/Br Amb2455970 [1,0,0,0,0,0|2,0,1]=4 762 B5R0.2 CCO\C=C\Br Amb10068669 [1,0,0,0,0,0|2,0,1]=4 763 B5R0.2 CCPCCN Amb24560329 [1,0,0,0,0,0|2,0,1]=4 764 B5R0.2 CCSCC=O Amb17940620 [1,0,0,0,0,0|1,0,0]=2 765 B5R0.2 CCSCCC Amb22168047 [1,0,0,0,0,0|2,0,1]=4 766 B5R0.2 CCS\C=C\Br Amb25745106 [1,0,0,0,0,0|2,0,1]=4 767 B5R0.2 CCS\C=C\Cl Amb25258363 [1,0,0,0,0,0|2,0,1]=4 768 B5R0.2 CC\C=C/C=C Amb25025160 [1,0,0,0,0,0|1,0,2]=4 769 B5R0.2 CC\C=C/CO Amb10975881 [1,0,0,0,0,0|0,0,3]=4 770 B5R0.2 CC\C=C\CO Amb22347892 [1,0,0,0,0,0|0,0,3]=4 771 B5R0.2 CNCCC#C Amb18962433 [1,0,0,0,0,0|2,0,1]=4 772 B5R0.2 CNCCC=C Amb18993048 [1,0,0,0,0,0|2,0,0]=3 773 B5R0.2 CNCCCCl Amb22002154 [1,0,0,0,0,0|2,0,1]=4 774 B5R0.2 CNCCCS Amb18121219 [1,0,0,0,0,0|1,1,1]=4 775 B5R0.2 CNCCNN Amb24117180 [1,0,0,0,0,0|3,0,0]=4 776 B5R0.2 CNCCNN Amb25810488 [1,0,0,0,0,0|3,0,0]=4 777 B5R0.2 CNCCOC Amb10609606 [1,0,0,0,0,0|3,0,0]=4 778 B5R0.2 CNCCON Amb24460312 [1,0,0,0,0,0|3,0,0]=4 779 B5R0.2 CNCCSC Amb15701319 [1,0,0,0,0,0|3,0,0]=4 780 B5R0.2 CNCCSC Amb20625111 [1,0,0,0,0,0|3,0,0]=4 781 B5R0.2 CNC\C=C/I Amb23539307 [1,0,0,0,0,0|2,0,1]=4 782 B5R0.2 CNC\C=C\I Amb25203641 [1,0,0,0,0,0|2,0,1]=4 783 B5R0.2 CNNCCC Amb24057117 [1,0,0,0,0,0|3,0,0]=4 784 B5R0.2 CNNCCC Amb25283190 [1,0,0,0,0,0|3,0,0]=4 785 B5R0.2 CN\C=C\C=O Amb24564349 [1,0,0,0,0,0|1,0,2]=4 786 B5R0.2 COCC=NO Amb24748531 [1,0,0,0,0,0|2,0,1]=4 787 B5R0.2 COCCC#C Amb18117254 [1,0,0,0,0,0|2,0,1]=4 788 B5R0.2 COCCC=O Amb10602324 [1,0,0,0,0,0|1,0,0]=2 789 B5R0.2 COCCCF Amb22007998 [1,0,0,0,0,0|2,0,1]=4 790 B5R0.2 COCCCI Amb22755452 [1,0,0,0,0,0|2,0,1]=4 791 B5R0.2 COCCCS Amb13952794 [1,0,0,0,0,0|1,1,1]=4 792 B5R0.2 COCCNN Amb10609107 [1,0,0,0,0,0|3,0,0]=4 793 B5R0.2 COCCNN Amb19374182 [1,0,0,0,0,0|3,0,0]=4 794 B5R0.2 COCCNN Amb22233534 [1,0,0,0,0,0|3,0,0]=4 795 B5R0.2 COCCNN Amb22587527 [1,0,0,0,0,0|3,0,0]=4 796 B5R0.2 COCCNO Amb25284480 [1,0,0,0,0,0|2,0,0]=3 797 B5R0.2 COCCOC Amb22338452 [1,0,0,0,0,0|3,0,0]=4 798 B5R0.2 COCCOC Amb22729734 [1,0,0,0,0,0|3,0,0]=4 799 B5R0.2 COCCOC Amb22733818 [1,0,0,0,0,0|3,0,0]=4 800 B5R0.2 COCCON Amb17194148 [1,0,0,0,0,0|3,0,0]=4 801 B5R0.2 COCCON Amb20623946 [1,0,0,0,0,0|3,0,0]=4 802 B5R0.2 COC\C=C\Br Amb25109338 [1,0,0,0,0,0|2,0,1]=4 803 B5R0.2 COC\C=C\Cl Amb24478538 [1,0,0,0,0,0|2,0,1]=4 804 B5R0.2 COC\C=C\I Amb24512110 [1,0,0,0,0,0|2,0,1]=4 805 B5R0.2 CSCC=NO Amb24641644 [1,0,0,0,0,0|2,0,1]=4 806 B5R0.2 CSCCC#C Amb24579788 [1,0,0,0,0,0|2,0,1]=4 807 B5R0.2 CSCCC#N Amb17307555 [1,0,0,0,0,0|2,0,1]=4 808 B5R0.2 CSCCC=C Amb24431590 [1,0,0,0,0,0|2,0,0]=3 809 B5R0.2 CSCCCBr Amb18180189 [1,0,0,0,0,0|2,0,1]=4 810 B5R0.2 CSCCCCl Amb10602296 [1,0,0,0,0,0|2,0,1]=4 811 B5R0.2 CSCCCS Amb25744031 [1,0,0,0,0,0|1,1,1]=4 812 B5R0.2 CSCCNN Amb18640583 [1,0,0,0,0,0|3,0,0]=4 813 B5R0.2 CSCCON Amb25806571 [1,0,0,0,0,0|3,0,0]=4 814 B5R0.2 CSCCSC Amb25101746 [1,0,0,0,0,0|3,0,0]=4 815 B5R0.2 CSCN=C=O Amb25114951 [1,0,0,0,0,0|2,0,1]=4 816 B5R0.2 CSCNC=O Amb24421815 [1,0,0,0,0,0|2,0,0]=3 817 B5R0.2 CSCSCC Amb24619526 [1,0,0,0,0,0|3,0,0]=4 818 B5R0.2 CSC\C=C/Cl Amb24710128 [1,0,0,0,0,0|2,0,1]=4 819 B5R0.2 CSC\C=C\Cl Amb24565594 [1,0,0,0,0,0|2,0,1]=4 820 B5R0.2 CSC\C=N\O Amb22168142 [1,0,0,0,0,0|2,0,1]=4 821 B5R0.2 CSSCC=C Amb22730604 [1,0,0,0,0,0|3,0,0]=4 822 B5R0.2 CS\C=C\C=O Amb25811358 [1,0,0,0,0,0|1,0,2]=4 823 B5R0.2 C[SiH2]CCCCl Amb24594928 [1,0,0,0,0,0|1,1,1]=4 824 B5R0.2 C[SiH2]CCCI Amb24673429 [1,0,0,0,0,0|1,1,1]=4 825 B5R0.2 C[SiH2]CC[SiH2]C Amb22227708 [1,0,0,0,0,0|1,2,0]=4 826 B5R0.2 C\C=C/CC=O Amb24728871 [1,0,0,0,0,0|0,0,2]=3 827 B5R0.2 C\C=C/CCO Amb19930204 [1,0,0,0,0,0|0,0,3]=4 828 B5R0.2 C\C=C\CCBr Amb25808954 [1,0,0,0,0,0|2,0,1]=4 829 B5R0.2 C\C=C\CCI Amb25744699 [1,0,0,0,0,0|2,0,1]=4 830 B5R0.2 C\C=C\CCN Amb10601619 [1,0,0,0,0,0|2,0,1]=4 831 B5R0.2 C\C=C\CCN Amb24271068 [1,0,0,0,0,0|2,0,1]=4 832 B5R0.2 C\C=C\CCO Amb24655557 [1,0,0,0,0,0|0,0,3]=4 833 B5R0.2 C\C=C\CSC Amb24634458 [1,0,0,0,0,0|2,0,1]=4 834 B5R0.2 C\C=C\NCC Amb25141439 [1,0,0,0,0,0|2,0,1]=4 835 B5R0.2 ClCCCOCl Amb24333124 [1,0,0,0,0,0|3,0,0]=4 836 B5R0.2 ClCCNCC Amb17334050 [1,0,0,0,0,0|2,0,1]=4 837 B5R0.2 Cl\C=C\CCBr Amb24334549 [1,0,0,0,0,0|2,0,1]=4 838 B5R0.2 FCCCCF Amb10839858 [1,0,0,0,0,0|2,0,1]=4 839 B5R0.2 FCCCCS Amb25065453 [1,0,0,0,0,0|1,1,1]=4 840 B5R0.2 F\C=C/CCI Amb25264412 [1,0,0,0,0,0|2,0,1]=4 841 B5R0.2 ICCCCI Amb17672573 [1,0,0,0,0,0|2,0,1]=4 842 B5R0.2 N#CCCCF Amb25146362 [1,0,0,0,0,0|2,0,1]=4 843 B5R0.2 N#CCCNO Amb22748730 [1,0,0,0,0,0|2,0,1]=4 844 B5R0.2 N#CCNC=O Amb24618148 [1,0,0,0,0,0|2,0,1]=4 845 B5R0.2 N#CCOC=O Amb22347946 [1,0,0,0,0,0|2,0,1]=4 846 B5R0.2 N#CSCC=O Amb25678532 [1,0,0,0,0,0|2,0,1]=4 847 B5R0.2 NCCCCBr Amb18644498 [1,0,0,0,0,0|2,0,1]=4 848 B5R0.2 NCCCCBr Amb21858985 [1,0,0,0,0,0|2,0,1]=4 849 B5R0.2 NCCCCCl Amb18640687 [1,0,0,0,0,0|2,0,1]=4 850 B5R0.2 NCCCCCl Amb22233734 [1,0,0,0,0,0|2,0,1]=4 851 B5R0.2 NCCCCN Amb22352431 [1,0,0,0,0,0|2,0,1]=4 852 B5R0.2 NCCCCN Amb22489528 [1,0,0,0,0,0|2,0,1]=4 853 B5R0.2 NCCCCS Amb17500976 [1,0,0,0,0,0|1,1,1]=4 854 B5R0.2 NCCCCS Amb22546260 [1,0,0,0,0,0|1,1,1]=4 855 B5R0.2 NCCCNCl Amb24333308 [1,0,0,0,0,0|3,0,0]=4 856 B5R0.2 NCCNC=O Amb25213948 [1,0,0,0,0,0|2,0,0]=3 857 B5R0.2 NCCNN=O Amb24377161 [1,0,0,0,0,0|3,0,0]=4 858 B5R0.2 NCCOC=C Amb17593030 [1,0,0,0,0,0|3,0,0]=4 859 B5R0.2 NCCOC=O Amb24612320 [1,0,0,0,0,0|2,0,0]=3 860 B5R0.2 NCCOCC Amb1130918 [1,0,0,0,0,0|2,0,1]=4 861 B5R0.2 NCOCCO Amb25851211 [1,0,0,0,0,0|2,0,1]=4 862 B5R0.2 NNCCCF Amb25696672 [1,0,0,0,0,0|3,0,0]=4 863 B5R0.2 NNCCCO Amb19514839 [1,0,0,0,0,0|2,0,1]=4 864 B5R0.2 NNCCCO Amb22058994 [1,0,0,0,0,0|2,0,1]=4 865 B5R0.2 NOCCCF Amb22896552 [1,0,0,0,0,0|3,0,0]=4 866 B5R0.2 NOCCCF Amb24632017 [1,0,0,0,0,0|3,0,0]=4 867 B5R0.2 NOCCCO Amb18061671 [1,0,0,0,0,0|2,0,1]=4 868 B5R0.2 NOCCCS Amb17608230 [1,0,0,0,0,0|3,0,0]=4 869 B5R0.2 N[13CH2]CC[13CH2]N Amb22367523 [1,0,0,0,0,0|2,0,1]=4 870 B5R0.2 N[13CH2][13CH2][13CH2][13CH2]N Amb22336801 [1,0,0,0,0,0|2,0,1]=4 871 B5R0.2 N\C=C\CC=O Amb24706738 [1,0,0,0,0,0|1,0,2]=4 872 B5R0.2 O=C=NCCF Amb24710430 [1,0,0,0,0,0|2,0,1]=4 873 B5R0.2 O=CCCC=O Amb22231966 [1,0,0,0,0,0|1,0,1]=3 874 B5R0.2 O=CCCCBr Amb18644189 [1,0,0,0,0,0|1,0,0]=2 875 B5R0.2 O=CCCCF Amb24056028 [1,0,0,0,0,0|1,0,0]=2 876 B5R0.2 O=CCCSCl Amb25146622 [1,0,0,0,0,0|2,0,0]=3 877 B5R0.2 O=CCCSS Amb22524519 [1,0,0,0,0,0|2,0,0]=3 878 B5R0.2 O=CCN=C=S Amb25833744 [1,0,0,0,0,0|2,0,1]=4 879 B5R0.2 O=CCOCBr Amb25765436 [1,0,0,0,0,0|2,0,0]=3 880 B5R0.2 O=CCOCC Amb24052108 [1,0,0,0,0,0|1,0,0]=2 881 B5R0.2 O=CCOCCl Amb24671305 [1,0,0,0,0,0|2,0,0]=3 882 B5R0.2 O=CC\C=C\Cl Amb24571938 [1,0,0,0,0,0|1,0,2]=4 883 B5R0.2 O=COCCCl Amb22345927 [1,0,0,0,0,0|2,0,0]=3 884 B5R0.2 O=CSCCCl Amb25808568 [1,0,0,0,0,0|2,0,0]=3 885 B5R0.2 O=C\C=C\CBr Amb18124626 [1,0,0,0,0,0|1,0,2]=4 886 B5R0.2 O=C\C=C\CCl Amb18122401 [1,0,0,0,0,0|1,0,2]=4 887 B5R0.2 O=C\C=C\CF Amb24569288 [1,0,0,0,0,0|1,0,2]=4 888 B5R0.2 O=NOCCBr Amb24334595 [1,0,0,0,0,0|3,0,0]=4 889 B5R0.2 OC#CCCO Amb24333438 [1,0,0,0,0,0|1,0,2]=4 890 B5R0.2 OC=NCCCl Amb24684796 [1,0,0,0,0,0|2,0,0]=3 891 B5R0.2 OCC#CC=O Amb24566145 [1,0,0,0,0,0|1,0,2]=4 892 B5R0.2 OCCC=NO Amb24581888 [1,0,0,0,0,0|2,0,1]=4 893 B5R0.2 OCCCC#C Amb1219893 [1,0,0,0,0,0|0,0,3]=4 894 B5R0.2 OCCCC=O Amb24589235 [1,0,0,0,0,0|1,0,0]=2 895 B5R0.2 OCCCCCl Amb1101976 [1,0,0,0,0,0|1,0,1]=3 896 B5R0.2 OCCCCF Amb17593046 [1,0,0,0,0,0|1,0,1]=3 897 B5R0.2 OCCCCI Amb25689806 [1,0,0,0,0,0|1,0,1]=3 898 B5R0.2 OCCCCS Amb22229807 [1,0,0,0,0,0|1,0,1]=3 899 B5R0.2 OCCCNCl Amb25146306 [1,0,0,0,0,0|2,0,1]=4 900 B5R0.2 OCCCNO Amb24719785 [1,0,0,0,0,0|2,0,0]=3 901 B5R0.2 OCCNC=S Amb24723087 [1,0,0,0,0,0|2,1,0]=4 902 B5R0.2 OCCOC=C Amb17674184 [1,0,0,0,0,0|3,0,0]=4 903 B5R0.2 OCCOCCl Amb24673634 [1,0,0,0,0,0|2,0,1]=4 904 B5R0.2 OCCON=O Amb22363071 [1,0,0,0,0,0|3,0,0]=4 905 B5R0.2 OCCSCC Amb1085958 [1,0,0,0,0,0|1,0,1]=3 906 B5R0.2 OCCSN=O Amb25145493 [1,0,0,0,0,0|3,0,0]=4 907 B5R0.2 OCC\C=C\I Amb24332782 [1,0,0,0,0,0|2,0,1]=4 908 B5R0.2 OCNCCO Amb22228429 [1,0,0,0,0,0|2,0,1]=4 909 B5R0.2 OCOCCCl Amb25335353 [1,0,0,0,0,0|2,0,1]=4 910 B5R0.2 OCOCCO Amb22228906 [1,0,0,0,0,0|2,0,1]=4 911 B5R0.2 OC\C=C\C=O Amb24356008 [1,0,0,0,0,0|1,0,2]=4 912 B5R0.2 ON=CCC=O Amb25744688 [1,0,0,0,0,0|2,0,1]=4 913 B5R0.2 ON=NCCO Amb25747385 [1,0,0,0,0,0|3,0,0]=4 914 B5R0.2 O\C=C\CCO Amb24333503 [1,0,0,0,0,0|1,0,1]=3 915 B5R0.2 O\N=C\CC=O Amb24640219 [1,0,0,0,0,0|2,0,1]=4 916 B5R0.2 O\N=N/CCCl Amb24571170 [1,0,0,0,0,0|3,0,0]=4 917 B5R0.2 SCCCC#N Amb17504257 [1,0,0,0,0,0|2,0,1]=4 918 B5R0.2 SCCCC=C Amb17939241 [1,0,0,0,0,0|2,0,0]=3 919 B5R0.2 SCCCCCl Amb24665692 [1,0,0,0,0,0|1,1,1]=4 920 B5R0.2 [15NH2]CCCC[15NH2] Amb22353369 [1,0,0,0,0,0|2,0,1]=4 921 B5R0.2 [C-]#[N+]CCC=O Amb24706723 [1,0,0,0,0,0|1,0,1]=3 922 B5R0.2 [C-]#[N+]CCCC Amb2235001 [1,0,0,0,0,0|2,0,0]=3 923 B5R0.2 [C-]#[N+]CCOC Amb1981032 [1,0,0,0,0,0|3,0,0]=4 924 B7R0.2 C#CC(N)CC(O)=O Amb24529562 [0,1,0,0,0,0|0,0,2]=3 925 B7R0.2 C#CC(O)CC(O)=O Amb25737576 [0,1,0,0,0,0|0,0,2]=3 926 B7R0.2 C=C(Br)C[C@H](O)CO Amb25369386 [0,1,0,0,0,0|3,0,0]=4 927 B7R0.2 C=C(CC(O)=O)C#C Amb24568901 [0,1,0,0,0,0|0,0,3]=4 928 B7R0.2 C=C(CC(O)=O)C=C Amb24561923 [0,1,0,0,0,0|0,0,3]=4 929 B7R0.2 C=C(Cl)CC(O)CO Amb24482396 [0,1,0,0,0,0|3,0,0]=4 930 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [0,1,0,0,0,0|3,0,0]=4 931 B7R0.2 C=CC(Br)CC(O)=O Amb18125534 [0,1,0,0,0,0|0,0,2]=3 932 B7R0.2 C=CC(Cl)CC(O)=O Amb18124408 [0,1,0,0,0,0|0,0,2]=3 933 B7R0.2 C=CC(F)CC(O)=O Amb25359137 [0,1,0,0,0,0|0,0,2]=3 934 B7R0.2 C=CC(N)CC(O)=O Amb22641963 [0,1,0,0,0,0|0,0,2]=3 935 B7R0.2 C=CC(O)CC(N)=O Amb25799663 [0,1,0,0,0,0|1,0,2]=4 936 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [0,1,0,0,0,0|0,0,2]=3 937 B7R0.2 C=CN(Br)CC(O)=O Amb24629979 [0,1,0,0,0,0|1,0,2]=4 938 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [0,1,0,0,0,0|0,0,2]=3 939 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [0,1,0,0,0,0|0,0,2]=3 940 B7R0.2 CC(=C)CC(N)CO Amb24665584 [0,1,0,0,0,0|3,0,0]=4 941 B7R0.2 CC(=C)CC(O)CCl Amb25322238 [0,1,0,0,0,0|3,0,0]=4 942 B7R0.2 CC(=C)C[C@H](O)CO Amb25235652 [0,1,0,0,0,0|3,0,0]=4 943 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [0,1,0,0,0,0|1,0,2]=4 944 B7R0.2 CC(=N)CC(=O)CC Amb24734350 [0,1,0,0,0,0|2,0,1]=4 945 B7R0.2 CC(=O)C=C(Br)CC Amb25327796 [0,1,0,0,0,0|1,0,2]=4 946 B7R0.2 CC(=O)C=C(Cl)CC Amb25809857 [0,1,0,0,0,0|1,0,2]=4 947 B7R0.2 CC(=O)CC(=C)CCl Amb25092223 [0,1,0,0,0,0|2,0,1]=4 948 B7R0.2 CC(=O)CC(=N)CF Amb25087799 [0,1,0,0,0,0|2,0,1]=4 949 B7R0.2 CC(=O)CC(=N)NC Amb24096720 [0,1,0,0,0,0|2,0,1]=4 950 B7R0.2 CC(=O)CC(=O)CBr Amb24442011 [0,1,0,0,0,0|2,0,1]=4 951 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [0,1,0,0,0,0|2,0,1]=4 952 B7R0.2 CC(=O)CC(=S)CC Amb24378474 [0,1,0,0,0,0|1,0,1]=3 953 B7R0.2 CC(=O)CC(=S)NC Amb24096719 [0,1,0,0,0,0|2,0,1]=4 954 B7R0.2 CC(=O)CC(=S)OC Amb24096829 [0,1,0,0,0,0|2,0,1]=4 955 B7R0.2 CC(=O)CC(Cl)CCl Amb25335495 [0,1,0,0,0,0|2,0,0]=3 956 B7R0.2 CC(=O)CC(O)C#C Amb24690832 [0,1,0,0,0,0|1,0,2]=4 957 B7R0.2 CC(=O)CC(O)C=C Amb25103770 [0,1,0,0,0,0|1,0,2]=4 958 B7R0.2 CC(=O)CC(O)C=O Amb24481554 [0,1,0,0,0,0|2,0,1]=4 959 B7R0.2 CC(=O)CC(O)CO Amb25304727 [0,1,0,0,0,0|2,0,0]=3 960 B7R0.2 CC(=O)CC(S)C=O Amb25838806 [0,1,0,0,0,0|2,0,1]=4 961 B7R0.2 CC(=O)C[C@@H](O)CO Amb24640954 [0,1,0,0,0,0|2,0,0]=3 962 B7R0.2 CC(=O)C[C@H](O)C=C Amb25051451 [0,1,0,0,0,0|1,0,2]=4 963 B7R0.2 CC(=O)C[C@H](O)CCl Amb25810138 [0,1,0,0,0,0|2,0,0]=3 964 B7R0.2 CC(=O)C\C(\Cl)=C/C Amb24553550 [0,1,0,0,0,0|1,0,2]=4 965 B7R0.2 CC(=O)C\C(\Cl)=C\C Amb25834378 [0,1,0,0,0,0|1,0,2]=4 966 B7R0.2 CC(=O)NC(=C)CC Amb25804486 [0,1,0,0,0,0|2,0,1]=4 967 B7R0.2 CC(=O)NC(=S)CC Amb25828544 [0,1,0,0,0,0|2,0,1]=4 968 B7R0.2 CC(=O)OC(=C)CC Amb25202254 [0,1,0,0,0,0|2,0,1]=4 969 B7R0.2 CC(=O)OC(=O)CC Amb21858081 [0,1,0,0,0,0|2,0,1]=4 970 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [0,1,0,0,0,0|3,0,0]=4 971 B7R0.2 CC(=O)OC(Cl)CBr Amb25843189 [0,1,0,0,0,0|3,0,0]=4 972 B7R0.2 CC(=O)OC(Cl)CCl Amb22729073 [0,1,0,0,0,0|3,0,0]=4 973 B7R0.2 CC(=O)\C=C(/Br)\CC Amb24434628 [0,1,0,0,0,0|1,0,2]=4 974 B7R0.2 CC(=O)\C=C(/Cl)\CC Amb25065790 [0,1,0,0,0,0|1,0,2]=4 975 B7R0.2 CC(=O)\C=C(/[O-])\CC Amb19960031 [0,1,0,0,0,0|1,0,2]=4 976 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,1,0,0,0,0|1,0,1]=3 977 B7R0.2 CC(C)CC(Br)CC Amb24346666 [0,1,0,0,0,0|2,0,1]=4 978 B7R0.2 CC(C)CC(C)CC Amb22228298 [0,1,0,0,0,0|2,0,1]=4 979 B7R0.2 CC(C)CC(N)CC Amb18523780 [0,1,0,0,0,0|2,0,1]=4 980 B7R0.2 CC(C)C[C@@H](N)CC Amb24675860 [0,1,0,0,0,0|2,0,1]=4 981 B7R0.2 CC(C)C[C@@H](O)CC Amb25795362 [0,1,0,0,0,0|2,0,1]=4 982 B7R0.2 CC(CBr)CC(C)=O Amb24365894 [0,1,0,0,0,0|2,0,0]=3 983 B7R0.2 CC(CBr)NC(C)=O Amb25223671 [0,1,0,0,0,0|3,0,0]=4 984 B7R0.2 CC(CBr)OC(N)=O Amb24368693 [0,1,0,0,0,0|3,0,0]=4 985 B7R0.2 CC(CC(=O)Cl)C=C Amb25278347 [0,1,0,0,0,0|1,0,2]=4 986 B7R0.2 CC(CC(C)=O)=NC Amb25250042 [0,1,0,0,0,0|2,0,1]=4 987 B7R0.2 CC(CC(C)=O)C#C Amb24738456 [0,1,0,0,0,0|1,0,2]=4 988 B7R0.2 CC(CC(C)=O)C#N Amb18124227 [0,1,0,0,0,0|2,0,1]=4 989 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [0,1,0,0,0,0|2,0,1]=4 990 B7R0.2 CC(CC(C)O)OC Amb22757067 [0,1,0,0,0,0|2,0,1]=4 991 B7R0.2 CC(CC(Cl)Cl)CC Amb25725024 [0,1,0,0,0,0|2,0,1]=4 992 B7R0.2 CC(CC(N)=O)CN Amb18641899 [0,1,0,0,0,0|2,0,0]=3 993 B7R0.2 CC(CC(O)=O)=C=C Amb25265849 [0,1,0,0,0,0|0,0,3]=4 994 B7R0.2 CC(CC(O)=O)=CCl Amb25802122 [0,1,0,0,0,0|1,0,2]=4 995 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [0,1,0,0,0,0|0,0,2]=3 996 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [0,1,0,0,0,0|1,0,1]=3 997 B7R0.2 CC(CC(O)=O)CO Amb18198168 [0,1,0,0,0,0|1,0,0]=2 998 B7R0.2 CC(CC(O)=O)SCl Amb24483173 [0,1,0,0,0,0|2,0,0]=3 999 B7R0.2 CC(CC)=CC(N)=O Amb24640827 [0,1,0,0,0,0|1,0,2]=4 1000 B7R0.2 CC(CC)CC(=N)N Amb10607625 [0,1,0,0,0,0|2,0,0]=3 1001 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [0,1,0,0,0,0|1,0,0]=2 1002 B7R0.2 CC(CCl)OC(C)=O Amb24481416 [0,1,0,0,0,0|3,0,0]=4 1003 B7R0.2 CC(CF)NC(C)=O Amb25077726 [0,1,0,0,0,0|3,0,0]=4 1004 B7R0.2 CC(CF)NC(N)=O Amb24354538 [0,1,0,0,0,0|3,0,0]=4 1005 B7R0.2 CC(CN)CC(C)=O Amb18251072 [0,1,0,0,0,0|2,0,0]=3 1006 B7R0.2 CC(CN)CC(C)O Amb19337142 [0,1,0,0,0,0|2,0,1]=4 1007 B7R0.2 CC(CN)CC(O)=O Amb18124263 [0,1,0,0,0,0|1,0,0]=2 1008 B7R0.2 CC(CN)CC(O)=O Amb20669501 [0,1,0,0,0,0|1,0,0]=2 1009 B7R0.2 CC(CN)CP(O)=O Amb25757942 [0,1,0,0,0,0|2,0,0]=3 1010 B7R0.2 CC(CN)NC(C)=O Amb18251073 [0,1,0,0,0,0|3,0,0]=4 1011 B7R0.2 CC(CN)NC(N)=O Amb18202682 [0,1,0,0,0,0|3,0,0]=4 1012 B7R0.2 CC(CN)SC(C)=O Amb25255492 [0,1,0,0,0,0|3,0,0]=4 1013 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [0,1,0,0,0,0|1,0,2]=4 1014 B7R0.2 CC(CO)CC(C)=O Amb24606485 [0,1,0,0,0,0|2,0,0]=3 1015 B7R0.2 CC(CO)CC(N)=N Amb24579212 [0,1,0,0,0,0|3,0,0]=4 1016 B7R0.2 CC(CO)CC(N)=O Amb24452895 [0,1,0,0,0,0|2,0,0]=3 1017 B7R0.2 CC(CO)OC(C)=O Amb25144303 [0,1,0,0,0,0|3,0,0]=4 1018 B7R0.2 CC(CO)OP(O)=O Amb24643413 [0,1,0,0,0,0|3,0,0]=4 1019 B7R0.2 CC(CS)=CC(O)=O Amb25073137 [0,1,0,0,0,0|1,0,2]=4 1020 B7R0.2 CC(Cl)CC(O)CC Amb25053890 [0,1,0,0,0,0|2,0,1]=4 1021 B7R0.2 CC(F)CC(O)CC Amb24675431 [0,1,0,0,0,0|2,0,1]=4 1022 B7R0.2 CC(NC(=O)N)CC Amb1105272 [0,1,0,0,0,0|2,0,0]=3 1023 B7R0.2 CC(NC)CC(=O)N Amb17231826 [0,1,0,0,0,0|2,0,0]=3 1024 B7R0.2 CC(NC)CC(=S)N Amb17231886 [0,1,0,0,0,0|2,1,0]=4 1025 B7R0.2 CC(O)CC(C)CO Amb25262806 [0,1,0,0,0,0|2,0,1]=4 1026 B7R0.2 CC(O)CC(N)CI Amb25197705 [0,1,0,0,0,0|2,0,1]=4 1027 B7R0.2 CC(O)CC(N)CO Amb25828018 [0,1,0,0,0,0|2,0,1]=4 1028 B7R0.2 CC(O)CC(O)CCl Amb24663123 [0,1,0,0,0,0|2,0,1]=4 1029 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [0,1,0,0,0,0|0,0,1]=2 1030 B7R0.2 CCC(=O)CC(C)O Amb25113617 [0,1,0,0,0,0|1,0,2]=4 1031 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [0,1,0,0,0,0|0,0,1]=2 1032 B7R0.2 CCC(=O)C[C@H](C)O Amb25746635 [0,1,0,0,0,0|1,0,2]=4 1033 B7R0.2 CCC(=O)C[N+]([O-])=O Amb21857551 [0,1,0,0,0,0|1,0,2]=4 1034 B7R0.2 CCC(Br)C=C(Cl)Cl Amb25690742 [0,1,0,0,0,0|2,0,1]=4 1035 B7R0.2 CCC(Br)CC(C)=C Amb24355903 [0,1,0,0,0,0|2,0,0]=3 1036 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [0,1,0,0,0,0|0,0,0]=1 1037 B7R0.2 CCC(C)C=C(Br)Br Amb24744207 [0,1,0,0,0,0|2,0,1]=4 1038 B7R0.2 CCC(C)C=C(Cl)Cl Amb24559351 [0,1,0,0,0,0|2,0,1]=4 1039 B7R0.2 CCC(C)CC(C)=C Amb22228340 [0,1,0,0,0,0|2,0,0]=3 1040 B7R0.2 CCC(C)CC(C)Br Amb24757470 [0,1,0,0,0,0|2,0,1]=4 1041 B7R0.2 CCC(C)CC(N)=N Amb19890168 [0,1,0,0,0,0|2,0,0]=3 1042 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,1,0,0,0,0|1,0,0]=2 1043 B7R0.2 CCC(C)CN(C)C Amb25851027 [0,1,0,0,0,0|3,0,0]=4 1044 B7R0.2 CCC(C)C[N+]([O-])=O Amb25075983 [0,1,0,0,0,0|1,0,1]=3 1045 B7R0.2 CCC(C)NC(C)=N Amb25081674 [0,1,0,0,0,0|3,0,0]=4 1046 B7R0.2 CCC(C)NC(C)=S Amb24332642 [0,1,0,0,0,0|2,1,0]=4 1047 B7R0.2 CCC(C)NC(N)=N Amb24531881 [0,1,0,0,0,0|3,0,0]=4 1048 B7R0.2 CCC(C)NC(O)=S Amb25368326 [0,1,0,0,0,0|1,1,0]=3 1049 B7R0.2 CCC(C)NC(S)=S Amb24382369 [0,1,0,0,0,0|1,2,0]=4 1050 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,1,0,0,0,0|2,0,0]=3 1051 B7R0.2 CCC(C)OC(N)=N Amb24563563 [0,1,0,0,0,0|3,0,0]=4 1052 B7R0.2 CCC(C)O[N+]([O-])=O Amb25088971 [0,1,0,0,0,0|2,0,1]=4 1053 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,1,0,0,0,0|2,0,0]=3 1054 B7R0.2 CCC(CC(=O)C)C Amb10608208 [0,1,0,0,0,0|1,0,0]=2 1055 B7R0.2 CCC(CC(=O)O)N Amb1993862 [0,1,0,0,0,0|0,0,0]=1 1056 B7R0.2 CCC(CC(=O)O)O Amb10844270 [0,1,0,0,0,0|0,0,0]=1 1057 B7R0.2 CCC(CC(N)C)C Amb10069423 [0,1,0,0,0,0|2,0,1]=4 1058 B7R0.2 CCC(Cl)C=C(C)C Amb25295453 [0,1,0,0,0,0|2,0,1]=4 1059 B7R0.2 CCC(Cl)C=C(Cl)Cl Amb24711397 [0,1,0,0,0,0|2,0,1]=4 1060 B7R0.2 CCC(Cl)CC(=O)Cl Amb24390220 [0,1,0,0,0,0|1,0,0]=2 1061 B7R0.2 CCC(Cl)CC(C)=C Amb24735482 [0,1,0,0,0,0|2,0,0]=3 1062 B7R0.2 CCC(Cl)CC(Cl)Cl Amb25258037 [0,1,0,0,0,0|2,0,1]=4 1063 B7R0.2 CCC(Cl)CN(C)C Amb25328843 [0,1,0,0,0,0|3,0,0]=4 1064 B7R0.2 CCC(Cl)OC(=O)Cl Amb25853933 [0,1,0,0,0,0|2,0,0]=3 1065 B7R0.2 CCC(F)=CC(O)=O Amb24674138 [0,1,0,0,0,0|0,0,2]=3 1066 B7R0.2 CCC(N)CC(C)=C Amb24367516 [0,1,0,0,0,0|2,0,0]=3 1067 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,1,0,0,0,0|1,0,0]=2 1068 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,1,0,0,0,0|1,0,0]=2 1069 B7R0.2 CCC(N)CS(C)=O Amb24481377 [0,1,0,0,0,0|2,0,0]=3 1070 B7R0.2 CCC(N)NC(C)=O Amb25062531 [0,1,0,0,0,0|2,0,0]=3 1071 B7R0.2 CCC(N)NC(N)=N Amb25275524 [0,1,0,0,0,0|3,0,0]=4 1072 B7R0.2 CCC(O)C=C(C)C Amb25340896 [0,1,0,0,0,0|2,0,1]=4 1073 B7R0.2 CCC(O)CC(C)=C Amb24062975 [0,1,0,0,0,0|2,0,0]=3 1074 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,1,0,0,0,0|1,0,0]=2 1075 B7R0.2 CCC(O)CC(N)=O Amb24616660 [0,1,0,0,0,0|1,0,0]=2 1076 B7R0.2 CCC(O)CC(O)=O Amb22363067 [0,1,0,0,0,0|0,0,0]=1 1077 B7R0.2 CCC(O)C[N+]([O-])=O Amb25136685 [0,1,0,0,0,0|1,0,1]=3 1078 B7R0.2 CCC(O)SC(C)=S Amb25332463 [0,1,0,0,0,0|2,1,0]=4 1079 B7R0.2 CCC(S)CC(O)=O Amb18303084 [0,1,0,0,0,0|0,0,0]=1 1080 B7R0.2 CCN(C)CC(=C)Br Amb25333139 [0,1,0,0,0,0|3,0,0]=4 1081 B7R0.2 CCN(C)NC(C)=O Amb24675229 [0,1,0,0,0,0|3,0,0]=4 1082 B7R0.2 CCN(CC(O)C)C Amb17334070 [0,1,0,0,0,0|2,0,1]=4 1083 B7R0.2 CCN(N)CC(O)=O Amb25738005 [0,1,0,0,0,0|1,0,0]=2 1084 B7R0.2 CCS(=O)CC(=C)Cl Amb25052718 [0,1,0,0,0,0|3,0,0]=4 1085 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,1,0,0,0,0|1,0,0]=2 1086 B7R0.2 CCS(=O)CC(C)O Amb25687853 [0,1,0,0,0,0|2,0,1]=4 1087 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [0,1,0,0,0,0|0,0,0]=1 1088 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [0,1,0,0,0,0|1,0,0]=2 1089 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [0,1,0,0,0,0|1,0,0]=2 1090 B7R0.2 CC[C@@H](C)NC(C)=O Amb25169508 [0,1,0,0,0,0|2,0,0]=3 1091 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [0,1,0,0,0,0|0,0,0]=1 1092 B7R0.2 CC[C@@H](N)CN(C)C Amb22587558 [0,1,0,0,0,0|3,0,0]=4 1093 B7R0.2 CC[C@@H](O)C=C(C)C Amb24475081 [0,1,0,0,0,0|2,0,1]=4 1094 B7R0.2 CC[C@@H](O)CC(C)=C Amb25136335 [0,1,0,0,0,0|2,0,0]=3 1095 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,1,0,0,0,0|1,0,0]=2 1096 B7R0.2 CC[C@@H](O)CN(C)C Amb24446828 [0,1,0,0,0,0|3,0,0]=4 1097 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [0,1,0,0,0,0|0,0,0]=1 1098 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [0,1,0,0,0,0|1,0,0]=2 1099 B7R0.2 CC[C@H](C)CC(C)N Amb25062813 [0,1,0,0,0,0|2,0,1]=4 1100 B7R0.2 CC[C@H](C)CC(N)=N Amb24409491 [0,1,0,0,0,0|2,0,0]=3 1101 B7R0.2 CC[C@H](C)NC(C)=O Amb25823467 [0,1,0,0,0,0|2,0,0]=3 1102 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [0,1,0,0,0,0|0,0,0]=1 1103 B7R0.2 CC[C@H](N)CN(C)C Amb22587381 [0,1,0,0,0,0|3,0,0]=4 1104 B7R0.2 CC[C@H](N)CN(C)C Amb23385277 [0,1,0,0,0,0|3,0,0]=4 1105 B7R0.2 CC[C@H](O)CN(C)C Amb25749217 [0,1,0,0,0,0|3,0,0]=4 1106 B7R0.2 CC[C@H](O)C[N+]([O-])=O Amb25854053 [0,1,0,0,0,0|1,0,1]=3 1107 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [0,1,0,0,0,0|1,0,0]=2 1108 B7R0.2 CC\C(\N)=C/C(N)=O Amb24624408 [0,1,0,0,0,0|1,0,2]=4 1109 B7R0.2 CN(CC(O)=O)C#N Amb25195711 [0,1,0,0,0,0|2,0,1]=4 1110 B7R0.2 CN(CC(O)=O)C=O Amb18951578 [0,1,0,0,0,0|2,0,1]=4 1111 B7R0.2 CNC(=O)CC(N)=O Amb24400836 [0,1,0,0,0,0|2,0,1]=4 1112 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,1,0,0,0,0|2,0,0]=3 1113 B7R0.2 CNC(C)CC(O)=O Amb21959674 [0,1,0,0,0,0|1,0,0]=2 1114 B7R0.2 CNC(C)CS(C)=O Amb24410768 [0,1,0,0,0,0|3,0,0]=4 1115 B7R0.2 CNC(C)C[N+]([O-])=O Amb25297025 [0,1,0,0,0,0|2,0,1]=4 1116 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [0,1,0,0,0,0|1,0,0]=2 1117 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [0,1,0,0,0,0|1,0,0]=2 1118 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,1,0,0,0,0|1,0,1]=3 1119 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,1,0,0,0,0|2,0,1]=4 1120 B7R0.2 COC(C)CC(N)=S Amb25782261 [0,1,0,0,0,0|2,1,0]=4 1121 B7R0.2 COC(C)CS([O-])=O Amb25690482 [0,1,0,0,0,0|2,0,1]=4 1122 B7R0.2 CON(C)CC(N)=O Amb24447118 [0,1,0,0,0,0|3,0,0]=4 1123 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [0,1,0,0,0,0|1,0,0]=2 1124 B7R0.2 CO[C@@H](O)CC(C)=O Amb24450127 [0,1,0,0,0,0|2,0,0]=3 1125 B7R0.2 CS(=O)CC(O)CN Amb24482487 [0,1,0,0,0,0|3,0,0]=4 1126 B7R0.2 CS(=O)C[C@@H](O)CN Amb25284334 [0,1,0,0,0,0|3,0,0]=4 1127 B7R0.2 CS(=O)C[C@H](N)CO Amb24436533 [0,1,0,0,0,0|3,0,0]=4 1128 B7R0.2 CS(=O)C[C@H](O)CN Amb25811520 [0,1,0,0,0,0|3,0,0]=4 1129 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,1,0,0,0,0|2,0,0]=3 1130 B7R0.2 CSC(C)CC(O)=O Amb18967824 [0,1,0,0,0,0|1,0,0]=2 1131 B7R0.2 C[C@@H](CC(C)=O)C#C Amb25721483 [0,1,0,0,0,0|1,0,2]=4 1132 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [0,1,0,0,0,0|2,0,1]=4 1133 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [0,1,0,0,0,0|2,0,0]=3 1134 B7R0.2 C[C@@H](CCl)OC(C)=O Amb24419691 [0,1,0,0,0,0|3,0,0]=4 1135 B7R0.2 C[C@@H](CO)CC(C)=C Amb25845281 [0,1,0,0,0,0|3,0,0]=4 1136 B7R0.2 C[C@@H](CO)CC(C)=O Amb25072788 [0,1,0,0,0,0|2,0,0]=3 1137 B7R0.2 C[C@@H](CO)NC(N)=O Amb25315937 [0,1,0,0,0,0|3,0,0]=4 1138 B7R0.2 C[C@@H](CO)OC(C)=O Amb25681753 [0,1,0,0,0,0|3,0,0]=4 1139 B7R0.2 C[C@@H](C[C@@H](C)O)NC Amb24505242 [0,1,0,0,0,0|2,0,1]=4 1140 B7R0.2 C[C@@H](C[C@H](C)O)NC Amb25324434 [0,1,0,0,0,0|2,0,1]=4 1141 B7R0.2 C[C@@H](O)C[C@H](C)CO Amb24642405 [0,1,0,0,0,0|2,0,1]=4 1142 B7R0.2 C[C@H](CBr)NC(C)=O Amb24690410 [0,1,0,0,0,0|3,0,0]=4 1143 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [0,1,0,0,0,0|0,0,2]=3 1144 B7R0.2 C[C@H](CO)NC(C)=O Amb24426644 [0,1,0,0,0,0|3,0,0]=4 1145 B7R0.2 C[C@H](CO)NC(N)=O Amb24682644 [0,1,0,0,0,0|3,0,0]=4 1146 B7R0.2 C[C@H](C[C@H](C)O)OC Amb24733201 [0,1,0,0,0,0|2,0,1]=4 1147 B7R0.2 C[C@H](O)C[C@@H](C)CO Amb25845280 [0,1,0,0,0,0|2,0,1]=4 1148 B7R0.2 C[C@H](O)C[C@@H](N)CO Amb25105060 [0,1,0,0,0,0|2,0,1]=4 1149 B7R0.2 C[C@H](S)C[C@@H](O)CC Amb25237174 [0,1,0,0,0,0|1,1,1]=4 1150 B7R0.2 C\C(\CBr)=C/C(O)=O Amb23538399 [0,1,0,0,0,0|1,0,2]=4 1151 B7R0.2 C\C(\CC(C)=O)=N/C Amb25093198 [0,1,0,0,0,0|2,0,1]=4 1152 B7R0.2 C\C(\CC(C)=O)=N\C Amb25285772 [0,1,0,0,0,0|2,0,1]=4 1153 B7R0.2 C\C(\CC(N)=O)=C\C Amb25055448 [0,1,0,0,0,0|1,0,2]=4 1154 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [0,1,0,0,0,0|0,0,2]=3 1155 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [0,1,0,0,0,0|2,0,1]=4 1156 B7R0.2 C\C(\CC)=C\C(O)=O Amb18281014 [0,1,0,0,0,0|0,0,2]=3 1157 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [0,1,0,0,0,0|1,0,2]=4 1158 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [0,1,0,0,0,0|0,0,2]=3 1159 B7R0.2 ClCC(=O)CC(=O)Cl Amb17593874 [0,1,0,0,0,0|2,0,1]=4 1160 B7R0.2 NC(=N)C[C@@H](O)CCl Amb24387966 [0,1,0,0,0,0|3,0,0]=4 1161 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,1,0,0,0,0|2,0,0]=3 1162 B7R0.2 NC(=O)C[C@H](O)CCl Amb25791271 [0,1,0,0,0,0|2,0,0]=3 1163 B7R0.2 NC(CC(N)=O)C#N Amb24122907 [0,1,0,0,0,0|2,0,1]=4 1164 B7R0.2 NC(CC(N)=O)C=O Amb24482471 [0,1,0,0,0,0|2,0,1]=4 1165 B7R0.2 NC(CF)CC(O)=O Amb24428065 [0,1,0,0,0,0|1,0,0]=2 1166 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [0,1,0,0,0,0|1,0,2]=4 1167 B7R0.2 NC(CO)CC(N)=O Amb24384089 [0,1,0,0,0,0|2,0,0]=3 1168 B7R0.2 NC(CS)CC(O)=O Amb25090412 [0,1,0,0,0,0|1,0,0]=2 1169 B7R0.2 NCC(Br)=CC(O)=O Amb25288089 [0,1,0,0,0,0|1,0,2]=4 1170 B7R0.2 NCC(Cl)=CC(O)=O Amb25368348 [0,1,0,0,0,0|1,0,2]=4 1171 B7R0.2 NCC(F)CC(O)=O Amb24550169 [0,1,0,0,0,0|1,0,0]=2 1172 B7R0.2 NCC(N)CC(O)=O Amb19515145 [0,1,0,0,0,0|1,0,0]=2 1173 B7R0.2 NCC(N)CC(O)=O Amb21858324 [0,1,0,0,0,0|1,0,0]=2 1174 B7R0.2 NCC(N)CC(O)=O Amb22751661 [0,1,0,0,0,0|1,0,0]=2 1175 B7R0.2 NCC(O)CC(N)=O Amb18641952 [0,1,0,0,0,0|2,0,0]=3 1176 B7R0.2 NCC(O)CP(=O)=O Amb24648320 [0,1,0,0,0,0|2,0,1]=4 1177 B7R0.2 NCC(O)CP(O)=O Amb24714285 [0,1,0,0,0,0|2,0,0]=3 1178 B7R0.2 NC[C@@H](F)CP(O)=O Amb24481490 [0,1,0,0,0,0|2,0,0]=3 1179 B7R0.2 NC[C@@H](N)CC(O)=O Amb22751651 [0,1,0,0,0,0|1,0,0]=2 1180 B7R0.2 NC[C@@H](N)CC(O)=O Amb25829509 [0,1,0,0,0,0|1,0,0]=2 1181 B7R0.2 NC[C@H](CC(=O)O)N Amb10603267 [0,1,0,0,0,0|1,0,0]=2 1182 B7R0.2 NC[C@H](F)CS(O)=O Amb25068064 [0,1,0,0,0,0|2,0,0]=3 1183 B7R0.2 NC[C@H](N)CC(O)=O Amb25378712 [0,1,0,0,0,0|1,0,0]=2 1184 B7R0.2 NC[C@H](O)CP(O)=O Amb25324060 [0,1,0,0,0,0|2,0,0]=3 1185 B7R0.2 NC\C(\Cl)=C\C(O)=O Amb24375873 [0,1,0,0,0,0|1,0,2]=4 1186 B7R0.2 NNC(=O)CC(O)=O Amb25073925 [0,1,0,0,0,0|2,0,1]=4 1187 B7R0.2 N[C@@H](CC(N)=O)C=O Amb24446454 [0,1,0,0,0,0|2,0,1]=4 1188 B7R0.2 N[C@@H](CC(O)=O)C#N Amb25757887 [0,1,0,0,0,0|1,0,1]=3 1189 B7R0.2 N[C@@H](CC([O-])=O)C=O Amb22800169 [0,1,0,0,0,0|1,0,2]=4 1190 B7R0.2 N[C@@H](CO)CC(N)=O Amb24704927 [0,1,0,0,0,0|2,0,0]=3 1191 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [0,1,0,0,0,0|1,0,1]=3 1192 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [0,1,0,0,0,0|1,0,0]=2 1193 B7R0.2 N[C@H](CO)CC(N)=O Amb24599306 [0,1,0,0,0,0|2,0,0]=3 1194 B7R0.2 N\C(\CC(O)=O)=N/N Amb25281098 [0,1,0,0,0,0|2,0,1]=4 1195 B7R0.2 O=C(Cl)CC(Cl)CCl Amb25138703 [0,1,0,0,0,0|2,0,0]=3 1196 B7R0.2 O=NN(CC(=O)O)C Amb17618622 [0,1,0,0,0,0|3,0,0]=4 1197 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [0,1,0,0,0,0|1,0,1]=3 1198 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [0,1,0,0,0,0|2,0,1]=4 1199 B7R0.2 OC(=O)CC(Br)CCl Amb25834578 [0,1,0,0,0,0|1,0,0]=2 1200 B7R0.2 OC(=O)CC(Cl)CCl Amb25335414 [0,1,0,0,0,0|1,0,0]=2 1201 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [0,1,0,0,0,0|1,0,1]=3 1202 B7R0.2 OC(=O)CN(O)C=O Amb25367291 [0,1,0,0,0,0|2,0,1]=4 1203 B7R0.2 OC(=O)CN(O)N=O Amb25041862 [0,1,0,0,0,0|3,0,0]=4 1204 B7R0.2 OC(=O)\C=C(\Br)/CCl Amb24355885 [0,1,0,0,0,0|1,0,2]=4 1205 B7R0.2 OC(=O)\C=C(\Cl)/CBr Amb25336694 [0,1,0,0,0,0|1,0,2]=4 1206 B7R0.2 OC(CC(=O)Cl)CCl Amb25806118 [0,1,0,0,0,0|2,0,0]=3 1207 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [0,1,0,0,0,0|1,0,0]=2 1208 B7R0.2 OCC(O)CP(O)=O Amb25316128 [0,1,0,0,0,0|2,0,0]=3 1209 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [0,1,0,0,0,0|1,0,0]=2 1210 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [0,1,0,0,0,0|1,0,0]=2 1211 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [0,1,0,0,0,0|1,0,0]=2 1212 B7R0.2 [O-]C(=O)CC(O)C=O Amb22733997 [0,1,0,0,0,0|1,0,2]=4 1213 B7R0.2 [O-]C(=O)CC(O)CO Amb24117078 [0,1,0,0,0,0|1,0,1]=3 1214 B7R0.2 [O-][N+](=O)CC(Cl)CCl Amb22347684 [0,1,0,0,0,0|2,0,1]=4 1215 B7R0.3 C#CC(=O)NCCN Amb18950627 [0,1,0,0,0,0|3,0,0]=4 1216 B7R0.3 C#CC(=O)OCCCl Amb24481474 [0,1,0,0,0,0|3,0,0]=4 1217 B7R0.3 C#CCCC(=O)CBr Amb25362236 [0,1,0,0,0,0|1,0,2]=4 1218 B7R0.3 C#CCCC(=O)CN Amb25678834 [0,1,0,0,0,0|1,0,2]=4 1219 B7R0.3 C#CCCC(=O)NN Amb18636071 [0,1,0,0,0,0|1,0,2]=4 1220 B7R0.3 C#CCCC(N)=NO Amb25025476 [0,1,0,0,0,0|1,0,2]=4 1221 B7R0.3 C=C(C=O)CCC#N Amb17593125 [0,1,0,0,0,0|2,0,1]=4 1222 B7R0.3 C=C(CCl)CCCBr Amb25266982 [0,1,0,0,0,0|3,0,0]=4 1223 B7R0.3 C=C(CO)CCCN Amb25747319 [0,1,0,0,0,0|2,0,0]=3 1224 B7R0.3 C=CC(=C)CCCBr Amb25111166 [0,1,0,0,0,0|3,0,0]=4 1225 B7R0.3 C=CC(=O)CCC#N Amb18641280 [0,1,0,0,0,0|2,0,1]=4 1226 B7R0.3 C=CC(=O)CCCBr Amb24726349 [0,1,0,0,0,0|2,0,0]=3 1227 B7R0.3 C=CC(=O)CCCCl Amb24568327 [0,1,0,0,0,0|2,0,0]=3 1228 B7R0.3 C=CC(=O)CCCN Amb25662517 [0,1,0,0,0,0|2,0,0]=3 1229 B7R0.3 C=CC(=O)CCCO Amb25284731 [0,1,0,0,0,0|2,0,0]=3 1230 B7R0.3 C=CC(=O)NCCCl Amb20668986 [0,1,0,0,0,0|3,0,0]=4 1231 B7R0.3 C=CC(=O)NCCN Amb18291565 [0,1,0,0,0,0|3,0,0]=4 1232 B7R0.3 C=CC(=O)NCCN Amb19514971 [0,1,0,0,0,0|3,0,0]=4 1233 B7R0.3 C=CC(=O)OCCBr Amb22049483 [0,1,0,0,0,0|3,0,0]=4 1234 B7R0.3 C=CC(=O)OCCCl Amb17933972 [0,1,0,0,0,0|3,0,0]=4 1235 B7R0.3 C=CC(=O)OCCN Amb24578210 [0,1,0,0,0,0|3,0,0]=4 1236 B7R0.3 C=CC(=O)SCCO Amb24575600 [0,1,0,0,0,0|3,0,0]=4 1237 B7R0.3 C=CC(O)CCCBr Amb24635348 [0,1,0,0,0,0|2,0,1]=4 1238 B7R0.3 C=CC(O)CCCN Amb25715133 [0,1,0,0,0,0|2,0,1]=4 1239 B7R0.3 C=CC(O)CCCO Amb24747215 [0,1,0,0,0,0|2,0,1]=4 1240 B7R0.3 C=CCCC(=C)C=O Amb25800063 [0,1,0,0,0,0|1,0,2]=4 1241 B7R0.3 C=CCCC(=C)CO Amb25849790 [0,1,0,0,0,0|1,0,2]=4 1242 B7R0.3 C=CCCC(=O)C=C Amb24524288 [0,1,0,0,0,0|1,0,2]=4 1243 B7R0.3 C=CCCC(=O)CBr Amb22059627 [0,1,0,0,0,0|1,0,2]=4 1244 B7R0.3 C=CCCC(=O)CCl Amb22059504 [0,1,0,0,0,0|1,0,2]=4 1245 B7R0.3 C=CCCC(=O)CN Amb24411061 [0,1,0,0,0,0|1,0,2]=4 1246 B7R0.3 C=CCCC(=O)CO Amb25763185 [0,1,0,0,0,0|0,0,2]=3 1247 B7R0.3 C=CCOC(=O)CO Amb24475151 [0,1,0,0,0,0|1,0,2]=4 1248 B7R0.3 C=CCOC(=O)NO Amb24457536 [0,1,0,0,0,0|1,0,2]=4 1249 B7R0.3 C=C[C@@H](O)CCCO Amb25314923 [0,1,0,0,0,0|2,0,1]=4 1250 B7R0.3 C=NC(=O)OCCCl Amb24349633 [0,1,0,0,0,0|3,0,0]=4 1251 B7R0.3 CC#CCC(=O)C=C Amb25283357 [0,1,0,0,0,0|1,0,2]=4 1252 B7R0.3 CC#CCC(=O)CN Amb24679249 [0,1,0,0,0,0|1,0,2]=4 1253 B7R0.3 CC(=CCCO)C=O Amb25366501 [0,1,0,0,0,0|2,0,1]=4 1254 B7R0.3 CC(=NO)SCCO Amb25071453 [0,1,0,0,0,0|3,0,0]=4 1255 B7R0.3 CC(C=O)=CCCBr Amb25366526 [0,1,0,0,0,0|2,0,1]=4 1256 B7R0.3 CC(C=O)CCCC Amb17593191 [0,1,0,0,0,0|1,0,1]=3 1257 B7R0.3 CC(CCCCl)=CCl Amb25328852 [0,1,0,0,0,0|3,0,0]=4 1258 B7R0.3 CC(CCCCl)=NO Amb24353583 [0,1,0,0,0,0|2,0,0]=3 1259 B7R0.3 CC(CCCCl)C=O Amb24376628 [0,1,0,0,0,0|2,0,1]=4 1260 B7R0.3 CC(CCCN)NO Amb25339843 [0,1,0,0,0,0|2,0,1]=4 1261 B7R0.3 CC(CCCO)=CBr Amb24355350 [0,1,0,0,0,0|3,0,0]=4 1262 B7R0.3 CC(CCCO)=CCl Amb25073713 [0,1,0,0,0,0|3,0,0]=4 1263 B7R0.3 CC(CCCO)C=O Amb24690170 [0,1,0,0,0,0|2,0,1]=4 1264 B7R0.3 CC(CCCO)CO Amb25098490 [0,1,0,0,0,0|2,0,1]=4 1265 B7R0.3 CC(CO)CCCBr Amb25173843 [0,1,0,0,0,0|2,0,1]=4 1266 B7R0.3 CC(CO)CCNC Amb17569900 [0,1,0,0,0,0|2,0,1]=4 1267 B7R0.3 CC(OC)CCCN Amb17569913 [0,1,0,0,0,0|2,0,1]=4 1268 B7R0.3 CCC#CC(=O)CO Amb25705398 [0,1,0,0,0,0|0,0,2]=3 1269 B7R0.3 CCC(=O)CCC#N Amb25321503 [0,1,0,0,0,0|2,0,1]=4 1270 B7R0.3 CCC(=O)CCC=O Amb18641783 [0,1,0,0,0,0|2,0,1]=4 1271 B7R0.3 CCC(=O)CCCBr Amb25765636 [0,1,0,0,0,0|2,0,0]=3 1272 B7R0.3 CCC(=O)CCCF Amb25101437 [0,1,0,0,0,0|2,0,0]=3 1273 B7R0.3 CCC(=O)CCCN Amb18833012 [0,1,0,0,0,0|2,0,0]=3 1274 B7R0.3 CCC(=O)CCCO Amb24629709 [0,1,0,0,0,0|2,0,0]=3 1275 B7R0.3 CCC(=O)CCSC Amb25680024 [0,1,0,0,0,0|2,0,0]=3 1276 B7R0.3 CCC(=O)CNCC Amb25032080 [0,1,0,0,0,0|2,0,0]=3 1277 B7R0.3 CCC(=O)CSCC Amb24715230 [0,1,0,0,0,0|2,0,0]=3 1278 B7R0.3 CCC(=O)NCCI Amb24436232 [0,1,0,0,0,0|3,0,0]=4 1279 B7R0.3 CCC(=O)NCCS Amb24505089 [0,1,0,0,0,0|3,0,0]=4 1280 B7R0.3 CCC(=O)NOCC Amb24481448 [0,1,0,0,0,0|3,0,0]=4 1281 B7R0.3 CCC(=O)SCCCl Amb24447033 [0,1,0,0,0,0|3,0,0]=4 1282 B7R0.3 CCC(=O)\C=C/CC Amb25128986 [0,1,0,0,0,0|1,0,2]=4 1283 B7R0.3 CCC(=O)\C=C\CC Amb25283354 [0,1,0,0,0,0|1,0,2]=4 1284 B7R0.3 CCC(=S)NCCC Amb25848578 [0,1,0,0,0,0|2,1,0]=4 1285 B7R0.3 CCC(O)CCCCl Amb24481301 [0,1,0,0,0,0|2,0,1]=4 1286 B7R0.3 CCC(O)CCCF Amb25321731 [0,1,0,0,0,0|2,0,1]=4 1287 B7R0.3 CCC(O)CCCN Amb18202667 [0,1,0,0,0,0|2,0,1]=4 1288 B7R0.3 CCC(O)CCCN Amb19374975 [0,1,0,0,0,0|2,0,1]=4 1289 B7R0.3 CCC(O)CCCS Amb24579615 [0,1,0,0,0,0|2,0,1]=4 1290 B7R0.3 CCC(O)CCNC Amb25215952 [0,1,0,0,0,0|2,0,1]=4 1291 B7R0.3 CCC(O)CCOC Amb22058972 [0,1,0,0,0,0|2,0,1]=4 1292 B7R0.3 CCC(O)CCSC Amb25114884 [0,1,0,0,0,0|2,0,1]=4 1293 B7R0.3 CCC(O)OCCC Amb25358083 [0,1,0,0,0,0|2,0,1]=4 1294 B7R0.3 CCCCC(=C)CBr Amb25249105 [0,1,0,0,0,0|2,0,0]=3 1295 B7R0.3 CCCCC(=C)CO Amb25079813 [0,1,0,0,0,0|1,0,0]=2 1296 B7R0.3 CCCCC(=N)NC Amb24377157 [0,1,0,0,0,0|2,0,0]=3 1297 B7R0.3 CCCCC(=N)OC Amb17617956 [0,1,0,0,0,0|1,0,0]=2 1298 B7R0.3 CCCCC(=N)OC Amb25353357 [0,1,0,0,0,0|1,0,0]=2 1299 B7R0.3 CCCCC(=O)C#N Amb22729179 [0,1,0,0,0,0|1,0,0]=2 1300 B7R0.3 CCCCC(=O)C=C Amb25062494 [0,1,0,0,0,0|1,0,0]=2 1301 B7R0.3 CCCCC(=O)C=O Amb18124252 [0,1,0,0,0,0|0,0,1]=2 1302 B7R0.3 CCCCC(=O)CBr Amb24563421 [0,1,0,0,0,0|1,0,0]=2 1303 B7R0.3 CCCCC(=O)CCl Amb17593420 [0,1,0,0,0,0|1,0,0]=2 1304 B7R0.3 CCCCC(=O)CF Amb24483296 [0,1,0,0,0,0|1,0,0]=2 1305 B7R0.3 CCCCC(=O)CN Amb24473062 [0,1,0,0,0,0|1,0,0]=2 1306 B7R0.3 CCCCC(=O)SC Amb25225724 [0,1,0,0,0,0|0,1,0]=2 1307 B7R0.3 CCCCC(Br)C#N Amb18127554 [0,1,0,0,0,0|2,0,1]=4 1308 B7R0.3 CCCCC(Br)C=C Amb25758328 [0,1,0,0,0,0|2,0,1]=4 1309 B7R0.3 CCCCC(Br)CC Amb18804679 [0,1,0,0,0,0|2,0,1]=4 1310 B7R0.3 CCCCC(Br)CN Amb25287843 [0,1,0,0,0,0|2,0,1]=4 1311 B7R0.3 CCCCC(C)=CC Amb22229367 [0,1,0,0,0,0|2,0,0]=3 1312 B7R0.3 CCCCC(C)=NO Amb19515982 [0,1,0,0,0,0|1,0,0]=2 1313 B7R0.3 CCCCC(C)C#N Amb18641663 [0,1,0,0,0,0|2,0,1]=4 1314 B7R0.3 CCCCC(C)C=C Amb22641469 [0,1,0,0,0,0|2,0,1]=4 1315 B7R0.3 CCCCC(C)CBr Amb22227886 [0,1,0,0,0,0|2,0,1]=4 1316 B7R0.3 CCCCC(C)CCl Amb24481359 [0,1,0,0,0,0|2,0,1]=4 1317 B7R0.3 CCCCC(C)CN Amb18311071 [0,1,0,0,0,0|2,0,1]=4 1318 B7R0.3 CCCCC(C)[Mg]Br Amb22897309 [0,1,0,0,0,0|2,0,1]=4 1319 B7R0.3 CCCCC(C)[Zn]Br Amb22000400 [0,1,0,0,0,0|2,0,1]=4 1320 B7R0.3 CCCCC(C=O)Br Amb17594581 [0,1,0,0,0,0|1,0,1]=3 1321 B7R0.3 CCCCC(CC)C Amb10071971 [0,1,0,0,0,0|2,0,1]=4 1322 B7R0.3 CCCCC(CC)O Amb10844720 [0,1,0,0,0,0|1,0,1]=3 1323 B7R0.3 CCCCC(CO)C Amb17593205 [0,1,0,0,0,0|1,0,1]=3 1324 B7R0.3 CCCCC(CO)N Amb2236185 [0,1,0,0,0,0|1,0,1]=3 1325 B7R0.3 CCCCC(Cl)=CBr Amb24552431 [0,1,0,0,0,0|2,0,0]=3 1326 B7R0.3 CCCCC(Cl)=CCl Amb24512078 [0,1,0,0,0,0|2,0,0]=3 1327 B7R0.3 CCCCC(Cl)C#C Amb25701395 [0,1,0,0,0,0|2,0,1]=4 1328 B7R0.3 CCCCC(Cl)C=C Amb24647663 [0,1,0,0,0,0|2,0,1]=4 1329 B7R0.3 CCCCC(Cl)C=O Amb18642973 [0,1,0,0,0,0|1,0,1]=3 1330 B7R0.3 CCCCC(Cl)CC Amb25361621 [0,1,0,0,0,0|2,0,1]=4 1331 B7R0.3 CCCCC(Cl)CN Amb24550911 [0,1,0,0,0,0|2,0,1]=4 1332 B7R0.3 CCCCC(Cl)CO Amb25760827 [0,1,0,0,0,0|1,0,1]=3 1333 B7R0.3 CCCCC(Cl)OC Amb24433133 [0,1,0,0,0,0|1,0,1]=3 1334 B7R0.3 CCCCC(F)=CBr Amb24483089 [0,1,0,0,0,0|2,0,0]=3 1335 B7R0.3 CCCCC(F)CCl Amb25091588 [0,1,0,0,0,0|2,0,1]=4 1336 B7R0.3 CCCCC(F)CN Amb24117055 [0,1,0,0,0,0|2,0,1]=4 1337 B7R0.3 CCCCC(F)CO Amb25134893 [0,1,0,0,0,0|1,0,1]=3 1338 B7R0.3 CCCCC(N)=NN Amb25781596 [0,1,0,0,0,0|2,0,0]=3 1339 B7R0.3 CCCCC(N)C#C Amb25798992 [0,1,0,0,0,0|2,0,1]=4 1340 B7R0.3 CCCCC(N)C#N Amb18975861 [0,1,0,0,0,0|2,0,1]=4 1341 B7R0.3 CCCCC(N)C=C Amb24677154 [0,1,0,0,0,0|2,0,1]=4 1342 B7R0.3 CCCCC(N)CN Amb19009750 [0,1,0,0,0,0|2,0,1]=4 1343 B7R0.3 CCCCC(O)C#N Amb23454545 [0,1,0,0,0,0|1,0,1]=3 1344 B7R0.3 CCCCC(O)CBr Amb25233429 [0,1,0,0,0,0|1,0,1]=3 1345 B7R0.3 CCCCC(O)CCl Amb24481415 [0,1,0,0,0,0|1,0,1]=3 1346 B7R0.3 CCCCC(O)CS Amb24554468 [0,1,0,0,0,0|0,1,1]=3 1347 B7R0.3 CCCCC(O)OC Amb24448002 [0,1,0,0,0,0|0,0,2]=3 1348 B7R0.3 CCCCC(S)CC Amb25314909 [0,1,0,0,0,0|1,1,1]=4 1349 B7R0.3 CCCCN(C)N=O Amb22231185 [0,1,0,0,0,0|2,0,0]=3 1350 B7R0.3 CCCCN(C)OC Amb24354551 [0,1,0,0,0,0|2,0,0]=3 1351 B7R0.3 CCCCN(CC)N Amb17593206 [0,1,0,0,0,0|3,0,0]=4 1352 B7R0.3 CCCC[14C](=O)O[Na] Amb22734535 [0,1,0,0,0,0|0,0,0]=1 1353 B7R0.3 CCCC[C@@H](Br)CC Amb25273533 [0,1,0,0,0,0|2,0,1]=4 1354 B7R0.3 CCCC[C@@H](C)CBr Amb25322055 [0,1,0,0,0,0|2,0,1]=4 1355 B7R0.3 CCCC[C@@H](Cl)CC Amb24546428 [0,1,0,0,0,0|2,0,1]=4 1356 B7R0.3 CCCC[C@@H](N)C=C Amb25710927 [0,1,0,0,0,0|2,0,1]=4 1357 B7R0.3 CCCC[C@@H](N)CO Amb23440322 [0,1,0,0,0,0|1,0,1]=3 1358 B7R0.3 CCCC[C@@H](O)C=C Amb24731913 [0,1,0,0,0,0|1,0,1]=3 1359 B7R0.3 CCCC[C@@H](O)C=O Amb24481527 [0,1,0,0,0,0|0,0,1]=2 1360 B7R0.3 CCCC[C@@H](O)CC Amb25675670 [0,1,0,0,0,0|1,0,1]=3 1361 B7R0.3 CCCC[C@@H](O)CO Amb25315976 [0,1,0,0,0,0|0,0,2]=3 1362 B7R0.3 CCCC[C@H](Br)CC Amb25765583 [0,1,0,0,0,0|2,0,1]=4 1363 B7R0.3 CCCC[C@H](C)NC Amb25745887 [0,1,0,0,0,0|2,0,1]=4 1364 B7R0.3 CCCC[C@H](F)C=O Amb25143375 [0,1,0,0,0,0|1,0,1]=3 1365 B7R0.3 CCCC[C@H](N)CN Amb25725218 [0,1,0,0,0,0|2,0,1]=4 1366 B7R0.3 CCCC[C@H](O)C=C Amb24591765 [0,1,0,0,0,0|1,0,1]=3 1367 B7R0.3 CCCC[C@H](O)CCl Amb24561798 [0,1,0,0,0,0|1,0,1]=3 1368 B7R0.3 CCCC\C(\Br)=C/Cl Amb25663235 [0,1,0,0,0,0|2,0,0]=3 1369 B7R0.3 CCCC\C(\C)=C/Cl Amb24627150 [0,1,0,0,0,0|2,0,0]=3 1370 B7R0.3 CCCC\C(\C)=N\O Amb21520448 [0,1,0,0,0,0|1,0,0]=2 1371 B7R0.3 CCCC\C(\Cl)=C/Cl Amb25745924 [0,1,0,0,0,0|2,0,0]=3 1372 B7R0.3 CCCNC(=N)CCl Amb25292181 [0,1,0,0,0,0|3,0,0]=4 1373 B7R0.3 CCCNC(=N)CF Amb24483075 [0,1,0,0,0,0|3,0,0]=4 1374 B7R0.3 CCCNC(=N)CO Amb23514974 [0,1,0,0,0,0|2,0,0]=3 1375 B7R0.3 CCCNC(=O)C#C Amb25101832 [0,1,0,0,0,0|2,0,0]=3 1376 B7R0.3 CCCNC(=O)CBr Amb17330843 [0,1,0,0,0,0|2,0,0]=3 1377 B7R0.3 CCCNC(=O)CCl Amb1207068 [0,1,0,0,0,0|2,0,0]=3 1378 B7R0.3 CCCNC(=O)CF Amb25141943 [0,1,0,0,0,0|2,0,0]=3 1379 B7R0.3 CCCNC(=O)CI Amb23512283 [0,1,0,0,0,0|2,0,0]=3 1380 B7R0.3 CCCNC(=O)CN Amb10781813 [0,1,0,0,0,0|2,0,0]=3 1381 B7R0.3 CCCNC(=O)OC Amb17797997 [0,1,0,0,0,0|1,0,0]=2 1382 B7R0.3 CCCNC(=O)SC Amb24746599 [0,1,0,0,0,0|1,1,0]=3 1383 B7R0.3 CCCNC(=S)C#N Amb24428088 [0,1,0,0,0,0|2,1,0]=4 1384 B7R0.3 CCCNC(=S)NN Amb1152670 [0,1,0,0,0,0|2,1,0]=4 1385 B7R0.3 CCCNC(=S)SC Amb25844084 [0,1,0,0,0,0|1,2,0]=4 1386 B7R0.3 CCCNC(C)CO Amb22292469 [0,1,0,0,0,0|2,0,1]=4 1387 B7R0.3 CCCNC(N)=NN Amb25057099 [0,1,0,0,0,0|3,0,0]=4 1388 B7R0.3 CCCOC(=C)C=O Amb24483012 [0,1,0,0,0,0|2,0,0]=3 1389 B7R0.3 CCCOC(=O)C=C Amb22045218 [0,1,0,0,0,0|2,0,0]=3 1390 B7R0.3 CCCOC(=O)C=O Amb18641875 [0,1,0,0,0,0|1,0,1]=3 1391 B7R0.3 CCCOC(=O)NO Amb24630559 [0,1,0,0,0,0|1,0,0]=2 1392 B7R0.3 CCCOC(N)=NO Amb24358642 [0,1,0,0,0,0|2,0,0]=3 1393 B7R0.3 CCCO[C@@H](C)CO Amb25257045 [0,1,0,0,0,0|2,0,1]=4 1394 B7R0.3 CCCSC(=C)CO Amb25694154 [0,1,0,0,0,0|2,0,0]=3 1395 B7R0.3 CCCSC(=S)OC Amb25758079 [0,1,0,0,0,0|1,1,0]=3 1396 B7R0.3 CCCSC(C)C=O Amb18124367 [0,1,0,0,0,0|2,0,1]=4 1397 B7R0.3 CCCSC(N)=NO Amb24655353 [0,1,0,0,0,0|2,0,0]=3 1398 B7R0.3 CCC\C=C(/C)\C=O Amb25194656 [0,1,0,0,0,0|1,0,1]=3 1399 B7R0.3 CCC\C=C(/F)\C=O Amb24653634 [0,1,0,0,0,0|1,0,1]=3 1400 B7R0.3 CCC\C=C(\Br)/CO Amb25306515 [0,1,0,0,0,0|1,0,1]=3 1401 B7R0.3 CCC\C=C(\C)/C=O Amb18641699 [0,1,0,0,0,0|1,0,1]=3 1402 B7R0.3 CCC\C=C(\C)/CCl Amb24656043 [0,1,0,0,0,0|2,0,1]=4 1403 B7R0.3 CCC\C=C(\C)/CO Amb25206584 [0,1,0,0,0,0|1,0,1]=3 1404 B7R0.3 CCC\C=C(\Cl)/C=O Amb18124371 [0,1,0,0,0,0|1,0,1]=3 1405 B7R0.3 CCC\C=C(\F)/C=O Amb18641881 [0,1,0,0,0,0|1,0,1]=3 1406 B7R0.3 CCC\C=C(\F)/CBr Amb24602495 [0,1,0,0,0,0|2,0,1]=4 1407 B7R0.3 CCC\C=C(\F)/CO Amb25093759 [0,1,0,0,0,0|1,0,1]=3 1408 B7R0.3 CCNCC(=O)C#C Amb25062852 [0,1,0,0,0,0|2,0,0]=3 1409 B7R0.3 CCNCC(=O)OC Amb19514718 [0,1,0,0,0,0|1,0,0]=2 1410 B7R0.3 CCNCC(C)CO Amb25806225 [0,1,0,0,0,0|2,0,1]=4 1411 B7R0.3 CCNCC(C)OC Amb19025030 [0,1,0,0,0,0|2,0,1]=4 1412 B7R0.3 CCNCC(Cl)=CCl Amb25142988 [0,1,0,0,0,0|3,0,0]=4 1413 B7R0.3 CCNCC(N)=NO Amb24612871 [0,1,0,0,0,0|2,0,0]=3 1414 B7R0.3 CCNCC(O)C=C Amb25047567 [0,1,0,0,0,0|2,0,1]=4 1415 B7R0.3 CCNCC(O)C=O Amb24399473 [0,1,0,0,0,0|1,0,1]=3 1416 B7R0.3 CCNCC(O)CCl Amb18124503 [0,1,0,0,0,0|2,0,1]=4 1417 B7R0.3 CCNCC(O)CN Amb18062380 [0,1,0,0,0,0|2,0,1]=4 1418 B7R0.3 CCNC[C@H](C)CO Amb24474559 [0,1,0,0,0,0|2,0,1]=4 1419 B7R0.3 CCNNC(=O)NN Amb24501434 [0,1,0,0,0,0|3,0,0]=4 1420 B7R0.3 CCNNC(=O)OC Amb25191868 [0,1,0,0,0,0|2,0,0]=3 1421 B7R0.3 CCOCC(=C)CCl Amb24682763 [0,1,0,0,0,0|3,0,0]=4 1422 B7R0.3 CCOCC(=C)CO Amb25222257 [0,1,0,0,0,0|2,0,0]=3 1423 B7R0.3 CCOCC(=C)NN Amb25811229 [0,1,0,0,0,0|3,0,0]=4 1424 B7R0.3 CCOCC(=N)NC Amb24591387 [0,1,0,0,0,0|3,0,0]=4 1425 B7R0.3 CCOCC(=O)C#C Amb24483100 [0,1,0,0,0,0|2,0,0]=3 1426 B7R0.3 CCOCC(=O)CBr Amb25261639 [0,1,0,0,0,0|2,0,0]=3 1427 B7R0.3 CCOCC(=O)CCl Amb25087764 [0,1,0,0,0,0|2,0,0]=3 1428 B7R0.3 CCOCC(=O)CS Amb24406072 [0,1,0,0,0,0|1,1,0]=3 1429 B7R0.3 CCOCC(=O)NN Amb2111918 [0,1,0,0,0,0|2,0,0]=3 1430 B7R0.3 CCOCC(C)=CBr Amb24433949 [0,1,0,0,0,0|3,0,0]=4 1431 B7R0.3 CCOCC(C)=CCl Amb24586962 [0,1,0,0,0,0|3,0,0]=4 1432 B7R0.3 CCOCC(C)=NN Amb25847659 [0,1,0,0,0,0|3,0,0]=4 1433 B7R0.3 CCOCC(C)CO Amb25823989 [0,1,0,0,0,0|2,0,1]=4 1434 B7R0.3 CCOCC(CN)O Amb1127575 [0,1,0,0,0,0|2,0,1]=4 1435 B7R0.3 CCOCC(Cl)=CCl Amb25204137 [0,1,0,0,0,0|3,0,0]=4 1436 B7R0.3 CCOCC(O)C#C Amb24717652 [0,1,0,0,0,0|2,0,1]=4 1437 B7R0.3 CCOCC(O)CBr Amb24533547 [0,1,0,0,0,0|2,0,1]=4 1438 B7R0.3 CCOCC(O)CCl Amb19888638 [0,1,0,0,0,0|2,0,1]=4 1439 B7R0.3 CCOCC(O)CI Amb24757378 [0,1,0,0,0,0|2,0,1]=4 1440 B7R0.3 CCOCC(O)CO Amb19148881 [0,1,0,0,0,0|1,0,2]=4 1441 B7R0.3 CCOCC(O)CS Amb25098647 [0,1,0,0,0,0|1,1,1]=4 1442 B7R0.3 CCOC[C@@H](O)CCl Amb24665745 [0,1,0,0,0,0|2,0,1]=4 1443 B7R0.3 CCOC[C@@H](O)CN Amb25256632 [0,1,0,0,0,0|2,0,1]=4 1444 B7R0.3 CCOC[C@H](O)CCl Amb25106854 [0,1,0,0,0,0|2,0,1]=4 1445 B7R0.3 CCOC[C@H](O)CO Amb24583044 [0,1,0,0,0,0|1,0,2]=4 1446 B7R0.3 CCONC(=O)C#C Amb24391088 [0,1,0,0,0,0|3,0,0]=4 1447 B7R0.3 CCONC(=O)CBr Amb25249598 [0,1,0,0,0,0|3,0,0]=4 1448 B7R0.3 CCONC(=O)CN Amb24445788 [0,1,0,0,0,0|3,0,0]=4 1449 B7R0.3 CCO\C=C(/Br)\C=O Amb25835720 [0,1,0,0,0,0|2,0,1]=4 1450 B7R0.3 CCO\C=C(/O)\C=O Amb25326136 [0,1,0,0,0,0|1,0,1]=3 1451 B7R0.3 CCO\C=C(\Br)/C=O Amb24580404 [0,1,0,0,0,0|2,0,1]=4 1452 B7R0.3 CCO\C=C(\O)/C=O Amb25195281 [0,1,0,0,0,0|1,0,1]=3 1453 B7R0.3 CCS(=O)CCCN Amb18306016 [0,1,0,0,0,0|3,0,0]=4 1454 B7R0.3 CCS(=O)CCCO Amb25226262 [0,1,0,0,0,0|3,0,0]=4 1455 B7R0.3 CCS(=O)CCNC Amb21984659 [0,1,0,0,0,0|3,0,0]=4 1456 B7R0.3 CCSCC(=C)C=O Amb18642813 [0,1,0,0,0,0|2,0,0]=3 1457 B7R0.3 CCSCC(=C)CCl Amb24529097 [0,1,0,0,0,0|3,0,0]=4 1458 B7R0.3 CCSCC(=O)C#C Amb25068174 [0,1,0,0,0,0|2,0,0]=3 1459 B7R0.3 CCSCC(=O)C=O Amb24741839 [0,1,0,0,0,0|1,0,1]=3 1460 B7R0.3 CCSCC(=O)CCl Amb24545960 [0,1,0,0,0,0|2,0,0]=3 1461 B7R0.3 CCSCC(=O)CO Amb25686953 [0,1,0,0,0,0|1,0,0]=2 1462 B7R0.3 CCSCC(=O)NC Amb24333216 [0,1,0,0,0,0|2,0,0]=3 1463 B7R0.3 CCSCC(C)=NO Amb25066024 [0,1,0,0,0,0|2,0,0]=3 1464 B7R0.3 CCSCC(C)CO Amb25726669 [0,1,0,0,0,0|2,0,1]=4 1465 B7R0.3 CCSCC(CCl)O Amb17593873 [0,1,0,0,0,0|2,0,1]=4 1466 B7R0.3 CCSCC(N)=NN Amb24533582 [0,1,0,0,0,0|3,0,0]=4 1467 B7R0.3 CCSCC(N)CO Amb18643038 [0,1,0,0,0,0|2,0,1]=4 1468 B7R0.3 CCSCC(O)C#C Amb24642731 [0,1,0,0,0,0|2,0,1]=4 1469 B7R0.3 CCSCC(O)C=C Amb24543994 [0,1,0,0,0,0|2,0,1]=4 1470 B7R0.3 CCSC[C@H](O)C=O Amb25844429 [0,1,0,0,0,0|1,0,1]=3 1471 B7R0.3 CCSNC(=O)CO Amb24631959 [0,1,0,0,0,0|2,0,0]=3 1472 B7R0.3 CC[C@H](O)CCCCl Amb25328557 [0,1,0,0,0,0|2,0,1]=4 1473 B7R0.3 CC[C@H](O)CSCC Amb24388051 [0,1,0,0,0,0|2,0,1]=4 1474 B7R0.3 CC\C(\C)=C/CCC Amb25227654 [0,1,0,0,0,0|2,0,1]=4 1475 B7R0.3 CC\C(\C)=C\CCC Amb25260956 [0,1,0,0,0,0|2,0,1]=4 1476 B7R0.3 CC\C=C/C(=O)OC Amb10071549 [0,1,0,0,0,0|0,0,2]=3 1477 B7R0.3 CC\C=C\C(=N)NO Amb25176439 [0,1,0,0,0,0|1,0,2]=4 1478 B7R0.3 CC\C=C\C(=O)CBr Amb25251595 [0,1,0,0,0,0|1,0,2]=4 1479 B7R0.3 CC\C=C\C(=O)NC Amb25345934 [0,1,0,0,0,0|1,0,2]=4 1480 B7R0.3 CC\C=C\C(=O)NN Amb25134883 [0,1,0,0,0,0|1,0,2]=4 1481 B7R0.3 CC\C=C\C(=O)NN Amb25176330 [0,1,0,0,0,0|1,0,2]=4 1482 B7R0.3 CN(C=O)CCCO Amb17593211 [0,1,0,0,0,0|3,0,0]=4 1483 B7R0.3 CN(CCCCl)C=O Amb24589375 [0,1,0,0,0,0|3,0,0]=4 1484 B7R0.3 CNC(=N)CCOC Amb24526950 [0,1,0,0,0,0|3,0,0]=4 1485 B7R0.3 CNC(=O)CCC#C Amb18636143 [0,1,0,0,0,0|1,0,2]=4 1486 B7R0.3 CNC(=O)CCC#N Amb17334052 [0,1,0,0,0,0|2,0,1]=4 1487 B7R0.3 CNC(=O)CCC=C Amb25041195 [0,1,0,0,0,0|1,0,2]=4 1488 B7R0.3 CNC(=O)CCCBr Amb24552452 [0,1,0,0,0,0|2,0,0]=3 1489 B7R0.3 CNC(=O)CCCCl Amb1137464 [0,1,0,0,0,0|2,0,0]=3 1490 B7R0.3 CNC(=O)CCCO Amb17231829 [0,1,0,0,0,0|2,0,0]=3 1491 B7R0.3 CNC(=O)CCN=C Amb24713898 [0,1,0,0,0,0|2,0,1]=4 1492 B7R0.3 CNC(=O)CCON Amb25744608 [0,1,0,0,0,0|3,0,0]=4 1493 B7R0.3 CNC(=O)NCCF Amb25757414 [0,1,0,0,0,0|3,0,0]=4 1494 B7R0.3 CNC(=O)NCCN Amb17231831 [0,1,0,0,0,0|3,0,0]=4 1495 B7R0.3 CNC(=O)NCCO Amb24376074 [0,1,0,0,0,0|3,0,0]=4 1496 B7R0.3 CNC(=O)NCSC Amb25082930 [0,1,0,0,0,0|3,0,0]=4 1497 B7R0.3 CNC(=O)OCCBr Amb25104424 [0,1,0,0,0,0|3,0,0]=4 1498 B7R0.3 CNC(=O)OCCCl Amb22363563 [0,1,0,0,0,0|3,0,0]=4 1499 B7R0.3 CNCCC(=O)C#C Amb24528728 [0,1,0,0,0,0|2,0,0]=3 1500 B7R0.3 CNCCC(=O)NC Amb19959924 [0,1,0,0,0,0|2,0,0]=3 1501 B7R0.3 CNCCC(=O)OC Amb22168213 [0,1,0,0,0,0|1,0,0]=2 1502 B7R0.3 CNCCC(OC)C Amb17569916 [0,1,0,0,0,0|2,0,1]=4 1503 B7R0.3 CNCCN(C)N=O Amb25770805 [0,1,0,0,0,0|3,0,0]=4 1504 B7R0.3 CNCCN(C)OC Amb24685325 [0,1,0,0,0,0|3,0,0]=4 1505 B7R0.3 CNCC\C(\N)=N/O Amb19981296 [0,1,0,0,0,0|2,0,0]=3 1506 B7R0.3 CNCC\C(\N)=N\O Amb22410480 [0,1,0,0,0,0|2,0,0]=3 1507 B7R0.3 CN\C=C\C(=O)OC Amb25236701 [0,1,0,0,0,0|1,0,2]=4 1508 B7R0.3 COC(=C)CCC=O Amb18641791 [0,1,0,0,0,0|2,0,1]=4 1509 B7R0.3 COC(=C)CCCCl Amb25703575 [0,1,0,0,0,0|2,0,0]=3 1510 B7R0.3 COC(=N)CCC#N Amb17593155 [0,1,0,0,0,0|2,0,1]=4 1511 B7R0.3 COC(=N)CCCCl Amb16231406 [0,1,0,0,0,0|2,0,0]=3 1512 B7R0.3 COC(=N)COCC Amb25315918 [0,1,0,0,0,0|2,0,0]=3 1513 B7R0.3 COC(=O)C#CCCl Amb17673855 [0,1,0,0,0,0|1,0,2]=4 1514 B7R0.3 COC(=O)C#CCI Amb25210353 [0,1,0,0,0,0|1,0,2]=4 1515 B7R0.3 COC(=O)C#CCN Amb24581713 [0,1,0,0,0,0|1,0,2]=4 1516 B7R0.3 COC(=O)C#CCO Amb16233601 [0,1,0,0,0,0|1,0,2]=4 1517 B7R0.3 COC(=O)CCC#C Amb18115985 [0,1,0,0,0,0|0,0,2]=3 1518 B7R0.3 COC(=O)CCC=C Amb2369959 [0,1,0,0,0,0|0,0,2]=3 1519 B7R0.3 COC(=O)CCC=O Amb18124259 [0,1,0,0,0,0|1,0,1]=3 1520 B7R0.3 COC(=O)CCCS Amb19373761 [0,1,0,0,0,0|1,0,0]=2 1521 B7R0.3 COC(=O)CCNN Amb24524272 [0,1,0,0,0,0|2,0,0]=3 1522 B7R0.3 COC(=O)CCNO Amb24644523 [0,1,0,0,0,0|2,0,0]=3 1523 B7R0.3 COC(=O)CCON Amb18641968 [0,1,0,0,0,0|2,0,0]=3 1524 B7R0.3 COC(=O)CC[Zn]Br Amb22898090 [0,1,0,0,0,0|2,0,0]=3 1525 B7R0.3 COC(=O)CN=C=S Amb2371376 [0,1,0,0,0,0|2,0,1]=4 1526 B7R0.3 COC(=O)CNC#N Amb24401724 [0,1,0,0,0,0|2,0,1]=4 1527 B7R0.3 COC(=O)CNC=O Amb22000868 [0,1,0,0,0,0|2,0,1]=4 1528 B7R0.3 COC(=O)CNCO Amb25369412 [0,1,0,0,0,0|2,0,0]=3 1529 B7R0.3 COC(=O)CNOC Amb25725740 [0,1,0,0,0,0|2,0,0]=3 1530 B7R0.3 COC(=O)COCBr Amb25288082 [0,1,0,0,0,0|2,0,0]=3 1531 B7R0.3 COC(=O)CSC#N Amb24688007 [0,1,0,0,0,0|2,0,1]=4 1532 B7R0.3 COC(=O)CSCCl Amb25689724 [0,1,0,0,0,0|2,0,0]=3 1533 B7R0.3 COC(=O)C\C=C\I Amb24531368 [0,1,0,0,0,0|1,0,2]=4 1534 B7R0.3 COC(=O)NCC=C Amb17794125 [0,1,0,0,0,0|1,0,2]=4 1535 B7R0.3 COC(=O)NCCBr Amb10608897 [0,1,0,0,0,0|2,0,0]=3 1536 B7R0.3 COC(=O)NCCCl Amb24526396 [0,1,0,0,0,0|2,0,0]=3 1537 B7R0.3 COC(=O)NCCN Amb18970459 [0,1,0,0,0,0|2,0,0]=3 1538 B7R0.3 COC(=O)NOCC Amb24735360 [0,1,0,0,0,0|2,0,0]=3 1539 B7R0.3 COC(=O)OCCCl Amb25261257 [0,1,0,0,0,0|2,0,0]=3 1540 B7R0.3 COC(=O)O[Mg]OC Amb22366959 [0,1,0,0,0,0|3,0,0]=4 1541 B7R0.3 COC(=O)\C=C/CBr Amb10068684 [0,1,0,0,0,0|1,0,2]=4 1542 B7R0.3 COC(=O)\C=C\CN Amb24117125 [0,1,0,0,0,0|1,0,2]=4 1543 B7R0.3 COC(=O)\C=C\CO Amb25081886 [0,1,0,0,0,0|1,0,2]=4 1544 B7R0.3 COC(=O)\C=C\CS Amb25366950 [0,1,0,0,0,0|1,0,2]=4 1545 B7R0.3 COC(=O)\C=C\SC Amb24483182 [0,1,0,0,0,0|1,0,2]=4 1546 B7R0.3 COC(=S)SCCO Amb24416434 [0,1,0,0,0,0|2,1,0]=4 1547 B7R0.3 COC(Cl)CCCCl Amb25055624 [0,1,0,0,0,0|2,0,1]=4 1548 B7R0.3 COC(O)CCCO Amb24619181 [0,1,0,0,0,0|1,0,2]=4 1549 B7R0.3 COCCC(=N)OC Amb24334438 [0,1,0,0,0,0|2,0,0]=3 1550 B7R0.3 COCCC(=O)C#N Amb24645428 [0,1,0,0,0,0|2,0,0]=3 1551 B7R0.3 COCCC(=O)C=C Amb24744935 [0,1,0,0,0,0|2,0,0]=3 1552 B7R0.3 COCCC(=O)C=O Amb24722152 [0,1,0,0,0,0|1,0,1]=3 1553 B7R0.3 COCCC(=O)CBr Amb25708389 [0,1,0,0,0,0|2,0,0]=3 1554 B7R0.3 COCCC(=O)CCl Amb20622320 [0,1,0,0,0,0|2,0,0]=3 1555 B7R0.3 COCCC(=O)CO Amb25049164 [0,1,0,0,0,0|1,0,0]=2 1556 B7R0.3 COCCC(=O)CS Amb24646143 [0,1,0,0,0,0|1,1,0]=3 1557 B7R0.3 COCCC(C)=NN Amb24614445 [0,1,0,0,0,0|3,0,0]=4 1558 B7R0.3 COCCC(C)NO Amb25127365 [0,1,0,0,0,0|2,0,1]=4 1559 B7R0.3 COCCC(C)OC Amb24060657 [0,1,0,0,0,0|2,0,1]=4 1560 B7R0.3 COCCC(Cl)CO Amb25725023 [0,1,0,0,0,0|2,0,1]=4 1561 B7R0.3 COCCC(O)C#N Amb25692459 [0,1,0,0,0,0|2,0,1]=4 1562 B7R0.3 COCCN(C)OC Amb25140330 [0,1,0,0,0,0|3,0,0]=4 1563 B7R0.3 COCC[C@@H](C)CO Amb24412889 [0,1,0,0,0,0|2,0,1]=4 1564 B7R0.3 COCC[C@H](C)CO Amb25333737 [0,1,0,0,0,0|2,0,1]=4 1565 B7R0.3 COCC\C(\N)=N/O Amb19890177 [0,1,0,0,0,0|2,0,0]=3 1566 B7R0.3 COCC\C(\N)=N\O Amb22490466 [0,1,0,0,0,0|2,0,0]=3 1567 B7R0.3 COCNC(=O)CCl Amb25141907 [0,1,0,0,0,0|3,0,0]=4 1568 B7R0.3 COC\C=C(\C)/C=O Amb24686454 [0,1,0,0,0,0|2,0,1]=4 1569 B7R0.3 COC\C=C(\C)/CO Amb25662125 [0,1,0,0,0,0|2,0,1]=4 1570 B7R0.3 CON(C)CCCCl Amb24401518 [0,1,0,0,0,0|3,0,0]=4 1571 B7R0.3 CON(C)CCCI Amb24505192 [0,1,0,0,0,0|3,0,0]=4 1572 B7R0.3 CON(C)CCCN Amb24697678 [0,1,0,0,0,0|3,0,0]=4 1573 B7R0.3 CON(C)CCSC Amb25132338 [0,1,0,0,0,0|3,0,0]=4 1574 B7R0.3 CON=CC(=O)NO Amb25353948 [0,1,0,0,0,0|2,0,1]=4 1575 B7R0.3 COP(=O)OCCO Amb24534031 [0,1,0,0,0,0|3,0,0]=4 1576 B7R0.3 COS(=O)OCCCl Amb25378747 [0,1,0,0,0,0|3,0,0]=4 1577 B7R0.3 CO[C@@H](C)CCCCl Amb25323981 [0,1,0,0,0,0|2,0,1]=4 1578 B7R0.3 CO[C@@H](C)CCCO Amb25306514 [0,1,0,0,0,0|2,0,1]=4 1579 B7R0.3 CO\C=C\C(=O)CO Amb25240406 [0,1,0,0,0,0|1,0,2]=4 1580 B7R0.3 CSC(=O)NCCO Amb24460774 [0,1,0,0,0,0|2,1,0]=4 1581 B7R0.3 CSC(=S)CCCCl Amb25354350 [0,1,0,0,0,0|1,2,0]=4 1582 B7R0.3 CSCCC(=O)C#C Amb24402673 [0,1,0,0,0,0|2,0,0]=3 1583 B7R0.3 CSCCC(=O)C#N Amb25730124 [0,1,0,0,0,0|2,0,0]=3 1584 B7R0.3 CSCCC(=O)C=C Amb25334636 [0,1,0,0,0,0|2,0,0]=3 1585 B7R0.3 CSCCC(=O)NO Amb25756883 [0,1,0,0,0,0|1,0,0]=2 1586 B7R0.3 CSCCC(C)CO Amb25338794 [0,1,0,0,0,0|2,0,1]=4 1587 B7R0.3 CSCCC(N)=NN Amb25327509 [0,1,0,0,0,0|3,0,0]=4 1588 B7R0.3 CSCCC(N)=NO Amb25127504 [0,1,0,0,0,0|2,0,0]=3 1589 B7R0.3 CSCCC(N)C=O Amb25367403 [0,1,0,0,0,0|2,0,1]=4 1590 B7R0.3 CSCCC(O)C#C Amb25106865 [0,1,0,0,0,0|2,0,1]=4 1591 B7R0.3 CSCCC(O)C#N Amb24065663 [0,1,0,0,0,0|2,0,1]=4 1592 B7R0.3 CSCCC(O)C=O Amb25107714 [0,1,0,0,0,0|1,0,1]=3 1593 B7R0.3 CSCCC(O)CBr Amb25824128 [0,1,0,0,0,0|2,0,1]=4 1594 B7R0.3 CSCCC(O)CCl Amb25067893 [0,1,0,0,0,0|2,0,1]=4 1595 B7R0.3 CSCCC(O)CN Amb25785761 [0,1,0,0,0,0|2,0,1]=4 1596 B7R0.3 CSCCN(C)C=O Amb25716635 [0,1,0,0,0,0|3,0,0]=4 1597 B7R0.3 CSCC[C@@H](N)CO Amb22753875 [0,1,0,0,0,0|2,0,1]=4 1598 B7R0.3 CSCC[C@@H](O)C=O Amb24481522 [0,1,0,0,0,0|1,0,1]=3 1599 B7R0.3 CSCNC(=O)CCl Amb24591194 [0,1,0,0,0,0|3,0,0]=4 1600 B7R0.3 CSCOC(=O)CBr Amb25257938 [0,1,0,0,0,0|3,0,0]=4 1601 B7R0.3 CSSCC(=O)CC Amb24584424 [0,1,0,0,0,0|3,0,0]=4 1602 B7R0.3 CSSCC(=O)NC Amb24729863 [0,1,0,0,0,0|3,0,0]=4 1603 B7R0.3 C[C@@H](CCCO)CO Amb24475366 [0,1,0,0,0,0|2,0,1]=4 1604 B7R0.3 C[C@H](CO)CCCBr Amb24632762 [0,1,0,0,0,0|2,0,1]=4 1605 B7R0.3 C\C(\C=O)=C/CCBr Amb25783964 [0,1,0,0,0,0|2,0,1]=4 1606 B7R0.3 C\C(\C=O)=C/NCC Amb25799956 [0,1,0,0,0,0|2,0,1]=4 1607 B7R0.3 C\C(\C=O)=C\NCC Amb24745542 [0,1,0,0,0,0|2,0,1]=4 1608 B7R0.3 C\C(\C=O)=C\OCC Amb18641771 [0,1,0,0,0,0|2,0,1]=4 1609 B7R0.3 C\C(\CC)=C/CCC Amb22732739 [0,1,0,0,0,0|2,0,1]=4 1610 B7R0.3 C\C(\CCCC)=C/C Amb22731328 [0,1,0,0,0,0|2,0,0]=3 1611 B7R0.3 C\C=C(\C)/CCCCl Amb25082428 [0,1,0,0,0,0|3,0,0]=4 1612 B7R0.3 C\C=C(\C)/CCCO Amb25080181 [0,1,0,0,0,0|3,0,0]=4 1613 B7R0.3 C\C=C(\Cl)/CCCO Amb25344045 [0,1,0,0,0,0|3,0,0]=4 1614 B7R0.3 C\C=C/CC(=C)C=O Amb25785570 [0,1,0,0,0,0|1,0,2]=4 1615 B7R0.3 C\C=C/CC(=O)CC Amb25357896 [0,1,0,0,0,0|1,0,2]=4 1616 B7R0.3 C\C=C\CC(=C)CO Amb25256052 [0,1,0,0,0,0|1,0,2]=4 1617 B7R0.3 C\C=C\CC(=O)CC Amb24590969 [0,1,0,0,0,0|1,0,2]=4 1618 B7R0.3 C\C=C\CC(=O)CCl Amb24349552 [0,1,0,0,0,0|1,0,2]=4 1619 B7R0.3 C\C=C\CC(=O)NC Amb25026166 [0,1,0,0,0,0|1,0,2]=4 1620 B7R0.3 C\C=C\CC(=O)NN Amb25264800 [0,1,0,0,0,0|1,0,2]=4 1621 B7R0.3 ClCCCC(=O)CC Amb17593423 [0,1,0,0,0,0|2,0,0]=3 1622 B7R0.3 ClCCCC(CO)O Amb17593523 [0,1,0,0,0,0|1,0,2]=4 1623 B7R0.3 ClCCNC(=O)CC Amb17103188 [0,1,0,0,0,0|3,0,0]=4 1624 B7R0.3 N#CC(=O)OCCCl Amb25189026 [0,1,0,0,0,0|3,0,0]=4 1625 B7R0.3 N#CC(O)CCCO Amb24661252 [0,1,0,0,0,0|2,0,1]=4 1626 B7R0.3 N#CCOC(=O)CO Amb24476607 [0,1,0,0,0,0|2,0,1]=4 1627 B7R0.3 N#C[C@@H](O)CCCBr Amb24702842 [0,1,0,0,0,0|2,0,1]=4 1628 B7R0.3 N=C(CO)NCCO Amb23514986 [0,1,0,0,0,0|3,0,0]=4 1629 B7R0.3 NC(CCCF)=NO Amb25263373 [0,1,0,0,0,0|2,0,0]=3 1630 B7R0.3 NC(CCCO)CO Amb18641979 [0,1,0,0,0,0|2,0,1]=4 1631 B7R0.3 NC(CNCO)=NO Amb24696467 [0,1,0,0,0,0|3,0,0]=4 1632 B7R0.3 NC(NCCF)=NO Amb24735349 [0,1,0,0,0,0|3,0,0]=4 1633 B7R0.3 NCC(=O)CCCO Amb24471240 [0,1,0,0,0,0|2,0,0]=3 1634 B7R0.3 NCC(=O)NCCN Amb18292756 [0,1,0,0,0,0|3,0,0]=4 1635 B7R0.3 NCC(=O)NCCO Amb21958723 [0,1,0,0,0,0|3,0,0]=4 1636 B7R0.3 NCC(=O)OCCBr Amb18522183 [0,1,0,0,0,0|3,0,0]=4 1637 B7R0.3 NCC(=O)OCCN Amb25831229 [0,1,0,0,0,0|3,0,0]=4 1638 B7R0.3 NCC(=O)SCCN Amb24579413 [0,1,0,0,0,0|3,0,0]=4 1639 B7R0.3 NCC(O)CCCO Amb18124267 [0,1,0,0,0,0|2,0,1]=4 1640 B7R0.3 NCCCC(=O)NN Amb18061734 [0,1,0,0,0,0|2,0,0]=3 1641 B7R0.3 NCCCC(CO)C Amb17569904 [0,1,0,0,0,0|2,0,1]=4 1642 B7R0.3 NCCCC(N)C=O Amb24653292 [0,1,0,0,0,0|2,0,1]=4 1643 B7R0.3 NCCCC(O)CN Amb24460595 [0,1,0,0,0,0|2,0,1]=4 1644 B7R0.3 NCCC[C@H](O)CBr Amb24334519 [0,1,0,0,0,0|2,0,1]=4 1645 B7R0.3 NCCC[C@H](O)CN Amb24527869 [0,1,0,0,0,0|2,0,1]=4 1646 B7R0.3 NCCNC(=O)CC Amb1137732 [0,1,0,0,0,0|3,0,0]=4 1647 B7R0.3 NCCNC(=O)CCl Amb18290714 [0,1,0,0,0,0|3,0,0]=4 1648 B7R0.3 NCCNC(=O)CO Amb18973279 [0,1,0,0,0,0|2,0,0]=3 1649 B7R0.3 NC\C=C\C(=O)NO Amb25676457 [0,1,0,0,0,0|1,0,2]=4 1650 B7R0.3 NNC(=O)CCC#N Amb24501346 [0,1,0,0,0,0|2,0,1]=4 1651 B7R0.3 NNC(=O)CCCS Amb24706258 [0,1,0,0,0,0|2,0,0]=3 1652 B7R0.3 NNC(=O)CCNO Amb25128022 [0,1,0,0,0,0|3,0,0]=4 1653 B7R0.3 NNC(=O)NCCN Amb19514735 [0,1,0,0,0,0|3,0,0]=4 1654 B7R0.3 NNC(=O)NCCS Amb25721958 [0,1,0,0,0,0|3,0,0]=4 1655 B7R0.3 NNC(=O)OCCCl Amb24448640 [0,1,0,0,0,0|3,0,0]=4 1656 B7R0.3 NNC(=O)SCCO Amb24576557 [0,1,0,0,0,0|3,0,0]=4 1657 B7R0.3 NOCCC(=O)C#N Amb24613190 [0,1,0,0,0,0|3,0,0]=4 1658 B7R0.3 N[C@@H](CCCO)CO Amb24117047 [0,1,0,0,0,0|2,0,1]=4 1659 B7R0.3 N[C@H](CO)CCCF Amb25198873 [0,1,0,0,0,0|2,0,1]=4 1660 B7R0.3 O=C(CBr)NCCBr Amb24104073 [0,1,0,0,0,0|3,0,0]=4 1661 B7R0.3 O=C(CBr)NCCF Amb22896639 [0,1,0,0,0,0|3,0,0]=4 1662 B7R0.3 O=C(CCCCl)CCl Amb22395285 [0,1,0,0,0,0|2,0,0]=3 1663 B7R0.3 O=C(CCl)CCCBr Amb22395325 [0,1,0,0,0,0|2,0,0]=3 1664 B7R0.3 O=C(CCl)NCCCl Amb22261518 [0,1,0,0,0,0|3,0,0]=4 1665 B7R0.3 O=C(CCl)NCCS Amb25350349 [0,1,0,0,0,0|3,0,0]=4 1666 B7R0.3 O=C(CCl)OCCBr Amb24753748 [0,1,0,0,0,0|3,0,0]=4 1667 B7R0.3 O=C(CCl)OCCF Amb24481440 [0,1,0,0,0,0|3,0,0]=4 1668 B7R0.3 O=C(CCl)SCCBr Amb24740244 [0,1,0,0,0,0|3,0,0]=4 1669 B7R0.3 O=C(CF)NCCCl Amb24505240 [0,1,0,0,0,0|3,0,0]=4 1670 B7R0.3 O=C(CF)OCCCl Amb25112007 [0,1,0,0,0,0|3,0,0]=4 1671 B7R0.3 O=C(CS)OCCCl Amb24409565 [0,1,0,0,0,0|2,1,0]=4 1672 B7R0.3 O=CC(=O)CCCCl Amb24385284 [0,1,0,0,0,0|1,0,1]=3 1673 B7R0.3 O=CC(=O)OCCCl Amb24515849 [0,1,0,0,0,0|2,0,1]=4 1674 B7R0.3 O=CCCC(=O)C=O Amb25024665 [0,1,0,0,0,0|1,0,2]=4 1675 B7R0.3 OCC(=O)CCCCl Amb24481374 [0,1,0,0,0,0|1,0,0]=2 1676 B7R0.3 OCC(CCSC)N Amb2236184 [0,1,0,0,0,0|2,0,1]=4 1677 B7R0.3 OCC(S)CCCS Amb25106055 [0,1,0,0,0,0|1,1,1]=4 1678 B7R0.3 OCCCC(=C)C#C Amb17593132 [0,1,0,0,0,0|3,0,0]=4 1679 B7R0.3 OCCCC(Br)C=O Amb25765431 [0,1,0,0,0,0|2,0,1]=4 1680 B7R0.3 OCCCC(CC)O Amb17593216 [0,1,0,0,0,0|2,0,1]=4 1681 B7R0.3 OCCCC(CO)O Amb17593225 [0,1,0,0,0,0|1,0,2]=4 1682 B7R0.3 OCCCC(Cl)CO Amb25275096 [0,1,0,0,0,0|2,0,1]=4 1683 B7R0.3 OCCCC(F)C=O Amb24553890 [0,1,0,0,0,0|2,0,1]=4 1684 B7R0.3 OCCCC(F)CO Amb25051440 [0,1,0,0,0,0|2,0,1]=4 1685 B7R0.3 OCCCC(O)C=O Amb18641948 [0,1,0,0,0,0|1,0,1]=3 1686 B7R0.3 OCCCC(O)CBr Amb24533940 [0,1,0,0,0,0|2,0,1]=4 1687 B7R0.3 OCCCC(O)CCl Amb24725283 [0,1,0,0,0,0|2,0,1]=4 1688 B7R0.3 OCCC[C@H](O)C=O Amb24570447 [0,1,0,0,0,0|1,0,1]=3 1689 B7R0.3 OCCC[C@H](O)CO Amb24687288 [0,1,0,0,0,0|1,0,2]=4 1690 B7R0.3 OCCNC(=O)CBr Amb17325573 [0,1,0,0,0,0|3,0,0]=4 1691 B7R0.3 OCCOC(=O)CCl Amb25173827 [0,1,0,0,0,0|3,0,0]=4 1692 B7R0.3 OCC\C=C(/Br)\C=O Amb25289253 [0,1,0,0,0,0|2,0,1]=4 1693 B7R0.3 OCC\C=C(\Cl)/C=O Amb24598291 [0,1,0,0,0,0|2,0,1]=4 1694 B7R0.3 OCC\C=C(\F)/C=O Amb24714897 [0,1,0,0,0,0|2,0,1]=4 1695 B7R0.3 OC\C(\F)=C/CCO Amb24647997 [0,1,0,0,0,0|2,0,1]=4 1696 B7R0.3 [N-]=[N+]=NCC(=O)OC Amb1101953 [0,1,0,0,0,0|3,0,0]=4 1697 B7R0.4 BrCCCCC(=O)C Amb16234126 [0,1,0,0,0,0|1,0,0]=2 1698 B7R0.4 C#CCCOC(=O)Cl Amb22360631 [0,1,0,0,0,0|1,0,2]=4 1699 B7R0.4 C#CCOCC(=O)Cl Amb24686000 [0,1,0,0,0,0|1,0,2]=4 1700 B7R0.4 C#CCSCC(=O)O Amb2372297 [0,1,0,0,0,0|0,0,2]=3 1701 B7R0.4 C#CCSCC(N)=O Amb24706564 [0,1,0,0,0,0|1,0,2]=4 1702 B7R0.4 C#C\C=C\CC(O)=O Amb24409578 [0,1,0,0,0,0|0,0,3]=4 1703 B7R0.4 C=C(Br)CCCC=O Amb24390485 [0,1,0,0,0,0|2,0,1]=4 1704 B7R0.4 C=C(Br)CCCCCl Amb24703183 [0,1,0,0,0,0|2,0,0]=3 1705 B7R0.4 C=C(Br)CCCCO Amb25381428 [0,1,0,0,0,0|2,0,0]=3 1706 B7R0.4 C=C(Br)CNCCN Amb18180845 [0,1,0,0,0,0|3,0,0]=4 1707 B7R0.4 C=C(Br)CNCCO Amb18523816 [0,1,0,0,0,0|3,0,0]=4 1708 B7R0.4 C=C(Br)COCCN Amb19020783 [0,1,0,0,0,0|3,0,0]=4 1709 B7R0.4 C=C(Br)CSCCN Amb18303981 [0,1,0,0,0,0|3,0,0]=4 1710 B7R0.4 C=C(Br)CSCCO Amb19053954 [0,1,0,0,0,0|3,0,0]=4 1711 B7R0.4 C=C(Cl)CCCCO Amb25064782 [0,1,0,0,0,0|2,0,0]=3 1712 B7R0.4 C=C(Cl)CNCCF Amb24709983 [0,1,0,0,0,0|3,0,0]=4 1713 B7R0.4 C=C(Cl)CNCCO Amb19004198 [0,1,0,0,0,0|3,0,0]=4 1714 B7R0.4 C=C(Cl)COCCN Amb19020765 [0,1,0,0,0,0|3,0,0]=4 1715 B7R0.4 C=C(F)CCCCBr Amb24635488 [0,1,0,0,0,0|2,0,0]=3 1716 B7R0.4 C=C(F)CCCCO Amb22641473 [0,1,0,0,0,0|2,0,0]=3 1717 B7R0.4 C=CCCCB(O)O Amb22169115 [0,1,0,0,0,0|1,0,2]=4 1718 B7R0.4 C=CCCCC(=O)C Amb17593171 [0,1,0,0,0,0|1,0,1]=3 1719 B7R0.4 C=CCCCC(N)=N Amb24595568 [0,1,0,0,0,0|2,0,1]=4 1720 B7R0.4 C=CCCCC(N)=O Amb24579642 [0,1,0,0,0,0|1,0,1]=3 1721 B7R0.4 C=CCCC[N+]([O-])=O Amb22338382 [0,1,0,0,0,0|1,0,2]=4 1722 B7R0.4 C=CCCNC(N)=O Amb25789999 [0,1,0,0,0,0|1,0,2]=4 1723 B7R0.4 C=CCCNC(O)=S Amb25083092 [0,1,0,0,0,0|0,1,2]=4 1724 B7R0.4 C=CCSCC(=O)O Amb1110888 [0,1,0,0,0,0|0,0,2]=3 1725 B7R0.4 C=CCSCC(N)=O Amb19129905 [0,1,0,0,0,0|1,0,2]=4 1726 B7R0.4 C=CC\C=C\C(O)=O Amb18641681 [0,1,0,0,0,0|0,0,3]=4 1727 B7R0.4 CC#CC#CC(O)=O Amb25230912 [0,1,0,0,0,0|0,0,3]=4 1728 B7R0.4 CC#CCCC(C)=O Amb24471185 [0,1,0,0,0,0|1,0,1]=3 1729 B7R0.4 CC#CCC[C@@H](C)O Amb22896361 [0,1,0,0,0,0|1,0,2]=4 1730 B7R0.4 CC#CCC[C@H](C)O Amb24734021 [0,1,0,0,0,0|1,0,2]=4 1731 B7R0.4 CC#CCNC(N)=O Amb24332663 [0,1,0,0,0,0|1,0,2]=4 1732 B7R0.4 CC#CCOC(=O)Cl Amb22001616 [0,1,0,0,0,0|1,0,2]=4 1733 B7R0.4 CC#CCOC(C)=O Amb22043383 [0,1,0,0,0,0|1,0,2]=4 1734 B7R0.4 CC#C\C=C\C(O)=O Amb25188432 [0,1,0,0,0,0|0,0,3]=4 1735 B7R0.4 CC(=C)CCCC=C Amb25787099 [0,1,0,0,0,0|2,0,1]=4 1736 B7R0.4 CC(=C)CCCC=O Amb18641705 [0,1,0,0,0,0|2,0,1]=4 1737 B7R0.4 CC(=C)CCCCBr Amb25129478 [0,1,0,0,0,0|2,0,0]=3 1738 B7R0.4 CC(=C)CCCCCl Amb24481468 [0,1,0,0,0,0|2,0,0]=3 1739 B7R0.4 CC(=C)CCCCN Amb25142976 [0,1,0,0,0,0|2,0,0]=3 1740 B7R0.4 CC(=C)CNCCN Amb25336867 [0,1,0,0,0,0|3,0,0]=4 1741 B7R0.4 CC(=C)CNCCO Amb24591963 [0,1,0,0,0,0|3,0,0]=4 1742 B7R0.4 CC(=C)COCCN Amb19020764 [0,1,0,0,0,0|3,0,0]=4 1743 B7R0.4 CC(=C)COCCN Amb20631068 [0,1,0,0,0,0|3,0,0]=4 1744 B7R0.4 CC(=C)CSCCCl Amb24462749 [0,1,0,0,0,0|3,0,0]=4 1745 B7R0.4 CC(=C)OCCCBr Amb25337400 [0,1,0,0,0,0|3,0,0]=4 1746 B7R0.4 CC(=C)OCCCO Amb24581723 [0,1,0,0,0,0|3,0,0]=4 1747 B7R0.4 CC(=N)CCCCN Amb25076530 [0,1,0,0,0,0|2,0,0]=3 1748 B7R0.4 CC(=N)NCCCF Amb25144823 [0,1,0,0,0,0|3,0,0]=4 1749 B7R0.4 CC(=O)CCCC#C Amb18115312 [0,1,0,0,0,0|1,0,1]=3 1750 B7R0.4 CC(=O)CCCC=O Amb18641775 [0,1,0,0,0,0|1,0,1]=3 1751 B7R0.4 CC(=O)CCN=C=O Amb24481500 [0,1,0,0,0,0|2,0,1]=4 1752 B7R0.4 CC(=O)CCN=[N+]=[N-] Amb18522048 [0,1,0,0,0,0|3,0,0]=4 1753 B7R0.4 CC(=O)CCNC=O Amb25075578 [0,1,0,0,0,0|2,0,1]=4 1754 B7R0.4 CC(=O)CCOC=O Amb24408302 [0,1,0,0,0,0|2,0,1]=4 1755 B7R0.4 CC(=O)CC\C=C/Br Amb25758398 [0,1,0,0,0,0|1,0,2]=4 1756 B7R0.4 CC(=O)CC\C=C\Br Amb25336747 [0,1,0,0,0,0|1,0,2]=4 1757 B7R0.4 CC(=O)CNCC#C Amb24528702 [0,1,0,0,0,0|1,0,2]=4 1758 B7R0.4 CC(=O)CNCCO Amb18108527 [0,1,0,0,0,0|2,0,0]=3 1759 B7R0.4 CC(=O)CNCCS Amb25328157 [0,1,0,0,0,0|2,0,0]=3 1760 B7R0.4 CC(=O)COCC=O Amb18641868 [0,1,0,0,0,0|2,0,1]=4 1761 B7R0.4 CC(=O)COCCCl Amb25346574 [0,1,0,0,0,0|2,0,0]=3 1762 B7R0.4 CC(=O)COCCN Amb18630459 [0,1,0,0,0,0|2,0,0]=3 1763 B7R0.4 CC(=O)CSCC#C Amb25333140 [0,1,0,0,0,0|1,0,2]=4 1764 B7R0.4 CC(=O)CSCC=C Amb25767863 [0,1,0,0,0,0|1,0,2]=4 1765 B7R0.4 CC(=O)CSCCCl Amb25110707 [0,1,0,0,0,0|2,0,0]=3 1766 B7R0.4 CC(=O)CSCCF Amb24621173 [0,1,0,0,0,0|2,0,0]=3 1767 B7R0.4 CC(=O)C\C=C\CO Amb24583096 [0,1,0,0,0,0|1,0,2]=4 1768 B7R0.4 CC(=O)NCCC#C Amb21942373 [0,1,0,0,0,0|1,0,2]=4 1769 B7R0.4 CC(=O)NCCCF Amb25048794 [0,1,0,0,0,0|2,0,0]=3 1770 B7R0.4 CC(=O)NCCCI Amb24733809 [0,1,0,0,0,0|2,0,0]=3 1771 B7R0.4 CC(=O)NCCCN Amb10610286 [0,1,0,0,0,0|2,0,0]=3 1772 B7R0.4 CC(=O)NCCNN Amb24117179 [0,1,0,0,0,0|3,0,0]=4 1773 B7R0.4 CC(=O)NCCNN Amb25076762 [0,1,0,0,0,0|3,0,0]=4 1774 B7R0.4 CC(=O)NCCON Amb17138368 [0,1,0,0,0,0|3,0,0]=4 1775 B7R0.4 CC(=O)NCCSCl Amb24482235 [0,1,0,0,0,0|3,0,0]=4 1776 B7R0.4 CC(=O)OCCC#N Amb18641722 [0,1,0,0,0,0|2,0,1]=4 1777 B7R0.4 CC(=O)OCCC=O Amb18641862 [0,1,0,0,0,0|2,0,1]=4 1778 B7R0.4 CC(=O)OCCCF Amb22008199 [0,1,0,0,0,0|2,0,0]=3 1779 B7R0.4 CC(=O)OCCCI Amb24532815 [0,1,0,0,0,0|2,0,0]=3 1780 B7R0.4 CC(=O)OCCCN Amb18641920 [0,1,0,0,0,0|2,0,0]=3 1781 B7R0.4 CC(=O)OCCCO Amb25854267 [0,1,0,0,0,0|2,0,0]=3 1782 B7R0.4 CC(=O)OCSCCl Amb25315538 [0,1,0,0,0,0|3,0,0]=4 1783 B7R0.4 CC(=O)OOCCBr Amb22233446 [0,1,0,0,0,0|3,0,0]=4 1784 B7R0.4 CC(=O)SCCC#N Amb22351951 [0,1,0,0,0,0|2,0,1]=4 1785 B7R0.4 CC(=O)SCCC=C Amb24117956 [0,1,0,0,0,0|1,0,2]=4 1786 B7R0.4 CC(=O)SCCC=O Amb25101351 [0,1,0,0,0,0|2,0,1]=4 1787 B7R0.4 CC(=O)SCCCBr Amb17610077 [0,1,0,0,0,0|2,0,0]=3 1788 B7R0.4 CC(=O)SCCCF Amb25240055 [0,1,0,0,0,0|2,0,0]=3 1789 B7R0.4 CC(=O)SCCCN Amb25368304 [0,1,0,0,0,0|2,0,0]=3 1790 B7R0.4 CC(=O)SSCCCl Amb25060782 [0,1,0,0,0,0|3,0,0]=4 1791 B7R0.4 CC(=O)SSCCN Amb24625990 [0,1,0,0,0,0|3,0,0]=4 1792 B7R0.4 CC(=O)\C=C\CCCl Amb25806173 [0,1,0,0,0,0|1,0,2]=4 1793 B7R0.4 CC(=S)OCCCCl Amb22232259 [0,1,0,0,0,0|2,1,0]=4 1794 B7R0.4 CC(=S)SCCCCl Amb24524361 [0,1,0,0,0,0|2,1,0]=4 1795 B7R0.4 CC(Br)=CCCCBr Amb22347606 [0,1,0,0,0,0|2,0,1]=4 1796 B7R0.4 CC(Br)=CCCCCl Amb25274964 [0,1,0,0,0,0|2,0,1]=4 1797 B7R0.4 CC(Br)CCCCO Amb25859232 [0,1,0,0,0,0|2,0,1]=4 1798 B7R0.4 CC(C)=CCCCBr Amb24483213 [0,1,0,0,0,0|2,0,1]=4 1799 B7R0.4 CC(C)=CCCCN Amb18641749 [0,1,0,0,0,0|2,0,1]=4 1800 B7R0.4 CC(C)CCCCCl Amb20670590 [0,1,0,0,0,0|2,0,1]=4 1801 B7R0.4 CC(C)CCCCN Amb19374781 [0,1,0,0,0,0|2,0,1]=4 1802 B7R0.4 CC(Cl)CCCCO Amb24532074 [0,1,0,0,0,0|2,0,1]=4 1803 B7R0.4 CC(F)CCCCBr Amb24440754 [0,1,0,0,0,0|2,0,1]=4 1804 B7R0.4 CC(F)CCCCO Amb24414878 [0,1,0,0,0,0|2,0,1]=4 1805 B7R0.4 CC(N)CCCCN Amb25214697 [0,1,0,0,0,0|2,0,1]=4 1806 B7R0.4 CC(O)CCCC#C Amb24360348 [0,1,0,0,0,0|1,0,2]=4 1807 B7R0.4 CC(O)CCCC#N Amb24354435 [0,1,0,0,0,0|1,0,2]=4 1808 B7R0.4 CC(O)CCCC=C Amb22059432 [0,1,0,0,0,0|1,0,2]=4 1809 B7R0.4 CC(O)CCCC=O Amb18641887 [0,1,0,0,0,0|1,0,2]=4 1810 B7R0.4 CC(O)CCCCBr Amb24552945 [0,1,0,0,0,0|1,0,1]=3 1811 B7R0.4 CC(O)CCCCCl Amb24462574 [0,1,0,0,0,0|1,0,1]=3 1812 B7R0.4 CC(O)CCCCO Amb22227757 [0,1,0,0,0,0|1,0,1]=3 1813 B7R0.4 CC(O)CCCON Amb24412992 [0,1,0,0,0,0|2,0,1]=4 1814 B7R0.4 CC(O)COCCO Amb24590103 [0,1,0,0,0,0|2,0,1]=4 1815 B7R0.4 CC(O)CSCCN Amb18304010 [0,1,0,0,0,0|2,0,1]=4 1816 B7R0.4 CC(O)CSCCO Amb22055428 [0,1,0,0,0,0|2,0,1]=4 1817 B7R0.4 CC=C=CCC(C)=O Amb24100849 [0,1,0,0,0,0|1,0,2]=4 1818 B7R0.4 CC=C=CCC(O)=O Amb25118481 [0,1,0,0,0,0|0,0,2]=3 1819 B7R0.4 CC=CCCC(C)=C Amb22228882 [0,1,0,0,0,0|2,0,1]=4 1820 B7R0.4 CCC#CCC(C)O Amb22045231 [0,1,0,0,0,0|1,0,2]=4 1821 B7R0.4 CCC#CC[C@H](C)O Amb25851544 [0,1,0,0,0,0|1,0,2]=4 1822 B7R0.4 CCC=C=CC(C)=O Amb25830543 [0,1,0,0,0,0|1,0,2]=4 1823 B7R0.4 CCCC#CC(=O)Cl Amb25250583 [0,1,0,0,0,0|1,0,1]=3 1824 B7R0.4 CCCC#CC(C)=C Amb22228884 [0,1,0,0,0,0|2,0,1]=4 1825 B7R0.4 CCCC#CC(C)O Amb24273363 [0,1,0,0,0,0|1,0,2]=4 1826 B7R0.4 CCCC#C[C@H](C)O Amb25283222 [0,1,0,0,0,0|1,0,2]=4 1827 B7R0.4 CCCC=NC(N)=O Amb24411468 [0,1,0,0,0,0|1,0,1]=3 1828 B7R0.4 CCCCC=C(C)C Amb22228888 [0,1,0,0,0,0|2,0,0]=3 1829 B7R0.4 CCCCC=C(F)F Amb10840485 [0,1,0,0,0,0|2,0,0]=3 1830 B7R0.4 CCCCCB(O)O Amb2447470 [0,1,0,0,0,0|1,0,1]=3 1831 B7R0.4 CCCCCC(C)Cl Amb22228752 [0,1,0,0,0,0|2,0,1]=4 1832 B7R0.4 CCCCCC(C)N Amb21962698 [0,1,0,0,0,0|2,0,1]=4 1833 B7R0.4 CCCCCC(C)S Amb17939452 [0,1,0,0,0,0|1,1,1]=4 1834 B7R0.4 CCCCCC(Cl)Br Amb25061271 [0,1,0,0,0,0|2,0,1]=4 1835 B7R0.4 CCCCCC(F)Br Amb24641242 [0,1,0,0,0,0|2,0,1]=4 1836 B7R0.4 CCCCCC(N)=N Amb19890171 [0,1,0,0,0,0|2,0,0]=3 1837 B7R0.4 CCCCCC(N)C Amb10843721 [0,1,0,0,0,0|2,0,1]=4 1838 B7R0.4 CCCCCC(N)O Amb24673933 [0,1,0,0,0,0|1,0,1]=3 1839 B7R0.4 CCCCCC([O-])=O Amb22337624 [0,1,0,0,0,0|0,0,1]=2 1840 B7R0.4 CCCCCC([O-])=O Amb22525161 [0,1,0,0,0,0|0,0,1]=2 1841 B7R0.4 CCCCCC([O-])=O Amb22730527 [0,1,0,0,0,0|0,0,1]=2 1842 B7R0.4 CCCCCC([O-])=O Amb22731343 [0,1,0,0,0,0|0,0,1]=2 1843 B7R0.4 CCCCCN(C)C Amb10560438 [0,1,0,0,0,0|3,0,0]=4 1844 B7R0.4 CCCCCN(C)N Amb24354275 [0,1,0,0,0,0|3,0,0]=4 1845 B7R0.4 CCCCC[13C](O)=O Amb22353417 [0,1,0,0,0,0|0,0,0]=1 1846 B7R0.4 CCCCC[C@@H](C)Br Amb24692738 [0,1,0,0,0,0|2,0,1]=4 1847 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [0,1,0,0,0,0|1,0,1]=3 1848 B7R0.4 CCCCC[N+]([O-])=O Amb22227991 [0,1,0,0,0,0|1,0,1]=3 1849 B7R0.4 CCCCC[SiH](C)C Amb25173961 [0,1,0,0,0,0|2,1,0]=4 1850 B7R0.4 CCCCNC(=N)N Amb16206158 [0,1,0,0,0,0|2,0,0]=3 1851 B7R0.4 CCCCNC(=O)Cl Amb24574309 [0,1,0,0,0,0|1,0,0]=2 1852 B7R0.4 CCCCNC(=S)N Amb1152044 [0,1,0,0,0,0|1,1,0]=3 1853 B7R0.4 CCCCNC(C)=C Amb25291695 [0,1,0,0,0,0|2,0,0]=3 1854 B7R0.4 CCCCNC(C)C Amb2111112 [0,1,0,0,0,0|2,0,1]=4 1855 B7R0.4 CCCCNC(C)O Amb24715795 [0,1,0,0,0,0|1,0,1]=3 1856 B7R0.4 CCCCNC(N)=N Amb19748357 [0,1,0,0,0,0|2,0,0]=3 1857 B7R0.4 CCCCOB(O)O Amb25687500 [0,1,0,0,0,0|1,0,1]=3 1858 B7R0.4 CCCCOC(=O)F Amb24710483 [0,1,0,0,0,0|1,0,0]=2 1859 B7R0.4 CCCCOC(C)=S Amb22230357 [0,1,0,0,0,0|1,1,0]=3 1860 B7R0.4 CCCCOC(C)Br Amb17689407 [0,1,0,0,0,0|2,0,1]=4 1861 B7R0.4 CCCCOC(C)Cl Amb17689402 [0,1,0,0,0,0|2,0,1]=4 1862 B7R0.4 CCCCOC(N)=N Amb24579254 [0,1,0,0,0,0|2,0,0]=3 1863 B7R0.4 CCCCOC(N)=S Amb24761515 [0,1,0,0,0,0|1,1,0]=3 1864 B7R0.4 CCCCSC(=N)N Amb10552525 [0,1,0,0,0,0|2,0,0]=3 1865 B7R0.4 CCCCSC(=O)C Amb10552685 [0,1,0,0,0,0|1,0,0]=2 1866 B7R0.4 CCCCSC(=O)Cl Amb22352826 [0,1,0,0,0,0|1,0,0]=2 1867 B7R0.4 CCCCSC(Cl)Cl Amb24635698 [0,1,0,0,0,0|2,0,1]=4 1868 B7R0.4 CCCCSC(F)F Amb24354543 [0,1,0,0,0,0|2,0,1]=4 1869 B7R0.4 CCCCSC(N)=O Amb24533653 [0,1,0,0,0,0|1,0,0]=2 1870 B7R0.4 CCCCSC([O-])=S Amb25359489 [0,1,0,0,0,0|0,1,1]=3 1871 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [0,1,0,0,0,0|0,0,0]=1 1872 B7R0.4 CCCNCC(=C)Br Amb18303968 [0,1,0,0,0,0|2,0,0]=3 1873 B7R0.4 CCCNCC(=C)C Amb17308631 [0,1,0,0,0,0|2,0,0]=3 1874 B7R0.4 CCCNCC(=C)Cl Amb19004838 [0,1,0,0,0,0|2,0,0]=3 1875 B7R0.4 CCCNCC(=O)N Amb1124632 [0,1,0,0,0,0|1,0,0]=2 1876 B7R0.4 CCCNCC(=O)O Amb10609640 [0,1,0,0,0,0|0,0,0]=1 1877 B7R0.4 CCCNCC(=O)O Amb1110628 [0,1,0,0,0,0|0,0,0]=1 1878 B7R0.4 CCCNCC(=S)N Amb17231883 [0,1,0,0,0,0|1,1,0]=3 1879 B7R0.4 CCCNCC(C)Cl Amb25074390 [0,1,0,0,0,0|2,0,1]=4 1880 B7R0.4 CCCNCC(C)N Amb19024658 [0,1,0,0,0,0|2,0,1]=4 1881 B7R0.4 CCCNCC(C)O Amb22292467 [0,1,0,0,0,0|1,0,1]=3 1882 B7R0.4 CCCNCC(C)S Amb18124358 [0,1,0,0,0,0|1,1,1]=4 1883 B7R0.4 CCCNCC(F)F Amb13951924 [0,1,0,0,0,0|2,0,1]=4 1884 B7R0.4 CCCNC[C@@H](C)O Amb25042630 [0,1,0,0,0,0|1,0,1]=3 1885 B7R0.4 CCCNC[C@H](C)N Amb25730636 [0,1,0,0,0,0|2,0,1]=4 1886 B7R0.4 CCCNC[C@H](C)O Amb24473274 [0,1,0,0,0,0|1,0,1]=3 1887 B7R0.4 CCCNN=C(C)C Amb24747220 [0,1,0,0,0,0|3,0,0]=4 1888 B7R0.4 CCCNNC(N)=S Amb19514593 [0,1,0,0,0,0|2,1,0]=4 1889 B7R0.4 CCCOCC(C)Br Amb24563738 [0,1,0,0,0,0|2,0,1]=4 1890 B7R0.4 CCCOC[C@H](C)O Amb24575974 [0,1,0,0,0,0|1,0,1]=3 1891 B7R0.4 CCCONC(N)=N Amb25843240 [0,1,0,0,0,0|3,0,0]=4 1892 B7R0.4 CCCSCC(=C)Br Amb25206483 [0,1,0,0,0,0|2,0,0]=3 1893 B7R0.4 CCCSCC(=C)Cl Amb24476596 [0,1,0,0,0,0|2,0,0]=3 1894 B7R0.4 CCCSCC(=O)O Amb1137113 [0,1,0,0,0,0|0,0,0]=1 1895 B7R0.4 CCCSCC(C)N Amb25101048 [0,1,0,0,0,0|2,0,1]=4 1896 B7R0.4 CCCSC[C@@H](C)N Amb25839433 [0,1,0,0,0,0|2,0,1]=4 1897 B7R0.4 CCCSC[C@H](C)N Amb24409083 [0,1,0,0,0,0|2,0,1]=4 1898 B7R0.4 CCCSC[C@H](C)O Amb24526704 [0,1,0,0,0,0|1,0,1]=3 1899 B7R0.4 CCCSSC(N)=N Amb25174907 [0,1,0,0,0,0|3,0,0]=4 1900 B7R0.4 CCC\C=C/C(=O)C Amb17593161 [0,1,0,0,0,0|1,0,1]=3 1901 B7R0.4 CCC\C=C\C(=C)O Amb24332587 [0,1,0,0,0,0|1,0,1]=3 1902 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [0,1,0,0,0,0|1,0,1]=3 1903 B7R0.4 CCC\C=C\C(C)O Amb25083446 [0,1,0,0,0,0|1,0,2]=4 1904 B7R0.4 CCC\C=C\C(N)=N Amb24549908 [0,1,0,0,0,0|2,0,1]=4 1905 B7R0.4 CCC\C=C\[N+]([O-])=O Amb24558342 [0,1,0,0,0,0|1,0,2]=4 1906 B7R0.4 CCN=C=CC(C)=O Amb24481402 [0,1,0,0,0,0|1,0,2]=4 1907 B7R0.4 CCNCC=C(C)C Amb25084591 [0,1,0,0,0,0|2,0,1]=4 1908 B7R0.4 CCNCCC(=S)N Amb17231882 [0,1,0,0,0,0|1,1,0]=3 1909 B7R0.4 CCNCCC(C)=C Amb18312576 [0,1,0,0,0,0|2,0,0]=3 1910 B7R0.4 CCNCCC(C)=O Amb18641851 [0,1,0,0,0,0|1,0,0]=2 1911 B7R0.4 CCNCCC(C)Br Amb25697002 [0,1,0,0,0,0|2,0,1]=4 1912 B7R0.4 CCNCCC(C)F Amb25250453 [0,1,0,0,0,0|2,0,1]=4 1913 B7R0.4 CCNCCC(C)N Amb18305008 [0,1,0,0,0,0|2,0,1]=4 1914 B7R0.4 CCNCCC(F)F Amb25307874 [0,1,0,0,0,0|2,0,1]=4 1915 B7R0.4 CCNCCC(N)=N Amb25112934 [0,1,0,0,0,0|2,0,0]=3 1916 B7R0.4 CCNCCN(C)C Amb1128271 [0,1,0,0,0,0|3,0,0]=4 1917 B7R0.4 CCNCCN(C)N Amb18641934 [0,1,0,0,0,0|3,0,0]=4 1918 B7R0.4 CCNCCS(N)=N Amb25255199 [0,1,0,0,0,0|3,0,0]=4 1919 B7R0.4 CCNCC[C@H](C)O Amb25757479 [0,1,0,0,0,0|1,0,1]=3 1920 B7R0.4 CCNCNC(C)=O Amb25809446 [0,1,0,0,0,0|2,0,0]=3 1921 B7R0.4 CCNN=CC(C)=O Amb24595042 [0,1,0,0,0,0|2,0,1]=4 1922 B7R0.4 CCNOCC(C)=C Amb24539134 [0,1,0,0,0,0|3,0,0]=4 1923 B7R0.4 CCNOCC(N)=O Amb24505259 [0,1,0,0,0,0|2,0,0]=3 1924 B7R0.4 CCN\C=C\C(C)=O Amb24761435 [0,1,0,0,0,0|1,0,2]=4 1925 B7R0.4 CCN\N=C\C(C)=O Amb25024484 [0,1,0,0,0,0|2,0,1]=4 1926 B7R0.4 CCOC#CC(C)=O Amb25335173 [0,1,0,0,0,0|1,0,2]=4 1927 B7R0.4 CCOC=NC(N)=O Amb24665192 [0,1,0,0,0,0|2,0,1]=4 1928 B7R0.4 CCOCC=C(C)C Amb25320552 [0,1,0,0,0,0|2,0,1]=4 1929 B7R0.4 CCOCCC(=O)Cl Amb20672027 [0,1,0,0,0,0|1,0,0]=2 1930 B7R0.4 CCOCCN(C)C Amb24676540 [0,1,0,0,0,0|3,0,0]=4 1931 B7R0.4 CCOCCN(C)N Amb24690005 [0,1,0,0,0,0|3,0,0]=4 1932 B7R0.4 CCOCCS(=O)Cl Amb24625733 [0,1,0,0,0,0|2,0,0]=3 1933 B7R0.4 CCOCCS(C)=O Amb25206909 [0,1,0,0,0,0|2,0,0]=3 1934 B7R0.4 CCOCC[C@@H](C)N Amb25744371 [0,1,0,0,0,0|2,0,1]=4 1935 B7R0.4 CCOCC[C@@H](C)O Amb24524285 [0,1,0,0,0,0|1,0,1]=3 1936 B7R0.4 CCOCC[C@H](C)N Amb24439507 [0,1,0,0,0,0|2,0,1]=4 1937 B7R0.4 CCOCNC(C)=O Amb24334070 [0,1,0,0,0,0|2,0,0]=3 1938 B7R0.4 CCOCNC(N)=O Amb25765493 [0,1,0,0,0,0|2,0,0]=3 1939 B7R0.4 CCOCNC(N)=S Amb25810109 [0,1,0,0,0,0|2,1,0]=4 1940 B7R0.4 CCOCOC(C)=O Amb25191864 [0,1,0,0,0,0|2,0,0]=3 1941 B7R0.4 CCONCC(N)=O Amb25745510 [0,1,0,0,0,0|2,0,0]=3 1942 B7R0.4 CCONC[C@@H](C)O Amb24526714 [0,1,0,0,0,0|2,0,1]=4 1943 B7R0.4 CCO\C=C/C(C)=O Amb24379536 [0,1,0,0,0,0|1,0,2]=4 1944 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [0,1,0,0,0,0|1,0,2]=4 1945 B7R0.4 CCSC#CC(C)=O Amb25322915 [0,1,0,0,0,0|1,0,2]=4 1946 B7R0.4 CCSC#CC(O)=O Amb25793529 [0,1,0,0,0,0|0,0,2]=3 1947 B7R0.4 CCSCC=C(C)C Amb24408057 [0,1,0,0,0,0|2,0,1]=4 1948 B7R0.4 CCSCCC(=S)N Amb17307560 [0,1,0,0,0,0|1,1,0]=3 1949 B7R0.4 CCSCCC(C)=C Amb25236682 [0,1,0,0,0,0|2,0,0]=3 1950 B7R0.4 CCSCCC(C)C Amb22230685 [0,1,0,0,0,0|2,0,1]=4 1951 B7R0.4 CCSCCC(C)N Amb19149259 [0,1,0,0,0,0|2,0,1]=4 1952 B7R0.4 CCSCNC(N)=S Amb24681142 [0,1,0,0,0,0|2,1,0]=4 1953 B7R0.4 CCSSCC(C)O Amb24412221 [0,1,0,0,0,0|2,0,1]=4 1954 B7R0.4 CCSSCC(O)=O Amb25233433 [0,1,0,0,0,0|1,0,0]=2 1955 B7R0.4 CCS\C=C/C(O)=O Amb25200140 [0,1,0,0,0,0|0,0,2]=3 1956 B7R0.4 CCS\C=C\C(C)=O Amb25328935 [0,1,0,0,0,0|1,0,2]=4 1957 B7R0.4 CCS\C=C\C(O)=O Amb18642902 [0,1,0,0,0,0|0,0,2]=3 1958 B7R0.4 CC\C=C\CC(N)=N Amb24642056 [0,1,0,0,0,0|2,0,1]=4 1959 B7R0.4 CC\C=C\CC(N)=O Amb24595892 [0,1,0,0,0,0|1,0,1]=3 1960 B7R0.4 CC\C=C\CC(O)O Amb24353159 [0,1,0,0,0,0|0,0,3]=4 1961 B7R0.4 CC\C=C\C[C@@H](C)O Amb24352295 [0,1,0,0,0,0|1,0,2]=4 1962 B7R0.4 CC\C=C\OC(C)=O Amb25219263 [0,1,0,0,0,0|1,0,2]=4 1963 B7R0.4 CN(C)CCCCBr Amb18178257 [0,1,0,0,0,0|3,0,0]=4 1964 B7R0.4 CN(C)CCCCBr Amb19148184 [0,1,0,0,0,0|3,0,0]=4 1965 B7R0.4 CN(C)CCCCCl Amb20668164 [0,1,0,0,0,0|3,0,0]=4 1966 B7R0.4 CN(C)CCCCF Amb24527895 [0,1,0,0,0,0|3,0,0]=4 1967 B7R0.4 CNCCC=C(C)C Amb18993046 [0,1,0,0,0,0|2,0,1]=4 1968 B7R0.4 CNCCCC(=O)O Amb1153115 [0,1,0,0,0,0|0,0,0]=1 1969 B7R0.4 CNCCCC(C)=C Amb25742210 [0,1,0,0,0,0|2,0,0]=3 1970 B7R0.4 CNCCCC(C)Cl Amb24706205 [0,1,0,0,0,0|2,0,1]=4 1971 B7R0.4 CNCCCC(N)=O Amb18303611 [0,1,0,0,0,0|1,0,0]=2 1972 B7R0.4 CNCCCC(O)C Amb17569899 [0,1,0,0,0,0|1,0,1]=3 1973 B7R0.4 CNCCCS(O)=O Amb24656214 [0,1,0,0,0,0|1,0,0]=2 1974 B7R0.4 CNCCNC(N)=N Amb24617858 [0,1,0,0,0,0|3,0,0]=4 1975 B7R0.4 CNCCNC(N)=O Amb18299975 [0,1,0,0,0,0|2,0,0]=3 1976 B7R0.4 CNCCOC(C)=O Amb18124262 [0,1,0,0,0,0|2,0,0]=3 1977 B7R0.4 CNCCOC(N)=O Amb25136928 [0,1,0,0,0,0|2,0,0]=3 1978 B7R0.4 CNCCOP(O)O Amb25131324 [0,1,0,0,0,0|2,0,1]=4 1979 B7R0.4 CNCCSC(N)=N Amb23590673 [0,1,0,0,0,0|3,0,0]=4 1980 B7R0.4 CNC\C=C\C(O)=O Amb25368293 [0,1,0,0,0,0|0,0,2]=3 1981 B7R0.4 COCCCC(=O)Cl Amb24481572 [0,1,0,0,0,0|1,0,0]=2 1982 B7R0.4 COCCCC(C)Br Amb18185551 [0,1,0,0,0,0|2,0,1]=4 1983 B7R0.4 COCCCC(C)S Amb25810805 [0,1,0,0,0,0|1,1,1]=4 1984 B7R0.4 COCCCC(N)=N Amb19269156 [0,1,0,0,0,0|2,0,0]=3 1985 B7R0.4 COCCCC(N)=O Amb24670109 [0,1,0,0,0,0|1,0,0]=2 1986 B7R0.4 COCCC[C@@H](C)N Amb24749054 [0,1,0,0,0,0|2,0,1]=4 1987 B7R0.4 COCCNC(=O)N Amb1104938 [0,1,0,0,0,0|2,0,0]=3 1988 B7R0.4 COCCNC(C)=N Amb24586273 [0,1,0,0,0,0|3,0,0]=4 1989 B7R0.4 COCCNC(N)=N Amb19374354 [0,1,0,0,0,0|3,0,0]=4 1990 B7R0.4 COCCNC(N)=N Amb22587024 [0,1,0,0,0,0|3,0,0]=4 1991 B7R0.4 COCCNC(S)=S Amb24366657 [0,1,0,0,0,0|1,2,0]=4 1992 B7R0.4 COCCNS(C)=O Amb24601463 [0,1,0,0,0,0|3,0,0]=4 1993 B7R0.4 COCCOC(N)=N Amb25313305 [0,1,0,0,0,0|3,0,0]=4 1994 B7R0.4 COCCOC(N)=O Amb25054225 [0,1,0,0,0,0|2,0,0]=3 1995 B7R0.4 COCCOC([S-])=S Amb20671928 [0,1,0,0,0,0|1,2,0]=4 1996 B7R0.4 COCCSC(N)=N Amb20675994 [0,1,0,0,0,0|3,0,0]=4 1997 B7R0.4 COCCSC(N)=N Amb24532155 [0,1,0,0,0,0|3,0,0]=4 1998 B7R0.4 COCNCC(C)O Amb25216574 [0,1,0,0,0,0|2,0,1]=4 1999 B7R0.4 COCSCC(C)=O Amb24717297 [0,1,0,0,0,0|2,0,0]=3 2000 B7R0.4 COC\C=C\C(C)=O Amb25066961 [0,1,0,0,0,0|1,0,2]=4 2001 B7R0.4 COC\C=C\C(O)=O Amb18296423 [0,1,0,0,0,0|0,0,2]=3 2002 B7R0.4 CONCCC(C)=C Amb24543965 [0,1,0,0,0,0|3,0,0]=4 2003 B7R0.4 CONCCC(C)=O Amb25342369 [0,1,0,0,0,0|2,0,0]=3 2004 B7R0.4 CONCCC(N)=O Amb24481431 [0,1,0,0,0,0|2,0,0]=3 2005 B7R0.4 CONCCC(O)=O Amb24441275 [0,1,0,0,0,0|1,0,0]=2 2006 B7R0.4 CON\C=C\C(O)=O Amb24333349 [0,1,0,0,0,0|1,0,2]=4 2007 B7R0.4 CO\C=C\CC(O)=O Amb25174889 [0,1,0,0,0,0|0,0,2]=3 2008 B7R0.4 CS(=O)NCCCI Amb24536638 [0,1,0,0,0,0|3,0,0]=4 2009 B7R0.4 CS(=O)NCCCN Amb25177124 [0,1,0,0,0,0|3,0,0]=4 2010 B7R0.4 CS(=O)NCCCO Amb25233860 [0,1,0,0,0,0|3,0,0]=4 2011 B7R0.4 CSCCCC(=O)O Amb17503622 [0,1,0,0,0,0|0,0,0]=1 2012 B7R0.4 CSCCCC(C)=O Amb25122381 [0,1,0,0,0,0|1,0,0]=2 2013 B7R0.4 CSCCCC(C)N Amb18124381 [0,1,0,0,0,0|2,0,1]=4 2014 B7R0.4 CSCCCC(N)=O Amb19129736 [0,1,0,0,0,0|1,0,0]=2 2015 B7R0.4 CSCCNC(N)=S Amb24414359 [0,1,0,0,0,0|2,1,0]=4 2016 B7R0.4 CSCCNC(S)=S Amb25856953 [0,1,0,0,0,0|1,2,0]=4 2017 B7R0.4 CSCCOC(=O)Cl Amb25857013 [0,1,0,0,0,0|2,0,0]=3 2018 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [0,1,0,0,0,0|1,0,2]=4 2019 B7R0.4 CSC\C=C\C(C)=O Amb24515276 [0,1,0,0,0,0|1,0,2]=4 2020 B7R0.4 CSC\C=C\C(O)=O Amb18291627 [0,1,0,0,0,0|0,0,2]=3 2021 B7R0.4 CS\C=C/CC(C)=O Amb25064716 [0,1,0,0,0,0|1,0,2]=4 2022 B7R0.4 CS\C=C\CC(C)=O Amb24690833 [0,1,0,0,0,0|1,0,2]=4 2023 B7R0.4 C[C@@H](O)CCCC#N Amb24556435 [0,1,0,0,0,0|1,0,2]=4 2024 B7R0.4 C[C@@H](O)CCCC=O Amb22896885 [0,1,0,0,0,0|1,0,2]=4 2025 B7R0.4 C[C@@H](O)CCCCN Amb22896886 [0,1,0,0,0,0|1,0,1]=3 2026 B7R0.4 C[C@@H](O)CNCCN Amb25689140 [0,1,0,0,0,0|2,0,1]=4 2027 B7R0.4 C[C@@H](O)CSCCO Amb24643786 [0,1,0,0,0,0|2,0,1]=4 2028 B7R0.4 C[C@H](O)CCCC=C Amb24704360 [0,1,0,0,0,0|1,0,2]=4 2029 B7R0.4 C[C@H](O)CCCCCl Amb25715881 [0,1,0,0,0,0|1,0,1]=3 2030 B7R0.4 C[C@H](O)CNCCN Amb25777107 [0,1,0,0,0,0|2,0,1]=4 2031 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [0,1,0,0,0,0|0,0,0]=1 2032 B7R0.4 C\C(\Br)=C\CCCBr Amb25169514 [0,1,0,0,0,0|2,0,1]=4 2033 B7R0.4 C\C=C/CCC(C)=O Amb24333832 [0,1,0,0,0,0|1,0,1]=3 2034 B7R0.4 C\C=C\C#CC(=O)O Amb17593127 [0,1,0,0,0,0|0,0,3]=4 2035 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [0,1,0,0,0,0|0,0,3]=4 2036 B7R0.4 C\C=C\CCC(=O)Cl Amb25246754 [0,1,0,0,0,0|1,0,1]=3 2037 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [0,1,0,0,0,0|0,0,1]=2 2038 B7R0.4 C\C=C\CCC(C)=C Amb25746764 [0,1,0,0,0,0|2,0,1]=4 2039 B7R0.4 C\C=C\CCC(N)=O Amb25343167 [0,1,0,0,0,0|1,0,1]=3 2040 B7R0.4 C\C=C\CNC(C)=O Amb24370252 [0,1,0,0,0,0|1,0,2]=4 2041 B7R0.4 C\C=C\OCC(C)=O Amb24481479 [0,1,0,0,0,0|1,0,2]=4 2042 B7R0.4 ClB(Cl)CCCCBr Amb25189034 [0,1,0,0,0,0|3,0,0]=4 2043 B7R0.4 ClC(=O)OCCC=C Amb10844792 [0,1,0,0,0,0|1,0,2]=4 2044 B7R0.4 ClC(Cl)=CCCCBr Amb24670156 [0,1,0,0,0,0|2,0,1]=4 2045 B7R0.4 ClC(Cl)CCCCBr Amb24567653 [0,1,0,0,0,0|2,0,1]=4 2046 B7R0.4 ClCCCCC(Cl)Cl Amb25238318 [0,1,0,0,0,0|2,0,1]=4 2047 B7R0.4 ClCCCCN(C)C Amb17334150 [0,1,0,0,0,0|3,0,0]=4 2048 B7R0.4 ClCCCCP(Cl)Cl Amb25774935 [0,1,0,0,0,0|3,0,0]=4 2049 B7R0.4 ClCCCOC(=O)Cl Amb10844795 [0,1,0,0,0,0|2,0,0]=3 2050 B7R0.4 ClCCOCC(=O)Cl Amb17610887 [0,1,0,0,0,0|2,0,0]=3 2051 B7R0.4 FC(Cl)=CCCCCl Amb24761249 [0,1,0,0,0,0|2,0,1]=4 2052 B7R0.4 FC(F)CCCCBr Amb24693913 [0,1,0,0,0,0|2,0,1]=4 2053 B7R0.4 N#CCCCC(=O)C Amb17106756 [0,1,0,0,0,0|1,0,1]=3 2054 B7R0.4 N#CCCCC(O)=O Amb18560874 [0,1,0,0,0,0|0,0,1]=2 2055 B7R0.4 N#CCSCC(=O)C Amb17501747 [0,1,0,0,0,0|2,0,1]=4 2056 B7R0.4 N#CC\C=C\C(O)=O Amb18123863 [0,1,0,0,0,0|0,0,3]=4 2057 B7R0.4 N#CSCCC(O)=O Amb24481186 [0,1,0,0,0,0|1,0,1]=3 2058 B7R0.4 N#C\C=C/CC(O)=O Amb18641630 [0,1,0,0,0,0|0,0,3]=4 2059 B7R0.4 NC(=N)NCCCO Amb25327526 [0,1,0,0,0,0|3,0,0]=4 2060 B7R0.4 NC(=N)SCCCO Amb24381931 [0,1,0,0,0,0|3,0,0]=4 2061 B7R0.4 NC(=O)CCCC#N Amb25337207 [0,1,0,0,0,0|1,0,1]=3 2062 B7R0.4 NC(=O)CCCCI Amb25788033 [0,1,0,0,0,0|1,0,0]=2 2063 B7R0.4 NC(=O)CCNC=O Amb24630476 [0,1,0,0,0,0|2,0,1]=4 2064 B7R0.4 NC(=O)CCSC#N Amb24333945 [0,1,0,0,0,0|2,0,1]=4 2065 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [0,1,0,0,0,0|1,0,2]=4 2066 B7R0.4 NC(=O)CNCCF Amb24443361 [0,1,0,0,0,0|2,0,0]=3 2067 B7R0.4 NC(=O)COCCBr Amb25133475 [0,1,0,0,0,0|2,0,0]=3 2068 B7R0.4 NC(=O)CSCC=O Amb25806671 [0,1,0,0,0,0|2,0,1]=4 2069 B7R0.4 NC(=O)CSCCCl Amb25846245 [0,1,0,0,0,0|2,0,0]=3 2070 B7R0.4 NC(=O)C\C=C\CCl Amb25169594 [0,1,0,0,0,0|1,0,2]=4 2071 B7R0.4 NC(=O)NCOCO Amb24469438 [0,1,0,0,0,0|3,0,0]=4 2072 B7R0.4 NC(=O)OCCCCl Amb24635478 [0,1,0,0,0,0|2,0,0]=3 2073 B7R0.4 NC(=O)SCCCCl Amb24481372 [0,1,0,0,0,0|2,0,0]=3 2074 B7R0.4 NC(=S)CCCCCl Amb25177620 [0,1,0,0,0,0|1,1,0]=3 2075 B7R0.4 NC(=S)CCCCF Amb24613464 [0,1,0,0,0,0|1,1,0]=3 2076 B7R0.4 NC(=S)NCCCF Amb25219344 [0,1,0,0,0,0|2,1,0]=4 2077 B7R0.4 NCCCCC(N)=N Amb25714813 [0,1,0,0,0,0|2,0,0]=3 2078 B7R0.4 NCCCCC(N)=O Amb18641897 [0,1,0,0,0,0|1,0,0]=2 2079 B7R0.4 NCCCCC(N)=S Amb24481404 [0,1,0,0,0,0|1,1,0]=3 2080 B7R0.4 NCCCCC(N)O Amb24333310 [0,1,0,0,0,0|1,0,1]=3 2081 B7R0.4 NCCCCC(O)C Amb17569903 [0,1,0,0,0,0|1,0,1]=3 2082 B7R0.4 NCCCCC([O-])=O Amb22753853 [0,1,0,0,0,0|0,0,1]=2 2083 B7R0.4 NCCCCP(O)=O Amb24520720 [0,1,0,0,0,0|1,0,0]=2 2084 B7R0.4 NCCCCS(=O)C Amb17617794 [0,1,0,0,0,0|2,0,0]=3 2085 B7R0.4 NCCCNC(N)=N Amb25859352 [0,1,0,0,0,0|3,0,0]=4 2086 B7R0.4 NCCCNC(N)=O Amb18296186 [0,1,0,0,0,0|2,0,0]=3 2087 B7R0.4 NCCCNC(N)=O Amb20622408 [0,1,0,0,0,0|2,0,0]=3 2088 B7R0.4 NCCCNC(O)=O Amb24093884 [0,1,0,0,0,0|1,0,0]=2 2089 B7R0.4 NCCCOP(O)O Amb24745951 [0,1,0,0,0,0|2,0,1]=4 2090 B7R0.4 NCCCSC(N)=N Amb25805750 [0,1,0,0,0,0|3,0,0]=4 2091 B7R0.4 NCCNCC(=O)O Amb17608063 [0,1,0,0,0,0|1,0,0]=2 2092 B7R0.4 NCCNCC(O)=O Amb19958818 [0,1,0,0,0,0|1,0,0]=2 2093 B7R0.4 NCCOCC(N)=O Amb18523830 [0,1,0,0,0,0|2,0,0]=3 2094 B7R0.4 NCCOCC(N)=O Amb20631066 [0,1,0,0,0,0|2,0,0]=3 2095 B7R0.4 NCCOCC(O)=O Amb18630146 [0,1,0,0,0,0|1,0,0]=2 2096 B7R0.4 NCCOCC(O)=O Amb22751540 [0,1,0,0,0,0|1,0,0]=2 2097 B7R0.4 NCCSCC(=O)C Amb17500454 [0,1,0,0,0,0|2,0,0]=3 2098 B7R0.4 NCCSCC(=O)O Amb17500446 [0,1,0,0,0,0|1,0,0]=2 2099 B7R0.4 NCCSCC(O)=O Amb20622325 [0,1,0,0,0,0|1,0,0]=2 2100 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [0,1,0,0,0,0|0,0,2]=3 2101 B7R0.4 NC\C=C\CC(O)=O Amb18641825 [0,1,0,0,0,0|0,0,2]=3 2102 B7R0.4 NNCCCC(O)=O Amb24455803 [0,1,0,0,0,0|1,0,0]=2 2103 B7R0.4 NOCCCC(=O)O Amb10975956 [0,1,0,0,0,0|1,0,0]=2 2104 B7R0.4 NOCCCC(O)=O Amb22011795 [0,1,0,0,0,0|1,0,0]=2 2105 B7R0.4 O=C(Cl)C\C=C\CCl Amb25127032 [0,1,0,0,0,0|1,0,2]=4 2106 B7R0.4 O=C(Cl)OCCCBr Amb25137067 [0,1,0,0,0,0|2,0,0]=3 2107 B7R0.4 O=C(F)CCCCCl Amb24472276 [0,1,0,0,0,0|1,0,0]=2 2108 B7R0.4 O=C(F)OCCCCl Amb25122991 [0,1,0,0,0,0|2,0,0]=3 2109 B7R0.4 O=C=NCCC(=O)Cl Amb17593404 [0,1,0,0,0,0|2,0,1]=4 2110 B7R0.4 O=CCCCC(=O)O Amb17593198 [0,1,0,0,0,0|0,0,1]=2 2111 B7R0.4 O=CCCNC(=O)C Amb17102165 [0,1,0,0,0,0|2,0,1]=4 2112 B7R0.4 OB(O)CCCCBr Amb20171450 [0,1,0,0,0,0|1,0,1]=3 2113 B7R0.4 OB(O)CCCCCl Amb25184744 [0,1,0,0,0,0|1,0,1]=3 2114 B7R0.4 OC(=O)CCC=C=C Amb10605299 [0,1,0,0,0,0|0,0,2]=3 2115 B7R0.4 OC(=O)CCN=C=S Amb24562253 [0,1,0,0,0,0|1,0,1]=3 2116 B7R0.4 OC(=O)CCNC=O Amb18290434 [0,1,0,0,0,0|1,0,1]=3 2117 B7R0.4 OC(=O)CC\C=C\Br Amb25238247 [0,1,0,0,0,0|0,0,2]=3 2118 B7R0.4 OC(=O)CC\C=C\Cl Amb25803087 [0,1,0,0,0,0|0,0,2]=3 2119 B7R0.4 OC(=O)CNCCS Amb18124468 [0,1,0,0,0,0|1,0,0]=2 2120 B7R0.4 OC(=O)COCCBr Amb24057760 [0,1,0,0,0,0|1,0,0]=2 2121 B7R0.4 OC(=O)COCCCl Amb21857870 [0,1,0,0,0,0|1,0,0]=2 2122 B7R0.4 OC(=O)CSCC=O Amb24628311 [0,1,0,0,0,0|1,0,1]=3 2123 B7R0.4 OC(=O)CSCCCl Amb18644703 [0,1,0,0,0,0|1,0,0]=2 2124 B7R0.4 OC(=O)CSCCS Amb24711400 [0,1,0,0,0,0|1,0,0]=2 2125 B7R0.4 OC(=O)CS\C=C/Cl Amb24693896 [0,1,0,0,0,0|1,0,2]=4 2126 B7R0.4 OC(=O)CS\C=C\Cl Amb18125504 [0,1,0,0,0,0|1,0,2]=4 2127 B7R0.4 OC(=O)C\C=C/CS Amb18124361 [0,1,0,0,0,0|0,0,2]=3 2128 B7R0.4 OC(=O)C\C=C\C=C Amb17593152 [0,1,0,0,0,0|0,0,3]=4 2129 B7R0.4 OC(=O)C\C=C\C=O Amb24437944 [0,1,0,0,0,0|0,0,3]=4 2130 B7R0.4 OC(=O)C\C=C\CBr Amb18125611 [0,1,0,0,0,0|0,0,2]=3 2131 B7R0.4 OC(=O)C\C=C\CCl Amb18124409 [0,1,0,0,0,0|0,0,2]=3 2132 B7R0.4 OC(=O)C\C=C\CS Amb24693621 [0,1,0,0,0,0|0,0,2]=3 2133 B7R0.4 OC(=O)\C=C\CCBr Amb25702661 [0,1,0,0,0,0|0,0,2]=3 2134 B7R0.4 OCC#CCC(O)=O Amb24395623 [0,1,0,0,0,0|0,0,2]=3 2135 B7R0.4 OCCC#CC(O)=O Amb25844914 [0,1,0,0,0,0|0,0,2]=3 2136 B7R0.4 OCCCCB(O)O Amb25351122 [0,1,0,0,0,0|1,0,1]=3 2137 B7R0.4 OCCCCC(=O)C Amb10603864 [0,1,0,0,0,0|1,0,0]=2 2138 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [0,1,0,0,0,0|0,0,1]=2 2139 B7R0.4 OCCCCC(N)C Amb17569907 [0,1,0,0,0,0|2,0,1]=4 2140 B7R0.4 OCCCCC(O)=O Amb22351244 [0,1,0,0,0,0|0,0,0]=1 2141 B7R0.4 OCCCCC(O)O Amb25204642 [0,1,0,0,0,0|0,0,2]=3 2142 B7R0.4 OCCCCN(Cl)Cl Amb25071515 [0,1,0,0,0,0|3,0,0]=4 2143 B7R0.4 OCCCC[C@H](O)C Amb10605245 [0,1,0,0,0,0|1,0,1]=3 2144 B7R0.4 OCCCOP(=O)S Amb24641084 [0,1,0,0,0,0|2,1,0]=4 2145 B7R0.4 OCCCOP(O)O Amb24643367 [0,1,0,0,0,0|2,0,1]=4 2146 B7R0.4 OCCOCC(O)O Amb24412995 [0,1,0,0,0,0|1,0,2]=4 2147 B7R0.4 OCCSCC(=O)O Amb1110090 [0,1,0,0,0,0|1,0,0]=2 2148 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [0,1,0,0,0,0|0,0,2]=3 2149 B7R0.4 OP(=O)OCCCCl Amb24562481 [0,1,0,0,0,0|2,0,0]=3 2150 B7R0.4 SCCCCC(=O)O Amb17503767 [0,1,0,0,0,0|0,0,0]=1 2151 B7R0.4 [N-]=[N+]=NCCC(O)=O Amb20622326 [0,1,0,0,0,0|2,0,0]=3 2152 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [0,1,0,0,0,0|0,0,1]=2 2153 B7R0.4 [O-][N+](=O)CCCCO Amb25739830 [0,1,0,0,0,0|1,0,1]=3 2154 B7R0.4 [O-][N+](=O)NCCCC Amb10552431 [0,1,0,0,0,0|1,0,1]=3 2155 B7R0.4 [O-][N+](=O)OCCCBr Amb21953589 [0,1,0,0,0,0|2,0,1]=4 2156 B7R0.4 [O-][N+](=O)OCCCC Amb17610378 [0,1,0,0,0,0|1,0,1]=3 2157 B7R0.4 [S-]C(=S)OCCCC Amb16186572 [0,1,0,0,0,0|0,2,0]=3 2158 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [0,1,0,0,0,0|1,0,2]=4 2159 B7R0.5 C#CCC(N)C(O)=O Amb19944472 [0,1,0,0,0,0|0,0,2]=3 2160 B7R0.5 C#CC[C@@H](N)C(O)=O Amb22748688 [0,1,0,0,0,0|0,0,2]=3 2161 B7R0.5 C#CC[C@@H](O)C(O)=O Amb25189884 [0,1,0,0,0,0|0,0,2]=3 2162 B7R0.5 C=C(CC=C)C(O)=O Amb18641687 [0,1,0,0,0,0|0,0,3]=4 2163 B7R0.5 C=C(CCBr)C(N)=O Amb24483117 [0,1,0,0,0,0|2,0,1]=4 2164 B7R0.5 C=C(CCCl)C(N)=O Amb24586928 [0,1,0,0,0,0|2,0,1]=4 2165 B7R0.5 C=C(CCO)C(N)=O Amb24548208 [0,1,0,0,0,0|2,0,1]=4 2166 B7R0.5 C=C(CON)C(O)=O Amb25778441 [0,1,0,0,0,0|2,0,1]=4 2167 B7R0.5 C=C(Cl)C(Cl)CCO Amb24710236 [0,1,0,0,0,0|3,0,0]=4 2168 B7R0.5 C=CCC(Br)C(=O)Cl Amb25690180 [0,1,0,0,0,0|1,0,2]=4 2169 B7R0.5 C=CCC(Br)C(O)=O Amb18648213 [0,1,0,0,0,0|0,0,2]=3 2170 B7R0.5 C=CCC(Cl)C(O)=O Amb25056173 [0,1,0,0,0,0|0,0,2]=3 2171 B7R0.5 C=CCC(N)C(O)=O Amb21856826 [0,1,0,0,0,0|0,0,2]=3 2172 B7R0.5 C=CCC(N)P(O)=O Amb24377187 [0,1,0,0,0,0|1,0,2]=4 2173 B7R0.5 C=CCC(O)C(=C)O Amb25072081 [0,1,0,0,0,0|1,0,2]=4 2174 B7R0.5 C=CC[C@@H](F)C(O)=O Amb24481338 [0,1,0,0,0,0|0,0,2]=3 2175 B7R0.5 C=CC[C@@H](N)C(O)=O Amb22745310 [0,1,0,0,0,0|0,0,2]=3 2176 B7R0.5 C=CC[C@@H](O)C(O)=O Amb24548731 [0,1,0,0,0,0|0,0,2]=3 2177 B7R0.5 CC#CC(C)C(C)=O Amb24481199 [0,1,0,0,0,0|1,0,2]=4 2178 B7R0.5 CC#CC(C)C(O)=O Amb22748425 [0,1,0,0,0,0|0,0,2]=3 2179 B7R0.5 CC(=C)C(F)CCO Amb25189994 [0,1,0,0,0,0|3,0,0]=4 2180 B7R0.5 CC(=C)C(O)CCCl Amb25746696 [0,1,0,0,0,0|3,0,0]=4 2181 B7R0.5 CC(=C)C(O)CCO Amb25781203 [0,1,0,0,0,0|3,0,0]=4 2182 B7R0.5 CC(=C=CC)C(O)=O Amb24481354 [0,1,0,0,0,0|0,0,3]=4 2183 B7R0.5 CC(=CCBr)C(O)=O Amb24551921 [0,1,0,0,0,0|1,0,2]=4 2184 B7R0.5 CC(=CCCl)C(O)=O Amb25114258 [0,1,0,0,0,0|1,0,2]=4 2185 B7R0.5 CC(=CCN)C(O)=O Amb25845292 [0,1,0,0,0,0|1,0,2]=4 2186 B7R0.5 CC(=CCO)C(O)=O Amb24730294 [0,1,0,0,0,0|1,0,2]=4 2187 B7R0.5 CC(=O)C(=C)CCO Amb25831249 [0,1,0,0,0,0|2,0,1]=4 2188 B7R0.5 CC(=O)C(=C)COC Amb25796652 [0,1,0,0,0,0|2,0,1]=4 2189 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,1,0,0,0,0|2,0,1]=4 2190 B7R0.5 CC(=O)C(=O)COC Amb24694271 [0,1,0,0,0,0|2,0,1]=4 2191 B7R0.5 CC(=O)C(=O)CSC Amb24623163 [0,1,0,0,0,0|2,0,1]=4 2192 B7R0.5 CC(=O)C(Cl)CC#N Amb18124339 [0,1,0,0,0,0|2,0,1]=4 2193 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [0,1,0,0,0,0|2,0,1]=4 2194 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [0,1,0,0,0,0|2,0,0]=3 2195 B7R0.5 CC(=O)C(F)CC=C Amb19889753 [0,1,0,0,0,0|1,0,2]=4 2196 B7R0.5 CC(=O)C(N)CCO Amb25087112 [0,1,0,0,0,0|2,0,0]=3 2197 B7R0.5 CC(=O)C(O)CC#N Amb24463934 [0,1,0,0,0,0|2,0,1]=4 2198 B7R0.5 CC(=O)C(O)CCS Amb24516694 [0,1,0,0,0,0|2,0,0]=3 2199 B7R0.5 CC(=O)C(S)CCO Amb25831127 [0,1,0,0,0,0|2,0,0]=3 2200 B7R0.5 CC(=O)N(Br)CCN Amb24424501 [0,1,0,0,0,0|3,0,0]=4 2201 B7R0.5 CC(=O)N(C)CCS Amb25335665 [0,1,0,0,0,0|3,0,0]=4 2202 B7R0.5 CC(=O)N(N)CCO Amb18641953 [0,1,0,0,0,0|3,0,0]=4 2203 B7R0.5 CC(=O)[C@@H](O)CC=O Amb25839860 [0,1,0,0,0,0|2,0,1]=4 2204 B7R0.5 CC(=O)[C@H](O)CC=C Amb24662420 [0,1,0,0,0,0|1,0,2]=4 2205 B7R0.5 CC(=O)\C(\Br)=C\CC Amb25205445 [0,1,0,0,0,0|1,0,2]=4 2206 B7R0.5 CC(=O)\C(\F)=C/CC Amb24565632 [0,1,0,0,0,0|1,0,2]=4 2207 B7R0.5 CC(Br)C(Br)CCC Amb22732685 [0,1,0,0,0,0|2,0,1]=4 2208 B7R0.5 CC(Br)C(F)CCC Amb24738916 [0,1,0,0,0,0|2,0,1]=4 2209 B7R0.5 CC(C(=O)C)CCO Amb13881368 [0,1,0,0,0,0|2,0,0]=3 2210 B7R0.5 CC(C(=O)O)CC#N Amb17334056 [0,1,0,0,0,0|1,0,1]=3 2211 B7R0.5 CC(C(=O)O)CNC Amb13952364 [0,1,0,0,0,0|1,0,0]=2 2212 B7R0.5 CC(C(=S)N)CNC Amb17231885 [0,1,0,0,0,0|2,1,0]=4 2213 B7R0.5 CC(C)C(Br)CCC Amb18184742 [0,1,0,0,0,0|2,0,1]=4 2214 B7R0.5 CC(C)[C@@H](O)CCC Amb25043106 [0,1,0,0,0,0|2,0,1]=4 2215 B7R0.5 CC(C)[C@H](O)CCC Amb25693041 [0,1,0,0,0,0|2,0,1]=4 2216 B7R0.5 CC(C=NO)C(O)=O Amb24616398 [0,1,0,0,0,0|2,0,1]=4 2217 B7R0.5 CC(CC#C)C(O)=O Amb18633959 [0,1,0,0,0,0|0,0,2]=3 2218 B7R0.5 CC(CC=C)C(=O)Cl Amb25702960 [0,1,0,0,0,0|1,0,2]=4 2219 B7R0.5 CC(CC=C)C(C)=O Amb19373098 [0,1,0,0,0,0|1,0,2]=4 2220 B7R0.5 CC(CC=O)C(C)=O Amb18641772 [0,1,0,0,0,0|2,0,1]=4 2221 B7R0.5 CC(CCBr)C(=O)Cl Amb25798925 [0,1,0,0,0,0|2,0,0]=3 2222 B7R0.5 CC(CCC)C(O)O Amb25380752 [0,1,0,0,0,0|0,0,2]=3 2223 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [0,1,0,0,0,0|2,0,0]=3 2224 B7R0.5 CC(CCCl)C(=O)F Amb25839945 [0,1,0,0,0,0|2,0,0]=3 2225 B7R0.5 CC(CCCl)C(C)=C Amb25757706 [0,1,0,0,0,0|3,0,0]=4 2226 B7R0.5 CC(CCF)C(O)=O Amb24678386 [0,1,0,0,0,0|1,0,0]=2 2227 B7R0.5 CC(CCN)C(C)=O Amb18251071 [0,1,0,0,0,0|2,0,0]=3 2228 B7R0.5 CC(CCN)C(N)=O Amb18641900 [0,1,0,0,0,0|2,0,0]=3 2229 B7R0.5 CC(CCN)C(O)=O Amb20667970 [0,1,0,0,0,0|1,0,0]=2 2230 B7R0.5 CC(CCN)P(O)O Amb24426881 [0,1,0,0,0,0|2,0,1]=4 2231 B7R0.5 CC(CCN)S(C)=O Amb20668090 [0,1,0,0,0,0|3,0,0]=4 2232 B7R0.5 CC(CCO)C(N)=N Amb24615954 [0,1,0,0,0,0|3,0,0]=4 2233 B7R0.5 CC(CCO)C(O)=O Amb18641949 [0,1,0,0,0,0|1,0,0]=2 2234 B7R0.5 CC(CCS)C(O)=O Amb25133689 [0,1,0,0,0,0|1,0,0]=2 2235 B7R0.5 CC(CNC)C(C)O Amb25809434 [0,1,0,0,0,0|2,0,1]=4 2236 B7R0.5 CC(COC)C(C)O Amb24746662 [0,1,0,0,0,0|2,0,1]=4 2237 B7R0.5 CC(F)C(Br)CCC Amb24608180 [0,1,0,0,0,0|2,0,1]=4 2238 B7R0.5 CC(O)C(C)CCN Amb18202662 [0,1,0,0,0,0|2,0,1]=4 2239 B7R0.5 CC(O)C(Cl)CCC Amb25700952 [0,1,0,0,0,0|1,0,1]=3 2240 B7R0.5 CC(O)C(N)CCC Amb24656798 [0,1,0,0,0,0|1,0,1]=3 2241 B7R0.5 CC(O)C(N)COC Amb18124266 [0,1,0,0,0,0|2,0,1]=4 2242 B7R0.5 CC(O)C(O)CCO Amb25851421 [0,1,0,0,0,0|2,0,1]=4 2243 B7R0.5 CC(O)C(O)COC Amb24414234 [0,1,0,0,0,0|2,0,1]=4 2244 B7R0.5 CC(O)C(O)OCC Amb25746147 [0,1,0,0,0,0|2,0,1]=4 2245 B7R0.5 CC(O)[C@@H](C)CCO Amb24431016 [0,1,0,0,0,0|2,0,1]=4 2246 B7R0.5 CC(SC#N)C(O)=O Amb24372688 [0,1,0,0,0,0|2,0,1]=4 2247 B7R0.5 CC(SCC)C(C)O Amb25741148 [0,1,0,0,0,0|2,0,1]=4 2248 B7R0.5 CCCC(=C(F)F)F Amb10838535 [0,1,0,0,0,0|2,0,1]=4 2249 B7R0.5 CCCC(=C)C(=O)Cl Amb25081936 [0,1,0,0,0,0|1,0,1]=3 2250 B7R0.5 CCCC(=C)C(C)O Amb25169348 [0,1,0,0,0,0|1,0,2]=4 2251 B7R0.5 CCCC(=C)C(N)=O Amb25189878 [0,1,0,0,0,0|1,0,1]=3 2252 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [0,1,0,0,0,0|0,0,1]=2 2253 B7R0.5 CCCC(=O)C(=O)Cl Amb24690783 [0,1,0,0,0,0|1,0,1]=3 2254 B7R0.5 CCCC(=O)C(C)O Amb24481443 [0,1,0,0,0,0|1,0,2]=4 2255 B7R0.5 CCCC(=O)C(N)=N Amb24670027 [0,1,0,0,0,0|2,0,1]=4 2256 B7R0.5 CCCC(=O)C(N)=O Amb24473081 [0,1,0,0,0,0|1,0,1]=3 2257 B7R0.5 CCCC(=O)C(N)=S Amb24562225 [0,1,0,0,0,0|1,1,1]=4 2258 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [0,1,0,0,0,0|0,0,1]=2 2259 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [0,1,0,0,0,0|0,0,1]=2 2260 B7R0.5 CCCC(=O)[C@@H](C)O Amb24582982 [0,1,0,0,0,0|1,0,2]=4 2261 B7R0.5 CCCC(=O)[C@H](C)O Amb24546365 [0,1,0,0,0,0|1,0,2]=4 2262 B7R0.5 CCCC(Br)C(=O)Br Amb24369503 [0,1,0,0,0,0|1,0,0]=2 2263 B7R0.5 CCCC(Br)C(N)=S Amb25805593 [0,1,0,0,0,0|1,1,0]=3 2264 B7R0.5 CCCC(Br)[N+]([O-])=O Amb17949822 [0,1,0,0,0,0|1,0,1]=3 2265 B7R0.5 CCCC(C(=O)Cl)Br Amb17569837 [0,1,0,0,0,0|1,0,0]=2 2266 B7R0.5 CCCC(C(=O)O)Cl Amb17593470 [0,1,0,0,0,0|0,0,0]=1 2267 B7R0.5 CCCC(C(=O)O)O Amb2582532 [0,1,0,0,0,0|0,0,0]=1 2268 B7R0.5 CCCC(C)C(C)=C Amb22730210 [0,1,0,0,0,0|2,0,0]=3 2269 B7R0.5 CCCC(C)C(C)Br Amb18184253 [0,1,0,0,0,0|2,0,1]=4 2270 B7R0.5 CCCC(C)C(C)Cl Amb25074279 [0,1,0,0,0,0|2,0,1]=4 2271 B7R0.5 CCCC(C)C(C)N Amb18289572 [0,1,0,0,0,0|2,0,1]=4 2272 B7R0.5 CCCC(C)C(N)=S Amb25138492 [0,1,0,0,0,0|1,1,0]=3 2273 B7R0.5 CCCC(C)N(C)C Amb25761134 [0,1,0,0,0,0|3,0,0]=4 2274 B7R0.5 CCCC(C)N(C)N Amb24732766 [0,1,0,0,0,0|3,0,0]=4 2275 B7R0.5 CCCC(C)[N+]([O-])=O Amb17940330 [0,1,0,0,0,0|1,0,1]=3 2276 B7R0.5 CCCC(Cl)C(Cl)Cl Amb25321940 [0,1,0,0,0,0|2,0,1]=4 2277 B7R0.5 CCCC(Cl)C(N)=O Amb25024550 [0,1,0,0,0,0|1,0,0]=2 2278 B7R0.5 CCCC(Cl)S(C)=O Amb25101399 [0,1,0,0,0,0|2,0,0]=3 2279 B7R0.5 CCCC(Cl)[SiH](Cl)Cl Amb25701542 [0,1,0,0,0,0|2,1,0]=4 2280 B7R0.5 CCCC(F)C(O)=O Amb25842008 [0,1,0,0,0,0|0,0,0]=1 2281 B7R0.5 CCCC(N)C(=O)S Amb25378817 [0,1,0,0,0,0|0,1,0]=2 2282 B7R0.5 CCCC(N)C(C)=C Amb24643425 [0,1,0,0,0,0|2,0,0]=3 2283 B7R0.5 CCCC(N)C(F)F Amb25355340 [0,1,0,0,0,0|2,0,1]=4 2284 B7R0.5 CCCC(N)C(N)=O Amb22284825 [0,1,0,0,0,0|1,0,0]=2 2285 B7R0.5 CCCC(N)P(O)O Amb24401110 [0,1,0,0,0,0|1,0,1]=3 2286 B7R0.5 CCCC(O)C(=C)Cl Amb25346262 [0,1,0,0,0,0|2,0,0]=3 2287 B7R0.5 CCCC(O)C(C)=C Amb25141736 [0,1,0,0,0,0|2,0,0]=3 2288 B7R0.5 CCCC(O)C(C)=O Amb22495823 [0,1,0,0,0,0|1,0,0]=2 2289 B7R0.5 CCCC(O)C(F)F Amb25266847 [0,1,0,0,0,0|2,0,1]=4 2290 B7R0.5 CCCC(O)C(N)=O Amb24116553 [0,1,0,0,0,0|1,0,0]=2 2291 B7R0.5 CCCC(O)C([O-])=O Amb22731263 [0,1,0,0,0,0|0,0,1]=2 2292 B7R0.5 CCCC(O)N(F)F Amb25169525 [0,1,0,0,0,0|3,0,0]=4 2293 B7R0.5 CCCC(O)P(O)=O Amb25143218 [0,1,0,0,0,0|1,0,0]=2 2294 B7R0.5 CCCC(S)C(C)=O Amb24689502 [0,1,0,0,0,0|1,0,0]=2 2295 B7R0.5 CCCC(S)C(O)=O Amb18124440 [0,1,0,0,0,0|0,0,0]=1 2296 B7R0.5 CCCN(C)C(C)=N Amb25235167 [0,1,0,0,0,0|3,0,0]=4 2297 B7R0.5 CCCN(C)C(C)=O Amb24451102 [0,1,0,0,0,0|2,0,0]=3 2298 B7R0.5 CCCN(N)C(N)=S Amb25321701 [0,1,0,0,0,0|2,1,0]=4 2299 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [0,1,0,0,0,0|1,0,0]=2 2300 B7R0.5 CCC[C@@H](C)C(N)=O Amb25257881 [0,1,0,0,0,0|1,0,0]=2 2301 B7R0.5 CCC[C@@H](C)[C@@H](C)N Amb25843225 [0,1,0,0,0,0|2,0,1]=4 2302 B7R0.5 CCC[C@@H](C)[C@H](C)N Amb24392737 [0,1,0,0,0,0|2,0,1]=4 2303 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [0,1,0,0,0,0|1,0,0]=2 2304 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [0,1,0,0,0,0|1,0,0]=2 2305 B7R0.5 CCC[C@@H](O)C(C)=O Amb24432580 [0,1,0,0,0,0|1,0,0]=2 2306 B7R0.5 CCC[C@@H](O)C(O)=O Amb22746731 [0,1,0,0,0,0|0,0,0]=1 2307 B7R0.5 CCC[C@H](C)C(C)O Amb25662135 [0,1,0,0,0,0|1,0,1]=3 2308 B7R0.5 CCC[C@H](C)C(N)=O Amb25305606 [0,1,0,0,0,0|1,0,0]=2 2309 B7R0.5 CCC[C@H](C)[C@H](C)N Amb24460677 [0,1,0,0,0,0|2,0,1]=4 2310 B7R0.5 CCC[C@H](F)C(O)=O Amb24657412 [0,1,0,0,0,0|0,0,0]=1 2311 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [0,1,0,0,0,0|1,0,0]=2 2312 B7R0.5 CCC[C@H](O)C(N)=O Amb25082239 [0,1,0,0,0,0|1,0,0]=2 2313 B7R0.5 CCC[C@H](O)C(O)=O Amb22226514 [0,1,0,0,0,0|0,0,0]=1 2314 B7R0.5 CCNC(=N)C(O)=O Amb18641879 [0,1,0,0,0,0|1,0,1]=3 2315 B7R0.5 CCNC(=O)C(=O)C Amb17399798 [0,1,0,0,0,0|2,0,1]=4 2316 B7R0.5 CCNC(C)C(N)=O Amb21959648 [0,1,0,0,0,0|2,0,0]=3 2317 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [0,1,0,0,0,0|1,0,0]=2 2318 B7R0.5 CCOC(=C)C(O)=O Amb18641872 [0,1,0,0,0,0|1,0,1]=3 2319 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,1,0,0,0,0|1,0,1]=3 2320 B7R0.5 CCOC(=S)C(=O)N Amb10604171 [0,1,0,0,0,0|2,0,1]=4 2321 B7R0.5 CCOC(C)C(N)=N Amb19375380 [0,1,0,0,0,0|3,0,0]=4 2322 B7R0.5 CCOC(C)C(N)=N Amb22059005 [0,1,0,0,0,0|3,0,0]=4 2323 B7R0.5 CCOC(C)C(N)=O Amb19960053 [0,1,0,0,0,0|2,0,0]=3 2324 B7R0.5 CCOC(C)C(N)=S Amb19148903 [0,1,0,0,0,0|2,1,0]=4 2325 B7R0.5 CCOC(Cl)C(=C)Cl Amb24571722 [0,1,0,0,0,0|3,0,0]=4 2326 B7R0.5 CCOC(O)C(C)=O Amb25189063 [0,1,0,0,0,0|2,0,0]=3 2327 B7R0.5 CCOC(O)C(O)=O Amb24680848 [0,1,0,0,0,0|1,0,0]=2 2328 B7R0.5 CCON(C)C(C)=O Amb25296888 [0,1,0,0,0,0|3,0,0]=4 2329 B7R0.5 CCON(Cl)C(N)=O Amb25338679 [0,1,0,0,0,0|3,0,0]=4 2330 B7R0.5 CCO[13C](=O)C(C)=O Amb22056123 [0,1,0,0,0,0|2,0,1]=4 2331 B7R0.5 CCO[C@@H](O)C(C)=O Amb25092956 [0,1,0,0,0,0|2,0,0]=3 2332 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [0,1,0,0,0,0|1,0,0]=2 2333 B7R0.5 CCSC(=O)C(N)=O Amb25081710 [0,1,0,0,0,0|2,0,1]=4 2334 B7R0.5 CCSC(=S)C(N)=O Amb25109531 [0,1,0,0,0,0|2,0,1]=4 2335 B7R0.5 CCSC(=S)C(O)=O Amb25210892 [0,1,0,0,0,0|1,0,1]=3 2336 B7R0.5 CCSC(C)C(N)=N Amb22059006 [0,1,0,0,0,0|3,0,0]=4 2337 B7R0.5 CCSC(C)C(N)=S Amb24468518 [0,1,0,0,0,0|2,1,0]=4 2338 B7R0.5 CCSC(O)C(O)=O Amb24444218 [0,1,0,0,0,0|1,0,0]=2 2339 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [0,1,0,0,0,0|1,0,0]=2 2340 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [0,1,0,0,0,0|1,0,0]=2 2341 B7R0.5 CC\C=C(/N)\C(N)=O Amb25858729 [0,1,0,0,0,0|1,0,2]=4 2342 B7R0.5 CC\C=C(\Br)/C(O)=O Amb18125610 [0,1,0,0,0,0|0,0,2]=3 2343 B7R0.5 CC\C=C(\F)/C(O)=O Amb25326985 [0,1,0,0,0,0|0,0,2]=3 2344 B7R0.5 CC\C=C(\N)/C(N)=O Amb24515060 [0,1,0,0,0,0|1,0,2]=4 2345 B7R0.5 CC\C=C(\N)/C(O)=O Amb24349496 [0,1,0,0,0,0|0,0,2]=3 2346 B7R0.5 CC\C=C(\S)/C(N)=O Amb25265251 [0,1,0,0,0,0|1,0,2]=4 2347 B7R0.5 CN(C(=O)C)CCN Amb17046786 [0,1,0,0,0,0|3,0,0]=4 2348 B7R0.5 CN(CCCl)C(=O)Cl Amb25285023 [0,1,0,0,0,0|3,0,0]=4 2349 B7R0.5 CN(CCN)C(N)=O Amb18953297 [0,1,0,0,0,0|3,0,0]=4 2350 B7R0.5 CNCC(=C)C(O)=O Amb24561619 [0,1,0,0,0,0|1,0,1]=3 2351 B7R0.5 CNCC(C(=O)O)N Amb10071505 [0,1,0,0,0,0|1,0,0]=2 2352 B7R0.5 CNCC(C(=O)O)N Amb10845350 [0,1,0,0,0,0|1,0,0]=2 2353 B7R0.5 CNCC(C)C(C)=O Amb25340555 [0,1,0,0,0,0|2,0,0]=3 2354 B7R0.5 CNCC(F)C(O)=O Amb24666017 [0,1,0,0,0,0|1,0,0]=2 2355 B7R0.5 CNCC(N)C(N)=O Amb25316352 [0,1,0,0,0,0|2,0,0]=3 2356 B7R0.5 CNCC(O)C(C)=C Amb24716760 [0,1,0,0,0,0|3,0,0]=4 2357 B7R0.5 CNC[C@@H](C(=O)O)N Amb17617148 [0,1,0,0,0,0|1,0,0]=2 2358 B7R0.5 CNC[C@@H](N)C(O)=O Amb19133072 [0,1,0,0,0,0|1,0,0]=2 2359 B7R0.5 CNC[C@@H](N)C(O)=O Amb22746009 [0,1,0,0,0,0|1,0,0]=2 2360 B7R0.5 CNC[C@@H](N)C(O)=O Amb22748835 [0,1,0,0,0,0|1,0,0]=2 2361 B7R0.5 CNC[C@H](N)C(O)=O Amb19892230 [0,1,0,0,0,0|1,0,0]=2 2362 B7R0.5 CNC[C@H](O)C(O)=O Amb25689188 [0,1,0,0,0,0|1,0,0]=2 2363 B7R0.5 CNN=C(N)C(O)=O Amb25684306 [0,1,0,0,0,0|2,0,1]=4 2364 B7R0.5 CNNC(C)C(O)=O Amb24070183 [0,1,0,0,0,0|2,0,0]=3 2365 B7R0.5 COCC(=C)C(N)=O Amb24668981 [0,1,0,0,0,0|2,0,1]=4 2366 B7R0.5 COCC(=O)C(O)=O Amb25304863 [0,1,0,0,0,0|1,0,1]=3 2367 B7R0.5 COCC(Br)C(C)=O Amb24483184 [0,1,0,0,0,0|2,0,0]=3 2368 B7R0.5 COCC(Br)C(N)=O Amb24740751 [0,1,0,0,0,0|2,0,0]=3 2369 B7R0.5 COCC(C(=O)O)Br Amb17594709 [0,1,0,0,0,0|1,0,0]=2 2370 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [0,1,0,0,0,0|1,0,0]=2 2371 B7R0.5 COCC(C)B(O)O Amb24561016 [0,1,0,0,0,0|2,0,1]=4 2372 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,1,0,0,0,0|2,0,0]=3 2373 B7R0.5 COCC(C)S(O)=O Amb25280974 [0,1,0,0,0,0|2,0,0]=3 2374 B7R0.5 COCC(C)S([O-])=O Amb24481940 [0,1,0,0,0,0|2,0,1]=4 2375 B7R0.5 COCC(Cl)C(C)=O Amb25073897 [0,1,0,0,0,0|2,0,0]=3 2376 B7R0.5 COCC(Cl)C(N)=N Amb22493750 [0,1,0,0,0,0|3,0,0]=4 2377 B7R0.5 COCC(Cl)C(N)=N Amb25269639 [0,1,0,0,0,0|3,0,0]=4 2378 B7R0.5 COCC(F)C(O)=O Amb24526772 [0,1,0,0,0,0|1,0,0]=2 2379 B7R0.5 COCC(N)C(N)=O Amb18984372 [0,1,0,0,0,0|2,0,0]=3 2380 B7R0.5 COCC(O)C(=C)Cl Amb25662110 [0,1,0,0,0,0|3,0,0]=4 2381 B7R0.5 COCC(O)C(C)=O Amb25072841 [0,1,0,0,0,0|2,0,0]=3 2382 B7R0.5 COCC(O)C(O)=O Amb18124273 [0,1,0,0,0,0|1,0,0]=2 2383 B7R0.5 COC[C@@H](N)C(N)=O Amb25211762 [0,1,0,0,0,0|2,0,0]=3 2384 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [0,1,0,0,0,0|1,0,0]=2 2385 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [0,1,0,0,0,0|1,0,0]=2 2386 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [0,1,0,0,0,0|1,0,0]=2 2387 B7R0.5 CONC(=O)C(O)=O Amb25340523 [0,1,0,0,0,0|2,0,1]=4 2388 B7R0.5 CO\C=C(\Cl)/C(O)=O Amb24385677 [0,1,0,0,0,0|1,0,2]=4 2389 B7R0.5 CO\C=C(\F)/C(O)=O Amb22641708 [0,1,0,0,0,0|1,0,2]=4 2390 B7R0.5 CSCC(C)C(=O)Cl Amb20247150 [0,1,0,0,0,0|2,0,0]=3 2391 B7R0.5 CSCC(C)C(C)=O Amb25268934 [0,1,0,0,0,0|2,0,0]=3 2392 B7R0.5 CSCC(C)C(N)=O Amb24475326 [0,1,0,0,0,0|2,0,0]=3 2393 B7R0.5 CSCC(C)C(O)=O Amb18967825 [0,1,0,0,0,0|1,0,0]=2 2394 B7R0.5 CSCC(Cl)C(=C)Cl Amb25168947 [0,1,0,0,0,0|3,0,0]=4 2395 B7R0.5 CSCC(Cl)C(C)=C Amb25123921 [0,1,0,0,0,0|3,0,0]=4 2396 B7R0.5 CSCC(N)C(C)=C Amb25142968 [0,1,0,0,0,0|3,0,0]=4 2397 B7R0.5 CSCC(N)C(N)=O Amb18294390 [0,1,0,0,0,0|2,0,0]=3 2398 B7R0.5 CSCC(O)C(O)=O Amb25131873 [0,1,0,0,0,0|1,0,0]=2 2399 B7R0.5 CSC[C@H](O)C(O)=O Amb24435256 [0,1,0,0,0,0|1,0,0]=2 2400 B7R0.5 CSSC(C)C(O)=O Amb25701741 [0,1,0,0,0,0|2,0,0]=3 2401 B7R0.5 C[C@@H](C(=O)O)CC#C Amb10844029 [0,1,0,0,0,0|0,0,2]=3 2402 B7R0.5 C[C@@H](C(=O)O)CC=C Amb10844040 [0,1,0,0,0,0|0,0,2]=3 2403 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [0,1,0,0,0,0|0,0,0]=1 2404 B7R0.5 C[C@@H](CC=C)C(N)=O Amb25232867 [0,1,0,0,0,0|1,0,2]=4 2405 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [0,1,0,0,0,0|1,0,0]=2 2406 B7R0.5 C[C@@H](NC=O)C(O)=O Amb22746684 [0,1,0,0,0,0|2,0,1]=4 2407 B7R0.5 C[C@@H](NON)C(O)=O Amb24409085 [0,1,0,0,0,0|3,0,0]=4 2408 B7R0.5 C[C@@H](O)[C@@H](C)CCO Amb24475865 [0,1,0,0,0,0|2,0,1]=4 2409 B7R0.5 C[C@@H](O)[C@@H](O)CCC Amb25686304 [0,1,0,0,0,0|1,0,1]=3 2410 B7R0.5 C[C@@H](O)[C@H](C)CCO Amb25206314 [0,1,0,0,0,0|2,0,1]=4 2411 B7R0.5 C[C@@H](O)[C@H](N)CCC Amb25328641 [0,1,0,0,0,0|1,0,1]=3 2412 B7R0.5 C[C@@H](O)[C@H](N)COC Amb25304782 [0,1,0,0,0,0|2,0,1]=4 2413 B7R0.5 C[C@H](C(=O)O)CC#C Amb10844036 [0,1,0,0,0,0|0,0,2]=3 2414 B7R0.5 C[C@H](C(=O)O)CC=C Amb10844033 [0,1,0,0,0,0|0,0,2]=3 2415 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [0,1,0,0,0,0|0,0,0]=1 2416 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [0,1,0,0,0,0|1,0,0]=2 2417 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [0,1,0,0,0,0|1,0,0]=2 2418 B7R0.5 C[C@H](CC#N)C(O)=O Amb24725603 [0,1,0,0,0,0|1,0,1]=3 2419 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [0,1,0,0,0,0|1,0,0]=2 2420 B7R0.5 C[C@H](N=[N+]=[N-])C(O)=O Amb25274282 [0,1,0,0,0,0|3,0,0]=4 2421 B7R0.5 C[C@H](NCC)[C@@H](C)O Amb25805873 [0,1,0,0,0,0|2,0,1]=4 2422 B7R0.5 C[C@H](NCC)[C@H](C)O Amb24559757 [0,1,0,0,0,0|2,0,1]=4 2423 B7R0.5 C[C@H](NCO)C(O)=O Amb24401217 [0,1,0,0,0,0|2,0,0]=3 2424 B7R0.5 C[C@H](O)[C@@H](Cl)CCC Amb25111275 [0,1,0,0,0,0|1,0,1]=3 2425 B7R0.5 C[C@H](O)[C@@H](N)COC Amb25169361 [0,1,0,0,0,0|2,0,1]=4 2426 B7R0.5 C[C@H](O)[C@H](C)CCO Amb25143027 [0,1,0,0,0,0|2,0,1]=4 2427 B7R0.5 C[C@H](O)[C@H](N)CCC Amb24604367 [0,1,0,0,0,0|1,0,1]=3 2428 B7R0.5 C[C@H](O)[C@H](O)CCC Amb24671438 [0,1,0,0,0,0|1,0,1]=3 2429 B7R0.5 C[C@H](SC#N)C(O)=O Amb24333429 [0,1,0,0,0,0|2,0,1]=4 2430 B7R0.5 C[Se]CC(=O)C(=O)O Amb17617778 [0,1,0,0,0,0|1,0,1]=3 2431 B7R0.5 C[Se]C[C@@H](C(=O)O)N Amb10601626 [0,1,0,0,0,0|1,0,0]=2 2432 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22350259 [0,1,0,0,0,0|1,0,0]=2 2433 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22745692 [0,1,0,0,0,0|1,0,0]=2 2434 B7R0.5 C\C(=C/CBr)\C(O)=O Amb24433947 [0,1,0,0,0,0|1,0,2]=4 2435 B7R0.5 C\C(=C/CC)\C(C)=O Amb25067970 [0,1,0,0,0,0|1,0,2]=4 2436 B7R0.5 C\C(=C/CCl)\C(O)=O Amb25844891 [0,1,0,0,0,0|1,0,2]=4 2437 B7R0.5 C\C(=C/CO)\C(O)=O Amb18641873 [0,1,0,0,0,0|1,0,2]=4 2438 B7R0.5 C\C(=C/OC)\C(O)=O Amb18641867 [0,1,0,0,0,0|1,0,2]=4 2439 B7R0.5 C\C(=C\CC)\C(C)=O Amb24575271 [0,1,0,0,0,0|1,0,2]=4 2440 B7R0.5 C\C(=C\CC)\C(N)=O Amb24706168 [0,1,0,0,0,0|1,0,2]=4 2441 B7R0.5 C\C=C/C(N)C(N)=O Amb24679364 [0,1,0,0,0,0|1,0,2]=4 2442 B7R0.5 C\C=C/C(O)C(=C)O Amb24437447 [0,1,0,0,0,0|1,0,2]=4 2443 B7R0.5 C\C=C/C(O)C(C)=O Amb24526785 [0,1,0,0,0,0|1,0,2]=4 2444 B7R0.5 C\C=C\C(=O)C(O)=O Amb24568283 [0,1,0,0,0,0|0,0,3]=4 2445 B7R0.5 C\C=C\C(C)C(N)=O Amb25299936 [0,1,0,0,0,0|1,0,2]=4 2446 B7R0.5 C\C=C\C(C)C(O)=O Amb18641786 [0,1,0,0,0,0|0,0,2]=3 2447 B7R0.5 C\C=C\C(N)C(N)=O Amb24515058 [0,1,0,0,0,0|1,0,2]=4 2448 B7R0.5 C\C=C\C(N)C(O)=O Amb24481451 [0,1,0,0,0,0|0,0,2]=3 2449 B7R0.5 C\C=C\C(O)C(O)=O Amb24481382 [0,1,0,0,0,0|0,0,2]=3 2450 B7R0.5 C\C=C\[C@@H](C)C(O)=O Amb25719907 [0,1,0,0,0,0|0,0,2]=3 2451 B7R0.5 C\C=C\[C@H](C)C(O)=O Amb24481336 [0,1,0,0,0,0|0,0,2]=3 2452 B7R0.5 C\C=C\[C@H](O)C(C)=O Amb25287343 [0,1,0,0,0,0|1,0,2]=4 2453 B7R0.5 N#CCC(O)C(O)=O Amb25678609 [0,1,0,0,0,0|1,0,1]=3 2454 B7R0.5 NC(=O)C(Br)CCBr Amb25174083 [0,1,0,0,0,0|2,0,0]=3 2455 B7R0.5 NC(=O)C(O)CCO Amb25703294 [0,1,0,0,0,0|2,0,0]=3 2456 B7R0.5 NC(=O)C(S)CCO Amb24525295 [0,1,0,0,0,0|2,0,0]=3 2457 B7R0.5 NC(=O)N(N)CCO Amb18641972 [0,1,0,0,0,0|3,0,0]=4 2458 B7R0.5 NC(C(=O)O)CCBr Amb10576584 [0,1,0,0,0,0|1,0,0]=2 2459 B7R0.5 NC(CC#N)C(O)=O Amb18641766 [0,1,0,0,0,0|1,0,1]=3 2460 B7R0.5 NC(CCBr)C(O)=O Amb21858417 [0,1,0,0,0,0|1,0,0]=2 2461 B7R0.5 NC(CCF)C(N)=O Amb24391278 [0,1,0,0,0,0|2,0,0]=3 2462 B7R0.5 NC(CCI)C(O)=O Amb25339674 [0,1,0,0,0,0|1,0,0]=2 2463 B7R0.5 NC(CCO)C(N)=O Amb24481392 [0,1,0,0,0,0|2,0,0]=3 2464 B7R0.5 NC(CCS)C(N)=O Amb24599383 [0,1,0,0,0,0|2,0,0]=3 2465 B7R0.5 NC(CCS)C(O)=O Amb19267093 [0,1,0,0,0,0|1,0,0]=2 2466 B7R0.5 NC(CS=O)C(O)=O Amb24557184 [0,1,0,0,0,0|2,0,0]=3 2467 B7R0.5 NC(CSCl)C(O)=O Amb24482298 [0,1,0,0,0,0|2,0,0]=3 2468 B7R0.5 NC(CSO)C(O)=O Amb24746797 [0,1,0,0,0,0|2,0,0]=3 2469 B7R0.5 NC(CSS)C(O)=O Amb24614616 [0,1,0,0,0,0|2,0,0]=3 2470 B7R0.5 NC(O)C(O)CCO Amb24505849 [0,1,0,0,0,0|2,0,1]=4 2471 B7R0.5 NC(\C=C\Cl)C(O)=O Amb24483058 [0,1,0,0,0,0|1,0,2]=4 2472 B7R0.5 NCCC(=O)C(O)=O Amb25724685 [0,1,0,0,0,0|1,0,1]=3 2473 B7R0.5 NCCC(C(=O)O)F Amb10838221 [0,1,0,0,0,0|1,0,0]=2 2474 B7R0.5 NCCC(C(=O)O)O Amb16232090 [0,1,0,0,0,0|1,0,0]=2 2475 B7R0.5 NCCC(Cl)C(O)=O Amb18124502 [0,1,0,0,0,0|1,0,0]=2 2476 B7R0.5 NCCC(F)C(O)=O Amb22229524 [0,1,0,0,0,0|1,0,0]=2 2477 B7R0.5 NCCC(N)C(N)=O Amb24634873 [0,1,0,0,0,0|2,0,0]=3 2478 B7R0.5 NCCC(N)C(O)=O Amb17678762 [0,1,0,0,0,0|1,0,0]=2 2479 B7R0.5 NCCC(N)C(O)=O Amb22348212 [0,1,0,0,0,0|1,0,0]=2 2480 B7R0.5 NCCC(S)C(O)=O Amb25083375 [0,1,0,0,0,0|1,0,0]=2 2481 B7R0.5 NCC[C@@H](Cl)C(O)=O Amb24481492 [0,1,0,0,0,0|1,0,0]=2 2482 B7R0.5 NCC[C@@H](F)C(O)=O Amb24055858 [0,1,0,0,0,0|1,0,0]=2 2483 B7R0.5 NCC[C@@H](N)C(O)=O Amb22750574 [0,1,0,0,0,0|1,0,0]=2 2484 B7R0.5 NCC[C@@H](N)C(O)=O Amb23438994 [0,1,0,0,0,0|1,0,0]=2 2485 B7R0.5 NCC[C@@H](O)C(O)=O Amb22225364 [0,1,0,0,0,0|1,0,0]=2 2486 B7R0.5 NCC[C@@H](O)C(O)=O Amb22748225 [0,1,0,0,0,0|1,0,0]=2 2487 B7R0.5 NCC[C@H](F)C(O)=O Amb24055857 [0,1,0,0,0,0|1,0,0]=2 2488 B7R0.5 NCC[C@H](N)C(O)=O Amb22886961 [0,1,0,0,0,0|1,0,0]=2 2489 B7R0.5 NC\C=C(/Br)\C(O)=O Amb24483175 [0,1,0,0,0,0|1,0,2]=4 2490 B7R0.5 NC\C=C(\Br)/C(O)=O Amb24627030 [0,1,0,0,0,0|1,0,2]=4 2491 B7R0.5 NC\C=C(\Cl)/C(O)=O Amb25231611 [0,1,0,0,0,0|1,0,2]=4 2492 B7R0.5 NOCC(N)C(N)=O Amb24388788 [0,1,0,0,0,0|3,0,0]=4 2493 B7R0.5 NOCC(N)C(O)=O Amb24184086 [0,1,0,0,0,0|2,0,0]=3 2494 B7R0.5 NOC[C@@H](N)C(O)=O Amb25791301 [0,1,0,0,0,0|2,0,0]=3 2495 B7R0.5 NOC[C@H](N)C(O)=O Amb24548229 [0,1,0,0,0,0|2,0,0]=3 2496 B7R0.5 N[C@@H](C(=O)O)CC#C Amb16183954 [0,1,0,0,0,0|0,0,2]=3 2497 B7R0.5 N[C@@H](C(=O)O)CCN Amb16183852 [0,1,0,0,0,0|1,0,0]=2 2498 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [0,1,0,0,0,0|1,0,1]=3 2499 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [0,1,0,0,0,0|1,0,1]=3 2500 B7R0.5 N[C@@H](CCBr)C(O)=O Amb22748283 [0,1,0,0,0,0|1,0,0]=2 2501 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [0,1,0,0,0,0|1,0,0]=2 2502 B7R0.5 N[C@@H](CCS)P(O)=O Amb24594746 [0,1,0,0,0,0|2,0,0]=3 2503 B7R0.5 N[C@@H](CCS)S(O)=O Amb25784628 [0,1,0,0,0,0|2,0,0]=3 2504 B7R0.5 N[C@@H](CNO)C(O)=O Amb24481412 [0,1,0,0,0,0|2,0,0]=3 2505 B7R0.5 N[C@@H](CO[SiH3])C(O)=O Amb24526864 [0,1,0,0,0,0|1,1,0]=3 2506 B7R0.5 N[C@@H](CSCl)C(O)=O Amb25055747 [0,1,0,0,0,0|2,0,0]=3 2507 B7R0.5 N[C@@H](CSO)C(O)=O Amb24481432 [0,1,0,0,0,0|2,0,0]=3 2508 B7R0.5 N[C@H](C(=O)O)CC#N Amb16183916 [0,1,0,0,0,0|1,0,1]=3 2509 B7R0.5 N[C@H](C(=O)O)CC=C Amb10982568 [0,1,0,0,0,0|0,0,2]=3 2510 B7R0.5 N[C@H](C(=O)O)CCN Amb16183862 [0,1,0,0,0,0|1,0,0]=2 2511 B7R0.5 N[C@H](CCS)C(O)=O Amb22230515 [0,1,0,0,0,0|1,0,0]=2 2512 B7R0.5 N[C@H](CNO)C(O)=O Amb24745929 [0,1,0,0,0,0|2,0,0]=3 2513 B7R0.5 N[C@H](\C=C\Cl)C(O)=O Amb25230190 [0,1,0,0,0,0|1,0,2]=4 2514 B7R0.5 O=C(Br)C(Br)CCBr Amb22234970 [0,1,0,0,0,0|2,0,0]=3 2515 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [0,1,0,0,0,0|2,0,0]=3 2516 B7R0.5 O=C(Cl)C(Cl)CCCl Amb24423919 [0,1,0,0,0,0|2,0,0]=3 2517 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [0,1,0,0,0,0|1,0,1]=3 2518 B7R0.5 O=CNC(C(=O)O)C Amb1144629 [0,1,0,0,0,0|2,0,1]=4 2519 B7R0.5 OC(=O)C(=O)CCCl Amb24592167 [0,1,0,0,0,0|1,0,1]=3 2520 B7R0.5 OC(=O)C(=O)CCO Amb25677024 [0,1,0,0,0,0|1,0,1]=3 2521 B7R0.5 OC(=O)C(Br)CCBr Amb19889695 [0,1,0,0,0,0|1,0,0]=2 2522 B7R0.5 OC(=O)C(Br)CCF Amb25073798 [0,1,0,0,0,0|1,0,0]=2 2523 B7R0.5 OC(=O)C(Cl)=CCBr Amb24621021 [0,1,0,0,0,0|1,0,2]=4 2524 B7R0.5 OC(=O)C(Cl)=CCCl Amb25836746 [0,1,0,0,0,0|1,0,2]=4 2525 B7R0.5 OC(=O)C(Cl)CCCl Amb18126030 [0,1,0,0,0,0|1,0,0]=2 2526 B7R0.5 OC(=O)[C@H](S)CCS Amb24483251 [0,1,0,0,0,0|1,0,0]=2 2527 B7R0.5 OC(=O)\C(\Br)=C/CO Amb24692651 [0,1,0,0,0,0|1,0,2]=4 2528 B7R0.5 OC(=O)\C(\Cl)=C/CO Amb24598039 [0,1,0,0,0,0|1,0,2]=4 2529 B7R0.5 OC(=O)\C(\F)=C/CO Amb25737076 [0,1,0,0,0,0|1,0,2]=4 2530 B7R0.5 OC(CC=O)C(O)=O Amb25225249 [0,1,0,0,0,0|1,0,1]=3 2531 B7R0.5 OC(CCS)C(O)=O Amb24586206 [0,1,0,0,0,0|1,0,0]=2 2532 B7R0.5 OC(O)C(O)CCO Amb25806560 [0,1,0,0,0,0|1,0,2]=4 2533 B7R0.5 OCC/C(Br)=C(/O)Br Amb17942926 [0,1,0,0,0,0|2,0,1]=4 2534 B7R0.5 OCCC(O)C(O)=O Amb24689942 [0,1,0,0,0,0|1,0,0]=2 2535 B7R0.5 O[15NH]CC(C(=O)O)N Amb17608097 [0,1,0,0,0,0|2,0,0]=3 2536 B7R0.5 O[C@@H](CCF)C(O)=O Amb24481351 [0,1,0,0,0,0|1,0,0]=2 2537 B7R0.5 [13CH3][13CH2]OC(=O)C(=O)Cl Amb22353953 [0,1,0,0,0,0|2,0,1]=4 2538 B7R0.5 [2H][13CH2]CC(=O)C([O-])=O Amb22337314 [0,1,0,0,0,0|1,0,2]=4 2539 B7R0.5 [N-]=[N+]=NC(O)C(O)=O Amb24374125 [0,1,0,0,0,0|3,0,0]=4 2540 B7R0.5 [O-]C(=O)C(=O)OCC Amb16192061 [0,1,0,0,0,0|1,0,2]=4 2541 B7R0.6 C=C(Br)CCC(O)=O Amb18648212 [0,1,0,0,0,0|0,0,2]=3 2542 B7R0.6 C=C(Cl)CCC(N)=O Amb25843741 [0,1,0,0,0,0|1,0,2]=4 2543 B7R0.6 C=C(Cl)CCC(O)=O Amb18642971 [0,1,0,0,0,0|0,0,2]=3 2544 B7R0.6 C=C(F)CCC(O)=O Amb25141041 [0,1,0,0,0,0|0,0,2]=3 2545 B7R0.6 CC(=C)CCC(=O)Cl Amb24640436 [0,1,0,0,0,0|1,0,1]=3 2546 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [0,1,0,0,0,0|0,0,1]=2 2547 B7R0.6 CC(=C)CNC(C)C Amb17308679 [0,1,0,0,0,0|3,0,0]=4 2548 B7R0.6 CC(=C)\C=C\C(=O)O Amb17593153 [0,1,0,0,0,0|0,0,3]=4 2549 B7R0.6 CC(=CCC(=O)C)C Amb17593170 [0,1,0,0,0,0|1,0,2]=4 2550 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [0,1,0,0,0,0|1,0,1]=3 2551 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,1,0,0,0,0|1,0,2]=4 2552 B7R0.6 CC(=O)CCC(=C)Br Amb24690678 [0,1,0,0,0,0|1,0,2]=4 2553 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [0,1,0,0,0,0|1,0,1]=3 2554 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [0,1,0,0,0,0|1,0,1]=3 2555 B7R0.6 CC(=O)CCC(Cl)Cl Amb25724918 [0,1,0,0,0,0|2,0,0]=3 2556 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [0,1,0,0,0,0|0,0,2]=3 2557 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [0,1,0,0,0,0|1,0,1]=3 2558 B7R0.6 CC(=O)CCS(=O)=O Amb25730256 [0,1,0,0,0,0|1,0,2]=4 2559 B7R0.6 CC(=O)CC[N+]([O-])=O Amb18198961 [0,1,0,0,0,0|1,0,2]=4 2560 B7R0.6 CC(=O)CNC(N)=O Amb24697691 [0,1,0,0,0,0|2,0,1]=4 2561 B7R0.6 CC(=O)CSC(C)=C Amb25809979 [0,1,0,0,0,0|2,0,1]=4 2562 B7R0.6 CC(=O)CSC(C)=N Amb24634756 [0,1,0,0,0,0|2,0,1]=4 2563 B7R0.6 CC(=O)NCC(=O)N Amb17231824 [0,1,0,0,0,0|2,0,1]=4 2564 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,1,0,0,0,0|1,0,1]=3 2565 B7R0.6 CC(=O)NCC(C)=C Amb25126091 [0,1,0,0,0,0|2,0,1]=4 2566 B7R0.6 CC(=O)NCC(O)O Amb25378443 [0,1,0,0,0,0|3,0,0]=4 2567 B7R0.6 CC(=O)OCC(=C)C Amb16187121 [0,1,0,0,0,0|2,0,1]=4 2568 B7R0.6 CC(=O)OCC(=O)Br Amb25032214 [0,1,0,0,0,0|2,0,1]=4 2569 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,1,0,0,0,0|1,0,1]=3 2570 B7R0.6 CC(=O)OCC(F)Cl Amb25116212 [0,1,0,0,0,0|3,0,0]=4 2571 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,1,0,0,0,0|2,0,1]=4 2572 B7R0.6 CC(=O)OCS(C)=O Amb24667100 [0,1,0,0,0,0|3,0,0]=4 2573 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,1,0,0,0,0|2,0,1]=4 2574 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [0,1,0,0,0,0|1,0,1]=3 2575 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [0,1,0,0,0,0|2,0,1]=4 2576 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,1,0,0,0,0|2,0,1]=4 2577 B7R0.6 CC(=O)\C=C/C(O)=O Amb24662475 [0,1,0,0,0,0|0,0,3]=4 2578 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [0,1,0,0,0,0|1,0,1]=3 2579 B7R0.6 CC(Br)CCC(=O)Cl Amb24483133 [0,1,0,0,0,0|1,0,0]=2 2580 B7R0.6 CC(Br)CCC(C)Cl Amb25216975 [0,1,0,0,0,0|2,0,1]=4 2581 B7R0.6 CC(Br)CCC(N)=O Amb24065438 [0,1,0,0,0,0|1,0,0]=2 2582 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [0,1,0,0,0,0|0,0,0]=1 2583 B7R0.6 CC(Br)CNC(C)=O Amb24727885 [0,1,0,0,0,0|2,0,0]=3 2584 B7R0.6 CC(Br)COC(C)=O Amb25360690 [0,1,0,0,0,0|2,0,0]=3 2585 B7R0.6 CC(Br)\C=C\C(=O)Cl Amb24602252 [0,1,0,0,0,0|1,0,2]=4 2586 B7R0.6 CC(Br)\C=C\C(C)=O Amb25334067 [0,1,0,0,0,0|1,0,2]=4 2587 B7R0.6 CC(Br)\C=C\C(O)=O Amb18648210 [0,1,0,0,0,0|0,0,2]=3 2588 B7R0.6 CC(C)=CCC([O-])=O Amb22491058 [0,1,0,0,0,0|0,0,3]=4 2589 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [0,1,0,0,0,0|1,0,1]=3 2590 B7R0.6 CC(C)CC=C(C)C Amb22731329 [0,1,0,0,0,0|2,0,1]=4 2591 B7R0.6 CC(C)CCB(F)F Amb24655127 [0,1,0,0,0,0|3,0,0]=4 2592 B7R0.6 CC(C)CCC(C)=C Amb22734286 [0,1,0,0,0,0|2,0,0]=3 2593 B7R0.6 CC(C)CCC(Cl)Cl Amb24483247 [0,1,0,0,0,0|2,0,1]=4 2594 B7R0.6 CC(C)CCC(N)=N Amb19890005 [0,1,0,0,0,0|2,0,0]=3 2595 B7R0.6 CC(C)CCN(C)C Amb25761687 [0,1,0,0,0,0|3,0,0]=4 2596 B7R0.6 CC(C)CCN(C)N Amb25344743 [0,1,0,0,0,0|3,0,0]=4 2597 B7R0.6 CC(C)CCS(C)=O Amb24369501 [0,1,0,0,0,0|2,0,0]=3 2598 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [0,1,0,0,0,0|0,0,0]=1 2599 B7R0.6 CC(C)CC[13C]([O-])=O Amb22369748 [0,1,0,0,0,0|0,0,1]=2 2600 B7R0.6 CC(C)CC[N+]([O-])=O Amb17672612 [0,1,0,0,0,0|1,0,1]=3 2601 B7R0.6 CC(C)CC[S+](C)C Amb24581198 [0,1,0,0,0,0|3,0,0]=4 2602 B7R0.6 CC(C)COB(O)O Amb24711780 [0,1,0,0,0,0|2,0,1]=4 2603 B7R0.6 CC(C)COC(N)=N Amb25789367 [0,1,0,0,0,0|3,0,0]=4 2604 B7R0.6 CC(C)COC(N)=S Amb25117523 [0,1,0,0,0,0|2,1,0]=4 2605 B7R0.6 CC(C)COC([S-])=S Amb22730882 [0,1,0,0,0,0|1,2,0]=4 2606 B7R0.6 CC(C)COC([S-])=S Amb22733535 [0,1,0,0,0,0|1,2,0]=4 2607 B7R0.6 CC(C)CO[N+]([O-])=O Amb22348027 [0,1,0,0,0,0|2,0,1]=4 2608 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,1,0,0,0,0|2,0,0]=3 2609 B7R0.6 CC(C)CSC(N)=N Amb20676000 [0,1,0,0,0,0|3,0,0]=4 2610 B7R0.6 CC(C)N=CC(O)=O Amb25243501 [0,1,0,0,0,0|1,0,1]=3 2611 B7R0.6 CC(C)NCC(=C)Br Amb18969561 [0,1,0,0,0,0|3,0,0]=4 2612 B7R0.6 CC(C)NCC(=C)Cl Amb18969179 [0,1,0,0,0,0|3,0,0]=4 2613 B7R0.6 CC(C)NC[C@H](C)O Amb25141479 [0,1,0,0,0,0|2,0,1]=4 2614 B7R0.6 CC(C)NNC(C)=O Amb22233621 [0,1,0,0,0,0|3,0,0]=4 2615 B7R0.6 CC(C)OCC(N)=N Amb22094742 [0,1,0,0,0,0|3,0,0]=4 2616 B7R0.6 CC(C)OCC([O-])=O Amb22754781 [0,1,0,0,0,0|1,0,1]=3 2617 B7R0.6 CC(C)OC[C@@H](C)O Amb24689920 [0,1,0,0,0,0|2,0,1]=4 2618 B7R0.6 CC(C)OC[C@H](C)O Amb24449028 [0,1,0,0,0,0|2,0,1]=4 2619 B7R0.6 CC(C)ONC(C)=O Amb25091857 [0,1,0,0,0,0|3,0,0]=4 2620 B7R0.6 CC(C)SCC(=C)Br Amb25847364 [0,1,0,0,0,0|3,0,0]=4 2621 B7R0.6 CC(C)SCC(=C)Cl Amb25204248 [0,1,0,0,0,0|3,0,0]=4 2622 B7R0.6 CC(C)SCC(C)=C Amb25058431 [0,1,0,0,0,0|3,0,0]=4 2623 B7R0.6 CC(C)SCC(C)=O Amb22549127 [0,1,0,0,0,0|2,0,0]=3 2624 B7R0.6 CC(C)SCC(C)O Amb24382860 [0,1,0,0,0,0|2,0,1]=4 2625 B7R0.6 CC(C)SCC(N)=N Amb25337291 [0,1,0,0,0,0|3,0,0]=4 2626 B7R0.6 CC(C)SC[C@@H](C)O Amb25283005 [0,1,0,0,0,0|2,0,1]=4 2627 B7R0.6 CC(C)\C=C/C(O)=O Amb24481395 [0,1,0,0,0,0|0,0,2]=3 2628 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [0,1,0,0,0,0|1,0,2]=4 2629 B7R0.6 CC(C)\C=C\C(N)=O Amb24473783 [0,1,0,0,0,0|1,0,2]=4 2630 B7R0.6 CC(CCB(O)O)C Amb13890540 [0,1,0,0,0,0|1,0,1]=3 2631 B7R0.6 CC(CCC(=O)O)C Amb1153016 [0,1,0,0,0,0|0,0,0]=1 2632 B7R0.6 CC(CCC(=O)O)N Amb17593212 [0,1,0,0,0,0|0,0,0]=1 2633 B7R0.6 CC(CNC(=O)N)C Amb1151241 [0,1,0,0,0,0|2,0,0]=3 2634 B7R0.6 CC(CNC(=S)N)C Amb2370605 [0,1,0,0,0,0|2,1,0]=4 2635 B7R0.6 CC(Cl)=C=CC(O)=O Amb25321565 [0,1,0,0,0,0|0,0,3]=4 2636 B7R0.6 CC(Cl)=CCC(N)=O Amb25324975 [0,1,0,0,0,0|1,0,2]=4 2637 B7R0.6 CC(Cl)C=NC(N)=O Amb24612038 [0,1,0,0,0,0|2,0,1]=4 2638 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,1,0,0,0,0|1,0,0]=2 2639 B7R0.6 CC(Cl)CCC(C)O Amb25136164 [0,1,0,0,0,0|1,0,1]=3 2640 B7R0.6 CC(Cl)CCC(N)=O Amb24469692 [0,1,0,0,0,0|1,0,0]=2 2641 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [0,1,0,0,0,0|0,0,0]=1 2642 B7R0.6 CC(Cl)CCN(C)C Amb25074217 [0,1,0,0,0,0|3,0,0]=4 2643 B7R0.6 CC(Cl)CNC(C)=O Amb25702921 [0,1,0,0,0,0|2,0,0]=3 2644 B7R0.6 CC(Cl)CNC(N)=O Amb25068414 [0,1,0,0,0,0|2,0,0]=3 2645 B7R0.6 CC(Cl)COC(=O)F Amb24470183 [0,1,0,0,0,0|2,0,0]=3 2646 B7R0.6 CC(Cl)COC(C)=O Amb25783984 [0,1,0,0,0,0|2,0,0]=3 2647 B7R0.6 CC(Cl)CSC(=O)Cl Amb24456190 [0,1,0,0,0,0|2,0,0]=3 2648 B7R0.6 CC(Cl)CSC(C)=O Amb24530194 [0,1,0,0,0,0|2,0,0]=3 2649 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [0,1,0,0,0,0|1,0,2]=4 2650 B7R0.6 CC(Cl)\C=C\C(C)=O Amb25782801 [0,1,0,0,0,0|1,0,2]=4 2651 B7R0.6 CC(F)CCC(O)=O Amb24682772 [0,1,0,0,0,0|0,0,0]=1 2652 B7R0.6 CC(N)CCC(C)=C Amb18641752 [0,1,0,0,0,0|2,0,0]=3 2653 B7R0.6 CC(N)CCC(C)=O Amb24698356 [0,1,0,0,0,0|1,0,0]=2 2654 B7R0.6 CC(N)CCC(N)=O Amb18641901 [0,1,0,0,0,0|1,0,0]=2 2655 B7R0.6 CC(N)CCC(O)=O Amb19515603 [0,1,0,0,0,0|0,0,0]=1 2656 B7R0.6 CC(N)CCS(C)=O Amb19337158 [0,1,0,0,0,0|2,0,0]=3 2657 B7R0.6 CC(N)CCS(C)=O Amb22059582 [0,1,0,0,0,0|2,0,0]=3 2658 B7R0.6 CC(N)CNC(C)=O Amb18631377 [0,1,0,0,0,0|2,0,0]=3 2659 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,1,0,0,0,0|2,0,0]=3 2660 B7R0.6 CC(N)CSC(N)=N Amb24423533 [0,1,0,0,0,0|3,0,0]=4 2661 B7R0.6 CC(N)\C=C\C(O)=O Amb18641827 [0,1,0,0,0,0|0,0,2]=3 2662 B7R0.6 CC(NCC(=O)N)C Amb2370772 [0,1,0,0,0,0|2,0,0]=3 2663 B7R0.6 CC(NCC(=O)O)C Amb2372347 [0,1,0,0,0,0|1,0,0]=2 2664 B7R0.6 CC(NCC(=S)N)C Amb17231884 [0,1,0,0,0,0|2,1,0]=4 2665 B7R0.6 CC(O)CC=C(C)C Amb24645341 [0,1,0,0,0,0|2,0,1]=4 2666 B7R0.6 CC(O)CC=C(Cl)Cl Amb25169372 [0,1,0,0,0,0|2,0,1]=4 2667 B7R0.6 CC(O)CCB(O)O Amb24594819 [0,1,0,0,0,0|1,0,1]=3 2668 B7R0.6 CC(O)CCC(C)=C Amb24062974 [0,1,0,0,0,0|2,0,0]=3 2669 B7R0.6 CC(O)CCC(C)=O Amb25829594 [0,1,0,0,0,0|1,0,0]=2 2670 B7R0.6 CC(O)CCC(C)N Amb18641930 [0,1,0,0,0,0|1,0,1]=3 2671 B7R0.6 CC(O)CCC(O)=O Amb18294804 [0,1,0,0,0,0|0,0,0]=1 2672 B7R0.6 CC(O)CCN(C)N Amb24370255 [0,1,0,0,0,0|2,0,1]=4 2673 B7R0.6 CC(O)CN=C(C)N Amb24370924 [0,1,0,0,0,0|3,0,0]=4 2674 B7R0.6 CC(O)CNS(C)=O Amb24536649 [0,1,0,0,0,0|3,0,0]=4 2675 B7R0.6 CC(O)COC(C)=O Amb24056158 [0,1,0,0,0,0|2,0,0]=3 2676 B7R0.6 CC(O)COP(O)=O Amb24591406 [0,1,0,0,0,0|2,0,0]=3 2677 B7R0.6 CC(O)COP(O)O Amb24475185 [0,1,0,0,0,0|2,0,1]=4 2678 B7R0.6 CC(O)CSC(N)=N Amb25168714 [0,1,0,0,0,0|3,0,0]=4 2679 B7R0.6 CC(O)CSC(N)=S Amb24652391 [0,1,0,0,0,0|2,1,0]=4 2680 B7R0.6 CC(O)NCC(O)=O Amb25141558 [0,1,0,0,0,0|1,0,0]=2 2681 B7R0.6 CC(O)OCC(C)=C Amb24333382 [0,1,0,0,0,0|3,0,0]=4 2682 B7R0.6 CC(O)\C=C\C(C)=O Amb25334941 [0,1,0,0,0,0|1,0,2]=4 2683 B7R0.6 CC(O)\C=C\C(N)=O Amb24597646 [0,1,0,0,0,0|1,0,2]=4 2684 B7R0.6 CC(O)\C=C\C(O)=O Amb18641876 [0,1,0,0,0,0|0,0,2]=3 2685 B7R0.6 CC(S)CNC(C)=O Amb24695989 [0,1,0,0,0,0|2,0,0]=3 2686 B7R0.6 CC(S)\C=C\C(O)=O Amb18124362 [0,1,0,0,0,0|0,0,2]=3 2687 B7R0.6 CC(SCC(=O)O)C Amb1128460 [0,1,0,0,0,0|1,0,0]=2 2688 B7R0.6 CN(C)CCC(O)=O Amb19888182 [0,1,0,0,0,0|1,0,0]=2 2689 B7R0.6 CN(C)NCC(N)=O Amb24634715 [0,1,0,0,0,0|3,0,0]=4 2690 B7R0.6 CN(C)NCC(O)=O Amb24481366 [0,1,0,0,0,0|2,0,0]=3 2691 B7R0.6 CN(C)SCC(N)=O Amb22492532 [0,1,0,0,0,0|3,0,0]=4 2692 B7R0.6 CN(C)\C=C\C(O)=O Amb25273624 [0,1,0,0,0,0|1,0,2]=4 2693 B7R0.6 CN(CCC(=N)N)C Amb13951664 [0,1,0,0,0,0|3,0,0]=4 2694 B7R0.6 CN(CCC(=O)C)C Amb1129203 [0,1,0,0,0,0|2,0,0]=3 2695 B7R0.6 CN(CCC(=O)N)C Amb17231825 [0,1,0,0,0,0|2,0,0]=3 2696 B7R0.6 CN(CCC(N)C)C Amb1141214 [0,1,0,0,0,0|3,0,0]=4 2697 B7R0.6 CS(=O)CCC(N)=N Amb25248432 [0,1,0,0,0,0|3,0,0]=4 2698 B7R0.6 CS(=O)CCC(N)=O Amb24475802 [0,1,0,0,0,0|2,0,0]=3 2699 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [0,1,0,0,0,0|1,0,0]=2 2700 B7R0.6 CS(=O)NCC(N)=O Amb24589713 [0,1,0,0,0,0|3,0,0]=4 2701 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [0,1,0,0,0,0|2,0,0]=3 2702 B7R0.6 CS(=O)\C=C\C(O)=O Amb18642965 [0,1,0,0,0,0|1,0,2]=4 2703 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [0,1,0,0,0,0|1,0,0]=2 2704 B7R0.6 C[C@@H](O)C#CC(O)=O Amb24334413 [0,1,0,0,0,0|0,0,2]=3 2705 B7R0.6 C[C@@H](O)CCB(O)O Amb25683632 [0,1,0,0,0,0|1,0,1]=3 2706 B7R0.6 C[C@@H](O)CCC(C)=C Amb22896943 [0,1,0,0,0,0|2,0,0]=3 2707 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [0,1,0,0,0,0|1,0,0]=2 2708 B7R0.6 C[C@@H](O)CCC(C)O Amb25846912 [0,1,0,0,0,0|1,0,1]=3 2709 B7R0.6 C[C@@H](O)CN=C(C)N Amb25026449 [0,1,0,0,0,0|3,0,0]=4 2710 B7R0.6 C[C@@H](O)CNC(C)=O Amb25133822 [0,1,0,0,0,0|2,0,0]=3 2711 B7R0.6 C[C@@H](O)COC(C)=O Amb25832756 [0,1,0,0,0,0|2,0,0]=3 2712 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [0,1,0,0,0,0|0,0,0]=1 2713 B7R0.6 C[C@H](Br)CC[C@@H](C)Br Amb25706509 [0,1,0,0,0,0|2,0,1]=4 2714 B7R0.6 C[C@H](Cl)CC[C@@H](C)Cl Amb24390387 [0,1,0,0,0,0|2,0,1]=4 2715 B7R0.6 C[C@H](Cl)CC[C@H](C)Cl Amb24532115 [0,1,0,0,0,0|2,0,1]=4 2716 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [0,1,0,0,0,0|0,0,0]=1 2717 B7R0.6 C[C@H](O)CNC(N)=N Amb24501581 [0,1,0,0,0,0|3,0,0]=4 2718 B7R0.6 C[C@H](O)CNC(N)=O Amb24384732 [0,1,0,0,0,0|2,0,0]=3 2719 B7R0.6 C[C@H](O)CSC(C)=O Amb25256687 [0,1,0,0,0,0|2,0,0]=3 2720 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [0,1,0,0,0,0|1,0,0]=2 2721 B7R0.6 C[S+](C)CCC([O-])=O Amb20247306 [0,1,0,0,0,0|1,0,1]=3 2722 B7R0.6 FC(COC(=O)C)F Amb10839327 [0,1,0,0,0,0|3,0,0]=4 2723 B7R0.6 NC(=N)CCC(=O)Cl Amb24565938 [0,1,0,0,0,0|2,0,1]=4 2724 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [0,1,0,0,0,0|1,0,1]=3 2725 B7R0.6 NC(=N)NCC(=O)O Amb16231404 [0,1,0,0,0,0|2,0,1]=4 2726 B7R0.6 NC(=N)N[13CH2][13C](=O)O Amb17614848 [0,1,0,0,0,0|2,0,1]=4 2727 B7R0.6 NC(=N)OCC(O)=O Amb24394884 [0,1,0,0,0,0|2,0,1]=4 2728 B7R0.6 NC(=N)SCC(O)=O Amb21955777 [0,1,0,0,0,0|2,0,1]=4 2729 B7R0.6 NC(=O)CCB(O)O Amb24483052 [0,1,0,0,0,0|3,0,0]=4 2730 B7R0.6 NC(=O)CCC(=O)N Amb1353209 [0,1,0,0,0,0|2,0,1]=4 2731 B7R0.6 NC(=O)CCC(F)F Amb25271130 [0,1,0,0,0,0|2,0,0]=3 2732 B7R0.6 NC(=O)CCC(N)=N Amb25680023 [0,1,0,0,0,0|2,0,1]=4 2733 B7R0.6 NC(=O)CCP(O)=O Amb25840251 [0,1,0,0,0,0|2,0,1]=4 2734 B7R0.6 NC(=O)CNC(O)=O Amb24705097 [0,1,0,0,0,0|2,0,1]=4 2735 B7R0.6 NC(=O)NCC(=O)O Amb16205895 [0,1,0,0,0,0|2,0,1]=4 2736 B7R0.6 NC(=O)OCC(Cl)Cl Amb25111164 [0,1,0,0,0,0|3,0,0]=4 2737 B7R0.6 NC(=O)OCC(O)=O Amb25777061 [0,1,0,0,0,0|2,0,1]=4 2738 B7R0.6 NC(=O)SCC(O)=O Amb24640543 [0,1,0,0,0,0|2,0,1]=4 2739 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [0,1,0,0,0,0|1,0,1]=3 2740 B7R0.6 NC(=S)OCC(O)=O Amb25340403 [0,1,0,0,0,0|2,0,1]=4 2741 B7R0.6 NC(=S)SCC(O)=O Amb25108057 [0,1,0,0,0,0|2,0,1]=4 2742 B7R0.6 O=C(Cl)CCC(Cl)Cl Amb24441999 [0,1,0,0,0,0|2,0,0]=3 2743 B7R0.6 O=C(F)CCC(=O)F Amb24483270 [0,1,0,0,0,0|2,0,1]=4 2744 B7R0.6 OB(O)CCC(O)=O Amb24640288 [0,1,0,0,0,0|2,0,0]=3 2745 B7R0.6 OC(=O)C#CC(F)F Amb24455798 [0,1,0,0,0,0|1,0,2]=4 2746 B7R0.6 OC(=O)CC=C(Cl)Cl Amb17593875 [0,1,0,0,0,0|1,0,2]=4 2747 B7R0.6 OC(=O)CC=C(F)F Amb25127059 [0,1,0,0,0,0|1,0,2]=4 2748 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [0,1,0,0,0,0|1,0,1]=3 2749 B7R0.6 OC(=O)CCC(Cl)Cl Amb25059214 [0,1,0,0,0,0|1,0,0]=2 2750 B7R0.6 OC(=O)CCC(F)F Amb20623135 [0,1,0,0,0,0|1,0,0]=2 2751 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [0,1,0,0,0,0|1,0,1]=3 2752 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [0,1,0,0,0,0|1,0,1]=3 2753 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [0,1,0,0,0,0|1,0,1]=3 2754 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [0,1,0,0,0,0|1,0,1]=3 2755 B7R0.6 OC(=O)CNC(=O)Cl Amb25277149 [0,1,0,0,0,0|2,0,1]=4 2756 B7R0.6 OC(=O)CNC(S)=S Amb24739663 [0,1,0,0,0,0|2,0,1]=4 2757 B7R0.6 OC(=O)COC(S)=S Amb24739791 [0,1,0,0,0,0|2,0,1]=4 2758 B7R0.6 OC(=O)COS(=O)=O Amb25064798 [0,1,0,0,0,0|3,0,0]=4 2759 B7R0.6 OC(=O)CSC(S)=S Amb24608205 [0,1,0,0,0,0|2,0,1]=4 2760 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [0,1,0,0,0,0|1,0,1]=3 2761 B7R0.6 OC(=O)C\C=C(\F)/Cl Amb24599232 [0,1,0,0,0,0|1,0,2]=4 2762 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [0,1,0,0,0,0|2,0,1]=4 2763 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [0,1,0,0,0,0|1,0,1]=3 2764 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [0,1,0,0,0,0|1,0,1]=3 2765 B7R0.6 OC(=O)\C=C\C(F)F Amb24340205 [0,1,0,0,0,0|1,0,2]=4 2766 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [0,1,0,0,0,0|1,0,1]=3 2767 B7R0.6 OC(O)CCC(O)=O Amb25762802 [0,1,0,0,0,0|1,0,0]=2 2768 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [0,1,0,0,0,0|1,0,1]=3 2769 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [0,1,0,0,0,0|1,0,1]=3 2770 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [0,1,0,0,0,0|1,0,1]=3 2771 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [0,1,0,0,0,0|0,0,1]=2 2772 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [0,1,0,0,0,0|1,0,1]=3 2773 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [0,1,0,0,0,0|1,0,1]=3 2774 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22230230 [0,1,0,0,0,0|1,0,2]=4 2775 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22330623 [0,1,0,0,0,0|1,0,2]=4 2776 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22360668 [0,1,0,0,0,0|1,0,2]=4 2777 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22731284 [0,1,0,0,0,0|1,0,2]=4 2778 B7R0.6 [O-][N+](=O)CCC(=O)Cl Amb24532013 [0,1,0,0,0,0|3,0,0]=4 2779 B7R0.6 [O-][N+](=O)CCC(=O)O Amb10843224 [0,1,0,0,0,0|2,0,0]=3 2780 B7R0.8 CC(C)(O)CCCCl Amb24333123 [0,1,0,0,0,0|2,0,1]=4 2781 B7R0.8 CC(C)(O)CCCO Amb20668492 [0,1,0,0,0,0|2,0,1]=4 2782 B7R0.8 CCCCB(O)(O)O Amb24422846 [0,1,0,0,0,0|1,0,1]=3 2783 B7R0.8 CCCCC(Br)(Br)C Amb15692624 [0,1,0,0,0,0|2,0,1]=4 2784 B7R0.8 CCCCC(C)(C)Br Amb24401418 [0,1,0,0,0,0|2,0,1]=4 2785 B7R0.8 CCCCC(C)(C)C Amb22045826 [0,1,0,0,0,0|2,0,1]=4 2786 B7R0.8 CCCCC(C)(C)C Amb22228234 [0,1,0,0,0,0|2,0,1]=4 2787 B7R0.8 CCCCC(C)(C)Cl Amb22052659 [0,1,0,0,0,0|2,0,1]=4 2788 B7R0.8 CCCCC(C)(C)N Amb18993512 [0,1,0,0,0,0|2,0,1]=4 2789 B7R0.8 CCCCC(C)(F)F Amb24667247 [0,1,0,0,0,0|2,0,1]=4 2790 B7R0.8 CCCCC(F)(F)F Amb22008013 [0,1,0,0,0,0|2,0,1]=4 2791 B7R0.8 CCCCP(O)(O)=O Amb22053921 [0,1,0,0,0,0|1,0,0]=2 2792 B7R0.8 CCCCS(=O)(=O)Br Amb23555505 [0,1,0,0,0,0|1,0,1]=3 2793 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [0,1,0,0,0,0|1,0,1]=3 2794 B7R0.8 CCCCS(=O)(=O)N Amb1132715 [0,1,0,0,0,0|1,0,1]=3 2795 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [0,1,0,0,0,0|1,0,0]=2 2796 B7R0.8 CCCCS(C)(=O)=O Amb24643027 [0,1,0,0,0,0|1,0,1]=3 2797 B7R0.8 CCCCS(O)(=O)=O Amb22269868 [0,1,0,0,0,0|1,0,0]=2 2798 B7R0.8 CCCC[B-](F)(F)F Amb20242702 [0,1,0,0,0,0|3,0,0]=4 2799 B7R0.8 CCCC[B-](O)(O)O Amb24457030 [0,1,0,0,0,0|1,0,1]=3 2800 B7R0.8 CCCC[Ge](Cl)(Cl)Cl Amb19930249 [0,1,0,0,0,0|2,1,0]=4 2801 B7R0.8 CCCC[N+](C)(C)C Amb22360338 [0,1,0,0,0,0|3,0,0]=4 2802 B7R0.8 CCCC[Si](C)(C)C Amb22360219 [0,1,0,0,0,0|2,1,0]=4 2803 B7R0.8 CCCC[Si](C)(C)F Amb19883807 [0,1,0,0,0,0|2,1,0]=4 2804 B7R0.8 CCCC[Si](C)(Cl)Cl Amb19893670 [0,1,0,0,0,0|2,1,0]=4 2805 B7R0.8 CCCC[Si](Cl)(Cl)Cl Amb19893673 [0,1,0,0,0,0|2,1,0]=4 2806 B7R0.8 CCCC[Sn](C)(C)Cl Amb22730074 [0,1,0,0,0,0|3,0,0]=4 2807 B7R0.8 CCCC[Sn](O)(O)Cl Amb19894194 [0,1,0,0,0,0|1,0,1]=3 2808 B7R0.8 CCCNS(=O)(=O)Cl Amb17193915 [0,1,0,0,0,0|2,0,1]=4 2809 B7R0.8 CCCNS(N)(=O)=O Amb22232401 [0,1,0,0,0,0|2,0,1]=4 2810 B7R0.8 CCCNS([NH-])(O)O Amb22007976 [0,1,0,0,0,0|2,0,1]=4 2811 B7R0.8 CCCOP(C)(O)=O Amb24553958 [0,1,0,0,0,0|2,0,0]=3 2812 B7R0.8 CCCOS(=O)(=O)Cl Amb22739823 [0,1,0,0,0,0|2,0,1]=4 2813 B7R0.8 CCCOS(C)(=O)=O Amb22388704 [0,1,0,0,0,0|2,0,1]=4 2814 B7R0.8 CCCOS([O-])(=O)=O Amb22641874 [0,1,0,0,0,0|2,0,1]=4 2815 B7R0.8 CCCSS(=O)(=O)C Amb17619610 [0,1,0,0,0,0|2,0,1]=4 2816 B7R0.8 CCNCC(O)(C)C Amb17138366 [0,1,0,0,0,0|2,0,1]=4 2817 B7R0.8 CCNCP(=O)(O)O Amb2233009 [0,1,0,0,0,0|2,0,0]=3 2818 B7R0.8 CCNCS(O)(=O)=O Amb25324324 [0,1,0,0,0,0|2,0,0]=3 2819 B7R0.8 CCOCC(C)(C)O Amb17940394 [0,1,0,0,0,0|2,0,1]=4 2820 B7R0.8 CCSCC(C)(C)O Amb24757304 [0,1,0,0,0,0|2,0,1]=4 2821 B7R0.8 CC\C=C\P(O)(O)=O Amb22388769 [0,1,0,0,0,0|1,0,2]=4 2822 B7R0.8 CNCCC(O)(C)C Amb10607875 [0,1,0,0,0,0|2,0,1]=4 2823 B7R0.8 CNCCS(N)(=O)=O Amb18292520 [0,1,0,0,0,0|2,0,1]=4 2824 B7R0.8 CNCCS([O-])(=O)=O Amb21858847 [0,1,0,0,0,0|2,0,1]=4 2825 B7R0.8 COCCS(=O)(=O)Br Amb23555508 [0,1,0,0,0,0|2,0,1]=4 2826 B7R0.8 COCCS(=O)(=O)F Amb19514633 [0,1,0,0,0,0|2,0,1]=4 2827 B7R0.8 COCCS(C)(=O)=O Amb24476598 [0,1,0,0,0,0|2,0,1]=4 2828 B7R0.8 COCCS([O-])(=O)=O Amb22496266 [0,1,0,0,0,0|2,0,1]=4 2829 B7R0.8 CP(C)(=O)CCCN Amb24481153 [0,1,0,0,0,0|3,0,0]=4 2830 B7R0.8 CP(O)(=O)CCCO Amb24448096 [0,1,0,0,0,0|2,0,0]=3 2831 B7R0.8 CS(=O)(=O)CCCBr Amb18320185 [0,1,0,0,0,0|2,0,1]=4 2832 B7R0.8 CS(=O)(=O)CCCCl Amb18034011 [0,1,0,0,0,0|2,0,1]=4 2833 B7R0.8 CS(=O)(=O)CCCI Amb20623053 [0,1,0,0,0,0|2,0,1]=4 2834 B7R0.8 CS(=O)(=O)CCCS Amb25092985 [0,1,0,0,0,0|2,0,1]=4 2835 B7R0.8 CSCCC(C)(C)O Amb24483080 [0,1,0,0,0,0|2,0,1]=4 2836 B7R0.8 CSCCS(O)(=O)=O Amb25200266 [0,1,0,0,0,0|2,0,0]=3 2837 B7R0.8 C[Si](C)(O)CCCCl Amb25335494 [0,1,0,0,0,0|2,1,0]=4 2838 B7R0.8 C[Si](C)(O)CCCN Amb22336683 [0,1,0,0,0,0|2,1,0]=4 2839 B7R0.8 C[Si](C)(O)CCCO Amb25296399 [0,1,0,0,0,0|2,1,0]=4 2840 B7R0.8 ClCCCS(=O)(=O)F Amb13952588 [0,1,0,0,0,0|2,0,1]=4 2841 B7R0.8 NCCCC(O)(C)C Amb17569908 [0,1,0,0,0,0|2,0,1]=4 2842 B7R0.8 NCCCS(=O)(=O)C Amb10609368 [0,1,0,0,0,0|2,0,1]=4 2843 B7R0.8 NCCCS(=O)(=O)N Amb10609522 [0,1,0,0,0,0|2,0,1]=4 2844 B7R0.8 NCCCS(=O)(=O)N Amb10609652 [0,1,0,0,0,0|2,0,1]=4 2845 B7R0.8 NCCCS(O)(=O)=O Amb22349635 [0,1,0,0,0,0|2,0,0]=3 2846 B7R0.8 NCCCS([O-])(=O)=O Amb22002055 [0,1,0,0,0,0|2,0,1]=4 2847 B7R0.8 NCCC[Si](O)(O)O Amb19894212 [0,1,0,0,0,0|1,1,1]=4 2848 B7R0.8 NCCNP(O)(O)=O Amb25313431 [0,1,0,0,0,0|3,0,0]=4 2849 B7R0.8 NCCNS(O)(=O)=O Amb25368312 [0,1,0,0,0,0|3,0,0]=4 2850 B7R0.8 NCCOS(O)(=O)=S Amb24373169 [0,1,0,0,0,0|3,0,0]=4 2851 B7R0.8 NCCSP(O)(O)=O Amb22349664 [0,1,0,0,0,0|3,0,0]=4 2852 B7R0.8 NNCCP(O)(O)=O Amb25784125 [0,1,0,0,0,0|3,0,0]=4 2853 B7R0.8 NP(O)(=O)NCCCl Amb24472289 [0,1,0,0,0,0|3,0,0]=4 2854 B7R0.8 NS(=O)(=O)CCCBr Amb19374293 [0,1,0,0,0,0|2,0,1]=4 2855 B7R0.8 NS(=O)(=O)CCCF Amb19148047 [0,1,0,0,0,0|2,0,1]=4 2856 B7R0.8 O=S(=O)(Cl)CCCBr Amb19338138 [0,1,0,0,0,0|2,0,1]=4 2857 B7R0.8 O=S(=O)(Cl)CCCF Amb19374916 [0,1,0,0,0,0|2,0,1]=4 2858 B7R0.8 O=S(=O)(F)CCCF Amb19374915 [0,1,0,0,0,0|2,0,1]=4 2859 B7R0.8 OCCCS(=O)(=O)C Amb10608209 [0,1,0,0,0,0|2,0,1]=4 2860 B7R0.8 OCCCS(=O)(=O)Cl Amb20667916 [0,1,0,0,0,0|2,0,1]=4 2861 B7R0.8 OCCCS(=O)(=O)F Amb24739291 [0,1,0,0,0,0|2,0,1]=4 2862 B7R0.8 OCCCS(O)(=O)=O Amb22002051 [0,1,0,0,0,0|2,0,0]=3 2863 B7R0.8 OCCCS(O)(=O)=O Amb22360758 [0,1,0,0,0,0|2,0,0]=3 2864 B7R0.8 OCCNP(O)(O)=O Amb25831960 [0,1,0,0,0,0|3,0,0]=4 2865 B7R0.8 OCCOS(O)(=O)=O Amb24746781 [0,1,0,0,0,0|3,0,0]=4 2866 B7R0.8 OP(=O)(Cl)OCCCl Amb24552890 [0,1,0,0,0,0|3,0,0]=4 2867 B7R0.8 OP(O)(=O)CCC=O Amb25350486 [0,1,0,0,0,0|2,0,1]=4 2868 B7R0.8 OP(O)(=O)CCCCl Amb22388825 [0,1,0,0,0,0|2,0,0]=3 2869 B7R0.8 OP(O)(=O)OCCBr Amb24724146 [0,1,0,0,0,0|3,0,0]=4 2870 B7R0.8 OP(O)(=O)OCCCl Amb22228751 [0,1,0,0,0,0|3,0,0]=4 2871 B7R0.8 OP(O)(=O)OCCCl Amb24481418 [0,1,0,0,0,0|3,0,0]=4 2872 B7R0.8 OS(=O)(=O)CCC=O Amb25326186 [0,1,0,0,0,0|2,0,1]=4 2873 B7R0.8 OS(=O)(=O)CCCS Amb20620653 [0,1,0,0,0,0|2,0,0]=3 2874 B7R0.8 OS(=O)(=O)CCCS Amb22360759 [0,1,0,0,0,0|2,0,0]=3 2875 B7R0.8 OS(=O)(=O)NCCCl Amb25716714 [0,1,0,0,0,0|3,0,0]=4 2876 B7R0.8 OS(=O)(=O)OCCCl Amb25064355 [0,1,0,0,0,0|3,0,0]=4 2877 B7R0.8 O[Si](O)(O)CCCCl Amb24334218 [0,1,0,0,0,0|1,1,1]=4 2878 B7R0.8 [NH3+]CCCS(=O)(=O)C Amb13883038 [0,1,0,0,0,0|2,0,1]=4 2879 B7R0.8 [O-]S(=O)(=O)CCCCl Amb22341918 [0,1,0,0,0,0|2,0,1]=4 2880 B7R0.8 [O-]S(=O)(=O)CCCI Amb22359841 [0,1,0,0,0,0|2,0,1]=4 2881 B7R0.8 [O-]S(=O)(=O)CCCO Amb22002047 [0,1,0,0,0,0|2,0,1]=4 2882 B7R1.2 C=C1CC(Br)CC1 Amb25135798 [0,0,0,1,0,0|3,0,0]=4 2883 B7R1.2 C=C1CC(N)CC1 Amb24352464 [0,0,0,1,0,0|3,0,0]=4 2884 B7R1.2 C=C1CC(O)CC1 Amb25246529 [0,0,0,1,0,0|3,0,0]=4 2885 B7R1.2 C=C1COC(=O)O1 Amb20248769 [0,0,0,1,0,0|1,0,2]=4 2886 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [0,0,0,1,0,0|2,0,1]=4 2887 B7R1.2 CC1=CC(NC1)C Amb17593062 [0,0,0,1,0,0|3,0,0]=4 2888 B7R1.2 CC1=CCC(=O)N1 Amb24119179 [0,0,0,1,0,0|1,0,2]=4 2889 B7R1.2 CC1=CNC(=O)O1 Amb22298623 [0,0,0,1,0,0|1,0,2]=4 2890 B7R1.2 CC1=COC(=O)O1 Amb24693155 [0,0,0,1,0,0|1,0,2]=4 2891 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [0,0,0,1,0,0|2,0,1]=4 2892 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [0,0,0,1,0,0|2,0,1]=4 2893 B7R1.2 CC1BC(C)CC1 Amb25760363 [0,0,0,1,0,0|2,0,1]=4 2894 B7R1.2 CC1C=CC(=O)N1 Amb25248060 [0,0,0,1,0,0|1,0,2]=4 2895 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [0,0,0,1,0,0|0,0,2]=3 2896 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [0,0,0,1,0,0|0,1,2]=4 2897 B7R1.2 CC1C=NC(=O)S1 Amb20620625 [0,0,0,1,0,0|1,1,1]=4 2898 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,0,0,1,0,0|2,0,0]=3 2899 B7R1.2 CC1CC(=O)NC1 Amb10608004 [0,0,0,1,0,0|2,0,0]=3 2900 B7R1.2 CC1CC(Cl)CC1 Amb25129430 [0,0,0,1,0,0|2,0,1]=4 2901 B7R1.2 CC1CC(N)CC1 Amb20669202 [0,0,0,1,0,0|2,0,1]=4 2902 B7R1.2 CC1CC(N)CC1 Amb24062164 [0,0,0,1,0,0|2,0,1]=4 2903 B7R1.2 CC1CC(O)CN1 Amb20668139 [0,0,0,1,0,0|2,0,1]=4 2904 B7R1.2 CC1CC(O)CS1 Amb24660406 [0,0,0,1,0,0|2,0,1]=4 2905 B7R1.2 CC1CC(S)CC1 Amb25829470 [0,0,0,1,0,0|1,1,1]=4 2906 B7R1.2 CC1CC=C(C)C1 Amb17674172 [0,0,0,1,0,0|2,0,1]=4 2907 B7R1.2 CC1CCC(=N)N1 Amb24479850 [0,0,0,1,0,0|2,0,0]=3 2908 B7R1.2 CC1CCC(=O)N1 Amb19267101 [0,0,0,1,0,0|1,0,0]=2 2909 B7R1.2 CC1CCC(=S)O1 Amb25361484 [0,0,0,1,0,0|0,1,0]=2 2910 B7R1.2 CC1CCC(C)=C1 Amb24479860 [0,0,0,1,0,0|2,0,0]=3 2911 B7R1.2 CC1CCC(C)=N1 Amb24598049 [0,0,0,1,0,0|2,0,0]=3 2912 B7R1.2 CC1CCC(C)N1 Amb20626165 [0,0,0,1,0,0|2,0,1]=4 2913 B7R1.2 CC1CCC(O)O1 Amb22295909 [0,0,0,1,0,0|0,0,2]=3 2914 B7R1.2 CC1CCC(O1)C Amb10602551 [0,0,0,1,0,0|1,0,1]=3 2915 B7R1.2 CC1CN(N)CC1 Amb24385963 [0,0,0,1,0,0|3,0,0]=4 2916 B7R1.2 CC1CN=C(C)O1 Amb25360042 [0,0,0,1,0,0|2,0,0]=3 2917 B7R1.2 CC1CN=C(S)O1 Amb25196024 [0,0,0,1,0,0|1,1,0]=3 2918 B7R1.2 CC1CNC(=N)S1 Amb24684074 [0,0,0,1,0,0|2,1,0]=4 2919 B7R1.2 CC1CNC(=O)N1 Amb17506853 [0,0,0,1,0,0|2,0,0]=3 2920 B7R1.2 CC1CNC(=O)O1 Amb19651732 [0,0,0,1,0,0|1,0,0]=2 2921 B7R1.2 CC1CNC(=O)S1 Amb25367335 [0,0,0,1,0,0|1,1,0]=3 2922 B7R1.2 CC1CNC(=S)S1 Amb17845151 [0,0,0,1,0,0|1,2,0]=4 2923 B7R1.2 CC1CNC(C)=C1 Amb25806978 [0,0,0,1,0,0|3,0,0]=4 2924 B7R1.2 CC1CNC(C)=N1 Amb22733191 [0,0,0,1,0,0|3,0,0]=4 2925 B7R1.2 CC1CNC(N)=N1 Amb25186469 [0,0,0,1,0,0|3,0,0]=4 2926 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,0,0,1,0,0|2,0,0]=3 2927 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,0,0,1,0,0|2,0,0]=3 2928 B7R1.2 CC1COC(=S)N1 Amb24479649 [0,0,0,1,0,0|2,1,0]=4 2929 B7R1.2 CC1COC(N)=N1 Amb23449369 [0,0,0,1,0,0|3,0,0]=4 2930 B7R1.2 CC1COC(O)O1 Amb25204639 [0,0,0,1,0,0|1,0,2]=4 2931 B7R1.2 CC1COS(=O)O1 Amb22346070 [0,0,0,1,0,0|2,0,0]=3 2932 B7R1.2 CC1CS(=O)CC1 Amb24333540 [0,0,0,1,0,0|2,0,0]=3 2933 B7R1.2 CC1CSC(=O)C1 Amb25136024 [0,0,0,1,0,0|2,0,0]=3 2934 B7R1.2 CC1CSC(=O)S1 Amb22055765 [0,0,0,1,0,0|1,1,0]=3 2935 B7R1.2 CC1CSC(=S)N1 Amb25849326 [0,0,0,1,0,0|2,1,0]=4 2936 B7R1.2 CC1CSC(Cl)=N1 Amb25811136 [0,0,0,1,0,0|3,0,0]=4 2937 B7R1.2 CC1CSC(N)=N1 Amb25076082 [0,0,0,1,0,0|3,0,0]=4 2938 B7R1.2 CC1NC(=S)CS1 Amb25131726 [0,0,0,1,0,0|2,1,0]=4 2939 B7R1.2 CC1NCC(O1)C Amb17506157 [0,0,0,1,0,0|2,0,1]=4 2940 B7R1.2 CC1NNC(=O)C1 Amb2371659 [0,0,0,1,0,0|3,0,0]=4 2941 B7R1.2 CC1NNC(=O)O1 Amb25832289 [0,0,0,1,0,0|2,0,0]=3 2942 B7R1.2 CC1OC(=O)CS1 Amb25314322 [0,0,0,1,0,0|1,0,0]=2 2943 B7R1.2 CC1OCC(C)O1 Amb24074042 [0,0,0,1,0,0|2,0,1]=4 2944 B7R1.2 CC1[N-]OC(=O)N1 Amb24481515 [0,0,0,1,0,0|3,0,0]=4 2945 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [0,0,0,1,0,0|1,0,2]=4 2946 B7R1.2 CC=1CC[C@H](O)C1 Amb24705946 [0,0,0,1,0,0|1,0,2]=4 2947 B7R1.2 CC=1CNC(=O)C1 Amb24479892 [0,0,0,1,0,0|2,0,1]=4 2948 B7R1.2 CC=1COC(=O)C1 Amb22002703 [0,0,0,1,0,0|2,0,1]=4 2949 B7R1.2 CN1CC(=O)CC1 Amb22236123 [0,0,0,1,0,0|2,0,0]=3 2950 B7R1.2 CN1CCC(=O)N1 Amb24064860 [0,0,0,1,0,0|2,0,0]=3 2951 B7R1.2 CN1CCC(Br)=N1 Amb25243373 [0,0,0,1,0,0|3,0,0]=4 2952 B7R1.2 CN1CCC(Cl)=N1 Amb25180094 [0,0,0,1,0,0|3,0,0]=4 2953 B7R1.2 CN1CCC(O)=C1 Amb24079726 [0,0,0,1,0,0|2,0,0]=3 2954 B7R1.2 CN1CC[C@@H](C1)O Amb10070789 [0,0,0,1,0,0|2,0,1]=4 2955 B7R1.2 CN1CNC(=O)C1 Amb24733801 [0,0,0,1,0,0|3,0,0]=4 2956 B7R1.2 CN1C[C@@H](O)CC1 Amb22748868 [0,0,0,1,0,0|2,0,1]=4 2957 B7R1.2 CP1CC(O)CC1 Amb24661188 [0,0,0,1,0,0|2,0,1]=4 2958 B7R1.2 C[C@@H]1C=CC(=O)O1 Amb25114434 [0,0,0,1,0,0|0,0,2]=3 2959 B7R1.2 C[C@@H]1CC(=O)CC1 Amb22801305 [0,0,0,1,0,0|1,0,0]=2 2960 B7R1.2 C[C@@H]1CC(O)OC1 Amb25795468 [0,0,0,1,0,0|2,0,1]=4 2961 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,0,0,1,0,0|1,0,0]=2 2962 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [0,0,0,1,0,0|1,0,0]=2 2963 B7R1.2 C[C@@H]1CCC(O)O1 Amb25369337 [0,0,0,1,0,0|0,0,2]=3 2964 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb22366804 [0,0,0,1,0,0|2,0,1]=4 2965 B7R1.2 C[C@@H]1CC[C@@H](N1)C Amb10567751 [0,0,0,1,0,0|2,0,1]=4 2966 B7R1.2 C[C@@H]1CC[C@@H](O)O1 Amb25176141 [0,0,0,1,0,0|0,0,2]=3 2967 B7R1.2 C[C@@H]1CC[C@H](C)N1 Amb24681649 [0,0,0,1,0,0|2,0,1]=4 2968 B7R1.2 C[C@@H]1CC[C@H](C)O1 Amb22799402 [0,0,0,1,0,0|1,0,1]=3 2969 B7R1.2 C[C@@H]1CC[C@H](N1)C Amb17613372 [0,0,0,1,0,0|2,0,1]=4 2970 B7R1.2 C[C@@H]1CC[C@H](O)O1 Amb25175220 [0,0,0,1,0,0|0,0,2]=3 2971 B7R1.2 C[C@@H]1CN=C(N)S1 Amb24479897 [0,0,0,1,0,0|2,1,0]=4 2972 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,0,0,1,0,0|2,0,0]=3 2973 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [0,0,0,1,0,0|1,0,0]=2 2974 B7R1.2 C[C@@H]1CNC(=S)S1 Amb25686959 [0,0,0,1,0,0|1,2,0]=4 2975 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,0,0,1,0,0|2,0,0]=3 2976 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,0,0,1,0,0|2,0,0]=3 2977 B7R1.2 C[C@@H]1COC(=S)N1 Amb25823566 [0,0,0,1,0,0|2,1,0]=4 2978 B7R1.2 C[C@@H]1COC(C)=N1 Amb24480955 [0,0,0,1,0,0|3,0,0]=4 2979 B7R1.2 C[C@@H]1CSC(=S)N1 Amb24641156 [0,0,0,1,0,0|2,1,0]=4 2980 B7R1.2 C[C@@H]1C[C@@H](C)CC1 Amb22747863 [0,0,0,1,0,0|2,0,1]=4 2981 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22745222 [0,0,0,1,0,0|2,0,1]=4 2982 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [0,0,0,1,0,0|2,0,1]=4 2983 B7R1.2 C[C@@H]1C[C@H](Br)CC1 Amb25026616 [0,0,0,1,0,0|2,0,1]=4 2984 B7R1.2 C[C@@H]1C[C@H](C)CC1 Amb22230412 [0,0,0,1,0,0|2,0,1]=4 2985 B7R1.2 C[C@@H]1C[C@H](I)CC1 Amb24561074 [0,0,0,1,0,0|2,0,1]=4 2986 B7R1.2 C[C@@H]1C[C@H](N)CC1 Amb25179651 [0,0,0,1,0,0|2,0,1]=4 2987 B7R1.2 C[C@@H]1C[C@H](O)CC1 Amb25241408 [0,0,0,1,0,0|1,0,1]=3 2988 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [0,0,0,1,0,0|2,0,1]=4 2989 B7R1.2 C[C@H]1C=CC(=O)O1 Amb13887292 [0,0,0,1,0,0|0,0,2]=3 2990 B7R1.2 C[C@H]1CC(=O)CN1 Amb25746539 [0,0,0,1,0,0|2,0,0]=3 2991 B7R1.2 C[C@H]1CCC(C)N1 Amb25147635 [0,0,0,1,0,0|2,0,1]=4 2992 B7R1.2 C[C@H]1CCC(O)O1 Amb25796315 [0,0,0,1,0,0|0,0,2]=3 2993 B7R1.2 C[C@H]1CC[C@H](C)O1 Amb25810674 [0,0,0,1,0,0|1,0,1]=3 2994 B7R1.2 C[C@H]1CN=C(N)S1 Amb24479830 [0,0,0,1,0,0|2,1,0]=4 2995 B7R1.2 C[C@H]1CNC(=O)O1 Amb24480854 [0,0,0,1,0,0|1,0,0]=2 2996 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,0,0,1,0,0|2,0,0]=3 2997 B7R1.2 C[C@H]1COC(=S)N1 Amb24480906 [0,0,0,1,0,0|2,1,0]=4 2998 B7R1.2 C[C@H]1COC(N)=N1 Amb24654801 [0,0,0,1,0,0|3,0,0]=4 2999 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb24560197 [0,0,0,1,0,0|2,0,1]=4 3000 B7R1.2 C[C@H]1C[C@H](C)CC1 Amb25176920 [0,0,0,1,0,0|2,0,1]=4 3001 B7R1.2 C[C@H]1C[C@H](I)CC1 Amb25338105 [0,0,0,1,0,0|2,0,1]=4 3002 B7R1.2 C[C@H]1C[C@H](O)CC1 Amb25241604 [0,0,0,1,0,0|1,0,1]=3 3003 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb24523959 [0,0,0,1,0,0|2,0,1]=4 3004 B7R1.2 C[C@H]1C[C@H](O)CO1 Amb25212245 [0,0,0,1,0,0|2,0,1]=4 3005 B7R1.2 ClC1CCC(Cl)O1 Amb25061300 [0,0,0,1,0,0|2,0,1]=4 3006 B7R1.2 ClC1COC(=O)O1 Amb10842117 [0,0,0,1,0,0|2,0,0]=3 3007 B7R1.2 FC1COC(=O)O1 Amb10841016 [0,0,0,1,0,0|2,0,0]=3 3008 B7R1.2 N=C1CCC(=O)N1 Amb10552414 [0,0,0,1,0,0|2,0,1]=4 3009 B7R1.2 NC1=NCC(=O)O1 Amb24061087 [0,0,0,1,0,0|2,0,1]=4 3010 B7R1.2 NC1C=CC(=O)O1 Amb24349779 [0,0,0,1,0,0|1,0,2]=4 3011 B7R1.2 NC1CC(=O)CC1 Amb22236085 [0,0,0,1,0,0|2,0,0]=3 3012 B7R1.2 NC1CC(=O)CC1 Amb22494268 [0,0,0,1,0,0|2,0,0]=3 3013 B7R1.2 NC1CC(=O)CS1 Amb25090377 [0,0,0,1,0,0|3,0,0]=4 3014 B7R1.2 NC1CC(O)CC1 Amb18561405 [0,0,0,1,0,0|2,0,1]=4 3015 B7R1.2 NC1CC(O)CC1 Amb19958405 [0,0,0,1,0,0|2,0,1]=4 3016 B7R1.2 NC1CCC(=O)N1 Amb24480433 [0,0,0,1,0,0|2,0,0]=3 3017 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,0,0,1,0,0|1,0,0]=2 3018 B7R1.2 NC1CCC(=O)S1 Amb24479819 [0,0,0,1,0,0|1,1,0]=3 3019 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,0,0,1,0,0|3,0,0]=4 3020 B7R1.2 NC1COC(=O)N1 Amb23590649 [0,0,0,1,0,0|3,0,0]=4 3021 B7R1.2 NC1CS(=O)CC1 Amb19149072 [0,0,0,1,0,0|3,0,0]=4 3022 B7R1.2 NC1CS(=O)CC1 Amb25133789 [0,0,0,1,0,0|3,0,0]=4 3023 B7R1.2 NC1NC(=O)CO1 Amb25709500 [0,0,0,1,0,0|3,0,0]=4 3024 B7R1.2 NC1NC(=O)CS1 Amb1922196 [0,0,0,1,0,0|3,0,0]=4 3025 B7R1.2 NC1NCC(=O)N1 Amb24079615 [0,0,0,1,0,0|3,0,0]=4 3026 B7R1.2 N[C@@H]1CC[C@@H](C1)O Amb10066973 [0,0,0,1,0,0|2,0,1]=4 3027 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb10066961 [0,0,0,1,0,0|2,0,1]=4 3028 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb16233749 [0,0,0,1,0,0|2,0,1]=4 3029 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,0,0,1,0,0|3,0,0]=4 3030 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,0,0,1,0,0|3,0,0]=4 3031 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22386861 [0,0,0,1,0,0|2,0,1]=4 3032 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22746957 [0,0,0,1,0,0|2,0,1]=4 3033 B7R1.2 N[C@@H]1C[C@H](O)CC1 Amb22274622 [0,0,0,1,0,0|2,0,1]=4 3034 B7R1.2 N[C@H]1CC(=O)OC1 Amb16233747 [0,0,0,1,0,0|3,0,0]=4 3035 B7R1.2 N[C@H]1CC[C@@H](C1)O Amb10066972 [0,0,0,1,0,0|2,0,1]=4 3036 B7R1.2 N[C@H]1CC[C@H](C1)O Amb10066971 [0,0,0,1,0,0|2,0,1]=4 3037 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,0,0,1,0,0|3,0,0]=4 3038 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,0,0,1,0,0|3,0,0]=4 3039 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,0,0,1,0,0|3,0,0]=4 3040 B7R1.2 N[C@H]1C[C@@H](O)CC1 Amb22406236 [0,0,0,1,0,0|2,0,1]=4 3041 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [0,0,0,1,0,0|1,0,2]=4 3042 B7R1.2 O=C1C=CC(I)O1 Amb25325287 [0,0,0,1,0,0|1,0,2]=4 3043 B7R1.2 O=C1CC(Br)CC1 Amb24334292 [0,0,0,1,0,0|2,0,0]=3 3044 B7R1.2 O=C1CC(Br)CO1 Amb25803413 [0,0,0,1,0,0|3,0,0]=4 3045 B7R1.2 O=C1CC(Cl)CO1 Amb24608923 [0,0,0,1,0,0|3,0,0]=4 3046 B7R1.2 O=C1CC(F)CC1 Amb21963553 [0,0,0,1,0,0|2,0,0]=3 3047 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,0,0,1,0,0|3,0,0]=4 3048 B7R1.2 O=C1CC(I)CC1 Amb22001809 [0,0,0,1,0,0|2,0,0]=3 3049 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,0,0,1,0,0|3,0,0]=4 3050 B7R1.2 O=C1CCC(=O)[15NH]1 Amb22338306 [0,0,0,1,0,0|2,0,1]=4 3051 B7R1.2 O=C1CCC(Br)=C1 Amb23399816 [0,0,0,1,0,0|2,0,1]=4 3052 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,0,0,1,0,0|1,0,0]=2 3053 B7R1.2 O=C1CCC(Cl)=N1 Amb24712377 [0,0,0,1,0,0|2,0,1]=4 3054 B7R1.2 O=C1CCC(Cl)N1 Amb24689591 [0,0,0,1,0,0|2,0,0]=3 3055 B7R1.2 O=C1CCC(I)=C1 Amb25811714 [0,0,0,1,0,0|2,0,1]=4 3056 B7R1.2 O=C1CC[C@@H](Cl)O1 Amb24710047 [0,0,0,1,0,0|1,0,0]=2 3057 B7R1.2 O=C1CNC(S)S1 Amb24460897 [0,0,0,1,0,0|2,1,0]=4 3058 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,0,0,1,0,0|3,0,0]=4 3059 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,0,0,1,0,0|3,0,0]=4 3060 B7R1.2 O=C1OCC(I)O1 Amb25681787 [0,0,0,1,0,0|2,0,0]=3 3061 B7R1.2 O=C1[14CH2][14CH2]C(=O)O1 Amb22729170 [0,0,0,1,0,0|1,0,1]=3 3062 B7R1.2 O=[13C]1CC[13C](=O)O1 Amb20243426 [0,0,0,1,0,0|1,0,1]=3 3063 B7R1.2 O=[13C]1[13CH2][13CH2][13C](=O)O1 Amb22056174 [0,0,0,1,0,0|1,0,1]=3 3064 B7R1.2 OC1C=CC(=O)O1 Amb24544763 [0,0,0,1,0,0|1,0,2]=4 3065 B7R1.2 OC1CC(=O)CC1 Amb22057378 [0,0,0,1,0,0|2,0,0]=3 3066 B7R1.2 OC1CC(Br)CC1 Amb25275238 [0,0,0,1,0,0|2,0,1]=4 3067 B7R1.2 OC1CC(S)CC1 Amb25051687 [0,0,0,1,0,0|2,0,1]=4 3068 B7R1.2 OC1CCC(=O)N1 Amb21963236 [0,0,0,1,0,0|2,0,0]=3 3069 B7R1.2 OC1CCC(=O)O1 Amb22740957 [0,0,0,1,0,0|1,0,0]=2 3070 B7R1.2 OC1CCC(Cl)=C1 Amb24661186 [0,0,0,1,0,0|3,0,0]=4 3071 B7R1.2 OC1CNC(=O)C1 Amb19958404 [0,0,0,1,0,0|3,0,0]=4 3072 B7R1.2 OC1COC(=O)N1 Amb24428770 [0,0,0,1,0,0|3,0,0]=4 3073 B7R1.2 O[C@@H]1C=CC(=O)O1 Amb25064237 [0,0,0,1,0,0|1,0,2]=4 3074 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [0,0,0,1,0,0|3,0,0]=4 3075 B7R1.2 O[C@@H]1CN(O)CC1 Amb25025106 [0,0,0,1,0,0|3,0,0]=4 3076 B7R1.2 O[C@H]1C=CC(=O)O1 Amb24479542 [0,0,0,1,0,0|1,0,2]=4 3077 B7R1.2 O[C@H]1CCC(Br)=C1 Amb24479014 [0,0,0,1,0,0|3,0,0]=4 3078 B7R1.2 O[C@H]1C[C@H](O)CC1 Amb24519755 [0,0,0,1,0,0|2,0,1]=4 3079 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,0,0,1,0,0|3,0,0]=4 3080 B7R1.3 BN1CCCCC1 Amb24621882 [0,0,0,1,0,0|3,0,0]=4 3081 B7R1.3 BrC1=CCCCO1 Amb24322651 [0,0,0,1,0,0|1,0,1]=3 3082 B7R1.3 BrC1=COCCO1 Amb24322806 [0,0,0,1,0,0|2,0,1]=4 3083 B7R1.3 BrC1CCCCO1 Amb24322575 [0,0,0,1,0,0|1,0,1]=3 3084 B7R1.3 BrC1COCCO1 Amb24322807 [0,0,0,1,0,0|2,0,1]=4 3085 B7R1.3 BrC=1CCCCC1 Amb21856761 [0,0,0,1,0,0|2,0,0]=3 3086 B7R1.3 BrC=1CCCOC1 Amb24322600 [0,0,0,1,0,0|3,0,0]=4 3087 B7R1.3 BrC=1CCNCC1 Amb24317585 [0,0,0,1,0,0|3,0,0]=4 3088 B7R1.3 BrC=1CCOCC1 Amb21964919 [0,0,0,1,0,0|3,0,0]=4 3089 B7R1.3 BrC=1CCSCC1 Amb22229691 [0,0,0,1,0,0|3,0,0]=4 3090 B7R1.3 C=C1CCNCC1 Amb19514763 [0,0,0,1,0,0|3,0,0]=4 3091 B7R1.3 C=C1CCNCC1 Amb24079604 [0,0,0,1,0,0|3,0,0]=4 3092 B7R1.3 C=C1CCOCC1 Amb22000865 [0,0,0,1,0,0|3,0,0]=4 3093 B7R1.3 C=C1CCSCC1 Amb25811623 [0,0,0,1,0,0|3,0,0]=4 3094 B7R1.3 C=C1CNCCC1 Amb19514641 [0,0,0,1,0,0|3,0,0]=4 3095 B7R1.3 C=C1CNCCC1 Amb22059305 [0,0,0,1,0,0|3,0,0]=4 3096 B7R1.3 C=C1CNCCO1 Amb25800394 [0,0,0,1,0,0|2,0,0]=3 3097 B7R1.3 C=C1CSCCC1 Amb22494848 [0,0,0,1,0,0|3,0,0]=4 3098 B7R1.3 C=C1OCCCO1 Amb25734089 [0,0,0,1,0,0|2,0,0]=3 3099 B7R1.3 CB1OCCCO1 Amb25273130 [0,0,0,1,0,0|3,0,0]=4 3100 B7R1.3 CC1=CCCCO1 Amb24480530 [0,0,0,1,0,0|1,0,1]=3 3101 B7R1.3 CC1=NCCCS1 Amb25808748 [0,0,0,1,0,0|2,1,0]=4 3102 B7R1.3 CC1CCCCN1 Amb10552680 [0,0,0,1,0,0|2,0,1]=4 3103 B7R1.3 CC1CCCCS1 Amb17666899 [0,0,0,1,0,0|1,1,1]=4 3104 B7R1.3 CC1CCOCO1 Amb17776591 [0,0,0,1,0,0|2,0,1]=4 3105 B7R1.3 CC1CNCCO1 Amb20621613 [0,0,0,1,0,0|2,0,1]=4 3106 B7R1.3 CC1NCCCO1 Amb17506191 [0,0,0,1,0,0|2,0,1]=4 3107 B7R1.3 CC=1CCCNC1 Amb25694414 [0,0,0,1,0,0|3,0,0]=4 3108 B7R1.3 CC=1CCNCC1 Amb18639053 [0,0,0,1,0,0|3,0,0]=4 3109 B7R1.3 CC=1CCNCC1 Amb21961140 [0,0,0,1,0,0|3,0,0]=4 3110 B7R1.3 CC=1CCOCC1 Amb24070517 [0,0,0,1,0,0|3,0,0]=4 3111 B7R1.3 CC=1CNCCC1 Amb23439963 [0,0,0,1,0,0|3,0,0]=4 3112 B7R1.3 CC=1CNCCC1 Amb25063349 [0,0,0,1,0,0|3,0,0]=4 3113 B7R1.3 CC=1CNCCN1 Amb22755966 [0,0,0,1,0,0|3,0,0]=4 3114 B7R1.3 CN1CCCCN1 Amb24681349 [0,0,0,1,0,0|3,0,0]=4 3115 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [0,0,0,1,0,0|2,0,1]=4 3116 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [0,0,0,1,0,0|2,0,1]=4 3117 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [0,0,0,1,0,0|2,0,1]=4 3118 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [0,0,0,1,0,0|2,0,1]=4 3119 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [0,0,0,1,0,0|2,0,1]=4 3120 B7R1.3 ClC1CCCCN1 Amb20242688 [0,0,0,1,0,0|2,0,1]=4 3121 B7R1.3 ClC1CCCCO1 Amb17673285 [0,0,0,1,0,0|1,0,1]=3 3122 B7R1.3 ClC1COCCO1 Amb24677637 [0,0,0,1,0,0|2,0,1]=4 3123 B7R1.3 ClC=1CCOCC1 Amb24581676 [0,0,0,1,0,0|3,0,0]=4 3124 B7R1.3 ClC=1CCSCC1 Amb25025197 [0,0,0,1,0,0|3,0,0]=4 3125 B7R1.3 Cl[C@H]1CCCCO1 Amb24479760 [0,0,0,1,0,0|1,0,1]=3 3126 B7R1.3 FC1=COCCO1 Amb24322817 [0,0,0,1,0,0|2,0,1]=4 3127 B7R1.3 FC1CCCCO1 Amb24322826 [0,0,0,1,0,0|1,0,1]=3 3128 B7R1.3 FC1COCCO1 Amb24322827 [0,0,0,1,0,0|2,0,1]=4 3129 B7R1.3 FC=1CCCOC1 Amb24322810 [0,0,0,1,0,0|3,0,0]=4 3130 B7R1.3 FN1CCCCC1 Amb24541335 [0,0,0,1,0,0|3,0,0]=4 3131 B7R1.3 IC1=COCCO1 Amb24322818 [0,0,0,1,0,0|2,0,1]=4 3132 B7R1.3 IC=1CCCOC1 Amb24322812 [0,0,0,1,0,0|3,0,0]=4 3133 B7R1.3 IC=1CCOCC1 Amb25364046 [0,0,0,1,0,0|3,0,0]=4 3134 B7R1.3 N=C1CCCCN1 Amb17616049 [0,0,0,1,0,0|2,0,0]=3 3135 B7R1.3 N=C1CCNCC1 Amb24626089 [0,0,0,1,0,0|3,0,0]=4 3136 B7R1.3 N=C1CCOCC1 Amb24618556 [0,0,0,1,0,0|3,0,0]=4 3137 B7R1.3 N=C1CNCCN1 Amb24587647 [0,0,0,1,0,0|3,0,0]=4 3138 B7R1.3 N=C1CNCCS1 Amb24542565 [0,0,0,1,0,0|2,1,0]=4 3139 B7R1.3 N=C1COCCN1 Amb24654396 [0,0,0,1,0,0|3,0,0]=4 3140 B7R1.3 N=C1NCCCN1 Amb22642014 [0,0,0,1,0,0|3,0,0]=4 3141 B7R1.3 N=C1NCCCO1 Amb23597225 [0,0,0,1,0,0|2,0,0]=3 3142 B7R1.3 N=C1NCCCS1 Amb22524353 [0,0,0,1,0,0|2,1,0]=4 3143 B7R1.3 NC1=NCCCN1 Amb17608307 [0,0,0,1,0,0|3,0,0]=4 3144 B7R1.3 NC1CCCCC1 Amb17837163 [0,0,0,1,0,0|2,0,1]=4 3145 B7R1.3 NC1CCCCC1 Amb20246801 [0,0,0,1,0,0|2,0,1]=4 3146 B7R1.3 NC1CCCCC1 Amb22350215 [0,0,0,1,0,0|2,0,1]=4 3147 B7R1.3 NC1CCCCC1 Amb22352716 [0,0,0,1,0,0|2,0,1]=4 3148 B7R1.3 NC1CCCCN1 Amb16233706 [0,0,0,1,0,0|2,0,1]=4 3149 B7R1.3 NC1CCCCN1 Amb22491043 [0,0,0,1,0,0|2,0,1]=4 3150 B7R1.3 NC1CCCCO1 Amb25137158 [0,0,0,1,0,0|1,0,1]=3 3151 B7R1.3 NC=1NCCCN1 Amb18278170 [0,0,0,1,0,0|3,0,0]=4 3152 B7R1.3 N[C@@H]1CCCCO1 Amb25146492 [0,0,0,1,0,0|1,0,1]=3 3153 B7R1.3 O=C1C=CCCN1 Amb22001783 [0,0,0,1,0,0|1,0,2]=4 3154 B7R1.3 O=C1CC=CCC1 Amb22365196 [0,0,0,1,0,0|1,0,2]=4 3155 B7R1.3 O=C1CC=CCN1 Amb24697654 [0,0,0,1,0,0|1,0,2]=4 3156 B7R1.3 O=C1CCCC=C1 Amb17843126 [0,0,0,1,0,0|1,0,1]=3 3157 B7R1.3 O=C1CCCCS1 Amb25186924 [0,0,0,1,0,0|0,1,0]=2 3158 B7R1.3 O=C1CCCNC1 Amb10070944 [0,0,0,1,0,0|2,0,0]=3 3159 B7R1.3 O=C1CCCNC1 Amb10602349 [0,0,0,1,0,0|2,0,0]=3 3160 B7R1.3 O=C1CCCNN1 Amb18061622 [0,0,0,1,0,0|2,0,0]=3 3161 B7R1.3 O=C1CCCSC1 Amb13952257 [0,0,0,1,0,0|2,0,0]=3 3162 B7R1.3 O=C1CCOC=C1 Amb22000873 [0,0,0,1,0,0|2,0,1]=4 3163 B7R1.3 O=C1CCSC=C1 Amb25375022 [0,0,0,1,0,0|2,0,1]=4 3164 B7R1.3 O=C1CCSCC1 Amb1154265 [0,0,0,1,0,0|2,0,0]=3 3165 B7R1.3 O=C1CCSCN1 Amb24479868 [0,0,0,1,0,0|2,0,0]=3 3166 B7R1.3 O=C1CNCCC1 Amb19958010 [0,0,0,1,0,0|2,0,0]=3 3167 B7R1.3 O=C1CNCCO1 Amb19958702 [0,0,0,1,0,0|1,0,0]=2 3168 B7R1.3 O=C1CNCNC1 Amb24479362 [0,0,0,1,0,0|3,0,0]=4 3169 B7R1.3 O=C1COCC=C1 Amb22234519 [0,0,0,1,0,0|2,0,1]=4 3170 B7R1.3 O=C1COCCC1 Amb19373430 [0,0,0,1,0,0|2,0,0]=3 3171 B7R1.3 O=C1COCCN1 Amb15691115 [0,0,0,1,0,0|2,0,0]=3 3172 B7R1.3 O=C1COCCO1 Amb17933352 [0,0,0,1,0,0|1,0,0]=2 3173 B7R1.3 O=C1COCOC1 Amb25319015 [0,0,0,1,0,0|3,0,0]=4 3174 B7R1.3 O=C1CSCCS1 Amb24539369 [0,0,0,1,0,0|1,1,0]=3 3175 B7R1.3 O=C1CSCSC1 Amb19148039 [0,0,0,1,0,0|3,0,0]=4 3176 B7R1.3 O=C1CSSCC1 Amb25718327 [0,0,0,1,0,0|3,0,0]=4 3177 B7R1.3 O=C1NCCC=N1 Amb24480889 [0,0,0,1,0,0|2,0,1]=4 3178 B7R1.3 O=C1NCCCO1 Amb10608499 [0,0,0,1,0,0|1,0,0]=2 3179 B7R1.3 O=C1NCCCS1 Amb24117134 [0,0,0,1,0,0|1,1,0]=3 3180 B7R1.3 O=C1NCNCN1 Amb25146452 [0,0,0,1,0,0|3,0,0]=4 3181 B7R1.3 O=C1NCOCN1 Amb24561653 [0,0,0,1,0,0|3,0,0]=4 3182 B7R1.3 O=C1NCSCN1 Amb24480692 [0,0,0,1,0,0|3,0,0]=4 3183 B7R1.3 O=C1OCCC=C1 Amb15693457 [0,0,0,1,0,0|0,0,2]=3 3184 B7R1.3 O=S1CCNCC1 Amb18943760 [0,0,0,1,0,0|3,0,0]=4 3185 B7R1.3 O=S1CCSCC1 Amb25679286 [0,0,0,1,0,0|3,0,0]=4 3186 B7R1.3 O=S1OCCCO1 Amb20240777 [0,0,0,1,0,0|2,0,0]=3 3187 B7R1.3 O=[13C]1CCCCC1 Amb22367406 [0,0,0,1,0,0|1,0,0]=2 3188 B7R1.3 OC1=CCNCN1 Amb24607917 [0,0,0,1,0,0|2,0,1]=4 3189 B7R1.3 OC1CCCCN1 Amb20247437 [0,0,0,1,0,0|1,0,1]=3 3190 B7R1.3 OC1CCCCS1 Amb17615672 [0,0,0,1,0,0|0,1,1]=3 3191 B7R1.3 OC1CCCOC1 Amb16192108 [0,0,0,1,0,0|2,0,1]=4 3192 B7R1.3 OC1CCNCC1 Amb1152974 [0,0,0,1,0,0|2,0,1]=4 3193 B7R1.3 OC1CNCCN1 Amb23442001 [0,0,0,1,0,0|2,0,1]=4 3194 B7R1.3 OC1CNCCO1 Amb13883759 [0,0,0,1,0,0|1,0,2]=4 3195 B7R1.3 OC1CNCCO1 Amb22011707 [0,0,0,1,0,0|1,0,2]=4 3196 B7R1.3 OC1COCCO1 Amb24536571 [0,0,0,1,0,0|1,0,2]=4 3197 B7R1.3 OC1COCCS1 Amb24404788 [0,0,0,1,0,0|1,1,1]=4 3198 B7R1.3 OC1CSCCO1 Amb25721431 [0,0,0,1,0,0|1,0,2]=4 3199 B7R1.3 OC1CSCCS1 Amb25333667 [0,0,0,1,0,0|1,1,1]=4 3200 B7R1.3 OC1OCCCO1 Amb24736493 [0,0,0,1,0,0|1,0,2]=4 3201 B7R1.3 OC=1CCN=NC1 Amb22756935 [0,0,0,1,0,0|3,0,0]=4 3202 B7R1.3 OC=1CNCCN1 Amb22330543 [0,0,0,1,0,0|2,0,0]=3 3203 B7R1.3 ON1CCOCC1 Amb25243510 [0,0,0,1,0,0|3,0,0]=4 3204 B7R1.3 O[13CH]1CCCCC1 Amb22336567 [0,0,0,1,0,0|1,0,1]=3 3205 B7R1.3 O[C@@H]1CCCC=C1 Amb10601567 [0,0,0,1,0,0|1,0,2]=4 3206 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [0,0,0,1,0,0|2,0,1]=4 3207 B7R1.3 O[C@@H]1COCCC1 Amb20241306 [0,0,0,1,0,0|2,0,1]=4 3208 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [0,0,0,1,0,0|2,0,1]=4 3209 B7R1.3 O[C@H]1CNCCC1 Amb20241315 [0,0,0,1,0,0|2,0,1]=4 3210 B7R1.3 O[C@H]1CSCCC1 Amb25761109 [0,0,0,1,0,0|2,0,1]=4 3211 B7R1.3 PC1CCCCC1 Amb19889857 [0,0,0,1,0,0|2,0,1]=4 3212 B7R1.3 S=C1CCCCC1 Amb24565839 [0,0,0,1,0,0|1,1,0]=3 3213 B7R1.3 S=C1CNCCC1 Amb24334274 [0,0,0,1,0,0|2,1,0]=4 3214 B7R1.3 S=C1NCCCO1 Amb22524560 [0,0,0,1,0,0|1,1,0]=3 3215 B7R1.3 SC1=NCCCN1 Amb2537133 [0,0,0,1,0,0|2,1,0]=4 3216 B7R1.3 SN1CCCCC1 Amb24479351 [0,0,0,1,0,0|2,1,0]=4 3217 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [0,0,0,1,0,0|2,0,1]=4 3218 B7R1.3 [NH3+]C1CCCCC1 Amb10552681 [0,0,0,1,0,0|2,0,1]=4 3219 B7R1.3 [SiH3]N1CCCCC1 Amb24565228 [0,0,0,1,0,0|3,0,0]=4 3220 B7R1.5 C=C1CC1CCBr Amb25700897 [0,0,0,1,0,0|3,0,0]=4 3221 B7R1.5 C=C1CC1CCO Amb25251181 [0,0,0,1,0,0|3,0,0]=4 3222 B7R1.5 CC1CC1CCC Amb24699677 [0,0,0,1,0,0|2,0,1]=4 3223 B7R1.5 CC1OC1CCBr Amb24479229 [0,0,0,1,0,0|2,0,1]=4 3224 B7R1.5 CC1OC1CCI Amb25137116 [0,0,0,1,0,0|2,0,1]=4 3225 B7R1.5 CC1OC1CCO Amb24471660 [0,0,0,1,0,0|2,0,1]=4 3226 B7R1.5 CC1O[C@@H]1CCCl Amb24478558 [0,0,0,1,0,0|2,0,1]=4 3227 B7R1.5 CCCC1CC1N Amb18523756 [0,0,0,1,0,0|2,0,1]=4 3228 B7R1.5 CCCC1CC1N Amb20623324 [0,0,0,1,0,0|2,0,1]=4 3229 B7R1.5 CCCC1CC1O Amb25811022 [0,0,0,1,0,0|1,0,1]=3 3230 B7R1.5 CCCC1ON1C Amb22232363 [0,0,0,1,0,0|2,0,0]=3 3231 B7R1.5 CCC[C@H]1C[C@@H]1Cl Amb25176030 [0,0,0,1,0,0|2,0,1]=4 3232 B7R1.5 C[C@@H]1C[C@@H]1CCC Amb24544739 [0,0,0,1,0,0|2,0,1]=4 3233 B7R1.5 C[C@@H]1O[C@@H]1CCBr Amb25216935 [0,0,0,1,0,0|2,0,1]=4 3234 B7R1.5 C[C@@H]1O[C@@H]1CCO Amb25176735 [0,0,0,1,0,0|2,0,1]=4 3235 B7R1.5 C[C@H]1C[C@H]1CCC Amb25302063 [0,0,0,1,0,0|2,0,1]=4 3236 B7R1.5 C[C@H]1O[C@@H]1CCO Amb25226333 [0,0,0,1,0,0|2,0,1]=4 3237 B7R1.5 C[C@H]1O[C@H]1CCO Amb25025230 [0,0,0,1,0,0|2,0,1]=4 3238 B7R1.7 BrCCC[C@@H]1CO1 Amb25073870 [0,0,0,1,0,0|2,0,1]=4 3239 B7R1.7 BrCCC[C@H]1CO1 Amb24441393 [0,0,0,1,0,0|2,0,1]=4 3240 B7R1.7 CCCCC1CO1 Amb17771532 [0,0,0,1,0,0|1,0,1]=3 3241 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [0,0,0,1,0,0|1,0,1]=3 3242 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [0,0,0,1,0,0|1,0,1]=3 3243 B7R1.7 CCOCC1CO1 Amb1133334 [0,0,0,1,0,0|2,0,1]=4 3244 B7R1.7 CCSC[C@@H]1CO1 Amb25721898 [0,0,0,1,0,0|2,0,1]=4 3245 B7R1.7 CCSC[C@H]1CO1 Amb24747272 [0,0,0,1,0,0|2,0,1]=4 3246 B7R1.7 CSCCC1CO1 Amb25241000 [0,0,0,1,0,0|2,0,1]=4 3247 B7R1.7 ClCCCC1CO1 Amb24093915 [0,0,0,1,0,0|2,0,1]=4 3248 B7R1.7 ClCCCC=1CC1 Amb24681071 [0,0,0,1,0,0|3,0,0]=4 3249 B7R1.7 OCCC[C@H]1CO1 Amb24661078 [0,0,0,1,0,0|2,0,1]=4 3250 B7R1.10 C#C[C@@H]1CC(=O)N1 Amb24350194 [0,0,0,1,0,0|1,0,2]=4 3251 B7R1.10 C=C1CC(CBr)C1 Amb24365342 [0,0,0,1,0,0|3,0,0]=4 3252 B7R1.10 C=C1CC(CO)C1 Amb25854323 [0,0,0,1,0,0|3,0,0]=4 3253 B7R1.10 C=C[C@H]1CC(=O)N1 Amb24383478 [0,0,0,1,0,0|1,0,2]=4 3254 B7R1.10 CC1CC(CO)O1 Amb24413015 [0,0,0,1,0,0|2,0,1]=4 3255 B7R1.10 CCC1CC(=C)C1 Amb25719578 [0,0,0,1,0,0|2,0,0]=3 3256 B7R1.10 CCC1CC(=O)C1 Amb24406738 [0,0,0,1,0,0|1,0,0]=2 3257 B7R1.10 CCC1CC(O)C1 Amb24654646 [0,0,0,1,0,0|1,0,1]=3 3258 B7R1.10 CCN1CC(O)C1 Amb19516884 [0,0,0,1,0,0|2,0,1]=4 3259 B7R1.10 CCN1CC(O)C1 Amb21960744 [0,0,0,1,0,0|2,0,1]=4 3260 B7R1.10 CC[C@H]1CC(=O)N1 Amb24479784 [0,0,0,1,0,0|1,0,0]=2 3261 B7R1.10 CNC1CC(=C)C1 Amb16230428 [0,0,0,1,0,0|3,0,0]=4 3262 B7R1.10 CNC1CC(O)C1 Amb19149003 [0,0,0,1,0,0|2,0,1]=4 3263 B7R1.10 CNC1CC(O)C1 Amb20623567 [0,0,0,1,0,0|2,0,1]=4 3264 B7R1.10 CN[C@@H]1C[C@@H](O)C1 Amb23440035 [0,0,0,1,0,0|2,0,1]=4 3265 B7R1.10 CN[C@@H]1C[C@@H](O)C1 Amb25173769 [0,0,0,1,0,0|2,0,1]=4 3266 B7R1.10 CN[C@@H]1C[C@H](O)C1 Amb23440266 [0,0,0,1,0,0|2,0,1]=4 3267 B7R1.10 COC1CC(=C)C1 Amb24733012 [0,0,0,1,0,0|3,0,0]=4 3268 B7R1.10 COC1CC(=O)C1 Amb22754340 [0,0,0,1,0,0|2,0,0]=3 3269 B7R1.10 COC=1CC(=O)C1 Amb25092069 [0,0,0,1,0,0|2,0,1]=4 3270 B7R1.10 CSC1CC(=O)N1 Amb25265230 [0,0,0,1,0,0|2,0,0]=3 3271 B7R1.10 CSC1CC(O)C1 Amb24581791 [0,0,0,1,0,0|2,0,1]=4 3272 B7R1.10 ClCC1CC(=O)C1 Amb10610581 [0,0,0,1,0,0|2,0,0]=3 3273 B7R1.10 N#CC1CC(=O)C1 Amb10603718 [0,0,0,1,0,0|2,0,1]=4 3274 B7R1.10 NCC1CC(=C)C1 Amb10071401 [0,0,0,1,0,0|3,0,0]=4 3275 B7R1.10 NCC1CC(=C)C1 Amb10976021 [0,0,0,1,0,0|3,0,0]=4 3276 B7R1.10 NCC1CC(=O)C1 Amb18251063 [0,0,0,1,0,0|2,0,0]=3 3277 B7R1.10 NCC1CC(=O)C1 Amb22406094 [0,0,0,1,0,0|2,0,0]=3 3278 B7R1.10 NCC1CC(=O)N1 Amb25230632 [0,0,0,1,0,0|2,0,0]=3 3279 B7R1.10 NCC1CC(O)C1 Amb21962033 [0,0,0,1,0,0|2,0,1]=4 3280 B7R1.10 NCC1CC(O)C1 Amb22405901 [0,0,0,1,0,0|2,0,1]=4 3281 B7R1.10 NC[C@@H]1CC(=O)N1 Amb24120375 [0,0,0,1,0,0|2,0,0]=3 3282 B7R1.10 NC[C@@H]1C[C@@H](O)C1 Amb22899712 [0,0,0,1,0,0|2,0,1]=4 3283 B7R1.10 NC[C@@H]1C[C@@H](O)C1 Amb22899737 [0,0,0,1,0,0|2,0,1]=4 3284 B7R1.10 NC[C@@H]1C[C@H](O)C1 Amb22831753 [0,0,0,1,0,0|2,0,1]=4 3285 B7R1.10 NC[C@@H]1C[C@H](O)C1 Amb22899743 [0,0,0,1,0,0|2,0,1]=4 3286 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [0,0,0,1,0,0|2,0,0]=3 3287 B7R1.10 O=C1CC(CBr)N1 Amb25779168 [0,0,0,1,0,0|2,0,0]=3 3288 B7R1.10 O=C1CC(CI)O1 Amb25169535 [0,0,0,1,0,0|1,0,0]=2 3289 B7R1.10 O=CC1CC(=O)N1 Amb24479772 [0,0,0,1,0,0|2,0,1]=4 3290 B7R1.10 OC1CC(C1)CO Amb22284484 [0,0,0,1,0,0|2,0,1]=4 3291 B7R1.10 OC1CC(CCl)C1 Amb25083416 [0,0,0,1,0,0|2,0,1]=4 3292 B7R1.10 OCC1CC(=O)C1 Amb16231082 [0,0,0,1,0,0|2,0,0]=3 3293 B7R1.10 OCC1CC(=O)N1 Amb22388379 [0,0,0,1,0,0|2,0,0]=3 3294 B7R1.10 OCC1CC(=O)O1 Amb25706008 [0,0,0,1,0,0|1,0,0]=2 3295 B7R1.10 OC[C@@H]1CC(=O)N1 Amb24578924 [0,0,0,1,0,0|2,0,0]=3 3296 B7R1.10 OC[C@H]1CC(=O)O1 Amb25769462 [0,0,0,1,0,0|1,0,0]=2 3297 B7R1.10 O[C@H]1C[C@H](C1)CO Amb24665713 [0,0,0,1,0,0|2,0,1]=4 3298 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [0,0,0,1,0,0|0,0,2]=3 3299 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [0,0,0,1,0,0|0,0,2]=3 3300 B7R1.12 CC(=O)C1CC1Br Amb24426068 [0,0,0,1,0,0|2,0,0]=3 3301 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [0,0,0,1,0,0|2,0,0]=3 3302 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [0,0,0,1,0,0|2,0,0]=3 3303 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [0,0,0,1,0,0|2,0,0]=3 3304 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [0,0,0,1,0,0|2,0,0]=3 3305 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [0,0,0,1,0,0|2,0,0]=3 3306 B7R1.12 CC1=CC1C(C)=O Amb24736062 [0,0,0,1,0,0|1,0,2]=4 3307 B7R1.12 CC1CC1C(C)=C Amb25694889 [0,0,0,1,0,0|2,0,0]=3 3308 B7R1.12 CC1CC1C(C)=O Amb25720437 [0,0,0,1,0,0|1,0,0]=2 3309 B7R1.12 CC1CC1C(C)N Amb24592597 [0,0,0,1,0,0|2,0,1]=4 3310 B7R1.12 CC1CC1C(C)O Amb25849677 [0,0,0,1,0,0|1,0,1]=3 3311 B7R1.12 CC1CC1C(C)S Amb25102055 [0,0,0,1,0,0|1,1,1]=4 3312 B7R1.12 CC1CC1C(Cl)Cl Amb24595481 [0,0,0,1,0,0|2,0,1]=4 3313 B7R1.12 CC1CC1C(N)=N Amb25139920 [0,0,0,1,0,0|2,0,0]=3 3314 B7R1.12 CC1CC1C(N)=S Amb25302556 [0,0,0,1,0,0|1,1,0]=3 3315 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [0,0,0,1,0,0|1,0,1]=3 3316 B7R1.12 CC1CC1[C@H](C)N Amb25687220 [0,0,0,1,0,0|2,0,1]=4 3317 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [0,0,0,1,0,0|1,0,1]=3 3318 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|1,0,0]=2 3319 B7R1.12 CC1OC1C(C)O Amb24687071 [0,0,0,1,0,0|2,0,1]=4 3320 B7R1.12 CC1OC1[C@H](C)O Amb24529514 [0,0,0,1,0,0|2,0,1]=4 3321 B7R1.12 CC1SC1C(C)=O Amb24333031 [0,0,0,1,0,0|2,0,0]=3 3322 B7R1.12 C[C@@H]1C[C@@H]1B(O)O Amb24329037 [0,0,0,1,0,0|1,0,1]=3 3323 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [0,0,0,1,0,0|1,0,0]=2 3324 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [0,0,0,1,0,0|1,0,0]=2 3325 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [0,0,0,1,0,0|0,0,0]=1 3326 B7R1.12 C[C@@H]1C[C@H]1B(O)O Amb24330179 [0,0,0,1,0,0|1,0,1]=3 3327 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|1,0,0]=2 3328 B7R1.12 C[C@@H]1C[C@H]1C(C)N Amb24120602 [0,0,0,1,0,0|2,0,1]=4 3329 B7R1.12 C[C@@H]1C[C@H]1C(C)O Amb24714696 [0,0,0,1,0,0|1,0,1]=3 3330 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [0,0,0,1,0,0|0,0,0]=1 3331 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [0,0,0,1,0,0|1,0,0]=2 3332 B7R1.12 C[C@@H]1O[C@@H]1[C@@H](C)O Amb24630796 [0,0,0,1,0,0|2,0,1]=4 3333 B7R1.12 C[C@@H]1O[C@@H]1[C@H](C)O Amb25176663 [0,0,0,1,0,0|2,0,1]=4 3334 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [0,0,0,1,0,0|1,0,0]=2 3335 B7R1.12 C[C@@H]1O[C@H]1[C@@H](C)O Amb24570001 [0,0,0,1,0,0|2,0,1]=4 3336 B7R1.12 C[C@@H]1S[C@H]1C(C)=O Amb24374150 [0,0,0,1,0,0|2,0,0]=3 3337 B7R1.12 C[C@H]1C[C@@H]1B(O)O Amb24608885 [0,0,0,1,0,0|1,0,1]=3 3338 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [0,0,0,1,0,0|0,0,0]=1 3339 B7R1.12 C[C@H]1C[C@H]1B(O)O Amb24515113 [0,0,0,1,0,0|1,0,1]=3 3340 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|0,0,0]=1 3341 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [0,0,0,1,0,0|1,0,0]=2 3342 B7R1.12 C[C@H]1C[C@H]1C(C)O Amb24593507 [0,0,0,1,0,0|1,0,1]=3 3343 B7R1.12 C[C@H]1C[C@H]1[C@@H](C)O Amb25026747 [0,0,0,1,0,0|1,0,1]=3 3344 B7R1.12 C[C@H]1O[C@@H]1C(C)O Amb25173891 [0,0,0,1,0,0|2,0,1]=4 3345 B7R1.12 C[C@H]1O[C@H]1C(C)O Amb24597224 [0,0,0,1,0,0|2,0,1]=4 3346 B7R1.12 C[C@H]1O[C@H]1[C@H](C)O Amb24671875 [0,0,0,1,0,0|2,0,1]=4 3347 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [0,0,0,1,0,0|2,0,0]=3 3348 B7R1.12 NC1CC1C(N)=O Amb18279694 [0,0,0,1,0,0|2,0,0]=3 3349 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [0,0,0,1,0,0|1,0,0]=2 3350 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [0,0,0,1,0,0|1,0,0]=2 3351 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [0,0,0,1,0,0|1,0,0]=2 3352 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [0,0,0,1,0,0|2,0,0]=3 3353 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [0,0,0,1,0,0|2,0,0]=3 3354 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,1,0,0|2,0,0]=3 3355 B7R1.12 OB(O)C1CC1Br Amb24314265 [0,0,0,1,0,0|2,0,1]=4 3356 B7R1.12 OC(=O)C1CC1F Amb22490547 [0,0,0,1,0,0|1,0,0]=2 3357 B7R1.12 OC(=O)C1CC1S Amb20246988 [0,0,0,1,0,0|1,0,0]=2 3358 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [0,0,0,1,0,0|1,0,0]=2 3359 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|1,0,0]=2 3360 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|1,0,0]=2 3361 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|1,0,0]=2 3362 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|1,0,0]=2 3363 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|1,0,0]=2 3364 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|1,0,0]=2 3365 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|1,0,0]=2 3366 B7R1.12 OC1CC1C(O)=O Amb24360896 [0,0,0,1,0,0|1,0,0]=2 3367 B7R1.14 Br[Se]1(Br)CCCC1 Amb22345411 [0,0,0,1,0,0|3,0,0]=4 3368 B7R1.14 CC1(Br)CCCC1 Amb24612443 [0,0,0,1,0,0|2,0,1]=4 3369 B7R1.14 CC1(N)CCCC1 Amb10609055 [0,0,0,1,0,0|2,0,1]=4 3370 B7R1.14 CC1(O)CNCC1 Amb20623853 [0,0,0,1,0,0|2,0,1]=4 3371 B7R1.14 CC1(O)CNCC1 Amb20671400 [0,0,0,1,0,0|2,0,1]=4 3372 B7R1.14 CC1(O)COCC1 Amb20667835 [0,0,0,1,0,0|2,0,1]=4 3373 B7R1.14 CP1(=O)CCCO1 Amb22732093 [0,0,0,1,0,0|3,0,0]=4 3374 B7R1.14 C[C@@]1(O)CNCC1 Amb22748513 [0,0,0,1,0,0|2,0,1]=4 3375 B7R1.14 C[C@@]1(O)CNCC1 Amb22754367 [0,0,0,1,0,0|2,0,1]=4 3376 B7R1.14 C[C@]1(O)CNCC1 Amb24676068 [0,0,0,1,0,0|2,0,1]=4 3377 B7R1.14 C[Si]1(C)CCCC1 Amb19893503 [0,0,0,1,0,0|2,1,0]=4 3378 B7R1.14 C[Si]1(Cl)CCCC1 Amb19893715 [0,0,0,1,0,0|2,1,0]=4 3379 B7R1.14 ClC1(Cl)CCCC1 Amb22733951 [0,0,0,1,0,0|2,0,1]=4 3380 B7R1.14 Cl[Si]1(Cl)CCCC1 Amb19893524 [0,0,0,1,0,0|2,1,0]=4 3381 B7R1.14 FC1(F)CCCC1 Amb10838599 [0,0,0,1,0,0|2,0,1]=4 3382 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [0,0,0,1,0,0|2,0,0]=3 3383 B7R1.14 NC1(O)CCCC1 Amb24465053 [0,0,0,1,0,0|1,0,1]=3 3384 B7R1.17 CC1(O)CCC1N Amb24117490 [0,0,0,1,0,0|2,0,1]=4 3385 B7R1.17 CC1(O)CC[C@H]1O Amb25107621 [0,0,0,1,0,0|2,0,1]=4 3386 B7R1.17 CC1CCC1(C)O Amb24620558 [0,0,0,1,0,0|1,0,1]=3 3387 B7R1.17 CC1CCS1(=O)=O Amb22364950 [0,0,0,1,0,0|1,0,1]=3 3388 B7R1.17 C[C@@]1(O)CC[C@@H]1N Amb24694300 [0,0,0,1,0,0|2,0,1]=4 3389 B7R1.18 CC(=C)C1CCC1 Amb25662691 [0,0,0,1,0,0|2,0,0]=3 3390 B7R1.18 CC(=O)C1CC=C1 Amb25807635 [0,0,0,1,0,0|1,0,2]=4 3391 B7R1.18 CC(=O)C1CCO1 Amb25745997 [0,0,0,1,0,0|2,0,0]=3 3392 B7R1.18 CC(=O)C1CCS1 Amb24105980 [0,0,0,1,0,0|2,0,0]=3 3393 B7R1.18 CC(=O)C1CNC1 Amb23400009 [0,0,0,1,0,0|2,0,0]=3 3394 B7R1.18 CC(=O)C1CNC1 Amb23401240 [0,0,0,1,0,0|2,0,0]=3 3395 B7R1.18 CC(=O)C=1CCC1 Amb23453500 [0,0,0,1,0,0|1,0,2]=4 3396 B7R1.18 CC(=O)N1CCC1 Amb22008358 [0,0,0,1,0,0|2,0,0]=3 3397 B7R1.18 CC(C)C1CCC1 Amb24479859 [0,0,0,1,0,0|2,0,1]=4 3398 B7R1.18 CC(C1CCC1)O Amb10603414 [0,0,0,1,0,0|1,0,1]=3 3399 B7R1.18 CC(Cl)C1CCC1 Amb25186056 [0,0,0,1,0,0|2,0,1]=4 3400 B7R1.18 CC(N)C1CCC1 Amb24183538 [0,0,0,1,0,0|2,0,1]=4 3401 B7R1.18 CC(O)C1CCN1 Amb25195548 [0,0,0,1,0,0|2,0,1]=4 3402 B7R1.18 CC(O)C1CCS1 Amb24439190 [0,0,0,1,0,0|2,0,1]=4 3403 B7R1.18 CC(O)C1CNC1 Amb25832454 [0,0,0,1,0,0|2,0,1]=4 3404 B7R1.18 CC(S)C1CCC1 Amb24509376 [0,0,0,1,0,0|1,1,1]=4 3405 B7R1.18 CN(N)C1CCC1 Amb24396575 [0,0,0,1,0,0|3,0,0]=4 3406 B7R1.18 CS(=O)C1CNC1 Amb24506496 [0,0,0,1,0,0|3,0,0]=4 3407 B7R1.18 C[C@@H](N)C1CCC1 Amb22747302 [0,0,0,1,0,0|2,0,1]=4 3408 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [0,0,0,1,0,0|1,0,1]=3 3409 B7R1.18 C[C@H](N)C1CCC1 Amb24562787 [0,0,0,1,0,0|2,0,1]=4 3410 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [0,0,0,1,0,0|1,0,1]=3 3411 B7R1.18 C[C@H](O)[C@@H]1CCO1 Amb25745486 [0,0,0,1,0,0|2,0,1]=4 3412 B7R1.18 C[C@H](O)[C@H]1CCO1 Amb25256565 [0,0,0,1,0,0|2,0,1]=4 3413 B7R1.18 NC(=N)C1CCC1 Amb19894979 [0,0,0,1,0,0|2,0,0]=3 3414 B7R1.18 NC(=N)C1CNC1 Amb24542761 [0,0,0,1,0,0|3,0,0]=4 3415 B7R1.18 NC(=N)N1CCC1 Amb24655942 [0,0,0,1,0,0|3,0,0]=4 3416 B7R1.18 NC(=N)[C@H]1CCN1 Amb24542766 [0,0,0,1,0,0|3,0,0]=4 3417 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,0,1,0,0|2,0,0]=3 3418 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,0,1,0,0|2,0,0]=3 3419 B7R1.18 NC(=O)C1CCO1 Amb24478900 [0,0,0,1,0,0|2,0,0]=3 3420 B7R1.18 NC(=O)C1CNC1 Amb10976072 [0,0,0,1,0,0|2,0,0]=3 3421 B7R1.18 NC(=O)C1CNC1 Amb20061301 [0,0,0,1,0,0|2,0,0]=3 3422 B7R1.18 NC(=O)C1CNC1 Amb21960249 [0,0,0,1,0,0|2,0,0]=3 3423 B7R1.18 NC(=O)N1CCC1 Amb25326782 [0,0,0,1,0,0|2,0,0]=3 3424 B7R1.18 NC(=S)C1CCC1 Amb18108358 [0,0,0,1,0,0|1,1,0]=3 3425 B7R1.18 NC(=S)N1CCC1 Amb23443673 [0,0,0,1,0,0|2,1,0]=4 3426 B7R1.18 O=C(Cl)C1COC1 Amb25201101 [0,0,0,1,0,0|2,0,0]=3 3427 B7R1.18 OB(C1CCC1)O Amb10071491 [0,0,0,1,0,0|1,0,1]=3 3428 B7R1.18 OB(O)C1COC1 Amb24544756 [0,0,0,1,0,0|2,0,1]=4 3429 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [0,0,0,1,0,0|0,0,2]=3 3430 B7R1.18 OC(=O)C1CCN1 Amb2371568 [0,0,0,1,0,0|1,0,0]=2 3431 B7R1.18 OC(=O)C1CCO1 Amb2383526 [0,0,0,1,0,0|1,0,0]=2 3432 B7R1.18 OC(=O)C1CNC1 Amb2444164 [0,0,0,1,0,0|1,0,0]=2 3433 B7R1.18 OC(=O)C1CSC1 Amb20171470 [0,0,0,1,0,0|1,0,0]=2 3434 B7R1.18 OP(=O)C1CNC1 Amb25212879 [0,0,0,1,0,0|2,0,0]=3 3435 B7R1.18 SC(=S)N1CCC1 Amb24078325 [0,0,0,1,0,0|1,2,0]=4 3436 B7R1.18 [O-][N+](=O)C1CCC1 Amb13883563 [0,0,0,1,0,0|1,0,1]=3 3437 B7R1.18 [O-][N+](=O)C1COC1 Amb22289560 [0,0,0,1,0,0|2,0,1]=4 3438 B7R1.20 BrC(=CC1CC1)Br Amb17612546 [0,0,0,1,0,0|2,0,1]=4 3439 B7R1.20 CC(=N)NC1CC1 Amb25369501 [0,0,0,1,0,0|3,0,0]=4 3440 B7R1.20 CC(=O)CC1CC1 Amb10603417 [0,0,0,1,0,0|1,0,0]=2 3441 B7R1.20 CC(=O)CC1CO1 Amb25718439 [0,0,0,1,0,0|2,0,0]=3 3442 B7R1.20 CC(=O)OC1CC1 Amb24334499 [0,0,0,1,0,0|2,0,0]=3 3443 B7R1.20 CC(=O)OC1CO1 Amb25261586 [0,0,0,1,0,0|3,0,0]=4 3444 B7R1.20 CC(CN1CC1)O Amb17334047 [0,0,0,1,0,0|2,0,1]=4 3445 B7R1.20 CC(Cl)CC1CC1 Amb24635709 [0,0,0,1,0,0|2,0,1]=4 3446 B7R1.20 CC(N)CC1CC1 Amb18958998 [0,0,0,1,0,0|2,0,1]=4 3447 B7R1.20 CC(O)CC1CO1 Amb25745084 [0,0,0,1,0,0|2,0,1]=4 3448 B7R1.20 CN(CC1CC1)C Amb1795989 [0,0,0,1,0,0|3,0,0]=4 3449 B7R1.20 CS(=O)CC1CO1 Amb25060906 [0,0,0,1,0,0|3,0,0]=4 3450 B7R1.20 CS(=O)C[C@H]1CO1 Amb24431713 [0,0,0,1,0,0|3,0,0]=4 3451 B7R1.20 CS(=O)NC1CC1 Amb25231505 [0,0,0,1,0,0|3,0,0]=4 3452 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [0,0,0,1,0,0|1,0,1]=3 3453 B7R1.20 C[C@@H](O)CC1CO1 Amb24644146 [0,0,0,1,0,0|2,0,1]=4 3454 B7R1.20 C[C@@H](O)C[C@@H]1CO1 Amb24630371 [0,0,0,1,0,0|2,0,1]=4 3455 B7R1.20 C[C@H](O)CC1CO1 Amb25687860 [0,0,0,1,0,0|2,0,1]=4 3456 B7R1.20 ClC(Cl)CC1CC1 Amb25115823 [0,0,0,1,0,0|2,0,1]=4 3457 B7R1.20 NC(=N)CC1CC1 Amb21964664 [0,0,0,1,0,0|2,0,0]=3 3458 B7R1.20 NC(=N)NC1CC1 Amb21955694 [0,0,0,1,0,0|3,0,0]=4 3459 B7R1.20 NC(=N)NC1CC1 Amb22492366 [0,0,0,1,0,0|3,0,0]=4 3460 B7R1.20 NC(=N)NC1CC1 Amb22587163 [0,0,0,1,0,0|3,0,0]=4 3461 B7R1.20 NC(=O)CC1CO1 Amb24654802 [0,0,0,1,0,0|2,0,0]=3 3462 B7R1.20 NC(=O)NC1CC1 Amb1152776 [0,0,0,1,0,0|2,0,0]=3 3463 B7R1.20 NC(N)=NC1CC1 Amb19374402 [0,0,0,1,0,0|3,0,0]=4 3464 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [0,0,0,1,0,0|1,0,0]=2 3465 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [0,0,0,1,0,0|2,0,0]=3 3466 B7R1.20 OC(=O)CC1CO1 Amb25244347 [0,0,0,1,0,0|1,0,0]=2 3467 B7R1.20 [O-][N+](=O)CC1CC1 Amb23589308 [0,0,0,1,0,0|1,0,1]=3 3468 B7R1.20 [O-][N+](=O)CC1CO1 Amb23589333 [0,0,0,1,0,0|2,0,1]=4 3469 B7R1.20 [S-]C(=S)NC1CC1 Amb24645667 [0,0,0,1,0,0|1,2,0]=4 3470 B7R1.23 CCC1CC1(C)C Amb24333362 [0,0,0,1,0,0|2,0,1]=4 3471 B7R1.23 CCC1CC1(C)O Amb24334471 [0,0,0,1,0,0|1,0,1]=3 3472 B7R1.23 O=S1(=O)CC1CCl Amb25324479 [0,0,0,1,0,0|2,0,1]=4 3473 B4R0.1 BC(=O)OC Amb22337865 [2,0,0,0,0,0|2,0,0]=4 3474 B4R0.1 BC(=O)OC Amb25199772 [2,0,0,0,0,0|2,0,0]=4 3475 B4R0.1 BCC(C)=O Amb25024392 [2,0,0,0,0,0|2,0,0]=4 3476 B4R0.1 C=CC(O)=O Amb22227738 [2,0,0,0,0,0|0,0,2]=4 3477 B4R0.1 C=CC(O)=O Amb22336305 [2,0,0,0,0,0|0,0,2]=4 3478 B4R0.1 C=CC(O)=O Amb22338581 [2,0,0,0,0,0|0,0,2]=4 3479 B4R0.1 C=CC(O)=O Amb22351186 [2,0,0,0,0,0|0,0,2]=4 3480 B4R0.1 C=CC(O)=O Amb22351399 [2,0,0,0,0,0|0,0,2]=4 3481 B4R0.1 C=CC(O)=O Amb22363130 [2,0,0,0,0,0|0,0,2]=4 3482 B4R0.1 C=C[13C](O)=O Amb22351199 [2,0,0,0,0,0|0,0,2]=4 3483 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|2,0,0]=4 3484 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|2,0,0]=4 3485 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|2,0,0]=4 3486 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|2,0,0]=4 3487 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|2,0,0]=4 3488 B4R0.1 CCC(=C)Br Amb22052658 [2,0,0,0,0,0|2,0,0]=4 3489 B4R0.1 CCC(=C)C Amb10069004 [2,0,0,0,0,0|2,0,0]=4 3490 B4R0.1 CCC(=C)Cl Amb22228725 [2,0,0,0,0,0|2,0,0]=4 3491 B4R0.1 CCC(=C)O Amb22338693 [2,0,0,0,0,0|1,0,0]=3 3492 B4R0.1 CCC(=O)Cl Amb22338551 [2,0,0,0,0,0|1,0,0]=3 3493 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,0]=3 3494 B4R0.1 CCC(=S)N Amb1114671 [2,0,0,0,0,0|1,1,0]=4 3495 B4R0.1 CCC(N)O Amb25076743 [2,0,0,0,0,0|1,0,1]=4 3496 B4R0.1 CCC(O)=O Amb22363268 [2,0,0,0,0,0|0,0,0]=2 3497 B4R0.1 CCC(O)Br Amb25045070 [2,0,0,0,0,0|1,0,1]=4 3498 B4R0.1 CCC(O)Cl Amb24390895 [2,0,0,0,0,0|1,0,1]=4 3499 B4R0.1 CCC(O)S Amb25057963 [2,0,0,0,0,0|0,1,1]=4 3500 B4R0.1 CCC(S)=S Amb25219037 [2,0,0,0,0,0|0,2,0]=4 3501 B4R0.1 CCC([O-])=O Amb17942918 [2,0,0,0,0,0|0,0,1]=3 3502 B4R0.1 CCC([O-])=O Amb22043363 [2,0,0,0,0,0|0,0,1]=3 3503 B4R0.1 CCC([O-])=O Amb22053980 [2,0,0,0,0,0|0,0,1]=3 3504 B4R0.1 CCC([O-])=O Amb22353324 [2,0,0,0,0,0|0,0,1]=3 3505 B4R0.1 CCC([O-])=O Amb22730265 [2,0,0,0,0,0|0,0,1]=3 3506 B4R0.1 CCC([O-])=O Amb22731204 [2,0,0,0,0,0|0,0,1]=3 3507 B4R0.1 CCC([O-])=O Amb22732964 [2,0,0,0,0,0|0,0,1]=3 3508 B4R0.1 CCC([O-])=O Amb22733966 [2,0,0,0,0,0|0,0,1]=3 3509 B4R0.1 CCI(=O)=O Amb25809920 [2,0,0,0,0,0|1,0,1]=4 3510 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|2,0,0]=4 3511 B4R0.1 CCS(=O)Cl Amb24647938 [2,0,0,0,0,0|2,0,0]=4 3512 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|2,0,0]=4 3513 B4R0.1 CCS(N)=O Amb24734600 [2,0,0,0,0,0|2,0,0]=4 3514 B4R0.1 CCS(O)=O Amb24332177 [2,0,0,0,0,0|1,0,0]=3 3515 B4R0.1 CCS([O-])=O Amb17943109 [2,0,0,0,0,0|1,0,1]=4 3516 B4R0.1 CCS([O-])=O Amb22411287 [2,0,0,0,0,0|1,0,1]=4 3517 B4R0.1 CC[13C](O)=O Amb22336570 [2,0,0,0,0,0|0,0,0]=2 3518 B4R0.1 CC[13C](O)=O Amb22732548 [2,0,0,0,0,0|0,0,0]=2 3519 B4R0.1 CC[13C]([O-])=O Amb22363364 [2,0,0,0,0,0|0,0,1]=3 3520 B4R0.1 CC[C@@H](N)O Amb25824305 [2,0,0,0,0,0|1,0,1]=4 3521 B4R0.1 CNC(=O)Br Amb25764660 [2,0,0,0,0,0|2,0,0]=4 3522 B4R0.1 CNC(=O)N Amb1152075 [2,0,0,0,0,0|2,0,0]=4 3523 B4R0.1 CNC(Cl)=O Amb17942998 [2,0,0,0,0,0|2,0,0]=4 3524 B4R0.1 CNC(N)=O Amb22899158 [2,0,0,0,0,0|2,0,0]=4 3525 B4R0.1 CNC(O)=S Amb25747283 [2,0,0,0,0,0|1,1,0]=4 3526 B4R0.1 COC([O-])=O Amb22731820 [2,0,0,0,0,0|1,0,1]=4 3527 B4R0.1 COC([O-])=O Amb25688001 [2,0,0,0,0,0|1,0,1]=4 3528 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 3529 B4R0.1 CSC(C)=O Amb22043188 [2,0,0,0,0,0|2,0,0]=4 3530 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 3531 B4R0.1 C[13CH2]C([O-])=O Amb22368991 [2,0,0,0,0,0|0,0,1]=3 3532 B4R0.1 C[13CH2][13C]([O-])=O Amb22338749 [2,0,0,0,0,0|0,0,1]=3 3533 B4R0.1 FC(=O)CCl Amb10839258 [2,0,0,0,0,0|2,0,0]=4 3534 B4R0.1 FCC(=O)Cl Amb16185604 [2,0,0,0,0,0|2,0,0]=4 3535 B4R0.1 NC(=O)CCl Amb1933827 [2,0,0,0,0,0|2,0,0]=4 3536 B4R0.1 NC(=O)CCl Amb20620153 [2,0,0,0,0,0|2,0,0]=4 3537 B4R0.1 NC(=O)CN Amb22234569 [2,0,0,0,0,0|2,0,0]=4 3538 B4R0.1 NC(=O)CO Amb1804460 [2,0,0,0,0,0|2,0,0]=4 3539 B4R0.1 NCC(=O)N Amb10604177 [2,0,0,0,0,0|2,0,0]=4 3540 B4R0.1 NCC(=O)S Amb17593043 [2,0,0,0,0,0|1,1,0]=4 3541 B4R0.1 NCC(O)=O Amb22274145 [2,0,0,0,0,0|1,0,0]=3 3542 B4R0.1 NCC(O)=O Amb22731925 [2,0,0,0,0,0|1,0,0]=3 3543 B4R0.1 NCC([O-])=O Amb20240906 [2,0,0,0,0,0|1,0,1]=4 3544 B4R0.1 NCC([O-])=O Amb21962917 [2,0,0,0,0,0|1,0,1]=4 3545 B4R0.1 NCC([O-])=O Amb22167467 [2,0,0,0,0,0|1,0,1]=4 3546 B4R0.1 NCC([O-])=O Amb22167948 [2,0,0,0,0,0|1,0,1]=4 3547 B4R0.1 NCC([O-])=O Amb22336294 [2,0,0,0,0,0|1,0,1]=4 3548 B4R0.1 NCC([O-])=O Amb22493796 [2,0,0,0,0,0|1,0,1]=4 3549 B4R0.1 NCC([O-])=O Amb22729954 [2,0,0,0,0,0|1,0,1]=4 3550 B4R0.1 NCC([O-])=O Amb22729967 [2,0,0,0,0,0|1,0,1]=4 3551 B4R0.1 NCC([O-])=O Amb22733691 [2,0,0,0,0,0|1,0,1]=4 3552 B4R0.1 NC[13C](O)=O Amb22354047 [2,0,0,0,0,0|1,0,0]=3 3553 B4R0.1 N[13CH2]C(O)=O Amb22363299 [2,0,0,0,0,0|1,0,0]=3 3554 B4R0.1 N[13CH2][13C](O)=O Amb22351252 [2,0,0,0,0,0|1,0,0]=3 3555 B4R0.1 O=C(Cl)CI Amb22045163 [2,0,0,0,0,0|2,0,0]=4 3556 B4R0.1 O=C(F)CF Amb24476837 [2,0,0,0,0,0|2,0,0]=4 3557 B4R0.1 O=C(P)CCl Amb24377624 [2,0,0,0,0,0|2,0,0]=4 3558 B4R0.1 OC(=O)CI Amb1916034 [2,0,0,0,0,0|1,0,0]=3 3559 B4R0.1 OC(=O)CI Amb22274295 [2,0,0,0,0,0|1,0,0]=3 3560 B4R0.1 OC(=O)CI Amb22353096 [2,0,0,0,0,0|1,0,0]=3 3561 B4R0.1 OC(=O)CO Amb22338156 [2,0,0,0,0,0|1,0,0]=3 3562 B4R0.1 OC(=O)CP Amb24476887 [2,0,0,0,0,0|1,0,0]=3 3563 B4R0.1 OC(=O)CS Amb22360787 [2,0,0,0,0,0|1,0,0]=3 3564 B4R0.1 OC(=O)CS Amb24323537 [2,0,0,0,0,0|1,0,0]=3 3565 B4R0.1 OC(=O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 3566 B4R0.1 OC(=O)[13CH2]Br Amb22363172 [2,0,0,0,0,0|1,0,0]=3 3567 B4R0.1 OC(=O)[13CH2]Cl Amb22351601 [2,0,0,0,0,0|1,0,0]=3 3568 B4R0.1 OC(=O)[13CH2]I Amb22367368 [2,0,0,0,0,0|1,0,0]=3 3569 B4R0.1 OC(=S)CCl Amb25064312 [2,0,0,0,0,0|1,1,0]=4 3570 B4R0.1 OC(=[18O])CBr Amb22367291 [2,0,0,0,0,0|1,0,0]=3 3571 B4R0.1 OCC(=O)Cl Amb25121296 [2,0,0,0,0,0|2,0,0]=4 3572 B4R0.1 OCC(O)=S Amb25245907 [2,0,0,0,0,0|1,1,0]=4 3573 B4R0.1 OCP(=O)O Amb1981423 [2,0,0,0,0,0|2,0,0]=4 3574 B4R0.1 O[13CH2][13C](O)=O Amb22055344 [2,0,0,0,0,0|1,0,0]=3 3575 B4R0.1 O[13C](=O)CBr Amb22351346 [2,0,0,0,0,0|1,0,0]=3 3576 B4R0.1 O[13C](=O)CCl Amb22351545 [2,0,0,0,0,0|1,0,0]=3 3577 B4R0.1 O[13C](=O)CI Amb22367367 [2,0,0,0,0,0|1,0,0]=3 3578 B4R0.1 O[13C](=O)[13CH2]Br Amb22351322 [2,0,0,0,0,0|1,0,0]=3 3579 B4R0.1 O[13C](=O)[13CH2]Cl Amb17610796 [2,0,0,0,0,0|1,0,0]=3 3580 B4R0.1 O[13C](=O)[13CH2]I Amb22367449 [2,0,0,0,0,0|1,0,0]=3 3581 B4R0.1 O[13C](=O)[13CH]=O Amb22055361 [2,0,0,0,0,0|1,0,1]=4 3582 B4R0.1 O[13C](=O)[13CH]=[13CH2] Amb17607705 [2,0,0,0,0,0|0,0,2]=4 3583 B4R0.1 O[13C](=[18O])CBr Amb22337237 [2,0,0,0,0,0|1,0,0]=3 3584 B4R0.1 O[14C](=O)CBr Amb22731740 [2,0,0,0,0,0|1,0,0]=3 3585 B4R0.1 O[14C](=O)O[Na] Amb22350243 [2,0,0,0,0,0|2,0,0]=4 3586 B4R0.1 [13CH3]CC([O-])=O Amb22336277 [2,0,0,0,0,0|0,0,1]=3 3587 B4R0.1 [13CH3][13CH2]C(O)=O Amb22337241 [2,0,0,0,0,0|0,0,0]=2 3588 B4R0.1 [13CH3][13CH2][13C](O)=O Amb22367502 [2,0,0,0,0,0|0,0,0]=2 3589 B4R0.1 [15NH2]C(=O)CI Amb22367467 [2,0,0,0,0,0|2,0,0]=4 3590 B4R0.1 [15NH2]CC(O)=O Amb22337980 [2,0,0,0,0,0|1,0,0]=3 3591 B4R0.1 [15NH2]C[13C](O)=O Amb22367030 [2,0,0,0,0,0|1,0,0]=3 3592 B4R0.1 [15NH2][13CH2]C(O)=O Amb22353332 [2,0,0,0,0,0|1,0,0]=3 3593 B4R0.1 [15NH2][13CH2][13C](O)=O Amb22055358 [2,0,0,0,0,0|1,0,0]=3 3594 B4R0.1 [O-]C(=O)CBr Amb22049507 [2,0,0,0,0,0|1,0,1]=4 3595 B4R0.1 [O-]C(=O)CC Amb10844614 [2,0,0,0,0,0|0,0,1]=3 3596 B4R0.1 [O-]C(=O)CCl Amb22330602 [2,0,0,0,0,0|1,0,1]=4 3597 B4R0.1 [O-]C(=O)CF Amb10840933 [2,0,0,0,0,0|1,0,1]=4 3598 B4R0.1 [O-]C(=O)CF Amb22230760 [2,0,0,0,0,0|1,0,1]=4 3599 B4R0.1 [O-]C(=O)CF Amb22730747 [2,0,0,0,0,0|1,0,1]=4 3600 B4R0.1 [O-]C(=O)CI Amb22229643 [2,0,0,0,0,0|1,0,1]=4 3601 B4R0.1 [O-]C(=O)CO Amb22045509 [2,0,0,0,0,0|1,0,1]=4 3602 B4R0.1 [O-]C(=O)CO Amb22730982 [2,0,0,0,0,0|1,0,1]=4 3603 B4R0.1 [O-]CC([O-])=O Amb22739620 [2,0,0,0,0,0|1,0,1]=4 3604 B4R0.2 BrCCCI Amb18090828 [2,0,0,0,0,0|2,0,0]=4 3605 B4R0.2 BrC[13CH2]CBr Amb22367401 [2,0,0,0,0,0|2,0,0]=4 3606 B4R0.2 Br[13CH2]C[13CH2]Br Amb22353660 [2,0,0,0,0,0|2,0,0]=4 3607 B4R0.2 C#CCC=O Amb25681696 [2,0,0,0,0,0|0,0,2]=4 3608 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|0,0,2]=4 3609 B4R0.2 C=CCCCl Amb22229725 [2,0,0,0,0,0|1,0,1]=4 3610 B4R0.2 C=CCCI Amb24079603 [2,0,0,0,0,0|1,0,1]=4 3611 B4R0.2 C=CCCS Amb24117955 [2,0,0,0,0,0|1,0,1]=4 3612 B4R0.2 CC#CC=O Amb24477088 [2,0,0,0,0,0|0,0,2]=4 3613 B4R0.2 CCBCC Amb24425029 [2,0,0,0,0,0|1,0,1]=4 3614 B4R0.2 CCC#CO Amb22492573 [2,0,0,0,0,0|0,0,2]=4 3615 B4R0.2 CCC=C=C Amb10565985 [2,0,0,0,0,0|0,0,2]=4 3616 B4R0.2 CCC=CCl Amb22227554 [2,0,0,0,0,0|1,0,1]=4 3617 B4R0.2 CCC=NO Amb24369620 [2,0,0,0,0,0|1,0,1]=4 3618 B4R0.2 CCCCN Amb22002333 [2,0,0,0,0,0|1,0,0]=3 3619 B4R0.2 CCCCN Amb24325127 [2,0,0,0,0,0|1,0,0]=3 3620 B4R0.2 CCCCN Amb24325258 [2,0,0,0,0,0|1,0,0]=3 3621 B4R0.2 CCCCO Amb22336484 [2,0,0,0,0,0|0,0,0]=2 3622 B4R0.2 CCCCO Amb22338139 [2,0,0,0,0,0|0,0,0]=2 3623 B4R0.2 CCCCO Amb22338167 [2,0,0,0,0,0|0,0,0]=2 3624 B4R0.2 CCCCO Amb22351678 [2,0,0,0,0,0|0,0,0]=2 3625 B4R0.2 CCCCP Amb24334197 [2,0,0,0,0,0|1,0,0]=3 3626 B4R0.2 CCCCS Amb22367090 [2,0,0,0,0,0|0,1,0]=3 3627 B4R0.2 CCCC[*] Amb24270972 [2,0,0,0,0,0|1,0,0]=3 3628 B4R0.2 CCCC[Mg+] Amb22045798 [2,0,0,0,0,0|1,0,0]=3 3629 B4R0.2 CCCC[NH3+] Amb22366025 [2,0,0,0,0,0|1,0,0]=3 3630 B4R0.2 CCCC[O-] Amb17940588 [2,0,0,0,0,0|0,0,1]=3 3631 B4R0.2 CCCC[O-] Amb22045714 [2,0,0,0,0,0|0,0,1]=3 3632 B4R0.2 CCCC[O-] Amb22047270 [2,0,0,0,0,0|0,0,1]=3 3633 B4R0.2 CCCC[O-] Amb22052429 [2,0,0,0,0,0|0,0,1]=3 3634 B4R0.2 CCCC[O-] Amb22053566 [2,0,0,0,0,0|0,0,1]=3 3635 B4R0.2 CCCC[O-] Amb22053645 [2,0,0,0,0,0|0,0,1]=3 3636 B4R0.2 CCCC[O-] Amb22053708 [2,0,0,0,0,0|0,0,1]=3 3637 B4R0.2 CCCC[SiH3] Amb19883792 [2,0,0,0,0,0|0,1,0]=3 3638 B4R0.2 CCCC[Sn+3] Amb22053676 [2,0,0,0,0,0|1,0,0]=3 3639 B4R0.2 CCCC[Zn+] Amb22230365 [2,0,0,0,0,0|1,0,0]=3 3640 B4R0.2 CCCNC Amb1125050 [2,0,0,0,0,0|1,0,1]=4 3641 B4R0.2 CCCNC Amb13951517 [2,0,0,0,0,0|1,0,1]=4 3642 B4R0.2 CCCNN Amb22490873 [2,0,0,0,0,0|2,0,0]=4 3643 B4R0.2 CCCNO Amb20621997 [2,0,0,0,0,0|1,0,0]=3 3644 B4R0.2 CCCNO Amb24333131 [2,0,0,0,0,0|1,0,0]=3 3645 B4R0.2 CCCOC Amb22227974 [2,0,0,0,0,0|1,0,1]=4 3646 B4R0.2 CCCON Amb21929105 [2,0,0,0,0,0|2,0,0]=4 3647 B4R0.2 CCCO[NH3+] Amb2412392 [2,0,0,0,0,0|2,0,0]=4 3648 B4R0.2 CCCPC Amb24334551 [2,0,0,0,0,0|1,0,1]=4 3649 B4R0.2 CCCSC Amb22045208 [2,0,0,0,0,0|1,0,1]=4 3650 B4R0.2 CCCS[Na] Amb22352940 [2,0,0,0,0,0|2,0,0]=4 3651 B4R0.2 CCC[Hg]Cl Amb22730789 [2,0,0,0,0,0|2,0,0]=4 3652 B4R0.2 CCC[Mg]Br Amb17939070 [2,0,0,0,0,0|2,0,0]=4 3653 B4R0.2 CCC[Mg]Cl Amb22352591 [2,0,0,0,0,0|2,0,0]=4 3654 B4R0.2 CCC[SiH2]C Amb19892273 [2,0,0,0,0,0|0,1,1]=4 3655 B4R0.2 CCC[SiH2]S Amb24349756 [2,0,0,0,0,0|0,2,0]=4 3656 B4R0.2 CCC[Zn]Br Amb22000414 [2,0,0,0,0,0|2,0,0]=4 3657 B4R0.2 CCNC=C Amb24120592 [2,0,0,0,0,0|1,0,1]=4 3658 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|1,0,0]=3 3659 B4R0.2 CCNC=S Amb24476965 [2,0,0,0,0,0|1,1,0]=4 3660 B4R0.2 CCNCC Amb21520464 [2,0,0,0,0,0|1,0,1]=4 3661 B4R0.2 CCNCC Amb22047271 [2,0,0,0,0,0|1,0,1]=4 3662 B4R0.2 CCNCC Amb22055088 [2,0,0,0,0,0|1,0,1]=4 3663 B4R0.2 CCNCC Amb22230065 [2,0,0,0,0,0|1,0,1]=4 3664 B4R0.2 CCNCC Amb24325405 [2,0,0,0,0,0|1,0,1]=4 3665 B4R0.2 CCNCN Amb24476959 [2,0,0,0,0,0|2,0,0]=4 3666 B4R0.2 CCOC=C Amb2447619 [2,0,0,0,0,0|1,0,1]=4 3667 B4R0.2 CCOC=N Amb22167706 [2,0,0,0,0,0|2,0,0]=4 3668 B4R0.2 CCOCC Amb10807375 [2,0,0,0,0,0|1,0,1]=4 3669 B4R0.2 CCOCC Amb22041346 [2,0,0,0,0,0|1,0,1]=4 3670 B4R0.2 CCOCC Amb22336266 [2,0,0,0,0,0|1,0,1]=4 3671 B4R0.2 CCOCC Amb22366872 [2,0,0,0,0,0|1,0,1]=4 3672 B4R0.2 CCOCC Amb22735021 [2,0,0,0,0,0|1,0,1]=4 3673 B4R0.2 CCOCI Amb25719508 [2,0,0,0,0,0|2,0,0]=4 3674 B4R0.2 CCOCN Amb24629720 [2,0,0,0,0,0|2,0,0]=4 3675 B4R0.2 CCOCO Amb25042105 [2,0,0,0,0,0|1,0,0]=3 3676 B4R0.2 CCON=O Amb17938639 [2,0,0,0,0,0|2,0,0]=4 3677 B4R0.2 CCO[13CH]=O Amb22351501 [2,0,0,0,0,0|1,0,0]=3 3678 B4R0.2 CCPCC Amb19889866 [2,0,0,0,0,0|1,0,1]=4 3679 B4R0.2 CCSC=C Amb10604172 [2,0,0,0,0,0|1,0,1]=4 3680 B4R0.2 CCSCC Amb22002238 [2,0,0,0,0,0|1,0,1]=4 3681 B4R0.2 CC[15NH]CC Amb22351888 [2,0,0,0,0,0|1,0,1]=4 3682 B4R0.2 CC[Al+]CC Amb22053706 [2,0,0,0,0,0|1,0,1]=4 3683 B4R0.2 CC[Al+]CC Amb22053728 [2,0,0,0,0,0|1,0,1]=4 3684 B4R0.2 CC[AsH]CC Amb22734251 [2,0,0,0,0,0|1,0,1]=4 3685 B4R0.2 CC[Cd]CC Amb21520378 [2,0,0,0,0,0|1,0,1]=4 3686 B4R0.2 CC[Ga+]CC Amb22733949 [2,0,0,0,0,0|1,0,1]=4 3687 B4R0.2 CC[GeH2]CC Amb19930259 [2,0,0,0,0,0|0,1,1]=4 3688 B4R0.2 CC[Ge]CC Amb22730158 [2,0,0,0,0,0|0,1,1]=4 3689 B4R0.2 CC[Hg]CC Amb22732529 [2,0,0,0,0,0|1,0,1]=4 3690 B4R0.2 CC[N-]CC Amb22045676 [2,0,0,0,0,0|1,0,1]=4 3691 B4R0.2 CC[N-]CC Amb22045681 [2,0,0,0,0,0|1,0,1]=4 3692 B4R0.2 CC[N-]CC Amb22045887 [2,0,0,0,0,0|1,0,1]=4 3693 B4R0.2 CC[N-]CC Amb22045897 [2,0,0,0,0,0|1,0,1]=4 3694 B4R0.2 CC[N-]CC Amb22732897 [2,0,0,0,0,0|1,0,1]=4 3695 B4R0.2 CC[NH2+]CC Amb17942806 [2,0,0,0,0,0|1,0,1]=4 3696 B4R0.2 CC[NH2+]CC Amb24483037 [2,0,0,0,0,0|1,0,1]=4 3697 B4R0.2 CC[Se]CC Amb22338511 [2,0,0,0,0,0|1,0,1]=4 3698 B4R0.2 CC[SiH2]CC Amb19893778 [2,0,0,0,0,0|0,1,1]=4 3699 B4R0.2 CC[Sn+2]CC Amb22053681 [2,0,0,0,0,0|1,0,1]=4 3700 B4R0.2 CC[Te]CC Amb15692680 [2,0,0,0,0,0|1,0,1]=4 3701 B4R0.2 CC\C=C\Br Amb22002685 [2,0,0,0,0,0|1,0,1]=4 3702 B4R0.2 CC\C=C\Cl Amb25024567 [2,0,0,0,0,0|1,0,1]=4 3703 B4R0.2 CC\C=C\N Amb25188893 [2,0,0,0,0,0|1,0,1]=4 3704 B4R0.2 CC\C=N\O Amb24333315 [2,0,0,0,0,0|1,0,1]=4 3705 B4R0.2 CN=NCO Amb24478079 [2,0,0,0,0,0|2,0,0]=4 3706 B4R0.2 CNCCBr Amb20224134 [2,0,0,0,0,0|2,0,0]=4 3707 B4R0.2 CNCCBr Amb22753915 [2,0,0,0,0,0|2,0,0]=4 3708 B4R0.2 CNCCCl Amb19338156 [2,0,0,0,0,0|2,0,0]=4 3709 B4R0.2 CNCCCl Amb2196487 [2,0,0,0,0,0|2,0,0]=4 3710 B4R0.2 CNCCF Amb25292993 [2,0,0,0,0,0|2,0,0]=4 3711 B4R0.2 CNCCI Amb2099455 [2,0,0,0,0,0|2,0,0]=4 3712 B4R0.2 CNCCN Amb19958520 [2,0,0,0,0,0|2,0,0]=4 3713 B4R0.2 CNCCN Amb22491691 [2,0,0,0,0,0|2,0,0]=4 3714 B4R0.2 CNCCS Amb18641549 [2,0,0,0,0,0|1,1,0]=4 3715 B4R0.2 CNCNO Amb24392932 [2,0,0,0,0,0|2,0,0]=4 3716 B4R0.2 COCC=C Amb10070248 [2,0,0,0,0,0|1,0,1]=4 3717 B4R0.2 COCCF Amb24436610 [2,0,0,0,0,0|2,0,0]=4 3718 B4R0.2 COCCI Amb22228848 [2,0,0,0,0,0|2,0,0]=4 3719 B4R0.2 COCCO Amb22338563 [2,0,0,0,0,0|1,0,0]=3 3720 B4R0.2 COCC[O-] Amb22034397 [2,0,0,0,0,0|1,0,1]=4 3721 B4R0.2 COCC[O-] Amb22042733 [2,0,0,0,0,0|1,0,1]=4 3722 B4R0.2 COCC[O-] Amb22045683 [2,0,0,0,0,0|1,0,1]=4 3723 B4R0.2 COCC[O-] Amb22045752 [2,0,0,0,0,0|1,0,1]=4 3724 B4R0.2 COCC[O-] Amb22045812 [2,0,0,0,0,0|1,0,1]=4 3725 B4R0.2 COCC[O-] Amb22045867 [2,0,0,0,0,0|1,0,1]=4 3726 B4R0.2 COCC[O-] Amb22045871 [2,0,0,0,0,0|1,0,1]=4 3727 B4R0.2 COCC[O-] Amb22052469 [2,0,0,0,0,0|1,0,1]=4 3728 B4R0.2 COCC[O-] Amb22729947 [2,0,0,0,0,0|1,0,1]=4 3729 B4R0.2 COCC[O-] Amb22731112 [2,0,0,0,0,0|1,0,1]=4 3730 B4R0.2 CPCCN Amb24587761 [2,0,0,0,0,0|2,0,0]=4 3731 B4R0.2 CSCCBr Amb18176565 [2,0,0,0,0,0|2,0,0]=4 3732 B4R0.2 CSCCF Amb24477944 [2,0,0,0,0,0|2,0,0]=4 3733 B4R0.2 CSCCI Amb24477438 [2,0,0,0,0,0|2,0,0]=4 3734 B4R0.2 C[ClH]CCBr Amb25731779 [2,0,0,0,0,0|2,0,0]=4 3735 B4R0.2 C[Se]CC=C Amb22735092 [2,0,0,0,0,0|1,0,1]=4 3736 B4R0.2 C\C=C/CO Amb24089436 [2,0,0,0,0,0|0,0,2]=4 3737 B4R0.2 C\C=C\CC Amb22730891 [2,0,0,0,0,0|1,0,1]=4 3738 B4R0.2 ClCCC=O Amb16233605 [2,0,0,0,0,0|1,0,0]=3 3739 B4R0.2 FCCCBr Amb10845700 [2,0,0,0,0,0|2,0,0]=4 3740 B4R0.2 FCCCF Amb10839359 [2,0,0,0,0,0|2,0,0]=4 3741 B4R0.2 FCCCI Amb10838561 [2,0,0,0,0,0|2,0,0]=4 3742 B4R0.2 NCCC=C Amb10601640 [2,0,0,0,0,0|1,0,1]=4 3743 B4R0.2 NCCC=O Amb24476871 [2,0,0,0,0,0|1,0,0]=3 3744 B4R0.2 NCCCBr Amb22489540 [2,0,0,0,0,0|2,0,0]=4 3745 B4R0.2 NCCCF Amb16186035 [2,0,0,0,0,0|2,0,0]=4 3746 B4R0.2 NCCCF Amb19374917 [2,0,0,0,0,0|2,0,0]=4 3747 B4R0.2 NCCCN Amb21953130 [2,0,0,0,0,0|2,0,0]=4 3748 B4R0.2 NCCCN Amb21953284 [2,0,0,0,0,0|2,0,0]=4 3749 B4R0.2 NCCCN Amb22347967 [2,0,0,0,0,0|2,0,0]=4 3750 B4R0.2 NCCCN Amb22731203 [2,0,0,0,0,0|2,0,0]=4 3751 B4R0.2 NCCCN Amb24325075 [2,0,0,0,0,0|2,0,0]=4 3752 B4R0.2 NCCCN Amb24325119 [2,0,0,0,0,0|2,0,0]=4 3753 B4R0.2 NCCCO Amb22229163 [2,0,0,0,0,0|1,0,0]=3 3754 B4R0.2 NCCCO Amb22350557 [2,0,0,0,0,0|1,0,0]=3 3755 B4R0.2 NCCCP Amb24476866 [2,0,0,0,0,0|2,0,0]=4 3756 B4R0.2 NCCCS Amb17500723 [2,0,0,0,0,0|1,1,0]=4 3757 B4R0.2 NCCCS Amb18368606 [2,0,0,0,0,0|1,1,0]=4 3758 B4R0.2 NCCCS Amb20623313 [2,0,0,0,0,0|1,1,0]=4 3759 B4R0.2 NCCC[*] Amb24270973 [2,0,0,0,0,0|2,0,0]=4 3760 B4R0.2 NCCC[SiH3] Amb24568762 [2,0,0,0,0,0|1,1,0]=4 3761 B4R0.2 NCCNO Amb24476856 [2,0,0,0,0,0|2,0,0]=4 3762 B4R0.2 NCCS=O Amb25826403 [2,0,0,0,0,0|2,0,0]=4 3763 B4R0.2 NCNCO Amb24461606 [2,0,0,0,0,0|2,0,0]=4 3764 B4R0.2 NNCC=O Amb24550561 [2,0,0,0,0,0|2,0,0]=4 3765 B4R0.2 NOCCO Amb17190317 [2,0,0,0,0,0|2,0,0]=4 3766 B4R0.2 NOCCO Amb22896795 [2,0,0,0,0,0|2,0,0]=4 3767 B4R0.2 NSCCO Amb25025533 [2,0,0,0,0,0|2,0,0]=4 3768 B4R0.2 O=CCCBr Amb18124460 [2,0,0,0,0,0|1,0,0]=3 3769 B4R0.2 O=CCCF Amb21858609 [2,0,0,0,0,0|1,0,0]=3 3770 B4R0.2 O=CCN=O Amb24477338 [2,0,0,0,0,0|2,0,0]=4 3771 B4R0.2 O=CNCCl Amb24613099 [2,0,0,0,0,0|2,0,0]=4 3772 B4R0.2 O=NCCCl Amb25721260 [2,0,0,0,0,0|2,0,0]=4 3773 B4R0.2 OCCC=O Amb24412391 [2,0,0,0,0,0|1,0,0]=3 3774 B4R0.2 OCCCO Amb22369724 [2,0,0,0,0,0|1,0,0]=3 3775 B4R0.2 OCCCO Amb22733136 [2,0,0,0,0,0|1,0,0]=3 3776 B4R0.2 OCCNO Amb24477455 [2,0,0,0,0,0|2,0,0]=4 3777 B4R0.2 OCCNS Amb24478081 [2,0,0,0,0,0|2,0,0]=4 3778 B4R0.2 OCCSO Amb25840750 [2,0,0,0,0,0|2,0,0]=4 3779 B4R0.2 OCCSS Amb25058419 [2,0,0,0,0,0|2,0,0]=4 3780 B4R0.2 OCNCCl Amb16224807 [2,0,0,0,0,0|2,0,0]=4 3781 B4R0.2 OCOC=O Amb25694134 [2,0,0,0,0,0|2,0,0]=4 3782 B4R0.2 OCOCO Amb25024936 [2,0,0,0,0,0|2,0,0]=4 3783 B4R0.2 OC[13CH2]CO Amb22338655 [2,0,0,0,0,0|1,0,0]=3 3784 B4R0.2 O[13CH2][13CH2][13CH2]Br Amb22338924 [2,0,0,0,0,0|1,0,0]=3 3785 B4R0.2 O\C=C/CCl Amb22338049 [2,0,0,0,0,0|1,0,1]=4 3786 B4R0.2 PCCCBr Amb24477118 [2,0,0,0,0,0|2,0,0]=4 3787 B4R0.2 PCCCCl Amb24332665 [2,0,0,0,0,0|2,0,0]=4 3788 B4R0.2 PCCCP Amb22227719 [2,0,0,0,0,0|2,0,0]=4 3789 B4R0.2 SCCCBr Amb22270209 [2,0,0,0,0,0|1,1,0]=4 3790 B4R0.2 SCCCCl Amb22360786 [2,0,0,0,0,0|1,1,0]=4 3791 B4R0.2 [13CH3]O[13CH2][13CH2]O Amb22337754 [2,0,0,0,0,0|1,0,0]=3 3792 B4R0.2 [2H]OCCC Amb22731779 [2,0,0,0,0,0|2,0,0]=4 3793 B4R0.2 [C-]#[N+]CCC Amb24117082 [2,0,0,0,0,0|1,0,1]=4 3794 B6R0.1 C=C(CCO)C=O Amb25278289 [1,1,0,0,0,0|2,0,0]=4 3795 B6R0.1 C=C(CCO)CO Amb25825219 [1,1,0,0,0,0|2,0,0]=4 3796 B6R0.1 C=C(CO)CCN Amb24426567 [1,1,0,0,0,0|2,0,0]=4 3797 B6R0.1 C=CC(=O)CCCl Amb24446646 [1,1,0,0,0,0|2,0,0]=4 3798 B6R0.1 CCC(=C)CCC Amb22228810 [1,1,0,0,0,0|2,0,0]=4 3799 B6R0.1 CCC(=O)CCN Amb18202790 [1,1,0,0,0,0|2,0,0]=4 3800 B6R0.1 CCC(=O)CCS Amb24733984 [1,1,0,0,0,0|2,0,0]=4 3801 B6R0.1 CCC(=O)COC Amb19515551 [1,1,0,0,0,0|2,0,0]=4 3802 B6R0.1 CCC(=O)SCC Amb22043397 [1,1,0,0,0,0|2,0,0]=4 3803 B6R0.1 CCCC(=C)C=O Amb18639170 [1,1,0,0,0,0|1,0,0]=3 3804 B6R0.1 CCCC(=N)NO Amb10069022 [1,1,0,0,0,0|1,0,0]=3 3805 B6R0.1 CCCC(=O)C#C Amb25696103 [1,1,0,0,0,0|1,0,0]=3 3806 B6R0.1 CCCC(=O)C=O Amb18639569 [1,1,0,0,0,0|0,0,1]=3 3807 B6R0.1 CCCC(=O)CBr Amb24433274 [1,1,0,0,0,0|1,0,0]=3 3808 B6R0.1 CCCC(=O)CCl Amb19372924 [1,1,0,0,0,0|1,0,0]=3 3809 B6R0.1 CCCC(=O)CF Amb25370812 [1,1,0,0,0,0|1,0,0]=3 3810 B6R0.1 CCCC(=O)CN Amb17593086 [1,1,0,0,0,0|1,0,0]=3 3811 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|0,0,0]=2 3812 B6R0.1 CCCC(=O)CS Amb24631668 [1,1,0,0,0,0|0,1,0]=3 3813 B6R0.1 CCCC(=S)OC Amb22043317 [1,1,0,0,0,0|0,1,0]=3 3814 B6R0.1 CCCC(Br)C=O Amb18126388 [1,1,0,0,0,0|1,0,1]=4 3815 B6R0.1 CCCC(Br)CO Amb25320904 [1,1,0,0,0,0|1,0,1]=4 3816 B6R0.1 CCCC(C)=CBr Amb24373188 [1,1,0,0,0,0|2,0,0]=4 3817 B6R0.1 CCCC(C)=CC Amb25744974 [1,1,0,0,0,0|2,0,0]=4 3818 B6R0.1 CCCC(C)=NN Amb24673239 [1,1,0,0,0,0|2,0,0]=4 3819 B6R0.1 CCCC(C)=NO Amb24693854 [1,1,0,0,0,0|1,0,0]=3 3820 B6R0.1 CCCC(C)NO Amb25737149 [1,1,0,0,0,0|1,0,1]=4 3821 B6R0.1 CCCC(C)ON Amb24424249 [1,1,0,0,0,0|1,0,1]=4 3822 B6R0.1 CCCC(Cl)C=O Amb18124277 [1,1,0,0,0,0|1,0,1]=4 3823 B6R0.1 CCCC(F)C=O Amb24544750 [1,1,0,0,0,0|1,0,1]=4 3824 B6R0.1 CCCC(I)C=O Amb25290285 [1,1,0,0,0,0|1,0,1]=4 3825 B6R0.1 CCCC(O)C=C Amb22002474 [1,1,0,0,0,0|1,0,1]=4 3826 B6R0.1 CCCC(O)C=O Amb24531721 [1,1,0,0,0,0|0,0,1]=3 3827 B6R0.1 CCCC(O)CBr Amb24365915 [1,1,0,0,0,0|1,0,1]=4 3828 B6R0.1 CCCC(O)CCl Amb24470722 [1,1,0,0,0,0|1,0,1]=4 3829 B6R0.1 CCCC(O)NN Amb25282642 [1,1,0,0,0,0|1,0,1]=4 3830 B6R0.1 CCCN(C)N=O Amb25231763 [1,1,0,0,0,0|2,0,0]=4 3831 B6R0.1 CCCN(C)OC Amb25250408 [1,1,0,0,0,0|2,0,0]=4 3832 B6R0.1 CCCN(N)C=O Amb18121867 [1,1,0,0,0,0|2,0,0]=4 3833 B6R0.1 CCCS(=O)NC Amb24645515 [1,1,0,0,0,0|2,0,0]=4 3834 B6R0.1 CCCS(=O)NN Amb24707685 [1,1,0,0,0,0|2,0,0]=4 3835 B6R0.1 CCC[14C](=O)O[Na] Amb22352104 [1,1,0,0,0,0|0,0,0]=2 3836 B6R0.1 CCC[C@@H](C)CO Amb22823174 [1,1,0,0,0,0|1,0,1]=4 3837 B6R0.1 CCC[C@@H](N)CO Amb22756532 [1,1,0,0,0,0|1,0,1]=4 3838 B6R0.1 CCC[C@@H](O)CCl Amb22736025 [1,1,0,0,0,0|1,0,1]=4 3839 B6R0.1 CCC[C@@H](O)CN Amb24428580 [1,1,0,0,0,0|1,0,1]=4 3840 B6R0.1 CCC[C@@H](O)CO Amb25215310 [1,1,0,0,0,0|0,0,2]=4 3841 B6R0.1 CCC[C@H](Br)CO Amb24478880 [1,1,0,0,0,0|1,0,1]=4 3842 B6R0.1 CCC[C@H](Cl)C=O Amb24470180 [1,1,0,0,0,0|1,0,1]=4 3843 B6R0.1 CCC[C@H](Cl)CO Amb25858080 [1,1,0,0,0,0|1,0,1]=4 3844 B6R0.1 CCC[C@H](O)C=C Amb25133740 [1,1,0,0,0,0|1,0,1]=4 3845 B6R0.1 CCC[C@H](O)CCl Amb22735942 [1,1,0,0,0,0|1,0,1]=4 3846 B6R0.1 CCC[C@H](O)CO Amb22225461 [1,1,0,0,0,0|0,0,2]=4 3847 B6R0.1 CCC\C(\C)=C/Cl Amb25299421 [1,1,0,0,0,0|2,0,0]=4 3848 B6R0.1 CCC\C(\Cl)=C\Cl Amb24546444 [1,1,0,0,0,0|2,0,0]=4 3849 B6R0.1 CCC\C(\N)=N\N Amb17933232 [1,1,0,0,0,0|2,0,0]=4 3850 B6R0.1 CCC\C(\N)=N\O Amb19890174 [1,1,0,0,0,0|1,0,0]=3 3851 B6R0.1 CCNC(=N)CO Amb23514995 [1,1,0,0,0,0|2,0,0]=4 3852 B6R0.1 CCNC(=N)OC Amb25335141 [1,1,0,0,0,0|2,0,0]=4 3853 B6R0.1 CCNC(=O)C#C Amb24057137 [1,1,0,0,0,0|2,0,0]=4 3854 B6R0.1 CCNC(=O)CBr Amb2090261 [1,1,0,0,0,0|2,0,0]=4 3855 B6R0.1 CCNC(=O)CCl Amb1643925 [1,1,0,0,0,0|2,0,0]=4 3856 B6R0.1 CCNC(=O)CI Amb23512617 [1,1,0,0,0,0|2,0,0]=4 3857 B6R0.1 CCNC(=O)CN Amb21956656 [1,1,0,0,0,0|2,0,0]=4 3858 B6R0.1 CCNC(=O)N=O Amb25745700 [1,1,0,0,0,0|1,0,1]=4 3859 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|1,0,0]=3 3860 B6R0.1 CCNC(=O)ON Amb25108031 [1,1,0,0,0,0|1,0,0]=3 3861 B6R0.1 CCNC(N)=NO Amb24389708 [1,1,0,0,0,0|2,0,0]=4 3862 B6R0.1 CCOC(=C)C=O Amb18639586 [1,1,0,0,0,0|2,0,0]=4 3863 B6R0.1 CCOC(=C)CO Amb23585492 [1,1,0,0,0,0|2,0,0]=4 3864 B6R0.1 CCOC(=N)CO Amb17593094 [1,1,0,0,0,0|2,0,0]=4 3865 B6R0.1 CCOC(=O)C#C Amb2182884 [1,1,0,0,0,0|2,0,0]=4 3866 B6R0.1 CCOC(=O)C=C Amb22338016 [1,1,0,0,0,0|2,0,0]=4 3867 B6R0.1 CCOC(=O)CN Amb20246808 [1,1,0,0,0,0|2,0,0]=4 3868 B6R0.1 CCOC(=O)C[NH3+] Amb24113741 [1,1,0,0,0,0|2,0,0]=4 3869 B6R0.1 CCOC(=O)NCl Amb24381604 [1,1,0,0,0,0|2,0,0]=4 3870 B6R0.1 CCOC(=O)[13CH2]Br Amb22337807 [1,1,0,0,0,0|2,0,0]=4 3871 B6R0.1 CCOC(=O)[13CH2]N Amb22055360 [1,1,0,0,0,0|2,0,0]=4 3872 B6R0.1 CCOC(=S)C=O Amb25746370 [1,1,0,0,0,0|1,1,0]=4 3873 B6R0.1 CCOC(=S)CO Amb25720817 [1,1,0,0,0,0|1,1,0]=4 3874 B6R0.1 CCOC(O)C=O Amb25207812 [1,1,0,0,0,0|1,0,1]=4 3875 B6R0.1 CCOP(=O)CO Amb25219603 [1,1,0,0,0,0|2,0,0]=4 3876 B6R0.1 CCO[13C](=O)CBr Amb22363272 [1,1,0,0,0,0|2,0,0]=4 3877 B6R0.1 CCO[13C](=O)[13CH2]Br Amb22351963 [1,1,0,0,0,0|2,0,0]=4 3878 B6R0.1 CCO[13C](=O)[13CH2]Cl Amb17613989 [1,1,0,0,0,0|2,0,0]=4 3879 B6R0.1 CCO[13C](=O)[13CH2]N Amb17614823 [1,1,0,0,0,0|2,0,0]=4 3880 B6R0.1 CCO\C(\N)=N\O Amb25378748 [1,1,0,0,0,0|2,0,0]=4 3881 B6R0.1 CCSC(=O)CBr Amb25227484 [1,1,0,0,0,0|2,0,0]=4 3882 B6R0.1 CCSC(=O)CCl Amb24530234 [1,1,0,0,0,0|2,0,0]=4 3883 B6R0.1 CCSC(=O)CN Amb24479789 [1,1,0,0,0,0|2,0,0]=4 3884 B6R0.1 CCSC(=O)NN Amb25074866 [1,1,0,0,0,0|2,0,0]=4 3885 B6R0.1 CC[C@H](O)CCC Amb25781736 [1,1,0,0,0,0|1,0,1]=4 3886 B6R0.1 CC\C=C(/Br)\C=O Amb25278288 [1,1,0,0,0,0|1,0,1]=4 3887 B6R0.1 CC\C=C(/C)\CO Amb22347713 [1,1,0,0,0,0|1,0,1]=4 3888 B6R0.1 CC\C=C(/F)\C=O Amb25122538 [1,1,0,0,0,0|1,0,1]=4 3889 B6R0.1 CC\C=C(\Br)/C=O Amb18645748 [1,1,0,0,0,0|1,0,1]=4 3890 B6R0.1 CC\C=C(\C)/CO Amb24677771 [1,1,0,0,0,0|1,0,1]=4 3891 B6R0.1 CC\C=C(\Cl)/C=O Amb18640561 [1,1,0,0,0,0|1,0,1]=4 3892 B6R0.1 CC\C=C(\F)/CO Amb25692315 [1,1,0,0,0,0|1,0,1]=4 3893 B6R0.1 CNC(=O)CCBr Amb17332890 [1,1,0,0,0,0|2,0,0]=4 3894 B6R0.1 CNC(=O)CCCl Amb1130566 [1,1,0,0,0,0|2,0,0]=4 3895 B6R0.1 CNC(=O)CCI Amb25205915 [1,1,0,0,0,0|2,0,0]=4 3896 B6R0.1 CNC(=O)CCN Amb1139824 [1,1,0,0,0,0|2,0,0]=4 3897 B6R0.1 CNC(=O)CCO Amb10608414 [1,1,0,0,0,0|2,0,0]=4 3898 B6R0.1 CNC(=O)CCS Amb25727705 [1,1,0,0,0,0|2,0,0]=4 3899 B6R0.1 CNC(=O)COC Amb22275885 [1,1,0,0,0,0|2,0,0]=4 3900 B6R0.1 CNC(=O)NCC Amb24120627 [1,1,0,0,0,0|2,0,0]=4 3901 B6R0.1 CNCC(=O)C#C Amb25675071 [1,1,0,0,0,0|2,0,0]=4 3902 B6R0.1 CNCC(=O)CN Amb25218252 [1,1,0,0,0,0|2,0,0]=4 3903 B6R0.1 CNCC(=O)NC Amb2371052 [1,1,0,0,0,0|2,0,0]=4 3904 B6R0.1 CNCC(=O)NN Amb16186920 [1,1,0,0,0,0|2,0,0]=4 3905 B6R0.1 CNCC(=O)NO Amb24640961 [1,1,0,0,0,0|1,0,0]=3 3906 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|1,0,0]=3 3907 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|1,0,0]=3 3908 B6R0.1 CNCC(N)=NO Amb24648670 [1,1,0,0,0,0|2,0,0]=4 3909 B6R0.1 CNNC(=O)OC Amb22411352 [1,1,0,0,0,0|2,0,0]=4 3910 B6R0.1 COC(=C)CCO Amb25024469 [1,1,0,0,0,0|2,0,0]=4 3911 B6R0.1 COC(=N)CCCl Amb19958799 [1,1,0,0,0,0|2,0,0]=4 3912 B6R0.1 COC(=N)CCCl Amb22234673 [1,1,0,0,0,0|2,0,0]=4 3913 B6R0.1 COC(=N)CCO Amb17593095 [1,1,0,0,0,0|2,0,0]=4 3914 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|1,0,1]=4 3915 B6R0.1 COC(=O)CCF Amb22748635 [1,1,0,0,0,0|1,0,0]=3 3916 B6R0.1 COC(=O)CCI Amb24442243 [1,1,0,0,0,0|1,0,0]=3 3917 B6R0.1 COC(=O)CCN Amb1105940 [1,1,0,0,0,0|1,0,0]=3 3918 B6R0.1 COC(=O)CCN Amb22489470 [1,1,0,0,0,0|1,0,0]=3 3919 B6R0.1 COC(=O)CON Amb18640433 [1,1,0,0,0,0|2,0,0]=4 3920 B6R0.1 COC(=O)NCCl Amb24479773 [1,1,0,0,0,0|2,0,0]=4 3921 B6R0.1 COC(=O)NOC Amb24480502 [1,1,0,0,0,0|2,0,0]=4 3922 B6R0.1 COC(=O)OCC Amb22732530 [1,1,0,0,0,0|1,0,0]=3 3923 B6R0.1 COC(=O)OCCl Amb20623618 [1,1,0,0,0,0|2,0,0]=4 3924 B6R0.1 COC(=S)CCCl Amb25758715 [1,1,0,0,0,0|1,1,0]=4 3925 B6R0.1 COC(=S)CCS Amb10795255 [1,1,0,0,0,0|1,1,0]=4 3926 B6R0.1 COCC(=C)CO Amb24523815 [1,1,0,0,0,0|2,0,0]=4 3927 B6R0.1 COCC(=N)NO Amb21858420 [1,1,0,0,0,0|2,0,0]=4 3928 B6R0.1 COCC(=O)C#N Amb25744731 [1,1,0,0,0,0|2,0,0]=4 3929 B6R0.1 COCC(=O)C=C Amb22168158 [1,1,0,0,0,0|2,0,0]=4 3930 B6R0.1 COCC(=O)CCl Amb24523799 [1,1,0,0,0,0|2,0,0]=4 3931 B6R0.1 COCC(=O)CN Amb18833134 [1,1,0,0,0,0|2,0,0]=4 3932 B6R0.1 COCC(=O)CO Amb24364722 [1,1,0,0,0,0|1,0,0]=3 3933 B6R0.1 COCC(=O)O[Na] Amb2227682 [1,1,0,0,0,0|1,0,0]=3 3934 B6R0.1 COCC(C)=NO Amb24530685 [1,1,0,0,0,0|2,0,0]=4 3935 B6R0.1 COCC(N)=S=O Amb25843320 [1,1,0,0,0,0|2,0,0]=4 3936 B6R0.1 COCC(O)C=O Amb18122318 [1,1,0,0,0,0|1,0,1]=4 3937 B6R0.1 COS(=O)CCCl Amb24635086 [1,1,0,0,0,0|2,0,0]=4 3938 B6R0.1 COS(=O)CCO Amb25713675 [1,1,0,0,0,0|2,0,0]=4 3939 B6R0.1 COS(=O)OCC Amb22729134 [1,1,0,0,0,0|2,0,0]=4 3940 B6R0.1 CO[13C](=O)[13CH2][15NH][13CH3] Amb22336903 [1,1,0,0,0,0|1,0,0]=3 3941 B6R0.1 CSC(=O)CCCl Amb24735675 [1,1,0,0,0,0|1,1,0]=4 3942 B6R0.1 CSCC(=O)NN Amb22058723 [1,1,0,0,0,0|2,0,0]=4 3943 B6R0.1 CSCC(C)=NO Amb25316343 [1,1,0,0,0,0|2,0,0]=4 3944 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|1,0,0]=3 3945 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|1,0,0]=3 3946 B6R0.1 C\C(\C=O)=C\CC Amb18120867 [1,1,0,0,0,0|1,0,1]=4 3947 B6R0.1 C\C(\CCC)=C/C Amb22734722 [1,1,0,0,0,0|2,0,0]=4 3948 B6R0.1 C\C=C/C(=O)CO Amb24530239 [1,1,0,0,0,0|0,0,2]=4 3949 B6R0.1 C\C=C\C(=O)CO Amb24633379 [1,1,0,0,0,0|0,0,2]=4 3950 B6R0.1 C\C=C\C(=O)NO Amb25076258 [1,1,0,0,0,0|0,0,2]=4 3951 B6R0.1 N#CC(=O)CCO Amb25730943 [1,1,0,0,0,0|2,0,0]=4 3952 B6R0.1 N=C(CCO)NO Amb22491265 [1,1,0,0,0,0|2,0,0]=4 3953 B6R0.1 NC(CCF)=NO Amb24540455 [1,1,0,0,0,0|2,0,0]=4 3954 B6R0.1 NCC(=O)CCN Amb18121893 [1,1,0,0,0,0|2,0,0]=4 3955 B6R0.1 NCC(=O)CCN Amb22227739 [1,1,0,0,0,0|2,0,0]=4 3956 B6R0.1 NCC(=O)CCN Amb22360700 [1,1,0,0,0,0|2,0,0]=4 3957 B6R0.1 NCCC(=O)CBr Amb24479170 [1,1,0,0,0,0|2,0,0]=4 3958 B6R0.1 NCCC(=O)NN Amb18559344 [1,1,0,0,0,0|2,0,0]=4 3959 B6R0.1 NCCC(=O)NO Amb22751684 [1,1,0,0,0,0|1,0,0]=3 3960 B6R0.1 NCCC(N)=NO Amb24761482 [1,1,0,0,0,0|2,0,0]=4 3961 B6R0.1 NCCC(O)C=O Amb25682881 [1,1,0,0,0,0|1,0,1]=4 3962 B6R0.1 NNC(=O)CCO Amb20622339 [1,1,0,0,0,0|2,0,0]=4 3963 B6R0.1 NNC(=O)CCS Amb20622690 [1,1,0,0,0,0|2,0,0]=4 3964 B6R0.1 O=C(CCCl)CCl Amb22395038 [1,1,0,0,0,0|2,0,0]=4 3965 B6R0.1 O=C(CCCl)NBr Amb24391501 [1,1,0,0,0,0|2,0,0]=4 3966 B6R0.1 O=C(CCCl)NCl Amb24427328 [1,1,0,0,0,0|2,0,0]=4 3967 B6R0.1 OCC(=O)CCO Amb24061314 [1,1,0,0,0,0|1,0,0]=3 3968 B6R0.1 OCC(=O)CCS Amb24332279 [1,1,0,0,0,0|1,0,0]=3 3969 B6R0.1 OCCC(=NO)N Amb13952693 [1,1,0,0,0,0|2,0,0]=4 3970 B6R0.1 OCCC(=O)CBr Amb25210851 [1,1,0,0,0,0|2,0,0]=4 3971 B6R0.1 OCCC(=O)CCl Amb24674169 [1,1,0,0,0,0|2,0,0]=4 3972 B6R0.1 OCCC(=O)CO Amb10603377 [1,1,0,0,0,0|1,0,0]=3 3973 B6R0.1 OCC[C@@H](O)C=O Amb24741761 [1,1,0,0,0,0|1,0,1]=4 3974 B6R0.1 OCC\C(=N\O)\N Amb1113605 [1,1,0,0,0,0|2,0,0]=4 3975 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [1,1,0,0,0,0|0,0,2]=4 3976 B6R0.2 CC(=C)CC(=O)C Amb17593075 [1,1,0,0,0,0|1,0,1]=4 3977 B6R0.2 CC(=CC(=O)O)C Amb1485519 [1,1,0,0,0,0|0,0,2]=4 3978 B6R0.2 CC(=N)CC(N)=O Amb25259783 [1,1,0,0,0,0|1,0,1]=4 3979 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [1,1,0,0,0,0|1,0,1]=4 3980 B6R0.2 CC(=O)CC(C)=N Amb22345922 [1,1,0,0,0,0|1,0,1]=4 3981 B6R0.2 CC(=O)CC(C)=O Amb22727963 [1,1,0,0,0,0|1,0,1]=4 3982 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,1,0,0,0,0|1,0,0]=3 3983 B6R0.2 CC(=O)CC(C)[O-] Amb22729909 [1,1,0,0,0,0|1,0,0]=3 3984 B6R0.2 CC(=O)CC(Cl)Cl Amb24476084 [1,1,0,0,0,0|2,0,0]=4 3985 B6R0.2 CC(=O)CC(F)F Amb24669174 [1,1,0,0,0,0|2,0,0]=4 3986 B6R0.2 CC(=O)CC(O)=O Amb22348460 [1,1,0,0,0,0|0,0,1]=3 3987 B6R0.2 CC(=O)CC(O)=S Amb24689856 [1,1,0,0,0,0|0,1,1]=4 3988 B6R0.2 CC(=O)CC(O)O Amb25273111 [1,1,0,0,0,0|2,0,0]=4 3989 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [1,1,0,0,0,0|0,0,2]=4 3990 B6R0.2 CC(=O)CS(C)=O Amb25025354 [1,1,0,0,0,0|2,0,0]=4 3991 B6R0.2 CC(=O)C[S+](C)C Amb24614662 [1,1,0,0,0,0|2,0,0]=4 3992 B6R0.2 CC(=S)CC(N)=O Amb24479846 [1,1,0,0,0,0|1,0,1]=4 3993 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [1,1,0,0,0,0|0,0,2]=4 3994 B6R0.2 CC(Br)CC(C)=C Amb24365286 [1,1,0,0,0,0|2,0,0]=4 3995 B6R0.2 CC(Br)CC(C)O Amb25139315 [1,1,0,0,0,0|1,0,1]=4 3996 B6R0.2 CC(Br)CC(N)=N Amb25700372 [1,1,0,0,0,0|2,0,0]=4 3997 B6R0.2 CC(Br)CC(N)=O Amb24635749 [1,1,0,0,0,0|1,0,0]=3 3998 B6R0.2 CC(Br)OC(C)=O Amb19958925 [1,1,0,0,0,0|2,0,0]=4 3999 B6R0.2 CC(C)CC(=C)Br Amb22583739 [1,1,0,0,0,0|2,0,0]=4 4000 B6R0.2 CC(C)CC([O-])=O Amb22732147 [1,1,0,0,0,0|0,0,1]=3 4001 B6R0.2 CC(C)CC([O-])=O Amb22732282 [1,1,0,0,0,0|0,0,1]=3 4002 B6R0.2 CC(C)CC([O-])=O Amb22734041 [1,1,0,0,0,0|0,0,1]=3 4003 B6R0.2 CC(C)CC([O-])=O Amb22734425 [1,1,0,0,0,0|0,0,1]=3 4004 B6R0.2 CC(C)CS(N)=O Amb24527860 [1,1,0,0,0,0|2,0,0]=4 4005 B6R0.2 CC(C)CS([O-])=O Amb19930010 [1,1,0,0,0,0|1,0,1]=4 4006 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [1,1,0,0,0,0|0,0,0]=2 4007 B6R0.2 CC(C)C[13C]([O-])=O Amb22336662 [1,1,0,0,0,0|0,0,1]=3 4008 B6R0.2 CC(C)C[N+]([O-])=O Amb17672613 [1,1,0,0,0,0|1,0,1]=4 4009 B6R0.2 CC(C)NC(=O)F Amb24567697 [1,1,0,0,0,0|2,0,0]=4 4010 B6R0.2 CC(C)OC(=C)O Amb24086570 [1,1,0,0,0,0|2,0,0]=4 4011 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [1,1,0,0,0,0|2,0,0]=4 4012 B6R0.2 CC(C)SC(N)=O Amb24461669 [1,1,0,0,0,0|2,0,0]=4 4013 B6R0.2 CC(CC(=C)C)O Amb17593083 [1,1,0,0,0,0|2,0,0]=4 4014 B6R0.2 CC(CC(=N)N)C Amb10066934 [1,1,0,0,0,0|2,0,0]=4 4015 B6R0.2 CC(CC(=O)C)Cl Amb17593234 [1,1,0,0,0,0|1,0,0]=3 4016 B6R0.2 CC(CC(=O)C)N Amb2583230 [1,1,0,0,0,0|1,0,0]=3 4017 B6R0.2 CC(CC(=O)C)O Amb17593091 [1,1,0,0,0,0|1,0,0]=3 4018 B6R0.2 CC(CC(Cl)C)O Amb17593253 [1,1,0,0,0,0|1,0,1]=4 4019 B6R0.2 CC(CC(O)C)O Amb10068523 [1,1,0,0,0,0|1,0,1]=4 4020 B6R0.2 CC(Cl)CC(C)=C Amb24558200 [1,1,0,0,0,0|2,0,0]=4 4021 B6R0.2 CC(Cl)CP(O)O Amb25061243 [1,1,0,0,0,0|1,0,1]=4 4022 B6R0.2 CC(Cl)NC(=O)Cl Amb24480662 [1,1,0,0,0,0|2,0,0]=4 4023 B6R0.2 CC(Cl)OC(C)=O Amb24058273 [1,1,0,0,0,0|2,0,0]=4 4024 B6R0.2 CC(Cl)OC(N)=O Amb24372683 [1,1,0,0,0,0|2,0,0]=4 4025 B6R0.2 CC(Cl)SC(C)=O Amb24625146 [1,1,0,0,0,0|2,0,0]=4 4026 B6R0.2 CC(F)=CC(O)=O Amb24676595 [1,1,0,0,0,0|0,0,2]=4 4027 B6R0.2 CC(F)CC(O)=O Amb24561809 [1,1,0,0,0,0|0,0,0]=2 4028 B6R0.2 CC(F)C[N+]([O-])=O Amb25024317 [1,1,0,0,0,0|1,0,1]=4 4029 B6R0.2 CC(I)=CC(O)=O Amb24668934 [1,1,0,0,0,0|0,0,2]=4 4030 B6R0.2 CC(I)CC(C)O Amb25743469 [1,1,0,0,0,0|1,0,1]=4 4031 B6R0.2 CC(I)CC(N)=O Amb25783800 [1,1,0,0,0,0|1,0,0]=3 4032 B6R0.2 CC(N)=CC(O)=O Amb25856437 [1,1,0,0,0,0|0,0,2]=4 4033 B6R0.2 CC(N)CC(=O)Cl Amb25830663 [1,1,0,0,0,0|1,0,0]=3 4034 B6R0.2 CC(N)CC(C)=C Amb25064223 [1,1,0,0,0,0|2,0,0]=4 4035 B6R0.2 CC(N)CC(C)=O Amb22587050 [1,1,0,0,0,0|1,0,0]=3 4036 B6R0.2 CC(N)CC(N)=N Amb25051498 [1,1,0,0,0,0|2,0,0]=4 4037 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,1,0,0,0,0|1,0,0]=3 4038 B6R0.2 CC(N)CC(N)=S Amb25198821 [1,1,0,0,0,0|1,1,0]=4 4039 B6R0.2 CC(N)CC(O)=O Amb19888354 [1,1,0,0,0,0|0,0,0]=2 4040 B6R0.2 CC(NC(=O)N)C Amb1104587 [1,1,0,0,0,0|2,0,0]=4 4041 B6R0.2 CC(O)CC(=C)Br Amb24618620 [1,1,0,0,0,0|2,0,0]=4 4042 B6R0.2 CC(O)CC(C)N Amb18640217 [1,1,0,0,0,0|1,0,1]=4 4043 B6R0.2 CC(O)CC(N)=S Amb24479794 [1,1,0,0,0,0|1,1,0]=4 4044 B6R0.2 CC(O)CC(O)=O Amb22348403 [1,1,0,0,0,0|0,0,0]=2 4045 B6R0.2 CC(O)CC(O)O Amb25716084 [1,1,0,0,0,0|0,0,2]=4 4046 B6R0.2 CC(O)CC(S)=S Amb25215114 [1,1,0,0,0,0|0,2,0]=4 4047 B6R0.2 CC(O)CP(O)=O Amb24406357 [1,1,0,0,0,0|1,0,0]=3 4048 B6R0.2 CC(O)NC(N)=O Amb25811550 [1,1,0,0,0,0|2,0,0]=4 4049 B6R0.2 CC(O)OC(N)=O Amb24669632 [1,1,0,0,0,0|2,0,0]=4 4050 B6R0.2 CC(O)SC(C)=O Amb24544015 [1,1,0,0,0,0|2,0,0]=4 4051 B6R0.2 CC(P)CC(C)O Amb25792365 [1,1,0,0,0,0|1,0,1]=4 4052 B6R0.2 CC(S)CC(C)=O Amb24600676 [1,1,0,0,0,0|1,0,0]=3 4053 B6R0.2 CC(S)CC(C)O Amb24122653 [1,1,0,0,0,0|1,0,1]=4 4054 B6R0.2 CC(S)CC(N)=O Amb24479823 [1,1,0,0,0,0|1,0,0]=3 4055 B6R0.2 CC(S)CC(O)=O Amb18281031 [1,1,0,0,0,0|0,0,0]=2 4056 B6R0.2 CN(Br)CC(O)=O Amb25745878 [1,1,0,0,0,0|1,0,0]=3 4057 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [1,1,0,0,0,0|2,0,0]=4 4058 B6R0.2 CN(C)CC([O-])=O Amb22002291 [1,1,0,0,0,0|1,0,1]=4 4059 B6R0.2 CN(C)CS(O)=O Amb25376029 [1,1,0,0,0,0|2,0,0]=4 4060 B6R0.2 CN(CC(=O)N)C Amb17231806 [1,1,0,0,0,0|2,0,0]=4 4061 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [1,1,0,0,0,0|1,0,0]=3 4062 B6R0.2 CN(N)CC(O)=O Amb23592296 [1,1,0,0,0,0|1,0,0]=3 4063 B6R0.2 CN(O)CC(O)=O Amb24732008 [1,1,0,0,0,0|1,0,0]=3 4064 B6R0.2 CS(=O)CC(N)=O Amb24394100 [1,1,0,0,0,0|2,0,0]=4 4065 B6R0.2 CS(=O)CC(O)=O Amb18957960 [1,1,0,0,0,0|1,0,0]=3 4066 B6R0.2 CS(C)=CC(O)=O Amb25717234 [1,1,0,0,0,0|1,0,1]=4 4067 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [1,1,0,0,0,0|0,0,1]=3 4068 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [1,1,0,0,0,0|0,0,0]=2 4069 B6R0.2 C[C@@H](Cl)CC(=O)Cl Amb25321802 [1,1,0,0,0,0|1,0,0]=3 4070 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [1,1,0,0,0,0|1,0,0]=3 4071 B6R0.2 C[C@@H](O)CC(=C)Br Amb25045702 [1,1,0,0,0,0|2,0,0]=4 4072 B6R0.2 C[C@@H](O)CC(C)O Amb25083401 [1,1,0,0,0,0|1,0,1]=4 4073 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [1,1,0,0,0,0|1,0,0]=3 4074 B6R0.2 C[C@@H](O)C[C@@H](C)N Amb24568258 [1,1,0,0,0,0|1,0,1]=4 4075 B6R0.2 C[C@@H](O)C[C@H](C)N Amb24479559 [1,1,0,0,0,0|1,0,1]=4 4076 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [1,1,0,0,0,0|0,0,0]=2 4077 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [1,1,0,0,0,0|0,0,0]=2 4078 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [1,1,0,0,0,0|0,0,0]=2 4079 B6R0.2 C[C@H](Cl)CC(=O)Cl Amb25053837 [1,1,0,0,0,0|1,0,0]=3 4080 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [1,1,0,0,0,0|0,0,0]=2 4081 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [1,1,0,0,0,0|0,0,0]=2 4082 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [1,1,0,0,0,0|1,0,0]=3 4083 B6R0.2 C[C@H](O)CC(C)N Amb25835759 [1,1,0,0,0,0|1,0,1]=4 4084 B6R0.2 C[C@H](O)CC(C)O Amb25381310 [1,1,0,0,0,0|1,0,1]=4 4085 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [1,1,0,0,0,0|0,0,0]=2 4086 B6R0.2 C[C@H](O)C[C@@H](C)N Amb24351024 [1,1,0,0,0,0|1,0,1]=4 4087 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [1,1,0,0,0,0|1,0,1]=4 4088 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [1,1,0,0,0,0|0,0,0]=2 4089 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [1,1,0,0,0,0|2,0,0]=4 4090 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [1,1,0,0,0,0|1,0,0]=3 4091 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [1,1,0,0,0,0|0,0,2]=4 4092 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [1,1,0,0,0,0|0,0,2]=4 4093 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [1,1,0,0,0,0|0,0,2]=4 4094 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [1,1,0,0,0,0|0,0,2]=4 4095 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [1,1,0,0,0,0|1,0,1]=4 4096 B6R0.2 NC(=O)CC(Cl)Cl Amb24479899 [1,1,0,0,0,0|2,0,0]=4 4097 B6R0.2 NC(=O)CC(O)O Amb25810087 [1,1,0,0,0,0|2,0,0]=4 4098 B6R0.2 NC(F)CC(O)=O Amb24479804 [1,1,0,0,0,0|1,0,0]=3 4099 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [1,1,0,0,0,0|1,0,0]=3 4100 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [1,1,0,0,0,0|1,0,0]=3 4101 B6R0.2 O=C(Cl)CC(Cl)Cl Amb24478549 [1,1,0,0,0,0|2,0,0]=4 4102 B6R0.2 OB(CC(C)C)O Amb2447316 [1,1,0,0,0,0|1,0,1]=4 4103 B6R0.2 OB(O)CC(O)=O Amb24053058 [1,1,0,0,0,0|2,0,0]=4 4104 B6R0.2 OC(=O)CC(=S)N Amb17465742 [1,1,0,0,0,0|1,0,1]=4 4105 B6R0.2 OC(=O)CC(F)Br Amb25336987 [1,1,0,0,0,0|1,0,0]=3 4106 B6R0.2 OC(=O)CC(F)F Amb22001551 [1,1,0,0,0,0|1,0,0]=3 4107 B6R0.2 OC(=O)CC(O)=O Amb21935659 [1,1,0,0,0,0|1,0,1]=4 4108 B6R0.2 OC(=O)CC(O)=O Amb22230690 [1,1,0,0,0,0|1,0,1]=4 4109 B6R0.2 OC(=O)CC(O)=O Amb22230927 [1,1,0,0,0,0|1,0,1]=4 4110 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [1,1,0,0,0,0|2,0,0]=4 4111 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [1,1,0,0,0,0|1,0,1]=4 4112 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [1,1,0,0,0,0|1,0,1]=4 4113 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [1,1,0,0,0,0|1,0,1]=4 4114 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [1,1,0,0,0,0|0,0,1]=3 4115 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [1,1,0,0,0,0|1,0,0]=3 4116 B6R0.2 [O-]C(=O)CC(F)F Amb24117960 [1,1,0,0,0,0|1,0,1]=4 4117 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [1,1,0,0,0,0|0,0,1]=3 4118 B6R0.3 C#CC(O)C(O)=O Amb22731622 [1,1,0,0,0,0|0,0,2]=4 4119 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [1,1,0,0,0,0|0,0,2]=4 4120 B6R0.3 C=C(CF)C(O)=O Amb25215375 [1,1,0,0,0,0|1,0,1]=4 4121 B6R0.3 C=C(CI)C(O)=O Amb24419641 [1,1,0,0,0,0|1,0,1]=4 4122 B6R0.3 C=C(CN)C(O)=O Amb25200864 [1,1,0,0,0,0|1,0,1]=4 4123 B6R0.3 C=C(CO)C(O)=O Amb18121817 [1,1,0,0,0,0|1,0,1]=4 4124 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [1,1,0,0,0,0|0,0,2]=4 4125 B6R0.3 C=CC(N)C(O)=O Amb20240543 [1,1,0,0,0,0|0,0,2]=4 4126 B6R0.3 C=CC(O)C(O)=O Amb24061247 [1,1,0,0,0,0|0,0,2]=4 4127 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [1,1,0,0,0,0|0,0,2]=4 4128 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [1,1,0,0,0,0|0,0,2]=4 4129 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [1,1,0,0,0,0|0,0,2]=4 4130 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [1,1,0,0,0,0|0,0,2]=4 4131 B6R0.3 CC(=O)C(Br)CO Amb24649743 [1,1,0,0,0,0|2,0,0]=4 4132 B6R0.3 CC(=O)C(Cl)CF Amb24594938 [1,1,0,0,0,0|2,0,0]=4 4133 B6R0.3 CC(=O)C(Cl)CO Amb25321596 [1,1,0,0,0,0|2,0,0]=4 4134 B6R0.3 CC(=O)C(F)CO Amb24725289 [1,1,0,0,0,0|2,0,0]=4 4135 B6R0.3 CC(=O)C(N)CN Amb24479898 [1,1,0,0,0,0|2,0,0]=4 4136 B6R0.3 CC(=O)C(N)CO Amb18640011 [1,1,0,0,0,0|2,0,0]=4 4137 B6R0.3 CC(=O)C(N)CS Amb24479874 [1,1,0,0,0,0|2,0,0]=4 4138 B6R0.3 CC(=O)C(O)CN Amb24636554 [1,1,0,0,0,0|2,0,0]=4 4139 B6R0.3 CC(=O)[C@@H](N)CO Amb22745043 [1,1,0,0,0,0|2,0,0]=4 4140 B6R0.3 CC(=O)[C@@H](O)CCl Amb24401543 [1,1,0,0,0,0|2,0,0]=4 4141 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [1,1,0,0,0,0|2,0,0]=4 4142 B6R0.3 CC(=O)[C@H](O)CCl Amb25169511 [1,1,0,0,0,0|2,0,0]=4 4143 B6R0.3 CC(=O)[C@H](O)CO Amb25838797 [1,1,0,0,0,0|2,0,0]=4 4144 B6R0.3 CC(C#C)C(O)=O Amb25085390 [1,1,0,0,0,0|0,0,2]=4 4145 B6R0.3 CC(C(=O)C)CO Amb10844844 [1,1,0,0,0,0|2,0,0]=4 4146 B6R0.3 CC(C(=O)O)C#N Amb17210512 [1,1,0,0,0,0|1,0,1]=4 4147 B6R0.3 CC(C=C)C(O)=O Amb21618706 [1,1,0,0,0,0|0,0,2]=4 4148 B6R0.3 CC(CBr)C(C)=O Amb25296678 [1,1,0,0,0,0|2,0,0]=4 4149 B6R0.3 CC(CBr)C(O)=O Amb22002601 [1,1,0,0,0,0|1,0,0]=3 4150 B6R0.3 CC(CC)C(O)Br Amb24635628 [1,1,0,0,0,0|1,0,1]=4 4151 B6R0.3 CC(CCl)C(=O)Cl Amb24479841 [1,1,0,0,0,0|2,0,0]=4 4152 B6R0.3 CC(CCl)C(=O)S Amb24410197 [1,1,0,0,0,0|1,1,0]=4 4153 B6R0.3 CC(CCl)C(N)=O Amb25061744 [1,1,0,0,0,0|2,0,0]=4 4154 B6R0.3 CC(CCl)C(O)=O Amb18522181 [1,1,0,0,0,0|1,0,0]=3 4155 B6R0.3 CC(CF)C(C)=O Amb25253758 [1,1,0,0,0,0|2,0,0]=4 4156 B6R0.3 CC(CF)C(O)=O Amb24432331 [1,1,0,0,0,0|1,0,0]=3 4157 B6R0.3 CC(CI)C(O)=O Amb25695307 [1,1,0,0,0,0|1,0,0]=3 4158 B6R0.3 CC(CN)C(=O)Cl Amb24525988 [1,1,0,0,0,0|2,0,0]=4 4159 B6R0.3 CC(CN)C(C)=O Amb18639690 [1,1,0,0,0,0|2,0,0]=4 4160 B6R0.3 CC(CO)C([O-])=O Amb24123145 [1,1,0,0,0,0|1,0,1]=4 4161 B6R0.3 CC(CS)C(C)=O Amb25830693 [1,1,0,0,0,0|2,0,0]=4 4162 B6R0.3 CC(CS)C(N)=O Amb25759660 [1,1,0,0,0,0|2,0,0]=4 4163 B6R0.3 CC(N=C)C(O)=O Amb24591339 [1,1,0,0,0,0|1,0,1]=4 4164 B6R0.3 CC(NBr)C(O)=O Amb24677636 [1,1,0,0,0,0|2,0,0]=4 4165 B6R0.3 CC(NCl)C(O)=O Amb25267473 [1,1,0,0,0,0|2,0,0]=4 4166 B6R0.3 CC(NN)C(O)=O Amb18640367 [1,1,0,0,0,0|2,0,0]=4 4167 B6R0.3 CC(O)[C@@H](N)CC Amb24453251 [1,1,0,0,0,0|1,0,1]=4 4168 B6R0.3 CC(ON)C(O)=O Amb24479235 [1,1,0,0,0,0|2,0,0]=4 4169 B6R0.3 CCC(=C)C(=O)Cl Amb22353554 [1,1,0,0,0,0|1,0,1]=4 4170 B6R0.3 CCC(=C)C(N)=O Amb24480748 [1,1,0,0,0,0|1,0,1]=4 4171 B6R0.3 CCC(=C)C(O)=O Amb18639591 [1,1,0,0,0,0|0,0,1]=3 4172 B6R0.3 CCC(=O)C(N)=O Amb22011827 [1,1,0,0,0,0|1,0,1]=4 4173 B6R0.3 CCC(=O)C(O)=O Amb22274199 [1,1,0,0,0,0|0,0,1]=3 4174 B6R0.3 CCC(=O)C([O-])=O Amb22360646 [1,1,0,0,0,0|0,0,2]=4 4175 B6R0.3 CCC(B(O)O)C Amb10071974 [1,1,0,0,0,0|1,0,1]=4 4176 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [1,1,0,0,0,0|1,0,0]=3 4177 B6R0.3 CCC(Br)C(C)=O Amb24615269 [1,1,0,0,0,0|1,0,0]=3 4178 B6R0.3 CCC(Br)C(Cl)=O Amb17666758 [1,1,0,0,0,0|1,0,0]=3 4179 B6R0.3 CCC(Br)[N+]([O-])=O Amb17673702 [1,1,0,0,0,0|1,0,1]=4 4180 B6R0.3 CCC(C(=O)Cl)N Amb17593240 [1,1,0,0,0,0|1,0,0]=3 4181 B6R0.3 CCC(C(=O)N)Br Amb13952819 [1,1,0,0,0,0|1,0,0]=3 4182 B6R0.3 CCC(C(=O)N)N Amb1914080 [1,1,0,0,0,0|1,0,0]=3 4183 B6R0.3 CCC(C(=O)O)S Amb17501370 [1,1,0,0,0,0|0,0,0]=2 4184 B6R0.3 CCC(C(O)C)O Amb2227553 [1,1,0,0,0,0|1,0,1]=4 4185 B6R0.3 CCC(C)C(=C)Br Amb22583745 [1,1,0,0,0,0|2,0,0]=4 4186 B6R0.3 CCC(C)S([O-])=O Amb19893328 [1,1,0,0,0,0|1,0,1]=4 4187 B6R0.3 CCC(Cl)C(=C)Cl Amb24426218 [1,1,0,0,0,0|2,0,0]=4 4188 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [1,1,0,0,0,0|1,0,0]=3 4189 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [1,1,0,0,0,0|1,0,0]=3 4190 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [1,1,0,0,0,0|1,0,0]=3 4191 B6R0.3 CCC(F)C(C)=O Amb24736393 [1,1,0,0,0,0|1,0,0]=3 4192 B6R0.3 CCC(F)C(N)=O Amb25811426 [1,1,0,0,0,0|1,0,0]=3 4193 B6R0.3 CCC(F)C(O)=O Amb25716167 [1,1,0,0,0,0|0,0,0]=2 4194 B6R0.3 CCC(I)C(N)=O Amb25131171 [1,1,0,0,0,0|1,0,0]=3 4195 B6R0.3 CCC(N)C(=O)S Amb24479075 [1,1,0,0,0,0|0,1,0]=3 4196 B6R0.3 CCC(N)C(C)=O Amb18202785 [1,1,0,0,0,0|1,0,0]=3 4197 B6R0.3 CCC(N)C(N)=S Amb24573684 [1,1,0,0,0,0|1,1,0]=4 4198 B6R0.3 CCC(N)P(O)=O Amb25269903 [1,1,0,0,0,0|1,0,0]=3 4199 B6R0.3 CCC(O)C(=C)Br Amb25236591 [1,1,0,0,0,0|2,0,0]=4 4200 B6R0.3 CCC(O)C(C)=O Amb25336501 [1,1,0,0,0,0|1,0,0]=3 4201 B6R0.3 CCC(O)C(N)=O Amb24116514 [1,1,0,0,0,0|1,0,0]=3 4202 B6R0.3 CCC(O)C(N)=S Amb23449332 [1,1,0,0,0,0|1,1,0]=4 4203 B6R0.3 CCC(O)C(O)=O Amb22352315 [1,1,0,0,0,0|0,0,0]=2 4204 B6R0.3 CCC(O)C(O)=O Amb22360643 [1,1,0,0,0,0|0,0,0]=2 4205 B6R0.3 CCC(O)C([O-])=O Amb17943026 [1,1,0,0,0,0|0,0,1]=3 4206 B6R0.3 CCC(O)C([O-])=O Amb24325325 [1,1,0,0,0,0|0,0,1]=3 4207 B6R0.3 CCC(O)P(O)=O Amb25169578 [1,1,0,0,0,0|1,0,0]=3 4208 B6R0.3 CCC(S)C(N)=O Amb24479879 [1,1,0,0,0,0|1,0,0]=3 4209 B6R0.3 CCN(C)C(C)=O Amb22753516 [1,1,0,0,0,0|2,0,0]=4 4210 B6R0.3 CCN(O)C(N)=O Amb24669876 [1,1,0,0,0,0|2,0,0]=4 4211 B6R0.3 CC[C@@H](Br)C(=O)Cl Amb24582761 [1,1,0,0,0,0|1,0,0]=3 4212 B6R0.3 CC[C@@H](Br)C(N)=O Amb25025862 [1,1,0,0,0,0|1,0,0]=3 4213 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [1,1,0,0,0,0|1,0,0]=3 4214 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [1,1,0,0,0,0|1,0,0]=3 4215 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [1,1,0,0,0,0|1,0,0]=3 4216 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [1,1,0,0,0,0|0,0,0]=2 4217 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [1,1,0,0,0,0|0,0,0]=2 4218 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [1,1,0,0,0,0|1,0,0]=3 4219 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [1,1,0,0,0,0|1,0,0]=3 4220 B6R0.3 CC[C@@H](O)C(C)=O Amb25108045 [1,1,0,0,0,0|1,0,0]=3 4221 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [1,1,0,0,0,0|0,0,0]=2 4222 B6R0.3 CC[C@H](Br)C(N)=O Amb24365914 [1,1,0,0,0,0|1,0,0]=3 4223 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [1,1,0,0,0,0|0,0,0]=2 4224 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [1,1,0,0,0,0|0,0,0]=2 4225 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [1,1,0,0,0,0|1,0,1]=4 4226 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [1,1,0,0,0,0|1,0,0]=3 4227 B6R0.3 CC[C@H](C)C(N)=S Amb25266928 [1,1,0,0,0,0|1,1,0]=4 4228 B6R0.3 CC[C@H](Cl)C(=O)Cl Amb24710023 [1,1,0,0,0,0|1,0,0]=3 4229 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [1,1,0,0,0,0|0,0,0]=2 4230 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [1,1,0,0,0,0|0,0,0]=2 4231 B6R0.3 CC[C@H](O)C(C)=O Amb24332700 [1,1,0,0,0,0|1,0,0]=3 4232 B6R0.3 CC[C@H](O)C(N)=O Amb25858046 [1,1,0,0,0,0|1,0,0]=3 4233 B6R0.3 CN=C(Cl)C(O)=O Amb24446313 [1,1,0,0,0,0|1,0,1]=4 4234 B6R0.3 CNC(=C)C(O)=O Amb25743212 [1,1,0,0,0,0|1,0,1]=4 4235 B6R0.3 CNC(=N)C(O)=O Amb18639921 [1,1,0,0,0,0|1,0,1]=4 4236 B6R0.3 CNC(=S)C(O)=O Amb24479905 [1,1,0,0,0,0|1,0,1]=4 4237 B6R0.3 CNC(C)C(C)=O Amb24369529 [1,1,0,0,0,0|2,0,0]=4 4238 B6R0.3 CNC(C)C(O)=O Amb19373699 [1,1,0,0,0,0|1,0,0]=3 4239 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [1,1,0,0,0,0|2,0,0]=4 4240 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [1,1,0,0,0,0|2,0,0]=4 4241 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [1,1,0,0,0,0|2,0,0]=4 4242 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [1,1,0,0,0,0|2,0,0]=4 4243 B6R0.3 COC(=C)C(O)=O Amb18639906 [1,1,0,0,0,0|1,0,1]=4 4244 B6R0.3 COC(=O)C(O)=O Amb22011503 [1,1,0,0,0,0|1,0,1]=4 4245 B6R0.3 COC(Br)C(C)=O Amb25360111 [1,1,0,0,0,0|2,0,0]=4 4246 B6R0.3 COC(N)C(N)=O Amb25178891 [1,1,0,0,0,0|2,0,0]=4 4247 B6R0.3 COC(N)C(O)=O Amb24621851 [1,1,0,0,0,0|1,0,0]=3 4248 B6R0.3 COC(O)C(O)=O Amb24479754 [1,1,0,0,0,0|1,0,0]=3 4249 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [1,1,0,0,0,0|2,0,0]=4 4250 B6R0.3 CSC(=O)C(O)=O Amb24731100 [1,1,0,0,0,0|1,0,1]=4 4251 B6R0.3 CSC(=S)C(O)=O Amb25702678 [1,1,0,0,0,0|1,0,1]=4 4252 B6R0.3 CSC(Br)C(O)=O Amb25169549 [1,1,0,0,0,0|1,0,0]=3 4253 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [1,1,0,0,0,0|2,0,0]=4 4254 B6R0.3 CSC(F)C(O)=O Amb25043740 [1,1,0,0,0,0|1,0,0]=3 4255 B6R0.3 CSC(O)C(C)=O Amb24479166 [1,1,0,0,0,0|2,0,0]=4 4256 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [1,1,0,0,0,0|1,0,0]=3 4257 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [1,1,0,0,0,0|1,0,0]=3 4258 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [1,1,0,0,0,0|1,0,0]=3 4259 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [1,1,0,0,0,0|1,0,0]=3 4260 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [1,1,0,0,0,0|1,0,0]=3 4261 B6R0.3 C[C@@H](CC)[C@H](C)O Amb24456969 [1,1,0,0,0,0|1,0,1]=4 4262 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [1,1,0,0,0,0|1,0,0]=3 4263 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [1,1,0,0,0,0|2,0,0]=4 4264 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [1,1,0,0,0,0|1,0,0]=3 4265 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [1,1,0,0,0,0|2,0,0]=4 4266 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [1,1,0,0,0,0|2,0,0]=4 4267 B6R0.3 C[C@@H](O)[C@@H](N)CC Amb24117049 [1,1,0,0,0,0|1,0,1]=4 4268 B6R0.3 C[C@@H](O)[C@H](N)CC Amb24117050 [1,1,0,0,0,0|1,0,1]=4 4269 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [1,1,0,0,0,0|2,0,0]=4 4270 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [1,1,0,0,0,0|1,0,0]=3 4271 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [1,1,0,0,0,0|1,0,0]=3 4272 B6R0.3 C[C@H](CC)[C@H](C)O Amb25675718 [1,1,0,0,0,0|1,0,1]=4 4273 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [1,1,0,0,0,0|2,0,0]=4 4274 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [1,1,0,0,0,0|1,0,0]=3 4275 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [1,1,0,0,0,0|1,0,0]=3 4276 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [1,1,0,0,0,0|1,0,0]=3 4277 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [1,1,0,0,0,0|1,0,1]=4 4278 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [1,1,0,0,0,0|2,0,0]=4 4279 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [1,1,0,0,0,0|2,0,0]=4 4280 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [1,1,0,0,0,0|0,0,2]=4 4281 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [1,1,0,0,0,0|0,0,2]=4 4282 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [1,1,0,0,0,0|0,0,2]=4 4283 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [1,1,0,0,0,0|2,0,0]=4 4284 B6R0.3 NC(=O)C(Cl)CO Amb24392534 [1,1,0,0,0,0|2,0,0]=4 4285 B6R0.3 NC(=O)C(F)CF Amb25128008 [1,1,0,0,0,0|2,0,0]=4 4286 B6R0.3 NC(=O)C(F)CO Amb24507432 [1,1,0,0,0,0|2,0,0]=4 4287 B6R0.3 NC(=O)[C@H](O)CO Amb25732480 [1,1,0,0,0,0|2,0,0]=4 4288 B6R0.3 NC(C#N)C(O)=O Amb25328320 [1,1,0,0,0,0|1,0,1]=4 4289 B6R0.3 NC(C(=O)N)CO Amb17593097 [1,1,0,0,0,0|2,0,0]=4 4290 B6R0.3 NC(C(=O)O)CF Amb10839589 [1,1,0,0,0,0|1,0,0]=3 4291 B6R0.3 NC(C(=O)O)CS Amb13961966 [1,1,0,0,0,0|1,0,0]=3 4292 B6R0.3 NC(C=O)C(O)=O Amb24349579 [1,1,0,0,0,0|1,0,1]=4 4293 B6R0.3 NC(C=S)C(O)=O Amb25227802 [1,1,0,0,0,0|1,0,1]=4 4294 B6R0.3 NC(CCl)C(O)=O Amb19651457 [1,1,0,0,0,0|1,0,0]=3 4295 B6R0.3 NC(CCl)C(O)=O Amb21961077 [1,1,0,0,0,0|1,0,0]=3 4296 B6R0.3 NC(CI)C(O)=O Amb25177412 [1,1,0,0,0,0|1,0,0]=3 4297 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [1,1,0,0,0,0|1,0,0]=3 4298 B6R0.3 NC(CS)C(N)=O Amb18641990 [1,1,0,0,0,0|2,0,0]=4 4299 B6R0.3 NC(CS)C(O)=O Amb22489523 [1,1,0,0,0,0|1,0,0]=3 4300 B6R0.3 NC(CS)P(O)=O Amb25772157 [1,1,0,0,0,0|2,0,0]=4 4301 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [1,1,0,0,0,0|1,0,0]=3 4302 B6R0.3 NCC(=O)C(O)=O Amb24361938 [1,1,0,0,0,0|1,0,1]=4 4303 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [1,1,0,0,0,0|1,0,0]=3 4304 B6R0.3 NCC(C(=O)O)S Amb17593238 [1,1,0,0,0,0|1,0,0]=3 4305 B6R0.3 NCC(Cl)C(N)=O Amb25173817 [1,1,0,0,0,0|2,0,0]=4 4306 B6R0.3 NCC(F)C(O)=O Amb22733051 [1,1,0,0,0,0|1,0,0]=3 4307 B6R0.3 NCC(N)C(N)=O Amb18122079 [1,1,0,0,0,0|2,0,0]=4 4308 B6R0.3 NCC(N)C(O)=O Amb22899095 [1,1,0,0,0,0|1,0,0]=3 4309 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [1,1,0,0,0,0|1,0,0]=3 4310 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [1,1,0,0,0,0|1,0,0]=3 4311 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [1,1,0,0,0,0|1,0,0]=3 4312 B6R0.3 NC[C@@H](S)C(N)=O Amb25106293 [1,1,0,0,0,0|2,0,0]=4 4313 B6R0.3 NC[C@H](N)C(N)=O Amb24470655 [1,1,0,0,0,0|2,0,0]=4 4314 B6R0.3 NOC(F)C(O)=O Amb24446310 [1,1,0,0,0,0|2,0,0]=4 4315 B6R0.3 NOC(O)C(O)=O Amb24735537 [1,1,0,0,0,0|2,0,0]=4 4316 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [1,1,0,0,0,0|1,0,0]=3 4317 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [1,1,0,0,0,0|1,0,0]=3 4318 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [1,1,0,0,0,0|1,0,0]=3 4319 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [1,1,0,0,0,0|1,0,0]=3 4320 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [1,1,0,0,0,0|1,0,0]=3 4321 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [1,1,0,0,0,0|1,0,0]=3 4322 B6R0.3 N[C@@H](CS)C(=O)Cl Amb24562196 [1,1,0,0,0,0|2,0,0]=4 4323 B6R0.3 N[C@@H](CS)C(N)=O Amb23437751 [1,1,0,0,0,0|2,0,0]=4 4324 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [1,1,0,0,0,0|1,0,0]=3 4325 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [1,1,0,0,0,0|1,0,0]=3 4326 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [1,1,0,0,0,0|1,0,0]=3 4327 B6R0.3 N[C@H](CO)C(N)=O Amb22886957 [1,1,0,0,0,0|2,0,0]=4 4328 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [1,1,0,0,0,0|1,0,0]=3 4329 B6R0.3 O=C(Cl)C(F)CCl Amb25324478 [1,1,0,0,0,0|2,0,0]=4 4330 B6R0.3 O=C(S)C(Cl)CCl Amb25112062 [1,1,0,0,0,0|1,1,0]=4 4331 B6R0.3 OC(=O)C(=O)CBr Amb10068671 [1,1,0,0,0,0|1,0,1]=4 4332 B6R0.3 OC(=O)C(=O)CCl Amb16233358 [1,1,0,0,0,0|1,0,1]=4 4333 B6R0.3 OC(=O)C(=O)CF Amb22008247 [1,1,0,0,0,0|1,0,1]=4 4334 B6R0.3 OC(=O)C(=O)CF Amb22274202 [1,1,0,0,0,0|1,0,1]=4 4335 B6R0.3 OC(=O)C(=O)CS Amb22360785 [1,1,0,0,0,0|1,0,1]=4 4336 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [1,1,0,0,0,0|1,0,0]=3 4337 B6R0.3 OC(=O)C(CF)Br Amb10605519 [1,1,0,0,0,0|1,0,0]=3 4338 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [1,1,0,0,0,0|1,0,1]=4 4339 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [1,1,0,0,0,0|1,0,0]=3 4340 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [1,1,0,0,0,0|1,0,0]=3 4341 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [1,1,0,0,0,0|1,0,0]=3 4342 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [1,1,0,0,0,0|1,0,0]=3 4343 B6R0.3 OC(=O)C(F)C=O Amb22055301 [1,1,0,0,0,0|1,0,1]=4 4344 B6R0.3 OC(=O)C(F)CF Amb24746801 [1,1,0,0,0,0|1,0,0]=3 4345 B6R0.3 OC(=O)C(S)CS Amb18643295 [1,1,0,0,0,0|1,0,0]=3 4346 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [1,1,0,0,0,0|1,0,0]=3 4347 B6R0.3 OC(C=O)C(O)=O Amb18640325 [1,1,0,0,0,0|1,0,1]=4 4348 B6R0.3 OC(CBr)C(O)=O Amb24061932 [1,1,0,0,0,0|1,0,0]=3 4349 B6R0.3 OC(CCl)P(O)=O Amb25069434 [1,1,0,0,0,0|2,0,0]=4 4350 B6R0.3 OC(CS)C(O)=O Amb18642053 [1,1,0,0,0,0|1,0,0]=3 4351 B6R0.3 OCC(Br)C(O)=O Amb18126327 [1,1,0,0,0,0|1,0,0]=3 4352 B6R0.3 OCC(C(=O)O)F Amb17593117 [1,1,0,0,0,0|1,0,0]=3 4353 B6R0.3 OCC(C(=O)O)O Amb17593103 [1,1,0,0,0,0|1,0,0]=3 4354 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [1,1,0,0,0,0|1,0,0]=3 4355 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [1,1,0,0,0,0|1,0,0]=3 4356 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [1,1,0,0,0,0|1,0,0]=3 4357 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [1,1,0,0,0,0|1,0,0]=3 4358 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [1,1,0,0,0,0|1,0,0]=3 4359 B6R0.3 ONC(O)C(O)=O Amb25832155 [1,1,0,0,0,0|2,0,0]=4 4360 B6R0.3 O[13C](=O)C(=O)CBr Amb22363329 [1,1,0,0,0,0|1,0,1]=4 4361 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [1,1,0,0,0,0|1,0,0]=3 4362 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [1,1,0,0,0,0|1,0,0]=3 4363 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [1,1,0,0,0,0|1,0,0]=3 4364 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [1,1,0,0,0,0|1,0,0]=3 4365 B6R0.3 [13CH3]CC(=O)C([O-])=O Amb22353582 [1,1,0,0,0,0|0,0,2]=4 4366 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [1,1,0,0,0,0|0,0,0]=2 4367 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [1,1,0,0,0,0|1,0,0]=3 4368 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [1,1,0,0,0,0|1,0,0]=3 4369 B6R0.3 [O-]C(=O)C(O)CO Amb22045196 [1,1,0,0,0,0|1,0,1]=4 4370 B6R0.3 [O-]C(=O)[C@@H](O)CO Amb22799769 [1,1,0,0,0,0|1,0,1]=4 4371 B6R0.3 [O-]C(=O)[C@H](C[S-])N Amb17621353 [1,1,0,0,0,0|1,0,1]=4 4372 B6R0.5 CCCC(N)(N)O Amb24616328 [1,1,0,0,0,0|1,0,1]=4 4373 B6R0.5 CCCC(N)(O)O Amb24480396 [1,1,0,0,0,0|0,0,2]=4 4374 B6R0.5 CCCP(=O)(Cl)Cl Amb22053922 [1,1,0,0,0,0|2,0,0]=4 4375 B6R0.5 CCCP(O)(O)=O Amb22230045 [1,1,0,0,0,0|1,0,0]=3 4376 B6R0.5 CCCS(=O)(=O)Br Amb23555502 [1,1,0,0,0,0|1,0,1]=4 4377 B6R0.5 CCCS(=O)(=O)F Amb10610150 [1,1,0,0,0,0|1,0,1]=4 4378 B6R0.5 CCCS(=O)(=O)N Amb1139748 [1,1,0,0,0,0|1,0,1]=4 4379 B6R0.5 CCCS(=O)(=O)[S-] Amb22369121 [1,1,0,0,0,0|1,0,1]=4 4380 B6R0.5 CCNS(O)(=O)=O Amb19650770 [1,1,0,0,0,0|2,0,0]=4 4381 B6R0.5 CCOP(C)(O)=O Amb17673498 [1,1,0,0,0,0|2,0,0]=4 4382 B6R0.5 CCOP(O)(=O)F Amb24609989 [1,1,0,0,0,0|2,0,0]=4 4383 B6R0.5 CCOP(O)(O)=O Amb22230660 [1,1,0,0,0,0|2,0,0]=4 4384 B6R0.5 COCP(O)(O)=O Amb24580709 [1,1,0,0,0,0|2,0,0]=4 4385 B6R0.5 CP(O)(=O)CCO Amb25085578 [1,1,0,0,0,0|2,0,0]=4 4386 B6R0.5 OCCP(O)(O)=O Amb22388824 [1,1,0,0,0,0|2,0,0]=4 4387 B6R0.5 OCCS(O)(=O)=O Amb22274016 [1,1,0,0,0,0|2,0,0]=4 4388 B6R0.5 OCCS(O)(=O)=O Amb22360755 [1,1,0,0,0,0|2,0,0]=4 4389 B6R0.5 OCCS(O)(=O)=O Amb22751389 [1,1,0,0,0,0|2,0,0]=4 4390 B6R0.5 OS(=O)(=O)CCBr Amb17938633 [1,1,0,0,0,0|2,0,0]=4 4391 B6R0.5 OS(=O)(=O)CCS Amb22337599 [1,1,0,0,0,0|2,0,0]=4 4392 B6R0.5 OS(=O)(=O)CCS Amb22337676 [1,1,0,0,0,0|2,0,0]=4 4393 B6R0.5 [15NH2]CCS(O)(=O)=O Amb22363139 [1,1,0,0,0,0|2,0,0]=4 4394 B6R0.6 BrCCCCC#C Amb17673315 [1,1,0,0,0,0|1,0,1]=4 4395 B6R0.6 C#CCCCCI Amb22752649 [1,1,0,0,0,0|1,0,1]=4 4396 B6R0.6 C#CCCCCN Amb20668925 [1,1,0,0,0,0|1,0,1]=4 4397 B6R0.6 C#CCCCCN Amb22059283 [1,1,0,0,0,0|1,0,1]=4 4398 B6R0.6 C#CCCCCS Amb24120444 [1,1,0,0,0,0|1,0,1]=4 4399 B6R0.6 C#CCOCC=O Amb25123719 [1,1,0,0,0,0|0,0,2]=4 4400 B6R0.6 C=C=CCCCBr Amb24479398 [1,1,0,0,0,0|2,0,0]=4 4401 B6R0.6 C=CCCCC#C Amb22227961 [1,1,0,0,0,0|1,0,1]=4 4402 B6R0.6 C=CCCCC=C Amb22227760 [1,1,0,0,0,0|1,0,1]=4 4403 B6R0.6 C=CCCCC=O Amb13883672 [1,1,0,0,0,0|0,0,1]=3 4404 B6R0.6 C=CCCCCF Amb24409527 [1,1,0,0,0,0|1,0,0]=3 4405 B6R0.6 C=CCCCCN Amb18639514 [1,1,0,0,0,0|1,0,0]=3 4406 B6R0.6 C=CCCCCN Amb22899138 [1,1,0,0,0,0|1,0,0]=3 4407 B6R0.6 C=CCCCON Amb25284631 [1,1,0,0,0,0|2,0,0]=4 4408 B6R0.6 C=CCCC[Zn]Br Amb22000384 [1,1,0,0,0,0|2,0,0]=4 4409 B6R0.6 C=CCCOCO Amb22338634 [1,1,0,0,0,0|2,0,0]=4 4410 B6R0.6 C=CCNCCF Amb25062629 [1,1,0,0,0,0|2,0,0]=4 4411 B6R0.6 C=CCNCCI Amb25026445 [1,1,0,0,0,0|2,0,0]=4 4412 B6R0.6 C=CCNCCS Amb18641942 [1,1,0,0,0,0|2,0,0]=4 4413 B6R0.6 C=CCOCCI Amb24739964 [1,1,0,0,0,0|2,0,0]=4 4414 B6R0.6 C=CCOCCN Amb19033754 [1,1,0,0,0,0|2,0,0]=4 4415 B6R0.6 C=CCOCCS Amb24333486 [1,1,0,0,0,0|2,0,0]=4 4416 B6R0.6 C=CCSCC=O Amb18641509 [1,1,0,0,0,0|0,0,2]=4 4417 B6R0.6 C=CCSCCBr Amb24390288 [1,1,0,0,0,0|2,0,0]=4 4418 B6R0.6 C=CCSCCS Amb25284972 [1,1,0,0,0,0|2,0,0]=4 4419 B6R0.6 C=COCCCBr Amb25811206 [1,1,0,0,0,0|2,0,0]=4 4420 B6R0.6 C=COCCCF Amb22008255 [1,1,0,0,0,0|2,0,0]=4 4421 B6R0.6 C=CSCCCO Amb25026486 [1,1,0,0,0,0|2,0,0]=4 4422 B6R0.6 CC#CCCC=O Amb24600953 [1,1,0,0,0,0|0,0,1]=3 4423 B6R0.6 CC#CCCCO Amb20242139 [1,1,0,0,0,0|0,0,2]=4 4424 B6R0.6 CC#CCNC=O Amb25146465 [1,1,0,0,0,0|0,0,2]=4 4425 B6R0.6 CC=C=CCC=O Amb24579458 [1,1,0,0,0,0|0,0,2]=4 4426 B6R0.6 CCC#CCC=C Amb22227956 [1,1,0,0,0,0|1,0,1]=4 4427 B6R0.6 CCCC#CC=C Amb17673843 [1,1,0,0,0,0|1,0,1]=4 4428 B6R0.6 CCCC/C=C/Br Amb17940862 [1,1,0,0,0,0|1,0,0]=3 4429 B6R0.6 CCCC=NOC Amb24507605 [1,1,0,0,0,0|1,0,1]=4 4430 B6R0.6 CCCCBOC Amb22728871 [1,1,0,0,0,0|1,0,0]=3 4431 B6R0.6 CCCCC=C=C Amb17670592 [1,1,0,0,0,0|1,0,0]=3 4432 B6R0.6 CCCCC=NN Amb25344632 [1,1,0,0,0,0|1,0,0]=3 4433 B6R0.6 CCCCCC[13CH3] Amb22337896 [1,1,0,0,0,0|1,0,1]=4 4434 B6R0.6 CCCCCC[15NH2] Amb22336214 [1,1,0,0,0,0|1,0,1]=4 4435 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,1,0,0,0,0|1,0,1]=4 4436 B6R0.6 CCCCCNN Amb22231340 [1,1,0,0,0,0|1,0,1]=4 4437 B6R0.6 CCCCCNO Amb25067859 [1,1,0,0,0,0|0,0,1]=3 4438 B6R0.6 CCCCCON Amb18122095 [1,1,0,0,0,0|0,0,1]=3 4439 B6R0.6 CCCCCSC Amb21618865 [1,1,0,0,0,0|0,1,1]=4 4440 B6R0.6 CCCCC[Mg]Br Amb17938645 [1,1,0,0,0,0|1,0,1]=4 4441 B6R0.6 CCCCC[Mg]Cl Amb22369733 [1,1,0,0,0,0|1,0,1]=4 4442 B6R0.6 CCCCN=[N+]=[N-] Amb17939434 [1,1,0,0,0,0|2,0,0]=4 4443 B6R0.6 CCCCNC#N Amb24479826 [1,1,0,0,0,0|1,0,1]=4 4444 B6R0.6 CCCCNC=C Amb25822786 [1,1,0,0,0,0|1,0,0]=3 4445 B6R0.6 CCCCNOC Amb24479420 [1,1,0,0,0,0|1,0,0]=3 4446 B6R0.6 CCCCOC#C Amb24453550 [1,1,0,0,0,0|1,0,1]=4 4447 B6R0.6 CCCCOCCl Amb22168152 [1,1,0,0,0,0|1,0,1]=4 4448 B6R0.6 CCCCOCO Amb24480826 [1,1,0,0,0,0|0,0,1]=3 4449 B6R0.6 CCCCOP=O Amb24354901 [1,1,0,0,0,0|1,0,0]=3 4450 B6R0.6 CCCCSCCl Amb25146885 [1,1,0,0,0,0|1,0,1]=4 4451 B6R0.6 CCCC[SiH2]CBr Amb25101548 [1,1,0,0,0,0|1,0,1]=4 4452 B6R0.6 CCCC\C=C\Cl Amb25306532 [1,1,0,0,0,0|1,0,0]=3 4453 B6R0.6 CCCC\C=C\I Amb25173925 [1,1,0,0,0,0|1,0,0]=3 4454 B6R0.6 CCCNCC#C Amb10610181 [1,1,0,0,0,0|1,0,1]=4 4455 B6R0.6 CCCNCC=C Amb22587187 [1,1,0,0,0,0|1,0,0]=3 4456 B6R0.6 CCCNCCBr Amb24360522 [1,1,0,0,0,0|1,0,1]=4 4457 B6R0.6 CCCNCCC Amb22350702 [1,1,0,0,0,0|1,0,1]=4 4458 B6R0.6 CCCNCCCl Amb17334074 [1,1,0,0,0,0|1,0,1]=4 4459 B6R0.6 CCCNCCF Amb24567579 [1,1,0,0,0,0|1,0,1]=4 4460 B6R0.6 CCCNCCI Amb25315312 [1,1,0,0,0,0|1,0,1]=4 4461 B6R0.6 CCCNCCN Amb22353438 [1,1,0,0,0,0|1,0,1]=4 4462 B6R0.6 CCCNCCS Amb18640722 [1,1,0,0,0,0|0,1,1]=4 4463 B6R0.6 CCCNCSC Amb25305097 [1,1,0,0,0,0|2,0,0]=4 4464 B6R0.6 CCCOCC=O Amb24421025 [1,1,0,0,0,0|0,0,0]=2 4465 B6R0.6 CCCOCNN Amb25856438 [1,1,0,0,0,0|2,0,0]=4 4466 B6R0.6 CCCONC=O Amb24374223 [1,1,0,0,0,0|1,0,0]=3 4467 B6R0.6 CCCSCC#C Amb25196546 [1,1,0,0,0,0|1,0,1]=4 4468 B6R0.6 CCCSCC=O Amb24479810 [1,1,0,0,0,0|0,0,0]=2 4469 B6R0.6 CCCSCCN Amb19888435 [1,1,0,0,0,0|1,0,1]=4 4470 B6R0.6 CCC[Hg]CCC Amb22732575 [1,1,0,0,0,0|1,0,1]=4 4471 B6R0.6 CCC[Sn+2]CCC Amb22728829 [1,1,0,0,0,0|1,0,1]=4 4472 B6R0.6 CCC\C=C/CC Amb22734071 [1,1,0,0,0,0|1,0,1]=4 4473 B6R0.6 CCC\C=C\C#N Amb18120245 [1,1,0,0,0,0|1,0,1]=4 4474 B6R0.6 CCC\C=C\CBr Amb25293717 [1,1,0,0,0,0|1,0,1]=4 4475 B6R0.6 CCC\C=C\CC Amb19930065 [1,1,0,0,0,0|1,0,1]=4 4476 B6R0.6 CCC\C=C\CI Amb24558601 [1,1,0,0,0,0|1,0,1]=4 4477 B6R0.6 CCC\C=C\CN Amb18639526 [1,1,0,0,0,0|1,0,1]=4 4478 B6R0.6 CCNCC=C=C Amb24481077 [1,1,0,0,0,0|2,0,0]=4 4479 B6R0.6 CCNCCC#C Amb18299437 [1,1,0,0,0,0|1,0,1]=4 4480 B6R0.6 CCNCCC=C Amb19025187 [1,1,0,0,0,0|1,0,0]=3 4481 B6R0.6 CCNCCC=O Amb25712349 [1,1,0,0,0,0|0,0,0]=2 4482 B6R0.6 CCNCCCI Amb25342283 [1,1,0,0,0,0|1,0,1]=4 4483 B6R0.6 CCNCCCS Amb18122695 [1,1,0,0,0,0|0,1,1]=4 4484 B6R0.6 CCNCCNN Amb24479853 [1,1,0,0,0,0|2,0,0]=4 4485 B6R0.6 CCNCCOC Amb22284536 [1,1,0,0,0,0|1,0,1]=4 4486 B6R0.6 CCNCCSC Amb19024605 [1,1,0,0,0,0|2,0,0]=4 4487 B6R0.6 CCNC\C=C/I Amb23539308 [1,1,0,0,0,0|1,0,1]=4 4488 B6R0.6 CCNC\C=C\I Amb24518608 [1,1,0,0,0,0|1,0,1]=4 4489 B6R0.6 CCNNCCO Amb25261700 [1,1,0,0,0,0|1,0,1]=4 4490 B6R0.6 CCNOCC=C Amb24543090 [1,1,0,0,0,0|2,0,0]=4 4491 B6R0.6 CCNSCCO Amb25744782 [1,1,0,0,0,0|1,0,1]=4 4492 B6R0.6 CCOCCC=C Amb25210333 [1,1,0,0,0,0|1,0,0]=3 4493 B6R0.6 CCOCCC=O Amb25688261 [1,1,0,0,0,0|0,0,0]=2 4494 B6R0.6 CCOCCCS Amb24479268 [1,1,0,0,0,0|0,1,1]=4 4495 B6R0.6 CCOCCNC Amb19959934 [1,1,0,0,0,0|2,0,0]=4 4496 B6R0.6 CCOCCNN Amb22587352 [1,1,0,0,0,0|2,0,0]=4 4497 B6R0.6 CCOCCON Amb18061689 [1,1,0,0,0,0|1,0,1]=4 4498 B6R0.6 CCOCCSC Amb24396764 [1,1,0,0,0,0|2,0,0]=4 4499 B6R0.6 CCOCC[Hg]Cl Amb22359817 [1,1,0,0,0,0|2,0,0]=4 4500 B6R0.6 CCOC\C=C\Cl Amb24676600 [1,1,0,0,0,0|1,0,1]=4 4501 B6R0.6 CCONCCO Amb25107790 [1,1,0,0,0,0|1,0,1]=4 4502 B6R0.6 CCO\C=C\C=O Amb18639560 [1,1,0,0,0,0|0,0,2]=4 4503 B6R0.6 CCSCCC#C Amb24670860 [1,1,0,0,0,0|1,0,1]=4 4504 B6R0.6 CCSCCCF Amb25846157 [1,1,0,0,0,0|1,0,1]=4 4505 B6R0.6 CCSCCOC Amb24333360 [1,1,0,0,0,0|1,0,1]=4 4506 B6R0.6 CCSCCON Amb24414250 [1,1,0,0,0,0|1,0,1]=4 4507 B6R0.6 CCSC\C=C\Cl Amb24415413 [1,1,0,0,0,0|1,0,1]=4 4508 B6R0.6 CCSSCC=C Amb24063524 [1,1,0,0,0,0|2,0,0]=4 4509 B6R0.6 CCS\C=C\C=O Amb18641909 [1,1,0,0,0,0|0,0,2]=4 4510 B6R0.6 CC[SiH2]CCCCl Amb24620188 [1,1,0,0,0,0|1,0,1]=4 4511 B6R0.6 CC\C=C/CC=O Amb18639157 [1,1,0,0,0,0|0,0,1]=3 4512 B6R0.6 CC\C=C\CC=C Amb25275369 [1,1,0,0,0,0|1,0,1]=4 4513 B6R0.6 CC\C=C\CC=O Amb25136370 [1,1,0,0,0,0|0,0,1]=3 4514 B6R0.6 CNCCC=C=C Amb24481063 [1,1,0,0,0,0|2,0,0]=4 4515 B6R0.6 CNCCCC#C Amb18993049 [1,1,0,0,0,0|1,0,1]=4 4516 B6R0.6 CNCCCC=C Amb18523846 [1,1,0,0,0,0|1,0,0]=3 4517 B6R0.6 CNCCCC=O Amb25026193 [1,1,0,0,0,0|0,0,0]=2 4518 B6R0.6 CNCCCCBr Amb22490953 [1,1,0,0,0,0|1,0,1]=4 4519 B6R0.6 CNCCCCBr Amb22491228 [1,1,0,0,0,0|1,0,1]=4 4520 B6R0.6 CNCCCCCl Amb25106571 [1,1,0,0,0,0|1,0,1]=4 4521 B6R0.6 CNCCCCI Amb25275194 [1,1,0,0,0,0|1,0,1]=4 4522 B6R0.6 CNCCCCN Amb17334048 [1,1,0,0,0,0|1,0,1]=4 4523 B6R0.6 CNCCCCO Amb17334049 [1,1,0,0,0,0|0,0,1]=3 4524 B6R0.6 CNCCCCS Amb24479785 [1,1,0,0,0,0|0,1,1]=4 4525 B6R0.6 CNCCOC=C Amb18639709 [1,1,0,0,0,0|2,0,0]=4 4526 B6R0.6 CNCCSC=C Amb25743976 [1,1,0,0,0,0|2,0,0]=4 4527 B6R0.6 CNCCSCC Amb16186669 [1,1,0,0,0,0|2,0,0]=4 4528 B6R0.6 CNCCSCC Amb19889162 [1,1,0,0,0,0|2,0,0]=4 4529 B6R0.6 CNC\C=C/CO Amb24479692 [1,1,0,0,0,0|1,0,1]=4 4530 B6R0.6 COCC#CC=O Amb25054795 [1,1,0,0,0,0|0,0,2]=4 4531 B6R0.6 COCCC=[N+]=[N-] Amb25103743 [1,1,0,0,0,0|2,0,0]=4 4532 B6R0.6 COCCCC#C Amb25694831 [1,1,0,0,0,0|1,0,1]=4 4533 B6R0.6 COCCCC=C Amb24432882 [1,1,0,0,0,0|1,0,0]=3 4534 B6R0.6 COCCCCCl Amb17942999 [1,1,0,0,0,0|1,0,1]=4 4535 B6R0.6 COCCCCN Amb10610278 [1,1,0,0,0,0|1,0,1]=4 4536 B6R0.6 COCCCCO Amb17666901 [1,1,0,0,0,0|0,0,1]=3 4537 B6R0.6 COCCCCS Amb24654696 [1,1,0,0,0,0|0,1,1]=4 4538 B6R0.6 COCCCOC Amb22168275 [1,1,0,0,0,0|1,0,1]=4 4539 B6R0.6 COCCCON Amb18559290 [1,1,0,0,0,0|1,0,1]=4 4540 B6R0.6 COCCC[Mg]Cl Amb22897395 [1,1,0,0,0,0|2,0,0]=4 4541 B6R0.6 COCCC[Zn]Cl Amb22897901 [1,1,0,0,0,0|2,0,0]=4 4542 B6R0.6 COCCNC=O Amb24334241 [1,1,0,0,0,0|1,0,0]=3 4543 B6R0.6 COCCOC=C Amb21520356 [1,1,0,0,0,0|2,0,0]=4 4544 B6R0.6 COCCOCC Amb22052684 [1,1,0,0,0,0|1,0,1]=4 4545 B6R0.6 COCNCCO Amb18522071 [1,1,0,0,0,0|1,0,1]=4 4546 B6R0.6 COCOCC=C Amb24385255 [1,1,0,0,0,0|2,0,0]=4 4547 B6R0.6 COCOCCO Amb23590973 [1,1,0,0,0,0|1,0,1]=4 4548 B6R0.6 COCSCCO Amb24701888 [1,1,0,0,0,0|1,0,1]=4 4549 B6R0.6 COC\C=C\C=O Amb18639577 [1,1,0,0,0,0|0,0,2]=4 4550 B6R0.6 COC\C=C\CO Amb25662350 [1,1,0,0,0,0|1,0,1]=4 4551 B6R0.6 CONCCC=C Amb22897002 [1,1,0,0,0,0|2,0,0]=4 4552 B6R0.6 CONCCCI Amb25846019 [1,1,0,0,0,0|2,0,0]=4 4553 B6R0.6 CONCCCO Amb24479622 [1,1,0,0,0,0|1,0,1]=4 4554 B6R0.6 CO\C=C/CC=O Amb24741941 [1,1,0,0,0,0|0,0,2]=4 4555 B6R0.6 CO\C=C\CC=O Amb24741886 [1,1,0,0,0,0|0,0,2]=4 4556 B6R0.6 CO\C=C\CCO Amb24661187 [1,1,0,0,0,0|1,0,1]=4 4557 B6R0.6 CO\C=C\COC Amb25025977 [1,1,0,0,0,0|1,0,1]=4 4558 B6R0.6 CSCCC=NN Amb24704642 [1,1,0,0,0,0|2,0,0]=4 4559 B6R0.6 CSCCCC#N Amb17504231 [1,1,0,0,0,0|1,0,1]=4 4560 B6R0.6 CSCCCCBr Amb19054837 [1,1,0,0,0,0|1,0,1]=4 4561 B6R0.6 CSCCCCCl Amb25240444 [1,1,0,0,0,0|1,0,1]=4 4562 B6R0.6 CSCCCCN Amb17500948 [1,1,0,0,0,0|1,0,1]=4 4563 B6R0.6 CSCCCNN Amb24093854 [1,1,0,0,0,0|2,0,0]=4 4564 B6R0.6 CSCCCSC Amb22043311 [1,1,0,0,0,0|2,0,0]=4 4565 B6R0.6 CSCCN=C=O Amb19889355 [1,1,0,0,0,0|1,0,1]=4 4566 B6R0.6 CSCCOC=C Amb25801320 [1,1,0,0,0,0|2,0,0]=4 4567 B6R0.6 CSC\C=C\CO Amb24387294 [1,1,0,0,0,0|1,0,1]=4 4568 B6R0.6 C\C=C/CCCC Amb24467666 [1,1,0,0,0,0|1,0,0]=3 4569 B6R0.6 C\C=C/CCCCl Amb22732552 [1,1,0,0,0,0|1,0,1]=4 4570 B6R0.6 C\C=C/CCCO Amb17614951 [1,1,0,0,0,0|0,0,2]=4 4571 B6R0.6 C\C=C\CCC=C Amb22734684 [1,1,0,0,0,0|1,0,1]=4 4572 B6R0.6 C\C=C\CCCBr Amb24525194 [1,1,0,0,0,0|1,0,1]=4 4573 B6R0.6 C\C=C\CCCI Amb25837122 [1,1,0,0,0,0|1,0,1]=4 4574 B6R0.6 C\C=C\CCCN Amb25288441 [1,1,0,0,0,0|1,0,1]=4 4575 B6R0.6 C\C=C\CCCO Amb22347882 [1,1,0,0,0,0|0,0,2]=4 4576 B6R0.6 C\C=C\CCNC Amb18993047 [1,1,0,0,0,0|1,0,1]=4 4577 B6R0.6 C\C=C\CCNO Amb25245372 [1,1,0,0,0,0|1,0,1]=4 4578 B6R0.6 C\C=C\CNCC Amb24370243 [1,1,0,0,0,0|1,0,1]=4 4579 B6R0.6 C\C=C\NCCC Amb25113340 [1,1,0,0,0,0|1,0,1]=4 4580 B6R0.6 C\C=C\SCCC Amb22168314 [1,1,0,0,0,0|1,0,1]=4 4581 B6R0.6 ClCCCC=C=C Amb17939722 [1,1,0,0,0,0|2,0,0]=4 4582 B6R0.6 ClCCCCCI Amb10069913 [1,1,0,0,0,0|1,0,1]=4 4583 B6R0.6 ClCCC\C=C\Br Amb25146715 [1,1,0,0,0,0|1,0,1]=4 4584 B6R0.6 ClCCNCC=C Amb17334072 [1,1,0,0,0,0|2,0,0]=4 4585 B6R0.6 Cl\C=C\CCCCl Amb24379157 [1,1,0,0,0,0|1,0,1]=4 4586 B6R0.6 FCCCCCBr Amb15701635 [1,1,0,0,0,0|1,0,1]=4 4587 B6R0.6 FCCCCCCl Amb24479767 [1,1,0,0,0,0|1,0,1]=4 4588 B6R0.6 FCCCCCI Amb25690320 [1,1,0,0,0,0|1,0,1]=4 4589 B6R0.6 FCCCCCS Amb24409033 [1,1,0,0,0,0|0,1,1]=4 4590 B6R0.6 FCCCC[Mg]Br Amb22897418 [1,1,0,0,0,0|2,0,0]=4 4591 B6R0.6 FCCCC[Zn]Br Amb22897529 [1,1,0,0,0,0|2,0,0]=4 4592 B6R0.6 N#CCCCC=O Amb18120556 [1,1,0,0,0,0|0,0,1]=3 4593 B6R0.6 N#CCCNC=O Amb18639097 [1,1,0,0,0,0|1,0,1]=4 4594 B6R0.6 N#CSCCC=O Amb24666788 [1,1,0,0,0,0|1,0,1]=4 4595 B6R0.6 N=CCCCC=O Amb24690651 [1,1,0,0,0,0|0,0,1]=3 4596 B6R0.6 N=CCOCCO Amb24407453 [1,1,0,0,0,0|2,0,0]=4 4597 B6R0.6 NCCCCC#N Amb18301883 [1,1,0,0,0,0|1,0,1]=4 4598 B6R0.6 NCCCCCBr Amb17610058 [1,1,0,0,0,0|1,0,1]=4 4599 B6R0.6 NCCCCCCl Amb17593241 [1,1,0,0,0,0|1,0,1]=4 4600 B6R0.6 NCCCCCN Amb22002397 [1,1,0,0,0,0|1,0,1]=4 4601 B6R0.6 NCCCCCN Amb22337298 [1,1,0,0,0,0|1,0,1]=4 4602 B6R0.6 NCCCCNCl Amb25228620 [1,1,0,0,0,0|2,0,0]=4 4603 B6R0.6 NCCCCNO Amb24117989 [1,1,0,0,0,0|1,0,0]=3 4604 B6R0.6 NCCCNCC Amb17315269 [1,1,0,0,0,0|1,0,1]=4 4605 B6R0.6 NCCC\C=C\Cl Amb24479838 [1,1,0,0,0,0|1,0,1]=4 4606 B6R0.6 NCCNCC=C Amb17091015 [1,1,0,0,0,0|2,0,0]=4 4607 B6R0.6 NCCSCC=C Amb13951462 [1,1,0,0,0,0|2,0,0]=4 4608 B6R0.6 NNCCCCCl Amb24674957 [1,1,0,0,0,0|2,0,0]=4 4609 B6R0.6 NNCCCCO Amb24692523 [1,1,0,0,0,0|1,0,1]=4 4610 B6R0.6 NOCCCCF Amb22896553 [1,1,0,0,0,0|1,0,1]=4 4611 B6R0.6 NOCCCCO Amb25756966 [1,1,0,0,0,0|1,0,1]=4 4612 B6R0.6 N[14CH2]CCC[14CH2]N Amb22350129 [1,1,0,0,0,0|1,0,1]=4 4613 B6R0.6 O=C=CCCCCl Amb25084548 [1,1,0,0,0,0|1,0,0]=3 4614 B6R0.6 O=CCCCC#C Amb17593060 [1,1,0,0,0,0|0,0,1]=3 4615 B6R0.6 O=CCCCCBr Amb18126353 [1,1,0,0,0,0|0,0,0]=2 4616 B6R0.6 O=CCCCCCl Amb18123550 [1,1,0,0,0,0|0,0,0]=2 4617 B6R0.6 O=CCCCCF Amb25725976 [1,1,0,0,0,0|0,0,0]=2 4618 B6R0.6 O=CCCCCI Amb24707459 [1,1,0,0,0,0|0,0,0]=2 4619 B6R0.6 O=CCCN=C=S Amb25081456 [1,1,0,0,0,0|1,0,1]=4 4620 B6R0.6 O=CCCNC=O Amb25087053 [1,1,0,0,0,0|1,0,1]=4 4621 B6R0.6 O=CCC\C=C\Br Amb24479765 [1,1,0,0,0,0|0,0,2]=4 4622 B6R0.6 O=CCC\C=C\C Amb17593074 [1,1,0,0,0,0|0,0,1]=3 4623 B6R0.6 O=CCNCC=O Amb24384445 [1,1,0,0,0,0|1,0,1]=4 4624 B6R0.6 O=CCOCC=O Amb18121758 [1,1,0,0,0,0|1,0,1]=4 4625 B6R0.6 O=CCOCCCl Amb24665263 [1,1,0,0,0,0|1,0,0]=3 4626 B6R0.6 O=CCSCC=O Amb18641963 [1,1,0,0,0,0|1,0,1]=4 4627 B6R0.6 O=CNCCCBr Amb25745639 [1,1,0,0,0,0|1,0,0]=3 4628 B6R0.6 O=CNCCCF Amb25092168 [1,1,0,0,0,0|1,0,0]=3 4629 B6R0.6 O=CNCCCS Amb24659838 [1,1,0,0,0,0|1,0,0]=3 4630 B6R0.6 O=COCCCBr Amb25725047 [1,1,0,0,0,0|1,0,0]=3 4631 B6R0.6 O=COCCCCl Amb24427057 [1,1,0,0,0,0|1,0,0]=3 4632 B6R0.6 O=COCCCF Amb22008204 [1,1,0,0,0,0|1,0,0]=3 4633 B6R0.6 O=COCCCI Amb25839622 [1,1,0,0,0,0|1,0,0]=3 4634 B6R0.6 O=C\C=C\CCF Amb25723268 [1,1,0,0,0,0|0,0,2]=4 4635 B6R0.6 O=S=NCCCCl Amb24523810 [1,1,0,0,0,0|2,0,0]=4 4636 B6R0.6 OCC=NCCO Amb24507433 [1,1,0,0,0,0|2,0,0]=4 4637 B6R0.6 OCCCC=C=C Amb10605300 [1,1,0,0,0,0|2,0,0]=4 4638 B6R0.6 OCCCCC=O Amb10603837 [1,1,0,0,0,0|0,0,0]=2 4639 B6R0.6 OCCCCCBr Amb10603824 [1,1,0,0,0,0|0,0,1]=3 4640 B6R0.6 OCCCCCF Amb24479828 [1,1,0,0,0,0|0,0,1]=3 4641 B6R0.6 OCCCCCI Amb25025520 [1,1,0,0,0,0|0,0,1]=3 4642 B6R0.6 OCCCCSCl Amb24619715 [1,1,0,0,0,0|1,0,1]=4 4643 B6R0.6 OCCCOC=O Amb24733886 [1,1,0,0,0,0|1,0,0]=3 4644 B6R0.6 OCCNCCCl Amb18642158 [1,1,0,0,0,0|1,0,1]=4 4645 B6R0.6 OCCNCCCl Amb22641891 [1,1,0,0,0,0|1,0,1]=4 4646 B6R0.6 OCCNCCO Amb22035219 [1,1,0,0,0,0|1,0,1]=4 4647 B6R0.6 OCCNCCS Amb18522180 [1,1,0,0,0,0|1,0,1]=4 4648 B6R0.6 OCCOCC=O Amb24060822 [1,1,0,0,0,0|1,0,0]=3 4649 B6R0.6 OCCOCCBr Amb24057456 [1,1,0,0,0,0|1,0,1]=4 4650 B6R0.6 OCCOCCF Amb17593119 [1,1,0,0,0,0|1,0,1]=4 4651 B6R0.6 OCCOCCO Amb19515789 [1,1,0,0,0,0|1,0,1]=4 4652 B6R0.6 OCCOCCO Amb22232249 [1,1,0,0,0,0|1,0,1]=4 4653 B6R0.6 OCCOCCS Amb22008751 [1,1,0,0,0,0|1,0,1]=4 4654 B6R0.6 OCCSCC=O Amb24525990 [1,1,0,0,0,0|1,0,0]=3 4655 B6R0.6 OCCSCCF Amb25261470 [1,1,0,0,0,0|1,0,1]=4 4656 B6R0.6 OCC\C=C\C=O Amb18119862 [1,1,0,0,0,0|0,0,2]=4 4657 B6R0.6 OC\C=C\CCBr Amb24720101 [1,1,0,0,0,0|1,0,1]=4 4658 B6R0.6 O\C=C\CCCO Amb24480597 [1,1,0,0,0,0|0,0,1]=3 4659 B6R0.6 O\N=C/CCCCl Amb25295218 [1,1,0,0,0,0|1,0,0]=3 4660 B6R0.6 SCCCCCBr Amb25775029 [1,1,0,0,0,0|0,1,1]=4 4661 B6R0.6 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2]Br Amb22367407 [1,1,0,0,0,0|1,0,1]=4 4662 B6R0.6 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2]O Amb22367427 [1,1,0,0,0,0|0,0,1]=3 4663 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [1,1,0,0,0,0|2,0,0]=4 4664 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [1,1,0,0,0,0|2,0,0]=4 4665 B8R0.2 C=C(C(O)CO)C(O)=O Amb18642874 [0,2,0,0,0,0|1,0,1]=4 4666 B8R0.2 C=CC(O)C(N)C(O)=O Amb18642830 [0,2,0,0,0,0|0,0,2]=4 4667 B8R0.2 C=C[C@@H](O)[C@H](N)C(O)=O Amb25111565 [0,2,0,0,0,0|0,0,2]=4 4668 B8R0.2 C=C[C@H](O)[C@H](N)C(O)=O Amb25328036 [0,2,0,0,0,0|0,0,2]=4 4669 B8R0.2 CC(=O)C(Cl)C(=O)CC Amb24373790 [0,2,0,0,0,0|1,0,1]=4 4670 B8R0.2 CC(=O)C(N)C(=O)CC Amb24744767 [0,2,0,0,0,0|1,0,1]=4 4671 B8R0.2 CC(=O)C(O)C(Cl)CC Amb24588006 [0,2,0,0,0,0|1,0,0]=3 4672 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,2,0,0,0,0|2,0,0]=4 4673 B8R0.2 CC(C#C)C(N)C(O)=O Amb25726710 [0,2,0,0,0,0|0,0,2]=4 4674 B8R0.2 CC(C#C)C(O)C(O)=O Amb24417906 [0,2,0,0,0,0|0,0,2]=4 4675 B8R0.2 CC(C(C)C#C)C(O)=O Amb25848905 [0,2,0,0,0,0|0,0,2]=4 4676 B8R0.2 CC(C(C)C#N)C(O)=O Amb25062368 [0,2,0,0,0,0|1,0,1]=4 4677 B8R0.2 CC(C(C)C=C)C(O)=O Amb18642611 [0,2,0,0,0,0|0,0,2]=4 4678 B8R0.2 CC(C(C)C=O)C(O)=O Amb24468282 [0,2,0,0,0,0|1,0,1]=4 4679 B8R0.2 CC(C(C)CN)P(O)=O Amb24623943 [0,2,0,0,0,0|2,0,0]=4 4680 B8R0.2 CC(C(C)CO)C(C)=O Amb25127275 [0,2,0,0,0,0|2,0,0]=4 4681 B8R0.2 CC(C(F)CC)C(O)=O Amb25836213 [0,2,0,0,0,0|0,0,0]=2 4682 B8R0.2 CC(C(F)CN)P(O)=O Amb24524185 [0,2,0,0,0,0|2,0,0]=4 4683 B8R0.2 CC(C(N)CC)C(C)O Amb24460640 [0,2,0,0,0,0|1,0,1]=4 4684 B8R0.2 CC(C(N)CC)C(O)=O Amb18832531 [0,2,0,0,0,0|0,0,0]=2 4685 B8R0.2 CC(C(N)CC)S(C)=O Amb25299874 [0,2,0,0,0,0|2,0,0]=4 4686 B8R0.2 CC(C(N)CN)C(O)=O Amb24532823 [0,2,0,0,0,0|1,0,0]=3 4687 B8R0.2 CC(C(O)=O)=C(Cl)CC Amb24719968 [0,2,0,0,0,0|0,0,2]=4 4688 B8R0.2 CC(C(O)C#C)C(O)=O Amb25123215 [0,2,0,0,0,0|0,0,2]=4 4689 B8R0.2 CC(C(O)C=C)C(O)=O Amb18642774 [0,2,0,0,0,0|0,0,2]=4 4690 B8R0.2 CC(C=C)C(Br)C(O)=O Amb25102712 [0,2,0,0,0,0|0,0,2]=4 4691 B8R0.2 CC(C=C)C(F)C(O)=O Amb24426918 [0,2,0,0,0,0|0,0,2]=4 4692 B8R0.2 CC(C=C)C(N)C(O)=O Amb18989861 [0,2,0,0,0,0|0,0,2]=4 4693 B8R0.2 CC(C=C)C(O)C(O)=O Amb18642750 [0,2,0,0,0,0|0,0,2]=4 4694 B8R0.2 CC(C=O)C(N)C(O)=O Amb24374650 [0,2,0,0,0,0|1,0,1]=4 4695 B8R0.2 CC(CC)=C(F)C(O)=O Amb25305731 [0,2,0,0,0,0|0,0,2]=4 4696 B8R0.2 CC(CC)C(Cl)C(=O)Cl Amb24635851 [0,2,0,0,0,0|1,0,0]=3 4697 B8R0.2 CC(CC)C(N)C(=O)S Amb24753871 [0,2,0,0,0,0|0,1,0]=3 4698 B8R0.2 CC(CC)C(N)C(N)=S Amb19374909 [0,2,0,0,0,0|1,1,0]=4 4699 B8R0.2 CC(CC)C(N)P(O)=O Amb24480138 [0,2,0,0,0,0|1,0,0]=3 4700 B8R0.2 CC(CC)C(N)P(O)O Amb24739487 [0,2,0,0,0,0|1,0,1]=4 4701 B8R0.2 CC(CC)C(O)C(C)=C Amb24478684 [0,2,0,0,0,0|2,0,0]=4 4702 B8R0.2 CC(CC)C(O)C(N)=O Amb24112761 [0,2,0,0,0,0|1,0,0]=3 4703 B8R0.2 CC(CC)C(O)C(O)=O Amb18288809 [0,2,0,0,0,0|0,0,0]=2 4704 B8R0.2 CC(CC)C([15NH2])C(O)=O Amb22732430 [0,2,0,0,0,0|0,0,0]=2 4705 B8R0.2 CC(CC)[C@@H](Br)C(O)=O Amb25706427 [0,2,0,0,0,0|0,0,0]=2 4706 B8R0.2 CC(CC)[C@@H](Cl)C(O)=O Amb25360795 [0,2,0,0,0,0|0,0,0]=2 4707 B8R0.2 CC(CC)[C@@H](N)C(N)=O Amb18538475 [0,2,0,0,0,0|1,0,0]=3 4708 B8R0.2 CC(CC)[C@@H](O)C(O)=O Amb25083795 [0,2,0,0,0,0|0,0,0]=2 4709 B8R0.2 CC(CC)[C@@H]([NH3+])C(N)=S Amb23437729 [0,2,0,0,0,0|1,1,0]=4 4710 B8R0.2 CC(CC)[C@H](F)C(O)=O Amb25679990 [0,2,0,0,0,0|0,0,0]=2 4711 B8R0.2 CC(CC)[C@H](O)C(O)=O Amb24700212 [0,2,0,0,0,0|0,0,0]=2 4712 B8R0.2 CC(CCl)[C@H](N)C(O)=O Amb24458196 [0,2,0,0,0,0|1,0,0]=3 4713 B8R0.2 CC(CF)C(N)C(O)=O Amb25223334 [0,2,0,0,0,0|1,0,0]=3 4714 B8R0.2 CC(CN)C(N)C(O)=O Amb25824065 [0,2,0,0,0,0|1,0,0]=3 4715 B8R0.2 CC(CN)C(O)C(O)=O Amb18642919 [0,2,0,0,0,0|1,0,0]=3 4716 B8R0.2 CC(NC)C(N)C(O)=O Amb18642890 [0,2,0,0,0,0|1,0,0]=3 4717 B8R0.2 CC(NC)C(O)C(O)=O Amb24477689 [0,2,0,0,0,0|1,0,0]=3 4718 B8R0.2 CC(O)C(O)C(C)CC Amb25818364 [0,2,0,0,0,0|1,0,1]=4 4719 B8R0.2 CC(O)C(O)C(N)CC Amb24480357 [0,2,0,0,0,0|1,0,1]=4 4720 B8R0.2 CC(OC)C(Cl)C(C)=O Amb24480084 [0,2,0,0,0,0|2,0,0]=4 4721 B8R0.2 CC(OC)C(O)C(N)=O Amb25706543 [0,2,0,0,0,0|2,0,0]=4 4722 B8R0.2 CC(OC)[C@@H](N)C(O)=O Amb25733335 [0,2,0,0,0,0|1,0,0]=3 4723 B8R0.2 CC(SC)C(N)C(O)=O Amb22228563 [0,2,0,0,0,0|1,0,0]=3 4724 B8R0.2 CCC(=C)C(C)C(O)=O Amb25228831 [0,2,0,0,0,0|0,0,1]=3 4725 B8R0.2 CCC(=C)C(N)C(O)=O Amb18642707 [0,2,0,0,0,0|0,0,1]=3 4726 B8R0.2 CCC(=C)[C@H](N)C(O)=O Amb25828765 [0,2,0,0,0,0|0,0,1]=3 4727 B8R0.2 CCC(=O)C(C)C(=O)Cl Amb24340219 [0,2,0,0,0,0|1,0,1]=4 4728 B8R0.2 CCC(=O)C(C)C(C)=O Amb17666954 [0,2,0,0,0,0|1,0,1]=4 4729 B8R0.2 CCC(=O)C(C)C(N)=O Amb24524504 [0,2,0,0,0,0|1,0,1]=4 4730 B8R0.2 CCC(=S)[C@H](N)C(O)=O Amb25111086 [0,2,0,0,0,0|0,0,1]=3 4731 B8R0.2 CCC(Br)C(Br)C(O)=O Amb24478770 [0,2,0,0,0,0|0,0,0]=2 4732 B8R0.2 CCC(C(C(=O)N)N)C Amb1105283 [0,2,0,0,0,0|1,0,0]=3 4733 B8R0.2 CCC(C(C(=O)N)N)C Amb1152621 [0,2,0,0,0,0|1,0,0]=3 4734 B8R0.2 CCC(C(C(=O)O)C)O Amb10844267 [0,2,0,0,0,0|0,0,0]=2 4735 B8R0.2 CCC(C(C(=O)O)Cl)C Amb17593752 [0,2,0,0,0,0|0,0,0]=2 4736 B8R0.2 CCC(C([N+](=O)[O-])C)O Amb17618435 [0,2,0,0,0,0|1,0,1]=4 4737 B8R0.2 CCC(C)C(=C)C(O)=O Amb18642655 [0,2,0,0,0,0|0,0,1]=3 4738 B8R0.2 CCC(C)C(=O)C(O)=O Amb22731530 [0,2,0,0,0,0|0,0,1]=3 4739 B8R0.2 CCC(C)C(=O)C([O-])=O Amb22055837 [0,2,0,0,0,0|0,0,2]=4 4740 B8R0.2 CCC(C)C(C)C(N)=O Amb24746800 [0,2,0,0,0,0|1,0,0]=3 4741 B8R0.2 CCC(C)C(C)C(N)=S Amb24504575 [0,2,0,0,0,0|1,1,0]=4 4742 B8R0.2 CCC(C)C(C)C(O)=O Amb18290719 [0,2,0,0,0,0|0,0,0]=2 4743 B8R0.2 CCC(C)N(C)C(=O)Cl Amb25680235 [0,2,0,0,0,0|2,0,0]=4 4744 B8R0.2 CCC(C)[C@H](C)[C@H](C)O Amb24748768 [0,2,0,0,0,0|1,0,1]=4 4745 B8R0.2 CCC(F)C(N)C(O)=O Amb24764202 [0,2,0,0,0,0|0,0,0]=2 4746 B8R0.2 CCC(F)C(N)C(O)O Amb25204781 [0,2,0,0,0,0|0,0,2]=4 4747 B8R0.2 CCC(N)C(=C)C(O)=O Amb24558624 [0,2,0,0,0,0|0,0,1]=3 4748 B8R0.2 CCC(O)C(=C)C(N)=O Amb25265250 [0,2,0,0,0,0|1,0,1]=4 4749 B8R0.2 CCC(O)C(N)C(O)=O Amb18203168 [0,2,0,0,0,0|0,0,0]=2 4750 B8R0.2 CCC(O)C(O)C(C)=O Amb24736298 [0,2,0,0,0,0|1,0,0]=3 4751 B8R0.2 CCC(O)C(O)C(O)=O Amb24441607 [0,2,0,0,0,0|0,0,0]=2 4752 B8R0.2 CCC(O)[C@@H](N)C(O)=O Amb22750712 [0,2,0,0,0,0|0,0,0]=2 4753 B8R0.2 CCC(O)[C@H](N)C(O)=O Amb24364655 [0,2,0,0,0,0|0,0,0]=2 4754 B8R0.2 CCC(S)C(N)C(O)=O Amb24365228 [0,2,0,0,0,0|0,0,0]=2 4755 B8R0.2 CCC(S)[C@@H](N)C(O)=O Amb24604283 [0,2,0,0,0,0|0,0,0]=2 4756 B8R0.2 CCC([13CH3])[13C](=O)[13C]([O-])=O Amb22055838 [0,2,0,0,0,0|0,0,2]=4 4757 B8R0.2 CCC([C@@H](C(=O)N)N)C Amb17231868 [0,2,0,0,0,0|1,0,0]=3 4758 B8R0.2 CCC([C@@H](C(=O)O)C)C Amb10844495 [0,2,0,0,0,0|0,0,0]=2 4759 B8R0.2 CCC([C@@H](C(=O)O)N)C Amb10844501 [0,2,0,0,0,0|0,0,0]=2 4760 B8R0.2 CCC([C@H](C(=O)O)N)C Amb10844500 [0,2,0,0,0,0|0,0,0]=2 4761 B8R0.2 CCN(C)C(C)C(N)=O Amb24467965 [0,2,0,0,0,0|2,0,0]=4 4762 B8R0.2 CCN(C)[C@H](C)C(O)=O Amb25073540 [0,2,0,0,0,0|1,0,0]=3 4763 B8R0.2 CCS(=O)C(C)C(C)=O Amb25772477 [0,2,0,0,0,0|2,0,0]=4 4764 B8R0.2 CCS(=O)C(C)C(O)=O Amb18984976 [0,2,0,0,0,0|1,0,0]=3 4765 B8R0.2 CC[C@@H](C)C(=O)C(O)=O Amb25129590 [0,2,0,0,0,0|0,0,1]=3 4766 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [0,2,0,0,0,0|1,0,0]=3 4767 B8R0.2 CC[C@@H](N)[C@H](O)C(O)=O Amb22831530 [0,2,0,0,0,0|0,0,0]=2 4768 B8R0.2 CC[C@@H](O)[C@@H](N)C(O)=O Amb24087716 [0,2,0,0,0,0|0,0,0]=2 4769 B8R0.2 CC[C@@H](O)[C@H](N)C(N)=O Amb24670277 [0,2,0,0,0,0|1,0,0]=3 4770 B8R0.2 CC[C@@H](O)[C@H](N)C(O)=O Amb24105353 [0,2,0,0,0,0|0,0,0]=2 4771 B8R0.2 CC[C@@H](O)[C@H](O)C(O)=O Amb24431211 [0,2,0,0,0,0|0,0,0]=2 4772 B8R0.2 CC[C@@H]([C@@H](C(=O)N)N)C Amb10878815 [0,2,0,0,0,0|1,0,0]=3 4773 B8R0.2 CC[C@@H]([C@@H](C(=O)O)Br)Br Amb16233350 [0,2,0,0,0,0|0,0,0]=2 4774 B8R0.2 CC[C@@H]([C@@H](C(=O)O)C)C Amb10844498 [0,2,0,0,0,0|0,0,0]=2 4775 B8R0.2 CC[C@@H]([C@H](C(=O)O)O)C Amb10576171 [0,2,0,0,0,0|0,0,0]=2 4776 B8R0.2 CC[C@H](C)C(=C)C(O)=O Amb24699439 [0,2,0,0,0,0|0,0,1]=3 4777 B8R0.2 CC[C@H](C)[C@@H](C)C(O)=O Amb25056174 [0,2,0,0,0,0|0,0,0]=2 4778 B8R0.2 CC[C@H](C)[C@H](C)C(N)=O Amb25076764 [0,2,0,0,0,0|1,0,0]=3 4779 B8R0.2 CC[C@H](N)C(=C)C(O)=O Amb24468573 [0,2,0,0,0,0|0,0,1]=3 4780 B8R0.2 CC[C@H](N)[C@@H](O)C(O)=O Amb24449588 [0,2,0,0,0,0|0,0,0]=2 4781 B8R0.2 CC[C@H](N)[C@H](O)C(O)=O Amb24477817 [0,2,0,0,0,0|0,0,0]=2 4782 B8R0.2 CC[C@H](O)[C@H](N)C(N)=O Amb25113391 [0,2,0,0,0,0|1,0,0]=3 4783 B8R0.2 CC[C@H]([C@@H](C(=O)O)N)C Amb10068321 [0,2,0,0,0,0|0,0,0]=2 4784 B8R0.2 CNC(C)C(C)C(O)=O Amb25342967 [0,2,0,0,0,0|1,0,0]=3 4785 B8R0.2 CN[C@@H](C)[C@H](C)C(O)=O Amb25676912 [0,2,0,0,0,0|1,0,0]=3 4786 B8R0.2 COC(=O)C(C)C(O)=O Amb18642868 [0,2,0,0,0,0|1,0,1]=4 4787 B8R0.2 COC(=O)C(N)C(O)=O Amb22491276 [0,2,0,0,0,0|1,0,1]=4 4788 B8R0.2 COC(=O)C(O)C(O)=O Amb25255680 [0,2,0,0,0,0|1,0,1]=4 4789 B8R0.2 COC(=O)[C@H](N)C(O)=O Amb24695000 [0,2,0,0,0,0|1,0,1]=4 4790 B8R0.2 COC(C(C(=O)O)Br)C Amb16233352 [0,2,0,0,0,0|1,0,0]=3 4791 B8R0.2 COC(C(C(=O)O)C)C Amb10844268 [0,2,0,0,0,0|1,0,0]=3 4792 B8R0.2 COC(C)C(=C)C(O)=O Amb25706403 [0,2,0,0,0,0|1,0,1]=4 4793 B8R0.2 COC(C)C(N)C(O)=O Amb17938689 [0,2,0,0,0,0|1,0,0]=3 4794 B8R0.2 COC(C)[C@H](C)C(O)=O Amb25722336 [0,2,0,0,0,0|1,0,0]=3 4795 B8R0.2 CO[C@@H](C)C(=O)C(O)=O Amb24597638 [0,2,0,0,0,0|1,0,1]=4 4796 B8R0.2 CO[C@@H](C)[C@@H](C)C(O)=O Amb25263126 [0,2,0,0,0,0|1,0,0]=3 4797 B8R0.2 CO[C@@H](Cl)[C@H](Cl)C(C)=O Amb25162294 [0,2,0,0,0,0|2,0,0]=4 4798 B8R0.2 CO[C@@H]([C@@H](C(=O)O)N)C Amb16183892 [0,2,0,0,0,0|1,0,0]=3 4799 B8R0.2 CO[C@@H]([C@H](C(=O)O)N)C Amb10603094 [0,2,0,0,0,0|1,0,0]=3 4800 B8R0.2 CO[C@H](C)[C@H](C)C(O)=O Amb24358364 [0,2,0,0,0,0|1,0,0]=3 4801 B8R0.2 CO[C@H]([C@@H](C(=O)O)C)C Amb10844258 [0,2,0,0,0,0|1,0,0]=3 4802 B8R0.2 CSC(C)C(C)C(O)=O Amb18644375 [0,2,0,0,0,0|1,0,0]=3 4803 B8R0.2 CS[C@@H](C)[C@H](C)C(O)=O Amb24552609 [0,2,0,0,0,0|1,0,0]=3 4804 B8R0.2 C[C@@H](C#C)[C@H](N)C(O)=O Amb25783160 [0,2,0,0,0,0|0,0,2]=4 4805 B8R0.2 C[C@@H](C=C)[C@H](N)C(O)=O Amb24340139 [0,2,0,0,0,0|0,0,2]=4 4806 B8R0.2 C[C@@H](C=O)[C@H](N)C(O)=O Amb25142449 [0,2,0,0,0,0|1,0,1]=4 4807 B8R0.2 C[C@@H](CC)C(=O)C([O-])=O Amb22757032 [0,2,0,0,0,0|0,0,2]=4 4808 B8R0.2 C[C@@H](CC)C(Br)C(O)=O Amb24635596 [0,2,0,0,0,0|0,0,0]=2 4809 B8R0.2 C[C@@H](CC)C(F)C(O)=O Amb25042866 [0,2,0,0,0,0|0,0,0]=2 4810 B8R0.2 C[C@@H](CC)C(O)C(O)=O Amb25088995 [0,2,0,0,0,0|0,0,0]=2 4811 B8R0.2 C[C@@H](CC)[C@@H](Br)C(O)=O Amb23401386 [0,2,0,0,0,0|0,0,0]=2 4812 B8R0.2 C[C@@H](CC)[C@@H](S)C(O)=O Amb24388715 [0,2,0,0,0,0|0,0,0]=2 4813 B8R0.2 C[C@@H](CC)[C@H](Cl)C(O)=O Amb22388560 [0,2,0,0,0,0|0,0,0]=2 4814 B8R0.2 C[C@@H](CC)[C@H](N)C(O)=O Amb22351114 [0,2,0,0,0,0|0,0,0]=2 4815 B8R0.2 C[C@@H](CC)[C@H]([15NH2])C(O)=O Amb22337867 [0,2,0,0,0,0|0,0,0]=2 4816 B8R0.2 C[C@@H](CO)[C@@H](N)C(O)=O Amb24117487 [0,2,0,0,0,0|1,0,0]=3 4817 B8R0.2 C[C@@H](CO)[C@H](N)C(O)=O Amb24117488 [0,2,0,0,0,0|1,0,0]=3 4818 B8R0.2 C[C@@H](NC)[C@H](N)C(O)=O Amb24477707 [0,2,0,0,0,0|1,0,0]=3 4819 B8R0.2 C[C@@H](NC)[C@H](O)C(O)=O Amb25146143 [0,2,0,0,0,0|1,0,0]=3 4820 B8R0.2 C[C@@H](O)[C@@H](O)[C@H](C)CC Amb24389196 [0,2,0,0,0,0|1,0,1]=4 4821 B8R0.2 C[C@@H](O)[C@H](C)[C@@H](O)CC Amb25369460 [0,2,0,0,0,0|1,0,1]=4 4822 B8R0.2 C[C@@H](OC)[C@@H](N)C(O)=O Amb23438804 [0,2,0,0,0,0|1,0,0]=3 4823 B8R0.2 C[C@@H](OC)[C@H](Br)C(=O)Cl Amb25325034 [0,2,0,0,0,0|2,0,0]=4 4824 B8R0.2 C[C@@H](OC)[C@H](Cl)C(O)=O Amb25701678 [0,2,0,0,0,0|1,0,0]=3 4825 B8R0.2 C[C@@H](OC)[C@H](N)C(O)=O Amb23438882 [0,2,0,0,0,0|1,0,0]=3 4826 B8R0.2 C[C@@H](OC)[C@H](O)C(O)=O Amb25316180 [0,2,0,0,0,0|1,0,0]=3 4827 B8R0.2 C[C@@H](SC)[C@@H](N)C(O)=O Amb24666742 [0,2,0,0,0,0|1,0,0]=3 4828 B8R0.2 C[C@@H]([C@@H](C)C=C)C(O)=O Amb24721924 [0,2,0,0,0,0|0,0,2]=4 4829 B8R0.2 C[C@@H]([C@@H](C)C=O)C(O)=O Amb24470204 [0,2,0,0,0,0|1,0,1]=4 4830 B8R0.2 C[C@@H]([C@@H](C)CO)C(O)=O Amb24696822 [0,2,0,0,0,0|1,0,0]=3 4831 B8R0.2 C[C@@H]([C@@H](O)CC)C(O)=O Amb24427100 [0,2,0,0,0,0|0,0,0]=2 4832 B8R0.2 C[C@@H]([C@H](N)CC)C(O)=O Amb24496209 [0,2,0,0,0,0|0,0,0]=2 4833 B8R0.2 C[C@@H]([C@H](O)C=C)C(O)=O Amb24622455 [0,2,0,0,0,0|0,0,2]=4 4834 B8R0.2 C[C@@H]([C@H](O)CC)C(C)=C Amb24672493 [0,2,0,0,0,0|2,0,0]=4 4835 B8R0.2 C[C@@H]([C@H](O)CC)C(O)=O Amb24472165 [0,2,0,0,0,0|0,0,0]=2 4836 B8R0.2 C[C@H](C=C)[C@@H](N)C(O)=O Amb24460813 [0,2,0,0,0,0|0,0,2]=4 4837 B8R0.2 C[C@H](C=C)[C@H](Br)C(O)=O Amb25074908 [0,2,0,0,0,0|0,0,2]=4 4838 B8R0.2 C[C@H](C=C)[C@H](Cl)C(O)=O Amb24361246 [0,2,0,0,0,0|0,0,2]=4 4839 B8R0.2 C[C@H](C=C)[C@H](F)C(O)=O Amb25138124 [0,2,0,0,0,0|0,0,2]=4 4840 B8R0.2 C[C@H](CC)C(N)C(O)=O Amb25206861 [0,2,0,0,0,0|0,0,0]=2 4841 B8R0.2 C[C@H](CC)[C@@H](Br)C(O)=O Amb24415133 [0,2,0,0,0,0|0,0,0]=2 4842 B8R0.2 C[C@H](CC)[C@H](Cl)C(O)=O Amb25147095 [0,2,0,0,0,0|0,0,0]=2 4843 B8R0.2 C[C@H](CC)[C@H](O)C(O)=O Amb25703176 [0,2,0,0,0,0|0,0,0]=2 4844 B8R0.2 C[C@H](NC)[C@@H](O)C(N)=O Amb25095009 [0,2,0,0,0,0|2,0,0]=4 4845 B8R0.2 C[C@H](NC)[C@H](O)C(O)=O Amb25755974 [0,2,0,0,0,0|1,0,0]=3 4846 B8R0.2 C[C@H](O)[C@@H](C)[C@@H](O)CC Amb25206574 [0,2,0,0,0,0|1,0,1]=4 4847 B8R0.2 C[C@H](O)[C@@H](O)[C@@H](C)CC Amb25741416 [0,2,0,0,0,0|1,0,1]=4 4848 B8R0.2 C[C@H](O)[C@@H](O)[C@H](C)CC Amb25145311 [0,2,0,0,0,0|1,0,1]=4 4849 B8R0.2 C[C@H](O)[C@H](C)[C@@H](O)CC Amb25369459 [0,2,0,0,0,0|1,0,1]=4 4850 B8R0.2 C[C@H](O)[C@H](O)[C@@H](C)CC Amb24735014 [0,2,0,0,0,0|1,0,1]=4 4851 B8R0.2 C[C@H](OC)[C@@H](Br)C(O)=O Amb24480242 [0,2,0,0,0,0|1,0,0]=3 4852 B8R0.2 C[C@H](OC)[C@@H](O)C(O)=O Amb25140960 [0,2,0,0,0,0|1,0,0]=3 4853 B8R0.2 C[C@H]([C@@H](O)CC)C(C)=O Amb25096669 [0,2,0,0,0,0|1,0,0]=3 4854 B8R0.2 C[C@H]([C@H](C)C=C)C(O)=O Amb24528497 [0,2,0,0,0,0|0,0,2]=4 4855 B8R0.2 C[C@H]([C@H](N)CC)C(O)=O Amb25737884 [0,2,0,0,0,0|0,0,0]=2 4856 B8R0.2 C\C(=C/C)\C(N)C(O)=O Amb18642706 [0,2,0,0,0,0|0,0,2]=4 4857 B8R0.2 C\C(=C/C)\[C@@H](N)C(O)=O Amb24695637 [0,2,0,0,0,0|0,0,2]=4 4858 B8R0.2 C\C(=C\C)\C(O)C(O)=O Amb24495368 [0,2,0,0,0,0|0,0,2]=4 4859 B8R0.2 ClCC(C(C(=O)O)O)O Amb17593871 [0,2,0,0,0,0|1,0,0]=3 4860 B8R0.2 FC[C@H]([C@@H](C(=O)O)N)O Amb13883676 [0,2,0,0,0,0|1,0,0]=3 4861 B8R0.2 NC(=O)[C@@H](O)[C@@H](O)CO Amb24533413 [0,2,0,0,0,0|2,0,0]=4 4862 B8R0.2 NC(=O)[C@H](O)[C@H](O)CO Amb25146059 [0,2,0,0,0,0|2,0,0]=4 4863 B8R0.2 NC(C(O)CO)C(O)=O Amb18642974 [0,2,0,0,0,0|1,0,0]=3 4864 B8R0.2 NC(CF)C(F)C(O)=O Amb24340267 [0,2,0,0,0,0|1,0,0]=3 4865 B8R0.2 NC(CO)C(O)C(O)=O Amb25270055 [0,2,0,0,0,0|1,0,0]=3 4866 B8R0.2 NCC(O)C(F)P(O)=O Amb25725015 [0,2,0,0,0,0|2,0,0]=4 4867 B8R0.2 NC[C@@H](F)[C@@H](F)C(O)=O Amb25366211 [0,2,0,0,0,0|1,0,0]=3 4868 B8R0.2 NC[C@@H](F)[C@H](F)C(O)=O Amb24452574 [0,2,0,0,0,0|1,0,0]=3 4869 B8R0.2 NC[C@H](O)[C@@H](O)C(O)=O Amb25323660 [0,2,0,0,0,0|1,0,0]=3 4870 B8R0.2 NC[C@H](O)[C@H](O)C(O)=O Amb25242625 [0,2,0,0,0,0|1,0,0]=3 4871 B8R0.2 N[C@@H](C(O)CBr)C(O)=O Amb24391545 [0,2,0,0,0,0|1,0,0]=3 4872 B8R0.2 N[C@@H](C(O)CCl)C(N)=O Amb24543859 [0,2,0,0,0,0|2,0,0]=4 4873 B8R0.2 N[C@@H](C(O)CF)C(O)=O Amb24426022 [0,2,0,0,0,0|1,0,0]=3 4874 B8R0.2 N[C@@H](CO)[C@H](O)C(O)=O Amb25738857 [0,2,0,0,0,0|1,0,0]=3 4875 B8R0.2 N[C@@H]([C@@H](O)CBr)C(O)=O Amb24480277 [0,2,0,0,0,0|1,0,0]=3 4876 B8R0.2 N[C@@H]([C@@H](O)CO)C(N)=O Amb24717733 [0,2,0,0,0,0|2,0,0]=4 4877 B8R0.2 N[C@@H]([C@@H](O)CO)C(O)=O Amb25678241 [0,2,0,0,0,0|1,0,0]=3 4878 B8R0.2 N[C@@H]([C@H](N)CO)C(O)=O Amb24761920 [0,2,0,0,0,0|1,0,0]=3 4879 B8R0.2 N[C@@H]([C@H](O)CCl)C(O)=O Amb25324441 [0,2,0,0,0,0|1,0,0]=3 4880 B8R0.2 N[C@@H]([C@H](O)CO)C(O)=O Amb24674136 [0,2,0,0,0,0|1,0,0]=3 4881 B8R0.2 N[C@H](CO)[C@H](O)C(N)=O Amb24677605 [0,2,0,0,0,0|2,0,0]=4 4882 B8R0.2 N[C@H](CO)[C@H](O)C(O)=O Amb25090400 [0,2,0,0,0,0|1,0,0]=3 4883 B8R0.2 N[C@H]([C@@H](O)CO)C(=O)Cl Amb25707913 [0,2,0,0,0,0|2,0,0]=4 4884 B8R0.2 N[C@H]([C@@H](O)CO)C(O)=O Amb25836554 [0,2,0,0,0,0|1,0,0]=3 4885 B8R0.2 N[C@H]([C@H](O)CO)C(O)=O Amb24671346 [0,2,0,0,0,0|1,0,0]=3 4886 B8R0.2 OC(=O)C(Br)C(Br)CBr Amb22347644 [0,2,0,0,0,0|1,0,0]=3 4887 B8R0.2 OC(C(O)C=O)C(O)=O Amb18124399 [0,2,0,0,0,0|1,0,1]=4 4888 B8R0.2 OC(C(O)CBr)C(O)=O Amb24358122 [0,2,0,0,0,0|1,0,0]=3 4889 B8R0.2 OC(CF)C(Br)C(O)=O Amb25733261 [0,2,0,0,0,0|1,0,0]=3 4890 B8R0.2 OCC(O)C(O)C(O)=O Amb22495524 [0,2,0,0,0,0|1,0,0]=3 4891 B8R0.2 OC[C@@H](O)[C@H](O)C(O)=O Amb22801448 [0,2,0,0,0,0|1,0,0]=3 4892 B8R0.2 OC[C@H](O)[C@@H](O)C([O-])=O Amb17943095 [0,2,0,0,0,0|1,0,1]=4 4893 B8R0.2 OC[C@H](O)[C@H](O)C(O)=O Amb25223742 [0,2,0,0,0,0|1,0,0]=3 4894 B8R0.2 O[C@@H]([C@H](O)CBr)C(O)=O Amb24426113 [0,2,0,0,0,0|1,0,0]=3 4895 B8R0.2 O[C@@H]([C@H](O)CCl)C(O)=O Amb25836734 [0,2,0,0,0,0|1,0,0]=3 4896 B8R0.2 SCC(C(C(=O)O)C)C Amb17593702 [0,2,0,0,0,0|1,0,0]=3 4897 B8R0.2 [14CH3][14CH]([14CH2][14CH3])[14CH](N)[14C](O)=O Amb22362774 [0,2,0,0,0,0|0,0,0]=2 4898 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22552521 [0,2,0,0,0,0|1,0,1]=4 4899 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22733096 [0,2,0,0,0,0|1,0,1]=4 4900 B8R0.2 [O-]C(=O)C(O)C(O)CO Amb22734344 [0,2,0,0,0,0|1,0,1]=4 4901 B8R0.2 [O-]C(=O)[C@@H](O)[C@H](O)CO Amb22744783 [0,2,0,0,0,0|1,0,1]=4 4902 B8R0.5 C#CCS(=O)CC(O)=O Amb24417332 [0,2,0,0,0,0|0,0,2]=4 4903 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb22746284 [0,2,0,0,0,0|0,0,1]=3 4904 B8R0.5 C#CC[C@@H](N)CC(O)=O Amb24539924 [0,2,0,0,0,0|0,0,1]=3 4905 B8R0.5 C#CC[C@H](N)CC(O)=O Amb22226648 [0,2,0,0,0,0|0,0,1]=3 4906 B8R0.5 C#CC[C@H](N)CC(O)=O Amb24642007 [0,2,0,0,0,0|0,0,1]=3 4907 B8R0.5 C=C(Br)CC(O)CCO Amb25343863 [0,2,0,0,0,0|2,0,0]=4 4908 B8R0.5 C=C(CC=C)CC(O)=O Amb25261334 [0,2,0,0,0,0|0,0,2]=4 4909 B8R0.5 C=C=CC(N)CC(O)=O Amb24476615 [0,2,0,0,0,0|0,0,2]=4 4910 B8R0.5 C=CCC(CC(=O)C)C Amb17593320 [0,2,0,0,0,0|1,0,1]=4 4911 B8R0.5 C=CCC(N)CC(O)=O Amb22641964 [0,2,0,0,0,0|0,0,1]=3 4912 B8R0.5 C=CCC(O)CC(O)=O Amb18642785 [0,2,0,0,0,0|0,0,1]=3 4913 B8R0.5 C=CCS(=O)CC(=O)O Amb10608086 [0,2,0,0,0,0|0,0,2]=4 4914 B8R0.5 C=CC[C@@H](CC(=O)O)C Amb10844371 [0,2,0,0,0,0|0,0,1]=3 4915 B8R0.5 C=CC[C@@H](N)CC(O)=O Amb22746166 [0,2,0,0,0,0|0,0,1]=3 4916 B8R0.5 C=CC[C@@H](O)CC(N)=O Amb24680790 [0,2,0,0,0,0|1,0,1]=4 4917 B8R0.5 C=CC[C@H](CC(=O)O)C Amb10844336 [0,2,0,0,0,0|0,0,1]=3 4918 B8R0.5 CC#CC(O)CC(C)=O Amb24736733 [0,2,0,0,0,0|1,0,1]=4 4919 B8R0.5 CC(=C)CC(=O)CCC Amb24377405 [0,2,0,0,0,0|2,0,0]=4 4920 B8R0.5 CC(=C)C[C@@H](O)CCO Amb24412924 [0,2,0,0,0,0|2,0,0]=4 4921 B8R0.5 CC(=C)C[C@H](O)CCO Amb24414030 [0,2,0,0,0,0|2,0,0]=4 4922 B8R0.5 CC(=CC(O)=O)OCC Amb25770190 [0,2,0,0,0,0|0,0,2]=4 4923 B8R0.5 CC(=CC(O)=O)SCC Amb25229812 [0,2,0,0,0,0|0,0,2]=4 4924 B8R0.5 CC(=O)C=C(N)CCC Amb25145980 [0,2,0,0,0,0|1,0,1]=4 4925 B8R0.5 CC(=O)CC(=N)OCC Amb24103656 [0,2,0,0,0,0|1,0,1]=4 4926 B8R0.5 CC(=O)CC(=O)CCC Amb22347230 [0,2,0,0,0,0|1,0,0]=3 4927 B8R0.5 CC(=O)CC(=O)CCO Amb25685471 [0,2,0,0,0,0|1,0,1]=4 4928 B8R0.5 CC(=O)CC(=O)OCC Amb22360190 [0,2,0,0,0,0|1,0,1]=4 4929 B8R0.5 CC(=O)CC(=S)OCC Amb25282821 [0,2,0,0,0,0|1,0,1]=4 4930 B8R0.5 CC(=O)C[C@H](O)CCBr Amb24634001 [0,2,0,0,0,0|1,0,0]=3 4931 B8R0.5 CC(=O)C[C@H](O)CCO Amb24551545 [0,2,0,0,0,0|1,0,0]=3 4932 B8R0.5 CC(=O)C\C(\Cl)=C/CC Amb24334261 [0,2,0,0,0,0|1,0,1]=4 4933 B8R0.5 CC(=O)C\C(\Cl)=C\CC Amb25370634 [0,2,0,0,0,0|1,0,1]=4 4934 B8R0.5 CC(=O)NC(=O)CCC Amb25324995 [0,2,0,0,0,0|1,0,1]=4 4935 B8R0.5 CC(=O)OC(Br)CCCl Amb25771672 [0,2,0,0,0,0|2,0,0]=4 4936 B8R0.5 CC(=O)OC(Cl)CCCl Amb25109244 [0,2,0,0,0,0|2,0,0]=4 4937 B8R0.5 CC(=O)\C=C(\Cl)/CCC Amb24339441 [0,2,0,0,0,0|1,0,1]=4 4938 B8R0.5 CC(CC#C)CC(C)=O Amb24707587 [0,2,0,0,0,0|1,0,1]=4 4939 B8R0.5 CC(CC#N)CC(C)=O Amb24339577 [0,2,0,0,0,0|1,0,1]=4 4940 B8R0.5 CC(CC#N)CC(O)=O Amb18642506 [0,2,0,0,0,0|0,0,1]=3 4941 B8R0.5 CC(CC(O)=O)NC=O Amb18967805 [0,2,0,0,0,0|1,0,1]=4 4942 B8R0.5 CC(CC=C)CC(O)=O Amb18642628 [0,2,0,0,0,0|0,0,1]=3 4943 B8R0.5 CC(CCBr)CC(C)=O Amb24740003 [0,2,0,0,0,0|1,0,0]=3 4944 B8R0.5 CC(CCBr)NC(C)=O Amb25213338 [0,2,0,0,0,0|2,0,0]=4 4945 B8R0.5 CC(CCBr)OC(C)=O Amb25111237 [0,2,0,0,0,0|2,0,0]=4 4946 B8R0.5 CC(CCCl)CC(C)=O Amb25231057 [0,2,0,0,0,0|1,0,0]=3 4947 B8R0.5 CC(CCF)CC(O)=O Amb24477914 [0,2,0,0,0,0|0,0,0]=2 4948 B8R0.5 CC(CCN)CB(O)O Amb25337156 [0,2,0,0,0,0|1,0,1]=4 4949 B8R0.5 CC(CCN)CC(C)O Amb25064091 [0,2,0,0,0,0|1,0,1]=4 4950 B8R0.5 CC(CCN)CC(O)=O Amb20667689 [0,2,0,0,0,0|0,0,0]=2 4951 B8R0.5 CC(CCN)CC(O)=O Amb24376646 [0,2,0,0,0,0|0,0,0]=2 4952 B8R0.5 CC(CCN)NC(C)=O Amb18986174 [0,2,0,0,0,0|2,0,0]=4 4953 B8R0.5 CC(CCN)NC(N)=O Amb18985721 [0,2,0,0,0,0|2,0,0]=4 4954 B8R0.5 CC(CCO)=CC(O)=O Amb25213064 [0,2,0,0,0,0|0,0,2]=4 4955 B8R0.5 CC(CCO)CC(C)=C Amb24525539 [0,2,0,0,0,0|2,0,0]=4 4956 B8R0.5 CC(CCO)CC(C)=O Amb24563263 [0,2,0,0,0,0|1,0,0]=3 4957 B8R0.5 CC(CCO)CC(O)=O Amb18642882 [0,2,0,0,0,0|0,0,0]=2 4958 B8R0.5 CC(CCO)NC(N)=O Amb25043087 [0,2,0,0,0,0|2,0,0]=4 4959 B8R0.5 CC(CCO)OC(N)=O Amb25090414 [0,2,0,0,0,0|2,0,0]=4 4960 B8R0.5 CC(CCS)=CC(O)=O Amb25328912 [0,2,0,0,0,0|0,0,2]=4 4961 B8R0.5 CC(CNC)=CC(O)=O Amb25126794 [0,2,0,0,0,0|0,0,2]=4 4962 B8R0.5 CC(COC)=CC(O)=O Amb25311787 [0,2,0,0,0,0|0,0,2]=4 4963 B8R0.5 CC(CSC)=CC(O)=O Amb25364860 [0,2,0,0,0,0|0,0,2]=4 4964 B8R0.5 CC(NCC)CC(=O)N Amb17231866 [0,2,0,0,0,0|1,0,0]=3 4965 B8R0.5 CC(NCC)CC(=O)O Amb13952759 [0,2,0,0,0,0|0,0,0]=2 4966 B8R0.5 CC(O)CC(N)CCC Amb24477692 [0,2,0,0,0,0|1,0,1]=4 4967 B8R0.5 CC(O)CC(O)CCO Amb24733599 [0,2,0,0,0,0|1,0,1]=4 4968 B8R0.5 CC(O)CC(O)COC Amb24543387 [0,2,0,0,0,0|1,0,1]=4 4969 B8R0.5 CC(O)CC(O)OCC Amb25734373 [0,2,0,0,0,0|1,0,1]=4 4970 B8R0.5 CC(O)CC(S)CCC Amb24379900 [0,2,0,0,0,0|1,0,1]=4 4971 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [0,2,0,0,0,0|0,0,0]=2 4972 B8R0.5 CCCC(=O)CC(C)O Amb24676902 [0,2,0,0,0,0|1,0,1]=4 4973 B8R0.5 CCCC(=O)C[C@@H](C)O Amb24645371 [0,2,0,0,0,0|1,0,1]=4 4974 B8R0.5 CCCC(=O)C[C@H](C)O Amb25767694 [0,2,0,0,0,0|1,0,1]=4 4975 B8R0.5 CCCC(Br)CC(O)=O Amb18127175 [0,2,0,0,0,0|0,0,0]=2 4976 B8R0.5 CCCC(C)CC(C)=C Amb22730409 [0,2,0,0,0,0|2,0,0]=4 4977 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [0,2,0,0,0,0|1,0,0]=3 4978 B8R0.5 CCCC(C)CC(C)O Amb22229840 [0,2,0,0,0,0|1,0,1]=4 4979 B8R0.5 CCCC(C)CC(N)=N Amb25771598 [0,2,0,0,0,0|2,0,0]=4 4980 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [0,2,0,0,0,0|1,0,0]=3 4981 B8R0.5 CCCC(C)NC(C)=N Amb25289823 [0,2,0,0,0,0|2,0,0]=4 4982 B8R0.5 CCCC(C)NC(N)=N Amb25189065 [0,2,0,0,0,0|2,0,0]=4 4983 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,2,0,0,0,0|1,0,0]=3 4984 B8R0.5 CCCC(C)SC(N)=N Amb25750723 [0,2,0,0,0,0|2,0,0]=4 4985 B8R0.5 CCCC(CC(=O)C)O Amb17593376 [0,2,0,0,0,0|1,0,0]=3 4986 B8R0.5 CCCC(CC(=O)O)N Amb1993864 [0,2,0,0,0,0|0,0,0]=2 4987 B8R0.5 CCCC(Cl)OC(=O)Cl Amb24480168 [0,2,0,0,0,0|1,0,0]=3 4988 B8R0.5 CCCC(N)CC(C)=C Amb25145992 [0,2,0,0,0,0|2,0,0]=4 4989 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,2,0,0,0,0|1,0,0]=3 4990 B8R0.5 CCCC(N)CC(O)=O Amb21961469 [0,2,0,0,0,0|0,0,0]=2 4991 B8R0.5 CCCC(N)NC(C)=O Amb24670118 [0,2,0,0,0,0|1,0,0]=3 4992 B8R0.5 CCCC(O)C=C(F)F Amb24414043 [0,2,0,0,0,0|2,0,0]=4 4993 B8R0.5 CCCC(O)CC(N)=O Amb25072270 [0,2,0,0,0,0|1,0,0]=3 4994 B8R0.5 CCCC(O)C[N+]([O-])=O Amb25265997 [0,2,0,0,0,0|1,0,1]=4 4995 B8R0.5 CCCC(O)OC(C)=O Amb25245948 [0,2,0,0,0,0|1,0,0]=3 4996 B8R0.5 CCCC(O)OC(N)=O Amb24476660 [0,2,0,0,0,0|1,0,0]=3 4997 B8R0.5 CCCC(O)OS(=O)=O Amb25098605 [0,2,0,0,0,0|1,0,1]=4 4998 B8R0.5 CCCN(C)CC(=C)Cl Amb24763817 [0,2,0,0,0,0|2,0,0]=4 4999 B8R0.5 CCCN(C)CC(N)=O Amb24700757 [0,2,0,0,0,0|1,0,0]=3 5000 B8R0.5 CCCN(C)CC(O)=O Amb19373314 [0,2,0,0,0,0|0,0,0]=2 5001 B8R0.5 CCCN(C)C[C@@H](C)O Amb24394137 [0,2,0,0,0,0|1,0,1]=4 5002 B8R0.5 CCCN(C)C[C@H](C)O Amb24502341 [0,2,0,0,0,0|1,0,1]=4 5003 B8R0.5 CCCN(CC(O)C)C Amb17334132 [0,2,0,0,0,0|1,0,1]=4 5004 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,2,0,0,0,0|0,0,0]=2 5005 B8R0.5 CCC[C@@H](C)CC(N)=O Amb24761385 [0,2,0,0,0,0|1,0,0]=3 5006 B8R0.5 CCC[C@@H](C)CC(O)=O Amb24622486 [0,2,0,0,0,0|0,0,0]=2 5007 B8R0.5 CCC[C@@H](C)NC(C)=O Amb25844046 [0,2,0,0,0,0|1,0,0]=3 5008 B8R0.5 CCC[C@@H](CC(=O)O)C Amb10844381 [0,2,0,0,0,0|0,0,0]=2 5009 B8R0.5 CCC[C@@H](N)CC(O)=O Amb22225223 [0,2,0,0,0,0|0,0,0]=2 5010 B8R0.5 CCC[C@@H](N)CC(O)=O Amb24739278 [0,2,0,0,0,0|0,0,0]=2 5011 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,2,0,0,0,0|1,0,0]=3 5012 B8R0.5 CCC[C@@H](O)CC(O)=O Amb25188904 [0,2,0,0,0,0|0,0,0]=2 5013 B8R0.5 CCC[C@H](C)CC(N)=O Amb25340178 [0,2,0,0,0,0|1,0,0]=3 5014 B8R0.5 CCC[C@H](N)CC(O)=O Amb22226359 [0,2,0,0,0,0|0,0,0]=2 5015 B8R0.5 CCC[C@H](O)CC(O)=O Amb25367955 [0,2,0,0,0,0|0,0,0]=2 5016 B8R0.5 CCC\C(\C)=C/C(C)=O Amb24676836 [0,2,0,0,0,0|1,0,1]=4 5017 B8R0.5 CCC\C(\C)=C\C(C)=O Amb25735089 [0,2,0,0,0,0|1,0,1]=4 5018 B8R0.5 CCC\C(\F)=C/C(O)=O Amb25359319 [0,2,0,0,0,0|0,0,1]=3 5019 B8R0.5 CCC\C(\N)=C\C(N)=O Amb24411410 [0,2,0,0,0,0|1,0,1]=4 5020 B8R0.5 CCNC(=N)CC(N)=O Amb25769007 [0,2,0,0,0,0|1,0,1]=4 5021 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,2,0,0,0,0|0,0,1]=3 5022 B8R0.5 CCNC(=S)CC([O-])=O Amb25771930 [0,2,0,0,0,0|0,0,2]=4 5023 B8R0.5 CCNC(C)CC(C)=O Amb25131542 [0,2,0,0,0,0|1,0,0]=3 5024 B8R0.5 CCNC(C)CC(C)O Amb25836121 [0,2,0,0,0,0|1,0,1]=4 5025 B8R0.5 CCOC(=O)CC(O)=O Amb22360654 [0,2,0,0,0,0|0,0,1]=3 5026 B8R0.5 CCOC(=O)CC([13CH3])=O Amb22366911 [0,2,0,0,0,0|1,0,1]=4 5027 B8R0.5 CCOC(=O)C[13C](C)=O Amb22336363 [0,2,0,0,0,0|1,0,1]=4 5028 B8R0.5 CCOC(=O)C[13C]([13CH3])=O Amb22351420 [0,2,0,0,0,0|1,0,1]=4 5029 B8R0.5 CCOC(=O)[13CH2]C([13CH3])=O Amb22362626 [0,2,0,0,0,0|1,0,1]=4 5030 B8R0.5 CCOC(Br)OC(C)=O Amb24425527 [0,2,0,0,0,0|2,0,0]=4 5031 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,2,0,0,0,0|1,0,0]=3 5032 B8R0.5 CCOC(C)NC(N)=O Amb24655701 [0,2,0,0,0,0|2,0,0]=4 5033 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,2,0,0,0,0|2,0,0]=4 5034 B8R0.5 CCO[13C](=O)[13CH2]C(C)=O Amb22353575 [0,2,0,0,0,0|1,0,1]=4 5035 B8R0.5 CCO[13C](=O)[13CH2][13C](=O)O Amb17618079 [0,2,0,0,0,0|0,0,1]=3 5036 B8R0.5 CCO[13C](=O)[13CH2][13C]([13CH3])=O Amb22351473 [0,2,0,0,0,0|1,0,1]=4 5037 B8R0.5 CCO[C@@H](O)CC(C)=O Amb25051240 [0,2,0,0,0,0|1,0,0]=3 5038 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [0,2,0,0,0,0|0,0,0]=2 5039 B8R0.5 CCO[C@H](C)C[C@@H](C)O Amb24466310 [0,2,0,0,0,0|1,0,1]=4 5040 B8R0.5 CCSC(C)CC(N)=N Amb24333275 [0,2,0,0,0,0|2,0,0]=4 5041 B8R0.5 CC\C=C(/C)\CC(C)=O Amb24751417 [0,2,0,0,0,0|1,0,1]=4 5042 B8R0.5 CC\C=C(\C)/CC(C)=O Amb25314826 [0,2,0,0,0,0|1,0,1]=4 5043 B8R0.5 CC\N=C(\C)/CC(C)=O Amb25838829 [0,2,0,0,0,0|1,0,1]=4 5044 B8R0.5 CN(CCCl)CC(N)=O Amb24626078 [0,2,0,0,0,0|2,0,0]=4 5045 B8R0.5 CN(CCCl)CC(O)=O Amb25829318 [0,2,0,0,0,0|1,0,0]=3 5046 B8R0.5 CN(CCF)CC(O)=O Amb25760005 [0,2,0,0,0,0|1,0,0]=3 5047 B8R0.5 CN(CCI)CC(N)=O Amb25042038 [0,2,0,0,0,0|2,0,0]=4 5048 B8R0.5 CN(CCN)CC(O)=O Amb18313585 [0,2,0,0,0,0|1,0,0]=3 5049 B8R0.5 CNCC(C)CC(O)=O Amb25284797 [0,2,0,0,0,0|0,0,0]=2 5050 B8R0.5 CNCC(C)NC(C)=O Amb25834936 [0,2,0,0,0,0|2,0,0]=4 5051 B8R0.5 CNNC(=N)CC(O)=O Amb25226519 [0,2,0,0,0,0|1,0,1]=4 5052 B8R0.5 COCC(=O)CC(=O)C Amb15701314 [0,2,0,0,0,0|1,0,1]=4 5053 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [0,2,0,0,0,0|0,0,1]=3 5054 B8R0.5 COCC(C)CC(O)=O Amb19024342 [0,2,0,0,0,0|0,0,0]=2 5055 B8R0.5 COCC(C)OC(N)=O Amb24645730 [0,2,0,0,0,0|2,0,0]=4 5056 B8R0.5 COCC(Cl)CC(=O)Cl Amb25059197 [0,2,0,0,0,0|1,0,0]=3 5057 B8R0.5 COCC(Cl)CC(O)=O Amb24627002 [0,2,0,0,0,0|0,0,0]=2 5058 B8R0.5 COCC(O)CC(C)=C Amb25716730 [0,2,0,0,0,0|2,0,0]=4 5059 B8R0.5 COCC(O)CC(N)=N Amb24665644 [0,2,0,0,0,0|2,0,0]=4 5060 B8R0.5 COCC(O)CC(O)=O Amb18832518 [0,2,0,0,0,0|0,0,0]=2 5061 B8R0.5 COC[C@@H](C)CC(O)=O Amb25064328 [0,2,0,0,0,0|0,0,0]=2 5062 B8R0.5 COC[C@@H](C)NC(C)=O Amb24477698 [0,2,0,0,0,0|2,0,0]=4 5063 B8R0.5 COC[C@@H](C)NC(N)=O Amb24718117 [0,2,0,0,0,0|2,0,0]=4 5064 B8R0.5 COC[C@H](C)NC(C)=O Amb24477723 [0,2,0,0,0,0|2,0,0]=4 5065 B8R0.5 CS(=O)CC(N)CCO Amb25711601 [0,2,0,0,0,0|2,0,0]=4 5066 B8R0.5 CS(=O)CC(O)CCN Amb25272158 [0,2,0,0,0,0|2,0,0]=4 5067 B8R0.5 CSCC(C)NC(C)=O Amb24481592 [0,2,0,0,0,0|2,0,0]=4 5068 B8R0.5 CSCC(C)OC(C)=O Amb24450062 [0,2,0,0,0,0|2,0,0]=4 5069 B8R0.5 CSCC(Cl)CC(O)=O Amb18126320 [0,2,0,0,0,0|0,0,0]=2 5070 B8R0.5 CSCC(N)CC(N)=O Amb25784570 [0,2,0,0,0,0|1,0,0]=3 5071 B8R0.5 CSCC(O)CC(O)=O Amb24621046 [0,2,0,0,0,0|0,0,0]=2 5072 B8R0.5 CSSC(C)CC(O)=O Amb25241180 [0,2,0,0,0,0|1,0,0]=3 5073 B8R0.5 C[13C](=O)C[13C](=O)OCC Amb22336726 [0,2,0,0,0,0|1,0,1]=4 5074 B8R0.5 C[C@@H](CCN)CC(O)=O Amb25318051 [0,2,0,0,0,0|0,0,0]=2 5075 B8R0.5 C[C@@H](CCO)CC(C)=C Amb25187356 [0,2,0,0,0,0|2,0,0]=4 5076 B8R0.5 C[C@@H](CCO)CC(O)=O Amb24699186 [0,2,0,0,0,0|0,0,0]=2 5077 B8R0.5 C[C@@H](CCO)NC(C)=O Amb25140356 [0,2,0,0,0,0|2,0,0]=4 5078 B8R0.5 C[C@@H](CCO)NC(N)=O Amb24676501 [0,2,0,0,0,0|2,0,0]=4 5079 B8R0.5 C[C@@H](O)C[C@@H](O)CCBr Amb24692601 [0,2,0,0,0,0|1,0,1]=4 5080 B8R0.5 C[C@@H](O)C[C@@H](S)CCC Amb25107605 [0,2,0,0,0,0|1,0,1]=4 5081 B8R0.5 C[C@H](CCO)CC(C)=C Amb24362138 [0,2,0,0,0,0|2,0,0]=4 5082 B8R0.5 C[C@H](CCO)NC(N)=O Amb24690086 [0,2,0,0,0,0|2,0,0]=4 5083 B8R0.5 C[C@H](O)C[C@H](O)CCC Amb25272245 [0,2,0,0,0,0|1,0,1]=4 5084 B8R0.5 C[C@H](O)C[C@H](O)COC Amb25688669 [0,2,0,0,0,0|1,0,1]=4 5085 B8R0.5 C\C(=C/C(=O)O)\CCC Amb10610367 [0,2,0,0,0,0|0,0,1]=3 5086 B8R0.5 C\C(=C\C(O)=O)\OCC Amb18642786 [0,2,0,0,0,0|0,0,2]=4 5087 B8R0.5 C\C(\CC(O)=O)=C/CC Amb25087318 [0,2,0,0,0,0|0,0,1]=3 5088 B8R0.5 C\C(\CC(O)=O)=C\CC Amb24562251 [0,2,0,0,0,0|0,0,1]=3 5089 B8R0.5 C\C(\CC(O)=O)=C\CS Amb18124785 [0,2,0,0,0,0|0,0,2]=4 5090 B8R0.5 C\C(\CCC)=C\C(O)=O Amb24055711 [0,2,0,0,0,0|0,0,1]=3 5091 B8R0.5 C\C(\CNC)=C/C(O)=O Amb24384927 [0,2,0,0,0,0|0,0,2]=4 5092 B8R0.5 C\C=C\C(C)CC(C)=O Amb25211017 [0,2,0,0,0,0|1,0,1]=4 5093 B8R0.5 C\C=C\C(C)CC(O)=O Amb24731262 [0,2,0,0,0,0|0,0,1]=3 5094 B8R0.5 C\C=C\C(N)CC(N)=O Amb24599388 [0,2,0,0,0,0|1,0,1]=4 5095 B8R0.5 C\C=C\C(O)CC(C)=O Amb24676886 [0,2,0,0,0,0|1,0,1]=4 5096 B8R0.5 C\C=C\C(O)CC(N)=O Amb24567413 [0,2,0,0,0,0|1,0,1]=4 5097 B8R0.5 C\C=C\[C@@H](C)CC(O)=O Amb25343237 [0,2,0,0,0,0|0,0,1]=3 5098 B8R0.5 C\C=C\[C@@H](O)CC(C)=O Amb25143519 [0,2,0,0,0,0|1,0,1]=4 5099 B8R0.5 C\C=C\[C@H](O)CC(O)=O Amb25312045 [0,2,0,0,0,0|0,0,1]=3 5100 B8R0.5 N#CCC(Br)CC(O)=O Amb25211652 [0,2,0,0,0,0|0,0,1]=3 5101 B8R0.5 N#CCS(=O)CC(O)=O Amb18984975 [0,2,0,0,0,0|1,0,1]=4 5102 B8R0.5 N#CC[C@H](O)CC(O)=O Amb25294743 [0,2,0,0,0,0|0,0,1]=3 5103 B8R0.5 NC(=O)CS(=O)CCCl Amb24751567 [0,2,0,0,0,0|2,0,0]=4 5104 B8R0.5 NC(=O)CS(=O)CCO Amb24502237 [0,2,0,0,0,0|2,0,0]=4 5105 B8R0.5 NC(=O)C[C@@H](O)CC#N Amb22226710 [0,2,0,0,0,0|1,0,1]=4 5106 B8R0.5 NC(=O)C[C@H](O)CC#N Amb22225367 [0,2,0,0,0,0|1,0,1]=4 5107 B8R0.5 NCCC(O)CP(O)=O Amb25708296 [0,2,0,0,0,0|1,0,0]=3 5108 B8R0.5 NCCS(=O)CC(O)=O Amb25124054 [0,2,0,0,0,0|1,0,0]=3 5109 B8R0.5 NCC[C@@H](CC(=O)O)N Amb10067021 [0,2,0,0,0,0|0,0,0]=2 5110 B8R0.5 NCC[C@H](CC(=O)O)N Amb10067019 [0,2,0,0,0,0|0,0,0]=2 5111 B8R0.5 N[C@@H](CCO)CC(O)=O Amb25851007 [0,2,0,0,0,0|0,0,0]=2 5112 B8R0.5 OC(=O)CS(=O)CCF Amb25094766 [0,2,0,0,0,0|1,0,0]=3 5113 B8R0.5 OCCN(CC(=O)C)C Amb10608107 [0,2,0,0,0,0|2,0,0]=4 5114 B8R0.5 OCCN(CC(=O)Cl)C Amb17142874 [0,2,0,0,0,0|2,0,0]=4 5115 B8R0.5 OCCN(CC(=O)N)C Amb17142858 [0,2,0,0,0,0|2,0,0]=4 5116 B8R0.5 [O-]C(=O)CC(=O)OCC Amb2221978 [0,2,0,0,0,0|0,0,2]=4 5117 B8R0.16 C=CC(CC(O)=O)C=C Amb18642422 [0,2,0,0,0,0|0,0,2]=4 5118 B8R0.16 C=CC(CC(O)=O)CO Amb25690344 [0,2,0,0,0,0|1,0,0]=3 5119 B8R0.16 C=C[C@H](CC(O)=O)CO Amb24534457 [0,2,0,0,0,0|1,0,0]=3 5120 B8R0.16 CC(=O)CC(CC)=CC Amb24551554 [0,2,0,0,0,0|1,0,1]=4 5121 B8R0.16 CC(=O)CC(CC)CC Amb25791160 [0,2,0,0,0,0|1,0,0]=3 5122 B8R0.16 CC(=O)CC(SC)SC Amb24689832 [0,2,0,0,0,0|2,0,0]=4 5123 B8R0.16 CC(=O)OC(CC)CC Amb24617396 [0,2,0,0,0,0|2,0,0]=4 5124 B8R0.16 CC(O)CC(CC)C#N Amb18642540 [0,2,0,0,0,0|1,0,1]=4 5125 B8R0.16 CC(O)CC(CC)C=O Amb24669026 [0,2,0,0,0,0|1,0,1]=4 5126 B8R0.16 CCC(C#C)NC(C)=O Amb25102560 [0,2,0,0,0,0|2,0,0]=4 5127 B8R0.16 CCC(C#N)NC(N)=O Amb25337865 [0,2,0,0,0,0|2,0,0]=4 5128 B8R0.16 CCC(C#N)OC(C)=O Amb24593580 [0,2,0,0,0,0|2,0,0]=4 5129 B8R0.16 CCC(C=C)OC(C)=O Amb24325174 [0,2,0,0,0,0|2,0,0]=4 5130 B8R0.16 CCC(C=O)OC(C)=O Amb18642754 [0,2,0,0,0,0|2,0,0]=4 5131 B8R0.16 CCC(CB(O)O)CC Amb24360547 [0,2,0,0,0,0|1,0,1]=4 5132 B8R0.16 CCC(CBr)NC(C)=O Amb25725356 [0,2,0,0,0,0|2,0,0]=4 5133 B8R0.16 CCC(CC(=C)Cl)C=O Amb25689367 [0,2,0,0,0,0|2,0,0]=4 5134 B8R0.16 CCC(CC(=O)Cl)CCl Amb25189070 [0,2,0,0,0,0|1,0,0]=3 5135 B8R0.16 CCC(CC(C)=C)C=O Amb24636947 [0,2,0,0,0,0|2,0,0]=4 5136 B8R0.16 CCC(CC(C)=O)C#N Amb18642298 [0,2,0,0,0,0|1,0,0]=3 5137 B8R0.16 CCC(CC(C)=O)C=O Amb18642641 [0,2,0,0,0,0|1,0,0]=3 5138 B8R0.16 CCC(CC(C)=O)OC Amb25053006 [0,2,0,0,0,0|1,0,0]=3 5139 B8R0.16 CCC(CC(C)=O)SC Amb24467065 [0,2,0,0,0,0|1,0,0]=3 5140 B8R0.16 CCC(CC(N)=N)CC Amb25213951 [0,2,0,0,0,0|2,0,0]=4 5141 B8R0.16 CCC(CC(N)=O)=CC Amb24610057 [0,2,0,0,0,0|1,0,1]=4 5142 B8R0.16 CCC(CC(N)=O)C#N Amb25366882 [0,2,0,0,0,0|1,0,0]=3 5143 B8R0.16 CCC(CC(N)=O)C=C Amb25691393 [0,2,0,0,0,0|1,0,0]=3 5144 B8R0.16 CCC(CC(N)=S)CC Amb24642789 [0,2,0,0,0,0|1,1,0]=4 5145 B8R0.16 CCC(CC(O)=O)C=C Amb18642661 [0,2,0,0,0,0|0,0,0]=2 5146 B8R0.16 CCC(CC(O)=O)C=O Amb25372312 [0,2,0,0,0,0|0,0,0]=2 5147 B8R0.16 CCC(CC(O)=O)CO Amb25188910 [0,2,0,0,0,0|0,0,0]=2 5148 B8R0.16 CCC(CC(O)=O)NC Amb25190337 [0,2,0,0,0,0|0,0,0]=2 5149 B8R0.16 CCC(CC(O)=O)OC Amb19037306 [0,2,0,0,0,0|0,0,0]=2 5150 B8R0.16 CCC(CC(O)=O)SC Amb18316304 [0,2,0,0,0,0|0,0,0]=2 5151 B8R0.16 CCC(CC)OC(N)=O Amb24614586 [0,2,0,0,0,0|2,0,0]=4 5152 B8R0.16 CCC(CN)CC(C)=C Amb24359882 [0,2,0,0,0,0|2,0,0]=4 5153 B8R0.16 CCC(CN)CC(O)=O Amb20669457 [0,2,0,0,0,0|0,0,0]=2 5154 B8R0.16 CCC(CN)CC(O)=O Amb22059482 [0,2,0,0,0,0|0,0,0]=2 5155 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [0,2,0,0,0,0|2,0,0]=4 5156 B8R0.16 CCC(CN)NC(N)=O Amb18908302 [0,2,0,0,0,0|2,0,0]=4 5157 B8R0.16 CCC(CO)CC(C)=C Amb25219191 [0,2,0,0,0,0|2,0,0]=4 5158 B8R0.16 CCC(C[N+]([O-])=O)CC Amb25174023 [0,2,0,0,0,0|1,0,1]=4 5159 B8R0.16 CCC(NC(=O)N)CC Amb1138537 [0,2,0,0,0,0|2,0,0]=4 5160 B8R0.16 CCN(CC(O)=O)C=O Amb18972736 [0,2,0,0,0,0|1,0,0]=3 5161 B8R0.16 CCN(CC(O)=O)CC Amb19258254 [0,2,0,0,0,0|1,0,0]=3 5162 B8R0.16 CCN(CC([O-])=O)CC Amb22732183 [0,2,0,0,0,0|1,0,1]=4 5163 B8R0.16 CCP(CC(N)=O)CC Amb24383719 [0,2,0,0,0,0|2,0,0]=4 5164 B8R0.16 CCP(CC(O)=O)CC Amb24687205 [0,2,0,0,0,0|1,0,0]=3 5165 B8R0.16 CC[C@@H](C=O)NC(C)=O Amb25064294 [0,2,0,0,0,0|2,0,0]=4 5166 B8R0.16 CC[C@@H](CC(N)=O)C=C Amb24476683 [0,2,0,0,0,0|1,0,0]=3 5167 B8R0.16 CC[C@@H](CN)CC(C)=C Amb24393061 [0,2,0,0,0,0|2,0,0]=4 5168 B8R0.16 CC[C@H](C#N)NC(C)=O Amb24476725 [0,2,0,0,0,0|2,0,0]=4 5169 B8R0.16 CC[C@H](C=O)NC(C)=O Amb24476942 [0,2,0,0,0,0|2,0,0]=4 5170 B8R0.16 CC[C@H](CC(C)=C)C=O Amb25833659 [0,2,0,0,0,0|2,0,0]=4 5171 B8R0.16 CC[C@H](CC(C)=O)C=O Amb25687293 [0,2,0,0,0,0|1,0,0]=3 5172 B8R0.16 CC[C@H](CO)NC(C)=O Amb24444629 [0,2,0,0,0,0|2,0,0]=4 5173 B8R0.16 CC\C(\C=C)=C/C(O)=O Amb25368328 [0,2,0,0,0,0|0,0,2]=4 5174 B8R0.16 CC\C(\C=O)=C/C(O)=O Amb18642578 [0,2,0,0,0,0|0,0,2]=4 5175 B8R0.16 CC\C(\C=O)=C\C(O)=O Amb25770561 [0,2,0,0,0,0|0,0,2]=4 5176 B8R0.16 CC\C(\CC(O)=O)=C/C Amb18642626 [0,2,0,0,0,0|0,0,1]=3 5177 B8R0.16 CC\[N+](\CC(O)=O)=N\[O-] Amb25365958 [0,2,0,0,0,0|1,0,0]=3 5178 B8R0.16 COC(CC(=O)N)OC Amb2417314 [0,2,0,0,0,0|2,0,0]=4 5179 B8R0.16 COC(CC(C)=O)C=O Amb25798334 [0,2,0,0,0,0|2,0,0]=4 5180 B8R0.16 COC(CC(O)=O)C=C Amb18642791 [0,2,0,0,0,0|1,0,0]=3 5181 B8R0.16 COC(CC(O)=O)CO Amb25738299 [0,2,0,0,0,0|1,0,0]=3 5182 B8R0.16 COC(CC(O)=O)OC Amb22231899 [0,2,0,0,0,0|1,0,0]=3 5183 B8R0.16 COC(CC)OC(N)=O Amb25055387 [0,2,0,0,0,0|2,0,0]=4 5184 B8R0.16 CO[C@H](CC(O)=O)C#C Amb25773997 [0,2,0,0,0,0|1,0,0]=3 5185 B8R0.16 CSC(CC(=O)Cl)CCl Amb25321994 [0,2,0,0,0,0|2,0,0]=4 5186 B8R0.16 N#CC(CC(O)=O)C#N Amb25228388 [0,2,0,0,0,0|1,0,1]=4 5187 B8R0.16 NCC(CC(O)=O)CO Amb22546422 [0,2,0,0,0,0|1,0,0]=3 5188 B8R0.16 NC[C@@H](CS)CC(O)=O Amb24562843 [0,2,0,0,0,0|1,0,0]=3 5189 B8R0.16 NC[C@H](CS)CC(O)=O Amb24598331 [0,2,0,0,0,0|1,0,0]=3 5190 B8R0.16 OC(=O)CC(C=O)C=O Amb24577569 [0,2,0,0,0,0|1,0,1]=4 5191 B8R0.19 CC(C#N)CC(=O)OC Amb17334095 [0,2,0,0,0,0|1,0,1]=4 5192 B8R0.19 CC(CC(=C)CC)CC Amb24478628 [0,2,0,0,0,0|2,0,0]=4 5193 B8R0.19 CC(CC(=O)NC)NC Amb22587223 [0,2,0,0,0,0|2,0,0]=4 5194 B8R0.19 CC(CC(=O)NN)CN Amb25676980 [0,2,0,0,0,0|2,0,0]=4 5195 B8R0.19 CC(CC(=O)OC)=CC Amb25215730 [0,2,0,0,0,0|0,0,2]=4 5196 B8R0.19 CC(CC(=O)OC)=NC Amb25349555 [0,2,0,0,0,0|1,0,1]=4 5197 B8R0.19 CC(CC(Br)C=O)CC Amb25249112 [0,2,0,0,0,0|1,0,1]=4 5198 B8R0.19 CC(CC(N)CO)CC Amb24721873 [0,2,0,0,0,0|1,0,1]=4 5199 B8R0.19 CC(CC(O)CBr)CC Amb24480278 [0,2,0,0,0,0|1,0,1]=4 5200 B8R0.19 CC(CC(O)CC)CO Amb25706078 [0,2,0,0,0,0|1,0,1]=4 5201 B8R0.19 CC(CC(O)CC)OC Amb25314649 [0,2,0,0,0,0|1,0,1]=4 5202 B8R0.19 CC(CC(O)CCl)CC Amb24540064 [0,2,0,0,0,0|1,0,1]=4 5203 B8R0.19 CC(CC(O)CN)CC Amb25044040 [0,2,0,0,0,0|1,0,1]=4 5204 B8R0.19 CC(CC(O)CO)CC Amb24456930 [0,2,0,0,0,0|0,0,2]=4 5205 B8R0.19 CC(CC(O)OC)CC Amb25788091 [0,2,0,0,0,0|0,0,2]=4 5206 B8R0.19 CC(CC)=CC(=O)OC Amb25334129 [0,2,0,0,0,0|0,0,2]=4 5207 B8R0.19 CC(CC)\C=C(/C)\C=O Amb18642478 [0,2,0,0,0,0|1,0,1]=4 5208 B8R0.19 CC(CF)NC(=O)CO Amb24481944 [0,2,0,0,0,0|2,0,0]=4 5209 B8R0.19 CC(CN)CC(=O)C=C Amb24698166 [0,2,0,0,0,0|2,0,0]=4 5210 B8R0.19 CC(CO)CC(=O)NN Amb25692312 [0,2,0,0,0,0|2,0,0]=4 5211 B8R0.19 CC(CO)CC(N)CC Amb19149274 [0,2,0,0,0,0|1,0,1]=4 5212 B8R0.19 CC(CS(=O)CC)CC Amb24333813 [0,2,0,0,0,0|2,0,0]=4 5213 B8R0.19 CCC(=C)CC(=O)C#N Amb24690781 [0,2,0,0,0,0|1,0,1]=4 5214 B8R0.19 CCC(=C)CC(=O)C=C Amb24638472 [0,2,0,0,0,0|1,0,1]=4 5215 B8R0.19 CCC(=C)CC(=O)CN Amb25329097 [0,2,0,0,0,0|1,0,1]=4 5216 B8R0.19 CCC(=C)CC(Cl)CC Amb25725705 [0,2,0,0,0,0|2,0,0]=4 5217 B8R0.19 CCC(=C)CC(N)CC Amb24392905 [0,2,0,0,0,0|2,0,0]=4 5218 B8R0.19 CCC(=C)CC(O)CC Amb24478745 [0,2,0,0,0,0|2,0,0]=4 5219 B8R0.19 CCC(=N)NC(=O)OC Amb24337400 [0,2,0,0,0,0|1,0,1]=4 5220 B8R0.19 CCC(=O)CC(=O)NO Amb24690699 [0,2,0,0,0,0|0,0,1]=3 5221 B8R0.19 CCC(=O)CC(C)CN Amb24690163 [0,2,0,0,0,0|2,0,0]=4 5222 B8R0.19 CCC(=O)CC(C)CO Amb25050722 [0,2,0,0,0,0|2,0,0]=4 5223 B8R0.19 CCC(=O)CC(Cl)CBr Amb25062486 [0,2,0,0,0,0|2,0,0]=4 5224 B8R0.19 CCC(=O)CC(N)CC Amb24481802 [0,2,0,0,0,0|1,0,0]=3 5225 B8R0.19 CCC(=O)CC(O)OC Amb25065360 [0,2,0,0,0,0|2,0,0]=4 5226 B8R0.19 CCC(=O)C[C@@H](O)CCl Amb24340137 [0,2,0,0,0,0|2,0,0]=4 5227 B8R0.19 CCC(=O)C[C@H](O)CC Amb25298397 [0,2,0,0,0,0|1,0,0]=3 5228 B8R0.19 CCC(=O)C[C@H](O)CCl Amb25359848 [0,2,0,0,0,0|2,0,0]=4 5229 B8R0.19 CCC(Br)OC(=O)C=C Amb24480104 [0,2,0,0,0,0|2,0,0]=4 5230 B8R0.19 CCC(C)CC(=C)C=O Amb25131177 [0,2,0,0,0,0|1,0,0]=3 5231 B8R0.19 CCC(C)CC(=O)C#C Amb25356354 [0,2,0,0,0,0|1,0,0]=3 5232 B8R0.19 CCC(C)CC(=O)C=C Amb25134056 [0,2,0,0,0,0|1,0,0]=3 5233 B8R0.19 CCC(C)CC(=O)CBr Amb25251707 [0,2,0,0,0,0|1,0,0]=3 5234 B8R0.19 CCC(C)CC(=O)CCl Amb22395327 [0,2,0,0,0,0|1,0,0]=3 5235 B8R0.19 CCC(C)CC(=O)NN Amb24758303 [0,2,0,0,0,0|1,0,0]=3 5236 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,2,0,0,0,0|0,0,0]=2 5237 B8R0.19 CCC(C)CC(C)C=O Amb18642673 [0,2,0,0,0,0|1,0,1]=4 5238 B8R0.19 CCC(C)CC(C)CO Amb24574609 [0,2,0,0,0,0|1,0,1]=4 5239 B8R0.19 CCC(C)CC(Cl)=NO Amb25310366 [0,2,0,0,0,0|1,0,0]=3 5240 B8R0.19 CCC(C)CC(N)=NO Amb24415677 [0,2,0,0,0,0|1,0,0]=3 5241 B8R0.19 CCC(C)CN(C)C=O Amb24438589 [0,2,0,0,0,0|2,0,0]=4 5242 B8R0.19 CCC(C)CN(C)OC Amb25852714 [0,2,0,0,0,0|2,0,0]=4 5243 B8R0.19 CCC(C)NC(=O)CN Amb21958749 [0,2,0,0,0,0|2,0,0]=4 5244 B8R0.19 CCC(C)NC(=O)CS Amb25052738 [0,2,0,0,0,0|1,1,0]=4 5245 B8R0.19 CCC(C)NC(=O)SC Amb25145616 [0,2,0,0,0,0|1,1,0]=4 5246 B8R0.19 CCC(C)OC(=O)C=C Amb22733882 [0,2,0,0,0,0|2,0,0]=4 5247 B8R0.19 CCC(C)OC(=O)C=O Amb25311231 [0,2,0,0,0,0|1,0,1]=4 5248 B8R0.19 CCC(C)OC(=O)CN Amb18307959 [0,2,0,0,0,0|2,0,0]=4 5249 B8R0.19 CCC(Cl)OC(=O)CCl Amb25772642 [0,2,0,0,0,0|2,0,0]=4 5250 B8R0.19 CCC(N)CC(=O)C#C Amb24388579 [0,2,0,0,0,0|1,0,0]=3 5251 B8R0.19 CCC(N)CC(=O)C=C Amb25108966 [0,2,0,0,0,0|1,0,0]=3 5252 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [0,2,0,0,0,0|0,0,0]=2 5253 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [0,2,0,0,0,0|0,0,0]=2 5254 B8R0.19 CCC(N)CC(N)=NO Amb24379538 [0,2,0,0,0,0|1,0,0]=3 5255 B8R0.19 CCC(N)CC(O)CC Amb25858181 [0,2,0,0,0,0|1,0,1]=4 5256 B8R0.19 CCC(N)C\C(\C)=C\C Amb25198785 [0,2,0,0,0,0|2,0,0]=4 5257 B8R0.19 CCC(NC(=O)CBr)C Amb17331628 [0,2,0,0,0,0|2,0,0]=4 5258 B8R0.19 CCC(NC(=O)CCl)C Amb1149867 [0,2,0,0,0,0|2,0,0]=4 5259 B8R0.19 CCC(NC(=O)OC)C Amb10568221 [0,2,0,0,0,0|1,0,0]=3 5260 B8R0.19 CCC(O)CC(=C)C#C Amb24576559 [0,2,0,0,0,0|2,0,0]=4 5261 B8R0.19 CCC(O)CC(=C)C=C Amb24687988 [0,2,0,0,0,0|2,0,0]=4 5262 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [0,2,0,0,0,0|0,0,0]=2 5263 B8R0.19 CCC(O)CC(=S)SC Amb24688018 [0,2,0,0,0,0|0,2,0]=4 5264 B8R0.19 CCC(O)CC(C)=CC Amb24062972 [0,2,0,0,0,0|2,0,0]=4 5265 B8R0.19 CCC(O)CC(O)C=O Amb25770125 [0,2,0,0,0,0|0,0,1]=3 5266 B8R0.19 CCC(O)CC(O)CC Amb25702353 [0,2,0,0,0,0|1,0,1]=4 5267 B8R0.19 CCC(O)CN(C)OC Amb24672344 [0,2,0,0,0,0|2,0,0]=4 5268 B8R0.19 CCC(O)NC(=O)C=C Amb24477763 [0,2,0,0,0,0|2,0,0]=4 5269 B8R0.19 CCC(O)OC(=O)C=C Amb24734213 [0,2,0,0,0,0|2,0,0]=4 5270 B8R0.19 CCC(O)\C=C(\C)/CO Amb25713264 [0,2,0,0,0,0|1,0,1]=4 5271 B8R0.19 CCN(C)CC(=O)CN Amb25364572 [0,2,0,0,0,0|2,0,0]=4 5272 B8R0.19 CCN(C)CC(=O)NC Amb25304735 [0,2,0,0,0,0|2,0,0]=4 5273 B8R0.19 CCN(C)CC(=O)NN Amb19890161 [0,2,0,0,0,0|2,0,0]=4 5274 B8R0.19 CCN(C)CC(=O)NN Amb21959605 [0,2,0,0,0,0|2,0,0]=4 5275 B8R0.19 CCN(O)CC(=O)OC Amb25259900 [0,2,0,0,0,0|1,0,0]=3 5276 B8R0.19 CCS(=O)CC(=O)CC Amb25361921 [0,2,0,0,0,0|2,0,0]=4 5277 B8R0.19 CCS(=O)CC(=O)OC Amb18787291 [0,2,0,0,0,0|1,0,0]=3 5278 B8R0.19 CC[C@@H](C)CC(C)C=O Amb24378509 [0,2,0,0,0,0|1,0,1]=4 5279 B8R0.19 CC[C@@H](C)C[C@H](C)C=O Amb24558292 [0,2,0,0,0,0|1,0,1]=4 5280 B8R0.19 CC[C@@H](C)NC(=O)OC Amb25368349 [0,2,0,0,0,0|1,0,0]=3 5281 B8R0.19 CC[C@@H](C)\C=C(\C)/CO Amb25185199 [0,2,0,0,0,0|1,0,1]=4 5282 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [0,2,0,0,0,0|0,0,0]=2 5283 B8R0.19 CC[C@@H](N)CN(C)OC Amb25334124 [0,2,0,0,0,0|2,0,0]=4 5284 B8R0.19 CC[C@@H](N)C[C@H](O)CC Amb19929572 [0,2,0,0,0,0|1,0,1]=4 5285 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [0,2,0,0,0,0|0,0,0]=2 5286 B8R0.19 CC[C@@H](O)C[C@H](O)CC Amb22388488 [0,2,0,0,0,0|1,0,1]=4 5287 B8R0.19 CC[C@H](C)CC(=C)C=O Amb25309429 [0,2,0,0,0,0|1,0,0]=3 5288 B8R0.19 CC[C@H](C)C[C@@H](C)C=O Amb25195051 [0,2,0,0,0,0|1,0,1]=4 5289 B8R0.19 CC[C@H](C)C[C@@H](C)CO Amb24593564 [0,2,0,0,0,0|1,0,1]=4 5290 B8R0.19 CC[C@H](C)C[C@H](C)CO Amb24726094 [0,2,0,0,0,0|1,0,1]=4 5291 B8R0.19 CC[C@H](C)NC(=O)C=C Amb24398563 [0,2,0,0,0,0|2,0,0]=4 5292 B8R0.19 CC[C@H](Cl)CC(=O)OC Amb25074562 [0,2,0,0,0,0|0,0,0]=2 5293 B8R0.19 CC[C@H](N)C[C@H](O)CC Amb19929573 [0,2,0,0,0,0|1,0,1]=4 5294 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [0,2,0,0,0,0|0,0,0]=2 5295 B8R0.19 CC[C@H](O)C[C@@H](O)CC Amb24467480 [0,2,0,0,0,0|1,0,1]=4 5296 B8R0.19 CC\C(\N)=C\C(=O)OC Amb25041460 [0,2,0,0,0,0|0,0,2]=4 5297 B8R0.19 CN(CC(=O)OC)OC Amb25072271 [0,2,0,0,0,0|2,0,0]=4 5298 B8R0.19 CN(CC)CC(=O)NN Amb10608256 [0,2,0,0,0,0|2,0,0]=4 5299 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [0,2,0,0,0,0|1,0,1]=4 5300 B8R0.19 CNC(=O)CC(C)OC Amb24673256 [0,2,0,0,0,0|2,0,0]=4 5301 B8R0.19 CNC(=O)CC(C)SC Amb24642838 [0,2,0,0,0,0|2,0,0]=4 5302 B8R0.19 CNC(=O)CC(O)CN Amb24442697 [0,2,0,0,0,0|2,0,0]=4 5303 B8R0.19 CNC(C)CC(N)=NO Amb25147148 [0,2,0,0,0,0|2,0,0]=4 5304 B8R0.19 CNC(CC(=O)NC)C Amb10608347 [0,2,0,0,0,0|2,0,0]=4 5305 B8R0.19 COC(=N)CC(=O)OC Amb24476600 [0,2,0,0,0,0|1,0,1]=4 5306 B8R0.19 COC(=O)CC(=C)CCl Amb24053257 [0,2,0,0,0,0|1,0,1]=4 5307 B8R0.19 COC(=O)CC(=O)CBr Amb24081949 [0,2,0,0,0,0|1,0,1]=4 5308 B8R0.19 COC(=O)CC(=O)CN Amb18115867 [0,2,0,0,0,0|1,0,1]=4 5309 B8R0.19 COC(=O)CC(Br)C=O Amb18647814 [0,2,0,0,0,0|1,0,1]=4 5310 B8R0.19 COC(=O)CC(Br)CF Amb24627105 [0,2,0,0,0,0|1,0,0]=3 5311 B8R0.19 COC(=O)CC(C)C=C Amb24712566 [0,2,0,0,0,0|0,0,2]=4 5312 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [0,2,0,0,0,0|1,0,1]=4 5313 B8R0.19 COC(=O)CC(C)CBr Amb24692917 [0,2,0,0,0,0|1,0,0]=3 5314 B8R0.19 COC(=O)CC(C)CN Amb18642843 [0,2,0,0,0,0|1,0,0]=3 5315 B8R0.19 COC(=O)CC(C)CO Amb24729571 [0,2,0,0,0,0|1,0,0]=3 5316 B8R0.19 COC(=O)CC(C)NO Amb25032324 [0,2,0,0,0,0|2,0,0]=4 5317 B8R0.19 COC(=O)CC(C)SC Amb19374125 [0,2,0,0,0,0|1,0,0]=3 5318 B8R0.19 COC(=O)CC(Cl)SCl Amb24710162 [0,2,0,0,0,0|2,0,0]=4 5319 B8R0.19 COC(=O)CC(N)C=C Amb25380673 [0,2,0,0,0,0|0,0,2]=4 5320 B8R0.19 COC(=O)CC(N)CN Amb22264781 [0,2,0,0,0,0|1,0,0]=3 5321 B8R0.19 COC(=O)CC(N)CN Amb25766036 [0,2,0,0,0,0|1,0,0]=3 5322 B8R0.19 COC(=O)CC(N)CO Amb24366077 [0,2,0,0,0,0|1,0,0]=3 5323 B8R0.19 COC(=O)CC(O)C=C Amb25746682 [0,2,0,0,0,0|0,0,2]=4 5324 B8R0.19 COC(=O)CC(O)CBr Amb25201054 [0,2,0,0,0,0|1,0,0]=3 5325 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [0,2,0,0,0,0|1,0,0]=3 5326 B8R0.19 COC(=O)CC(O)CN Amb25146166 [0,2,0,0,0,0|1,0,0]=3 5327 B8R0.19 COC(=O)CC([NH3+])C[NH3+] Amb24112943 [0,2,0,0,0,0|1,0,0]=3 5328 B8R0.19 COC(=O)CS(=O)CCl Amb24582180 [0,2,0,0,0,0|2,0,0]=4 5329 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [0,2,0,0,0,0|1,0,0]=3 5330 B8R0.19 COC(=O)C[C@@H](CO)O Amb13883661 [0,2,0,0,0,0|1,0,0]=3 5331 B8R0.19 COC(=O)C[C@@H](N)C=C Amb25704281 [0,2,0,0,0,0|0,0,2]=4 5332 B8R0.19 COC(=O)C[C@@H](O)C=C Amb24705874 [0,2,0,0,0,0|0,0,2]=4 5333 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [0,2,0,0,0,0|1,0,0]=3 5334 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [0,2,0,0,0,0|1,0,0]=3 5335 B8R0.19 COC(=O)C[C@H](C)CBr Amb25249104 [0,2,0,0,0,0|1,0,0]=3 5336 B8R0.19 COC(=O)C[C@H](N)CN Amb24360537 [0,2,0,0,0,0|1,0,0]=3 5337 B8R0.19 COC(=O)C[C@H](N)CO Amb24561636 [0,2,0,0,0,0|1,0,0]=3 5338 B8R0.19 COC(=O)C[C@H](O)C#C Amb24748370 [0,2,0,0,0,0|0,0,2]=4 5339 B8R0.19 COC(=O)C[C@H](O)C=C Amb25788939 [0,2,0,0,0,0|0,0,2]=4 5340 B8R0.19 COC(=O)NC(C)CN Amb18251139 [0,2,0,0,0,0|2,0,0]=4 5341 B8R0.19 COC(=O)NC(N)OC Amb24562342 [0,2,0,0,0,0|2,0,0]=4 5342 B8R0.19 COC(=O)NC(N)SC Amb24340152 [0,2,0,0,0,0|2,0,0]=4 5343 B8R0.19 COC(=O)N[C@@H](C)CN Amb22747138 [0,2,0,0,0,0|2,0,0]=4 5344 B8R0.19 COC(=O)N[C@H](C)CO Amb24478791 [0,2,0,0,0,0|2,0,0]=4 5345 B8R0.19 COC(C)CC(=O)C#C Amb25188993 [0,2,0,0,0,0|2,0,0]=4 5346 B8R0.19 COC(C)CC(=O)C=C Amb25836096 [0,2,0,0,0,0|2,0,0]=4 5347 B8R0.19 COC(C)CC(=O)NO Amb24476739 [0,2,0,0,0,0|1,0,0]=3 5348 B8R0.19 COC(C)CC(N)=NO Amb25116224 [0,2,0,0,0,0|2,0,0]=4 5349 B8R0.19 C[C@@H](CC(=O)CC)CC Amb24448957 [0,2,0,0,0,0|1,0,0]=3 5350 B8R0.19 C[C@@H](C[C@H](N)CO)CC Amb25231217 [0,2,0,0,0,0|1,0,1]=4 5351 B8R0.19 C[C@H](CC(=O)CC)CC Amb24689490 [0,2,0,0,0,0|1,0,0]=3 5352 B8R0.19 C[C@H](CC(O)C=C)CC Amb25296223 [0,2,0,0,0,0|1,0,1]=4 5353 B8R0.19 C\C(\C=O)=C\C(O)CC Amb25205229 [0,2,0,0,0,0|1,0,1]=4 5354 B8R0.19 C\C(\CC(=O)OC)=C\C Amb24453303 [0,2,0,0,0,0|0,0,2]=4 5355 B8R0.19 NCC(O)CC(=O)NO Amb25203640 [0,2,0,0,0,0|1,0,0]=3 5356 B8R0.19 NNC(=O)CC(O)CCl Amb19942496 [0,2,0,0,0,0|2,0,0]=4 5357 B8R0.19 NNC(=O)C[C@@H](O)CCl Amb24476045 [0,2,0,0,0,0|2,0,0]=4 5358 B8R0.19 OCC(=O)CC(=O)CO Amb24608175 [0,2,0,0,0,0|1,0,1]=4 5359 B8R0.19 OCC(O)CC(O)C=O Amb22731319 [0,2,0,0,0,0|1,0,1]=4 5360 B8R0.19 OC[C@@H](O)CC(=O)C=O Amb24468249 [0,2,0,0,0,0|1,0,1]=4 5361 B8R0.19 OC[C@@H](O)C[C@@H](O)C=O Amb25340462 [0,2,0,0,0,0|1,0,1]=4 5362 B8R0.19 OC[C@H](O)C[C@@H](O)C=O Amb24441617 [0,2,0,0,0,0|1,0,1]=4 5363 B8R0.19 O[C@@H](CC(=O)CO)CO Amb24387900 [0,2,0,0,0,0|1,0,0]=3 5364 B8R0.23 BrC(C(=O)O)CC(C)C Amb16233356 [0,2,0,0,0,0|0,0,0]=2 5365 B8R0.23 C=C(Br)C(O)CC(O)=O Amb24648348 [0,2,0,0,0,0|0,0,2]=4 5366 B8R0.23 C=C(Br)CC(N)C(O)=O Amb24557771 [0,2,0,0,0,0|0,0,2]=4 5367 B8R0.23 C=C(Br)C[C@@H](N)C(O)=O Amb22746251 [0,2,0,0,0,0|0,0,2]=4 5368 B8R0.23 C=C(Cl)CC(N)C(O)=O Amb24411473 [0,2,0,0,0,0|0,0,2]=4 5369 B8R0.23 C=C(F)CC(N)C(O)=O Amb24580886 [0,2,0,0,0,0|0,0,2]=4 5370 B8R0.23 C=C(I)CC(N)C(O)=O Amb25842052 [0,2,0,0,0,0|0,0,2]=4 5371 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,2,0,0,0,0|2,0,0]=4 5372 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,2,0,0,0,0|0,0,1]=3 5373 B8R0.23 CC(=C)C(N)CC(N)=O Amb24401112 [0,2,0,0,0,0|1,0,1]=4 5374 B8R0.23 CC(=C)C(O)CC(O)=O Amb18642756 [0,2,0,0,0,0|0,0,1]=3 5375 B8R0.23 CC(=C)CC(=C)C(O)=O Amb24669131 [0,2,0,0,0,0|0,0,2]=4 5376 B8R0.23 CC(=C)CC(C)C(N)=O Amb24475657 [0,2,0,0,0,0|1,0,1]=4 5377 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [0,2,0,0,0,0|0,0,1]=3 5378 B8R0.23 CC(=C)CC(O)C(O)=O Amb24534477 [0,2,0,0,0,0|0,0,1]=3 5379 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [0,2,0,0,0,0|0,0,1]=3 5380 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [0,2,0,0,0,0|0,0,1]=3 5381 B8R0.23 CC(=C)C[C@@H](N)C(O)=O Amb22801689 [0,2,0,0,0,0|0,0,1]=3 5382 B8R0.23 CC(=C)C[C@H](N)C(O)=O Amb25757900 [0,2,0,0,0,0|0,0,1]=3 5383 B8R0.23 CC(=C)[C@@H](O)CC(O)=O Amb25789715 [0,2,0,0,0,0|0,0,1]=3 5384 B8R0.23 CC(=CC(O)=O)C(C)F Amb25108468 [0,2,0,0,0,0|0,0,2]=4 5385 B8R0.23 CC(=CC(O)=O)C(C)N Amb24339945 [0,2,0,0,0,0|0,0,2]=4 5386 B8R0.23 CC(=O)C(=C)CC(C)C Amb22277685 [0,2,0,0,0,0|1,0,1]=4 5387 B8R0.23 CC(=O)C(=O)CC(C)C Amb22489717 [0,2,0,0,0,0|1,0,1]=4 5388 B8R0.23 CC(=O)C(=O)CC(C)N Amb25769599 [0,2,0,0,0,0|1,0,1]=4 5389 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,2,0,0,0,0|0,0,1]=3 5390 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,2,0,0,0,0|0,0,1]=3 5391 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,2,0,0,0,0|1,0,1]=4 5392 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,2,0,0,0,0|0,0,1]=3 5393 B8R0.23 CC(=O)C(O)CN(C)C Amb24571624 [0,2,0,0,0,0|2,0,0]=4 5394 B8R0.23 CC(=O)CC(=O)C(O)=O Amb18642736 [0,2,0,0,0,0|0,0,2]=4 5395 B8R0.23 CC(=O)CC(=S)C(C)C Amb24632255 [0,2,0,0,0,0|1,0,1]=4 5396 B8R0.23 CC(=O)CC(Br)C(O)=O Amb24710683 [0,2,0,0,0,0|0,0,1]=3 5397 B8R0.23 CC(=O)CC(C)C(O)=S Amb24061827 [0,2,0,0,0,0|0,1,1]=4 5398 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,2,0,0,0,0|0,0,1]=3 5399 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,2,0,0,0,0|0,0,1]=3 5400 B8R0.23 CC(=O)CC(O)C(O)=O Amb22500917 [0,2,0,0,0,0|0,0,1]=3 5401 B8R0.23 CC(=O)C[C@@H](C)C(C)=C Amb25347412 [0,2,0,0,0,0|1,0,1]=4 5402 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,2,0,0,0,0|0,0,1]=3 5403 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,2,0,0,0,0|0,0,1]=3 5404 B8R0.23 CC(=O)C[C@H](O)C(O)=O Amb24358758 [0,2,0,0,0,0|0,0,1]=3 5405 B8R0.23 CC(=O)NC(O)C(O)=O Amb25146184 [0,2,0,0,0,0|1,0,1]=4 5406 B8R0.23 CC(=O)N[C@H](C)C(O)=O Amb19944277 [0,2,0,0,0,0|1,0,1]=4 5407 B8R0.23 CC(=O)OC(C)C(O)=O Amb22360672 [0,2,0,0,0,0|1,0,1]=4 5408 B8R0.23 CC(=O)SC(C)C(O)=O Amb25719066 [0,2,0,0,0,0|1,0,1]=4 5409 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,2,0,0,0,0|0,0,1]=3 5410 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,2,0,0,0,0|0,0,1]=3 5411 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,2,0,0,0,0|0,0,1]=3 5412 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [0,2,0,0,0,0|0,0,1]=3 5413 B8R0.23 CC(=S)N[C@@H](C)C(O)=O Amb24529119 [0,2,0,0,0,0|1,0,1]=4 5414 B8R0.23 CC(Br)CN(C)C(C)=O Amb24672871 [0,2,0,0,0,0|2,0,0]=4 5415 B8R0.23 CC(C(=O)N)CN(C)C Amb17231865 [0,2,0,0,0,0|2,0,0]=4 5416 B8R0.23 CC(C(=O)O)NC(C)C Amb10199874 [0,2,0,0,0,0|1,0,0]=3 5417 B8R0.23 CC(C(=O)O)NC(C)C Amb1110769 [0,2,0,0,0,0|1,0,0]=3 5418 B8R0.23 CC(C(=O)O)OC(C)C Amb10607866 [0,2,0,0,0,0|1,0,0]=3 5419 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,2,0,0,0,0|0,0,0]=2 5420 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [0,2,0,0,0,0|0,0,2]=4 5421 B8R0.23 CC(C)=C[C@@H](C)C(O)=O Amb25794277 [0,2,0,0,0,0|0,0,2]=4 5422 B8R0.23 CC(C)=C[C@H](N)C(O)=O Amb24629144 [0,2,0,0,0,0|0,0,2]=4 5423 B8R0.23 CC(C)C(=C)CC(O)=O Amb25074109 [0,2,0,0,0,0|0,0,1]=3 5424 B8R0.23 CC(C)C(=O)CC(C)=O Amb17778966 [0,2,0,0,0,0|1,0,1]=4 5425 B8R0.23 CC(C)C(Br)CC(N)=O Amb25706465 [0,2,0,0,0,0|1,0,0]=3 5426 B8R0.23 CC(C)C(C)CC(C)=O Amb25835876 [0,2,0,0,0,0|1,0,0]=3 5427 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,2,0,0,0,0|1,0,0]=3 5428 B8R0.23 CC(C)C(C)NC(C)=O Amb23329033 [0,2,0,0,0,0|2,0,0]=4 5429 B8R0.23 CC(C)C(C)OC(C)=O Amb24458336 [0,2,0,0,0,0|2,0,0]=4 5430 B8R0.23 CC(C)C(Cl)=CC(O)=O Amb24413053 [0,2,0,0,0,0|0,0,2]=4 5431 B8R0.23 CC(C)C(Cl)CC(=O)Cl Amb24479955 [0,2,0,0,0,0|1,0,0]=3 5432 B8R0.23 CC(C)C(Cl)SC(C)=O Amb24479957 [0,2,0,0,0,0|2,0,0]=4 5433 B8R0.23 CC(C)C(F)CC(O)=O Amb25854273 [0,2,0,0,0,0|0,0,0]=2 5434 B8R0.23 CC(C)C(N)=CC(O)=O Amb24481870 [0,2,0,0,0,0|0,0,2]=4 5435 B8R0.23 CC(C)C(N)CC(=O)Cl Amb24763731 [0,2,0,0,0,0|1,0,0]=3 5436 B8R0.23 CC(C)C(N)CC(=O)S Amb24477693 [0,2,0,0,0,0|0,1,0]=3 5437 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,2,0,0,0,0|1,0,0]=3 5438 B8R0.23 CC(C)C(N)CS(C)=O Amb25268163 [0,2,0,0,0,0|2,0,0]=4 5439 B8R0.23 CC(C)C(O)=CC(O)=O Amb24548066 [0,2,0,0,0,0|0,0,2]=4 5440 B8R0.23 CC(C)C(O)CC(C)=C Amb22228361 [0,2,0,0,0,0|2,0,0]=4 5441 B8R0.23 CC(C)C(O)CC(C)=O Amb24079595 [0,2,0,0,0,0|1,0,0]=3 5442 B8R0.23 CC(C)C(O)CC(N)=O Amb24481942 [0,2,0,0,0,0|1,0,0]=3 5443 B8R0.23 CC(C)C(O)C[N+]([O-])=O Amb25176366 [0,2,0,0,0,0|1,0,1]=4 5444 B8R0.23 CC(C)C(S)CC(C)=O Amb24736725 [0,2,0,0,0,0|1,0,0]=3 5445 B8R0.23 CC(C)CC(=C)C(N)=O Amb24369675 [0,2,0,0,0,0|1,0,1]=4 5446 B8R0.23 CC(C)CC(=C)C(O)=O Amb18642603 [0,2,0,0,0,0|0,0,1]=3 5447 B8R0.23 CC(C)CC(=O)C([O-])=O Amb21962530 [0,2,0,0,0,0|0,0,2]=4 5448 B8R0.23 CC(C)CC(=O)C([O-])=O Amb22360647 [0,2,0,0,0,0|0,0,2]=4 5449 B8R0.23 CC(C)CC(=O)[13C]([O-])=O Amb22353494 [0,2,0,0,0,0|0,0,2]=4 5450 B8R0.23 CC(C)CC(Br)C(C)=C Amb24480024 [0,2,0,0,0,0|2,0,0]=4 5451 B8R0.23 CC(C)CC(Br)C(N)=O Amb24423796 [0,2,0,0,0,0|1,0,0]=3 5452 B8R0.23 CC(C)CC(C)C(C)=O Amb24640121 [0,2,0,0,0,0|1,0,0]=3 5453 B8R0.23 CC(C)CC(C)C(N)=N Amb24332069 [0,2,0,0,0,0|2,0,0]=4 5454 B8R0.23 CC(C)CC(C)C(N)=O Amb25733229 [0,2,0,0,0,0|1,0,0]=3 5455 B8R0.23 CC(C)CC(C)C(N)=S Amb24481694 [0,2,0,0,0,0|1,1,0]=4 5456 B8R0.23 CC(C)CC(C)C(O)=O Amb18975244 [0,2,0,0,0,0|0,0,0]=2 5457 B8R0.23 CC(C)CC(C)S([O-])=O Amb24371233 [0,2,0,0,0,0|1,0,1]=4 5458 B8R0.23 CC(C)CC(Cl)C(C)=C Amb25233440 [0,2,0,0,0,0|2,0,0]=4 5459 B8R0.23 CC(C)CC(Cl)C(N)=O Amb24534175 [0,2,0,0,0,0|1,0,0]=3 5460 B8R0.23 CC(C)CC(F)C(O)=O Amb24565634 [0,2,0,0,0,0|0,0,0]=2 5461 B8R0.23 CC(C)CC(N)B(O)O Amb25125820 [0,2,0,0,0,0|1,0,1]=4 5462 B8R0.23 CC(C)CC(N)C(C)=C Amb25764676 [0,2,0,0,0,0|2,0,0]=4 5463 B8R0.23 CC(C)CC(N)C(C)=O Amb18203220 [0,2,0,0,0,0|1,0,0]=3 5464 B8R0.23 CC(C)CC(N)C(C)=O Amb22899479 [0,2,0,0,0,0|1,0,0]=3 5465 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,2,0,0,0,0|1,0,1]=4 5466 B8R0.23 CC(C)CC(N)C(O)=O Amb22001061 [0,2,0,0,0,0|0,0,0]=2 5467 B8R0.23 CC(C)CC(N)[13C](O)=O Amb22363198 [0,2,0,0,0,0|0,0,0]=2 5468 B8R0.23 CC(C)CC(O)C(C)=C Amb25142332 [0,2,0,0,0,0|2,0,0]=4 5469 B8R0.23 CC(C)CC(O)C(C)O Amb24570892 [0,2,0,0,0,0|1,0,1]=4 5470 B8R0.23 CC(C)CC(S)C(O)=O Amb18296292 [0,2,0,0,0,0|0,0,0]=2 5471 B8R0.23 CC(C)CC([15NH2])C(O)=O Amb22351200 [0,2,0,0,0,0|0,0,0]=2 5472 B8R0.23 CC(C)CN(C)C(C)=O Amb24545444 [0,2,0,0,0,0|2,0,0]=4 5473 B8R0.23 CC(C)C[13CH](N)C(O)=O Amb22351309 [0,2,0,0,0,0|0,0,0]=2 5474 B8R0.23 CC(C)C[13CH](N)[13C](O)=O Amb22367336 [0,2,0,0,0,0|0,0,0]=2 5475 B8R0.23 CC(C)C[C@@H](Br)C(=O)Cl Amb25290167 [0,2,0,0,0,0|1,0,0]=3 5476 B8R0.23 CC(C)C[C@@H](Br)C(N)=O Amb25310991 [0,2,0,0,0,0|1,0,0]=3 5477 B8R0.23 CC(C)C[C@@H](Br)C(O)=O Amb24648832 [0,2,0,0,0,0|0,0,0]=2 5478 B8R0.23 CC(C)C[C@@H](Cl)C(O)=O Amb22800398 [0,2,0,0,0,0|0,0,0]=2 5479 B8R0.23 CC(C)C[C@@H](F)C(O)=O Amb24616998 [0,2,0,0,0,0|0,0,0]=2 5480 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,2,0,0,0,0|1,0,0]=3 5481 B8R0.23 CC(C)C[C@@H]([15NH2])C(O)=O Amb22801141 [0,2,0,0,0,0|0,0,0]=2 5482 B8R0.23 CC(C)C[C@H](Br)C(O)=O Amb22226489 [0,2,0,0,0,0|0,0,0]=2 5483 B8R0.23 CC(C)C[C@H](Cl)C(N)=O Amb25145996 [0,2,0,0,0,0|1,0,0]=3 5484 B8R0.23 CC(C)C[C@H](Cl)C(O)=O Amb22388637 [0,2,0,0,0,0|0,0,0]=2 5485 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,2,0,0,0,0|1,0,1]=4 5486 B8R0.23 CC(C)C[C@H](N)C(=O)Cl Amb25842766 [0,2,0,0,0,0|1,0,0]=3 5487 B8R0.23 CC(C)C[C@H](N)C(O)=O Amb22351113 [0,2,0,0,0,0|0,0,0]=2 5488 B8R0.23 CC(C)C[C@H](N)C(O)O Amb24353011 [0,2,0,0,0,0|0,0,2]=4 5489 B8R0.23 CC(C)C[C@H](N)[C@@H](C)O Amb25851073 [0,2,0,0,0,0|1,0,1]=4 5490 B8R0.23 CC(C)C[C@H](O)C(N)=O Amb24548495 [0,2,0,0,0,0|1,0,0]=3 5491 B8R0.23 CC(C)C[C@H](S)C(O)=O Amb24457027 [0,2,0,0,0,0|0,0,0]=2 5492 B8R0.23 CC(C)N(C)CC(C)=O Amb22587141 [0,2,0,0,0,0|2,0,0]=4 5493 B8R0.23 CC(C)N(C)CC(N)=O Amb24384718 [0,2,0,0,0,0|2,0,0]=4 5494 B8R0.23 CC(C)N(O)CC(N)=O Amb24481943 [0,2,0,0,0,0|2,0,0]=4 5495 B8R0.23 CC(C)N=C(Cl)C(O)=O Amb25799222 [0,2,0,0,0,0|1,0,1]=4 5496 B8R0.23 CC(C)NC(C)C(C)=O Amb18642711 [0,2,0,0,0,0|2,0,0]=4 5497 B8R0.23 CC(C)N[C@@H](C)C(N)=O Amb24749342 [0,2,0,0,0,0|2,0,0]=4 5498 B8R0.23 CC(C)N[C@H](C)C(N)=O Amb24680081 [0,2,0,0,0,0|2,0,0]=4 5499 B8R0.23 CC(C)OC(=O)C(O)=O Amb25709215 [0,2,0,0,0,0|1,0,1]=4 5500 B8R0.23 CC(C)SC(F)C(O)=O Amb24671129 [0,2,0,0,0,0|1,0,0]=3 5501 B8R0.23 CC(C)S[C@@H](C)C(O)=O Amb25108429 [0,2,0,0,0,0|1,0,0]=3 5502 B8R0.23 CC(C)[13CH2][13C](=O)[13C]([O-])=O Amb22055839 [0,2,0,0,0,0|0,0,2]=4 5503 B8R0.23 CC(C)[C@@H](N)CC(C)=C Amb25821833 [0,2,0,0,0,0|2,0,0]=4 5504 B8R0.23 CC(C)[C@@H](N)CC(O)=O Amb22226647 [0,2,0,0,0,0|0,0,0]=2 5505 B8R0.23 CC(C)[C@@H](O)CC(C)=C Amb25069574 [0,2,0,0,0,0|2,0,0]=4 5506 B8R0.23 CC(C)[C@@H](O)CC(C)=O Amb25147078 [0,2,0,0,0,0|1,0,0]=3 5507 B8R0.23 CC(C)[C@@H](O)CC(O)=O Amb25761246 [0,2,0,0,0,0|0,0,0]=2 5508 B8R0.23 CC(C)[C@H](C)CC(C)=O Amb25188966 [0,2,0,0,0,0|1,0,0]=3 5509 B8R0.23 CC(C)[C@H](N)CC(C)=C Amb24715099 [0,2,0,0,0,0|2,0,0]=4 5510 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,2,0,0,0,0|1,0,0]=3 5511 B8R0.23 CC(C)[C@H](N)CC(O)=O Amb20240790 [0,2,0,0,0,0|0,0,0]=2 5512 B8R0.23 CC(C)[C@H](O)CC(C)=C Amb25721776 [0,2,0,0,0,0|2,0,0]=4 5513 B8R0.23 CC(C)[C@H](O)CC(C)=O Amb25135567 [0,2,0,0,0,0|1,0,0]=3 5514 B8R0.23 CC(C)[C@H](O)CC(O)=O Amb24561913 [0,2,0,0,0,0|0,0,0]=2 5515 B8R0.23 CC(C)[C@H](O)C[C@@H](C)O Amb25229464 [0,2,0,0,0,0|1,0,1]=4 5516 B8R0.23 CC(C)\C(\Br)=C\C(O)=O Amb25074552 [0,2,0,0,0,0|0,0,2]=4 5517 B8R0.23 CC(C)\C=C(/F)\C(O)=O Amb18642877 [0,2,0,0,0,0|0,0,2]=4 5518 B8R0.23 CC(CC(C)=C)C(C)N Amb25136931 [0,2,0,0,0,0|2,0,0]=4 5519 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [0,2,0,0,0,0|1,0,0]=3 5520 B8R0.23 CC(CC(C)=O)S(C)=O Amb25712236 [0,2,0,0,0,0|2,0,0]=4 5521 B8R0.23 CC(CC(C)N)C(O)=O Amb20620336 [0,2,0,0,0,0|0,0,0]=2 5522 B8R0.23 CC(CC(C)N)S(C)=O Amb24340289 [0,2,0,0,0,0|2,0,0]=4 5523 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [0,2,0,0,0,0|1,0,0]=3 5524 B8R0.23 CC(CC(F)F)C(C)=O Amb24360266 [0,2,0,0,0,0|2,0,0]=4 5525 B8R0.23 CC(CC(F)F)C(O)=O Amb22896466 [0,2,0,0,0,0|1,0,0]=3 5526 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,2,0,0,0,0|0,0,0]=2 5527 B8R0.23 CC(CC(O)=O)C(N)=O Amb25737942 [0,2,0,0,0,0|1,0,1]=4 5528 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [0,2,0,0,0,0|1,0,0]=3 5529 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,2,0,0,0,0|1,0,0]=3 5530 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [0,2,0,0,0,0|1,0,0]=3 5531 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [0,2,0,0,0,0|1,0,0]=3 5532 B8R0.23 CC(Cl)CC(Cl)C(C)=O Amb25700978 [0,2,0,0,0,0|1,0,0]=3 5533 B8R0.23 CC(Cl)CN(C)C(C)=O Amb25325778 [0,2,0,0,0,0|2,0,0]=4 5534 B8R0.23 CC(F)CC(N)C(O)=O Amb25803619 [0,2,0,0,0,0|0,0,0]=2 5535 B8R0.23 CC(N(C)C)CC(=O)N Amb17231867 [0,2,0,0,0,0|2,0,0]=4 5536 B8R0.23 CC(N(CC(=O)O)C)C Amb10609863 [0,2,0,0,0,0|1,0,0]=3 5537 B8R0.23 CC(N)C(=O)CC(N)=O Amb24712024 [0,2,0,0,0,0|1,0,1]=4 5538 B8R0.23 CC(N)CN(C)C(C)=O Amb24096452 [0,2,0,0,0,0|2,0,0]=4 5539 B8R0.23 CC(N)CN(C)C(N)=O Amb18203178 [0,2,0,0,0,0|2,0,0]=4 5540 B8R0.23 CC(NC(C)=O)C(C)O Amb25188915 [0,2,0,0,0,0|2,0,0]=4 5541 B8R0.23 CC(NN(C)C)C(O)=O Amb24523085 [0,2,0,0,0,0|2,0,0]=4 5542 B8R0.23 CC(NS(C)=O)C(O)=O Amb25241916 [0,2,0,0,0,0|2,0,0]=4 5543 B8R0.23 CC(O)C(C)CC(C)O Amb25308000 [0,2,0,0,0,0|1,0,1]=4 5544 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,2,0,0,0,0|0,0,0]=2 5545 B8R0.23 CC(O)C(O)CC(C)=C Amb24740055 [0,2,0,0,0,0|2,0,0]=4 5546 B8R0.23 CC(O)C(O)CC(C)=O Amb25708226 [0,2,0,0,0,0|1,0,0]=3 5547 B8R0.23 CC(O)CC(=O)C(O)=O Amb25789747 [0,2,0,0,0,0|0,0,1]=3 5548 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [0,2,0,0,0,0|0,0,0]=2 5549 B8R0.23 CC(O)CC(N)C(O)=O Amb18642918 [0,2,0,0,0,0|0,0,0]=2 5550 B8R0.23 CC(O)CC(O)C(N)=O Amb24523077 [0,2,0,0,0,0|1,0,0]=3 5551 B8R0.23 CC(O)CN(C)C(C)=O Amb24072011 [0,2,0,0,0,0|2,0,0]=4 5552 B8R0.23 CC(O)CN(C)C(N)=O Amb25214415 [0,2,0,0,0,0|2,0,0]=4 5553 B8R0.23 CC(OC(C)=O)C(C)Br Amb25321799 [0,2,0,0,0,0|2,0,0]=4 5554 B8R0.23 CC(OC(C)=O)C(C)Cl Amb24480182 [0,2,0,0,0,0|2,0,0]=4 5555 B8R0.23 CC(OC(F)F)C(O)=O Amb24358717 [0,2,0,0,0,0|2,0,0]=4 5556 B8R0.23 CC(S(=O)CC(=O)O)C Amb10608021 [0,2,0,0,0,0|1,0,0]=3 5557 B8R0.23 CC(S)CC(O)C(O)=O Amb25032270 [0,2,0,0,0,0|0,0,0]=2 5558 B8R0.23 CC(\C(=C\C(=O)O)\C)C Amb17506861 [0,2,0,0,0,0|0,0,2]=4 5559 B8R0.23 CN(C(=O)CC(=O)O)C Amb17399822 [0,2,0,0,0,0|1,0,1]=4 5560 B8R0.23 CN(C)CC(F)C(O)=O Amb25178248 [0,2,0,0,0,0|1,0,0]=3 5561 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,2,0,0,0,0|2,0,0]=4 5562 B8R0.23 CN(C)CC(N)C(O)=O Amb22352274 [0,2,0,0,0,0|1,0,0]=3 5563 B8R0.23 CN(C)CC(N)C(O)=O Amb23558085 [0,2,0,0,0,0|1,0,0]=3 5564 B8R0.23 CN(C)CC(O)C(N)=O Amb24333804 [0,2,0,0,0,0|2,0,0]=4 5565 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb19889770 [0,2,0,0,0,0|1,0,0]=3 5566 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb22800468 [0,2,0,0,0,0|1,0,0]=3 5567 B8R0.23 CN(C)C[C@H](N)C(O)=O Amb24078627 [0,2,0,0,0,0|1,0,0]=3 5568 B8R0.23 CN(C)C[C@H](O)C(O)=O Amb24372674 [0,2,0,0,0,0|1,0,0]=3 5569 B8R0.23 CN(N)C(=O)CC(O)=O Amb25326354 [0,2,0,0,0,0|1,0,1]=4 5570 B8R0.23 CS(=N)CC(N)C(O)=O Amb24374643 [0,2,0,0,0,0|1,0,0]=3 5571 B8R0.23 CS(=O)CC(N)C(O)=O Amb18125279 [0,2,0,0,0,0|1,0,0]=3 5572 B8R0.23 CS(=O)CC(O)C(O)=O Amb24692848 [0,2,0,0,0,0|1,0,0]=3 5573 B8R0.23 CS(=O)C[C@@H](C(=O)O)N Amb16232229 [0,2,0,0,0,0|1,0,0]=3 5574 B8R0.23 CS(=O)C[C@@H](N)C(O)=O Amb22745418 [0,2,0,0,0,0|1,0,0]=3 5575 B8R0.23 C[C@@H](C(=O)O)CC(C)C Amb10844070 [0,2,0,0,0,0|0,0,0]=2 5576 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,2,0,0,0,0|0,0,0]=2 5577 B8R0.23 C[C@@H](CC(C)=C)[C@H](C)N Amb25267568 [0,2,0,0,0,0|2,0,0]=4 5578 B8R0.23 C[C@@H](CC(O)=O)C(Cl)Cl Amb24480304 [0,2,0,0,0,0|1,0,0]=3 5579 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,2,0,0,0,0|1,0,1]=4 5580 B8R0.23 C[C@@H](Cl)[C@H](C)OC(=O)Cl Amb25765785 [0,2,0,0,0,0|2,0,0]=4 5581 B8R0.23 C[C@@H](N)CN(C)C(C)=O Amb24465078 [0,2,0,0,0,0|2,0,0]=4 5582 B8R0.23 C[C@@H](N)[C@@H](O)CC(O)=O Amb25188895 [0,2,0,0,0,0|0,0,0]=2 5583 B8R0.23 C[C@@H](N)[C@H](O)CP(O)=O Amb25236573 [0,2,0,0,0,0|1,0,0]=3 5584 B8R0.23 C[C@@H](NC(C)=O)[C@@H](C)Br Amb24366649 [0,2,0,0,0,0|2,0,0]=4 5585 B8R0.23 C[C@@H](O)CC(=O)C(O)=O Amb25239377 [0,2,0,0,0,0|0,0,1]=3 5586 B8R0.23 C[C@@H](O)CN(C)C(C)=O Amb24416218 [0,2,0,0,0,0|2,0,0]=4 5587 B8R0.23 C[C@@H](O)C[C@H](N)C(O)=O Amb25162814 [0,2,0,0,0,0|0,0,0]=2 5588 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [0,2,0,0,0,0|0,0,0]=2 5589 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [0,2,0,0,0,0|0,0,0]=2 5590 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [0,2,0,0,0,0|0,0,0]=2 5591 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Br Amb24480012 [0,2,0,0,0,0|2,0,0]=4 5592 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Cl Amb25146769 [0,2,0,0,0,0|2,0,0]=4 5593 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)O Amb25333442 [0,2,0,0,0,0|2,0,0]=4 5594 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Br Amb24432955 [0,2,0,0,0,0|2,0,0]=4 5595 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Cl Amb24740430 [0,2,0,0,0,0|2,0,0]=4 5596 B8R0.23 C[C@@H](OC(F)F)C(O)=O Amb24389309 [0,2,0,0,0,0|2,0,0]=4 5597 B8R0.23 C[C@H](C(=O)O)CC(C)C Amb10844071 [0,2,0,0,0,0|0,0,0]=2 5598 B8R0.23 C[C@H](C(=O)O)CN(C)C Amb10844031 [0,2,0,0,0,0|1,0,0]=3 5599 B8R0.23 C[C@H](CC(C)=C)[C@@H](C)N Amb25125319 [0,2,0,0,0,0|2,0,0]=4 5600 B8R0.23 C[C@H](CC(C)=C)[C@@H](C)O Amb25113682 [0,2,0,0,0,0|2,0,0]=4 5601 B8R0.23 C[C@H](CC(N)=O)C(O)=O Amb25077589 [0,2,0,0,0,0|1,0,1]=4 5602 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,2,0,0,0,0|1,0,1]=4 5603 B8R0.23 C[C@H](Cl)C[C@H](N)C(O)=O Amb25849347 [0,2,0,0,0,0|0,0,0]=2 5604 B8R0.23 C[C@H](N)[C@@H](O)CC(O)=O Amb25727721 [0,2,0,0,0,0|0,0,0]=2 5605 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)Br Amb25075106 [0,2,0,0,0,0|2,0,0]=4 5606 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)O Amb25132762 [0,2,0,0,0,0|2,0,0]=4 5607 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)Br Amb24480158 [0,2,0,0,0,0|2,0,0]=4 5608 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)O Amb24562842 [0,2,0,0,0,0|2,0,0]=4 5609 B8R0.23 C[C@H](O)CC(=O)C(O)=O Amb25859340 [0,2,0,0,0,0|0,0,1]=3 5610 B8R0.23 C[C@H](O)CN(C)C(C)=O Amb24553313 [0,2,0,0,0,0|2,0,0]=4 5611 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [0,2,0,0,0,0|0,0,0]=2 5612 B8R0.23 C[C@H](O)C[C@H](N)C(O)=O Amb24461394 [0,2,0,0,0,0|0,0,0]=2 5613 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)Br Amb24558149 [0,2,0,0,0,0|2,0,0]=4 5614 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)O Amb24642757 [0,2,0,0,0,0|2,0,0]=4 5615 B8R0.23 C[S+](C)CC(=O)C(O)=O Amb24524581 [0,2,0,0,0,0|1,0,1]=4 5616 B8R0.23 C[S+](C)CC(N)C([O-])=O Amb25242630 [0,2,0,0,0,0|1,0,1]=4 5617 B8R0.23 C[S+](C)CC(O)C(O)=O Amb24373144 [0,2,0,0,0,0|1,0,0]=3 5618 B8R0.23 C\C(=C/C(C)C)\C(O)=O Amb18642616 [0,2,0,0,0,0|0,0,2]=4 5619 B8R0.23 C\C(=C/C(C)O)\C(O)=O Amb18642769 [0,2,0,0,0,0|0,0,2]=4 5620 B8R0.23 C\C(=C/C(O)=O)\C(C)F Amb25331272 [0,2,0,0,0,0|0,0,2]=4 5621 B8R0.23 C\C(=C/C(O)=O)\[C@@H](C)N Amb24477674 [0,2,0,0,0,0|0,0,2]=4 5622 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)N Amb24394205 [0,2,0,0,0,0|0,0,2]=4 5623 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,2,0,0,0,0|0,0,2]=4 5624 B8R0.23 C\C(=C/[C@@H](C)N)\C(O)=O Amb24476675 [0,2,0,0,0,0|0,0,2]=4 5625 B8R0.23 C\C(=C\C(C)N)\C(O)=O Amb25731207 [0,2,0,0,0,0|0,0,2]=4 5626 B8R0.23 C\C(=C\C(C)O)\C(O)=O Amb24548753 [0,2,0,0,0,0|0,0,2]=4 5627 B8R0.23 C\C(\Cl)=C\C(Cl)C(O)=O Amb24710290 [0,2,0,0,0,0|0,0,2]=4 5628 B8R0.23 ClC(C(=O)O)CC(C)C Amb17593753 [0,2,0,0,0,0|0,0,0]=2 5629 B8R0.23 F[C@H](C(=O)O)CC(C)C Amb10841083 [0,2,0,0,0,0|0,0,0]=2 5630 B8R0.23 NC(=O)C(Cl)CC(Cl)Cl Amb25724974 [0,2,0,0,0,0|2,0,0]=4 5631 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,2,0,0,0,0|1,0,1]=4 5632 B8R0.23 NC(=O)C(O)CC(O)=O Amb25378786 [0,2,0,0,0,0|1,0,1]=4 5633 B8R0.23 NC(=O)C[C@@H](C(=O)O)C Amb10843937 [0,2,0,0,0,0|1,0,1]=4 5634 B8R0.23 NC(=O)C[C@@H](O)C(O)=O Amb24681022 [0,2,0,0,0,0|1,0,1]=4 5635 B8R0.23 NC(=O)C[C@H](Br)C(O)=O Amb25137878 [0,2,0,0,0,0|1,0,1]=4 5636 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,2,0,0,0,0|1,0,1]=4 5637 B8R0.23 NC(=O)C[C@H](Cl)C(O)=O Amb24479999 [0,2,0,0,0,0|1,0,1]=4 5638 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,2,0,0,0,0|1,0,1]=4 5639 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,2,0,0,0,0|1,0,1]=4 5640 B8R0.23 NC(=S)CC(N)C(O)=O Amb24728838 [0,2,0,0,0,0|1,0,1]=4 5641 B8R0.23 NC(C(=O)O)CC(F)F Amb13952714 [0,2,0,0,0,0|1,0,0]=3 5642 B8R0.23 NC(C(=O)O)CC(F)F Amb13952720 [0,2,0,0,0,0|1,0,0]=3 5643 B8R0.23 NC(C(C)C)CC(=O)O Amb2436060 [0,2,0,0,0,0|0,0,0]=2 5644 B8R0.23 NC(CC(F)Cl)C(O)=O Amb24339513 [0,2,0,0,0,0|1,0,0]=3 5645 B8R0.23 NC(CC(N)=O)C(Cl)Cl Amb25227960 [0,2,0,0,0,0|2,0,0]=4 5646 B8R0.23 NC(CC(O)=O)C(F)F Amb23570587 [0,2,0,0,0,0|1,0,0]=3 5647 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,2,0,0,0,0|1,0,1]=4 5648 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,2,0,0,0,0|1,0,1]=4 5649 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,2,0,0,0,0|1,0,1]=4 5650 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,2,0,0,0,0|1,0,1]=4 5651 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,2,0,0,0,0|1,0,1]=4 5652 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,2,0,0,0,0|1,0,1]=4 5653 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,2,0,0,0,0|1,0,1]=4 5654 B8R0.23 NC(CC([O-])=O)C(O)=O Amb22731484 [0,2,0,0,0,0|1,0,1]=4 5655 B8R0.23 NC(CN(S)S)C(O)=O Amb24655070 [0,2,0,0,0,0|2,0,0]=4 5656 B8R0.23 NC(CS(=O)=O)C(O)=O Amb24480078 [0,2,0,0,0,0|2,0,0]=4 5657 B8R0.23 NC(CS(N)=O)C(O)=O Amb25139436 [0,2,0,0,0,0|2,0,0]=4 5658 B8R0.23 NC(CS(O)=O)C(O)=O Amb21913242 [0,2,0,0,0,0|2,0,0]=4 5659 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,2,0,0,0,0|1,0,1]=4 5660 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,2,0,0,0,0|1,0,1]=4 5661 B8R0.23 NC(C[N+]([O-])=O)C(O)=O Amb24642660 [0,2,0,0,0,0|2,0,0]=4 5662 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,2,0,0,0,0|1,0,1]=4 5663 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,2,0,0,0,0|1,0,1]=4 5664 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,2,0,0,0,0|1,0,1]=4 5665 B8R0.23 N[C@@H](C(=O)N)CC(C)C Amb16183944 [0,2,0,0,0,0|1,0,0]=3 5666 B8R0.23 N[C@@H](C(C)C)CC(=O)O Amb16184024 [0,2,0,0,0,0|0,0,0]=2 5667 B8R0.23 N[C@@H](CB(O)O)C(O)=O Amb25844412 [0,2,0,0,0,0|2,0,0]=4 5668 B8R0.23 N[C@@H](CC(Cl)Cl)C(O)=O Amb24746791 [0,2,0,0,0,0|1,0,0]=3 5669 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,2,0,0,0,0|1,0,1]=4 5670 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,2,0,0,0,0|1,0,1]=4 5671 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,2,0,0,0,0|1,0,1]=4 5672 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,2,0,0,0,0|1,0,1]=4 5673 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,2,0,0,0,0|1,0,1]=4 5674 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb20240565 [0,2,0,0,0,0|1,0,1]=4 5675 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb22748769 [0,2,0,0,0,0|1,0,1]=4 5676 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,2,0,0,0,0|1,0,1]=4 5677 B8R0.23 N[C@@H](C[N+]([O-])=O)C(O)=O Amb25710255 [0,2,0,0,0,0|2,0,0]=4 5678 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,2,0,0,0,0|1,0,1]=4 5679 B8R0.23 N[C@H](C(=O)N)CC(C)C Amb10670112 [0,2,0,0,0,0|1,0,0]=3 5680 B8R0.23 N[C@H](C(C)C)CC(=O)O Amb16184030 [0,2,0,0,0,0|0,0,0]=2 5681 B8R0.23 N[C@H](CC(F)F)C(O)=O Amb25117310 [0,2,0,0,0,0|1,0,0]=3 5682 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,2,0,0,0,0|1,0,1]=4 5683 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,2,0,0,0,0|2,0,0]=4 5684 B8R0.23 N[C@H](CN(S)S)C(O)=O Amb24564540 [0,2,0,0,0,0|2,0,0]=4 5685 B8R0.23 N[C@H](CS(O)=O)C(O)=O Amb24366002 [0,2,0,0,0,0|2,0,0]=4 5686 B8R0.23 OC(=O)C(Cl)CC(Cl)Cl Amb25350003 [0,2,0,0,0,0|1,0,0]=3 5687 B8R0.23 OC(=O)C(Cl)CS(O)=O Amb25708099 [0,2,0,0,0,0|2,0,0]=4 5688 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,2,0,0,0,0|1,0,1]=4 5689 B8R0.23 OC(=O)C(O)CC(=O)S Amb25690206 [0,2,0,0,0,0|1,0,1]=4 5690 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,2,0,0,0,0|1,0,1]=4 5691 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,2,0,0,0,0|1,0,1]=4 5692 B8R0.23 OC(=O)CC(=O)C(=O)C Amb17593364 [0,2,0,0,0,0|0,0,2]=4 5693 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,2,0,0,0,0|1,0,1]=4 5694 B8R0.23 OC(=O)CC(O)C(=O)Cl Amb25700438 [0,2,0,0,0,0|1,0,1]=4 5695 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,2,0,0,0,0|1,0,1]=4 5696 B8R0.23 OC(=O)CC([N+](=O)[O-])O Amb2222216 [0,2,0,0,0,0|2,0,0]=4 5697 B8R0.23 OC(=O)CN(C(=O)C)C Amb1111693 [0,2,0,0,0,0|1,0,1]=4 5698 B8R0.23 OC(=O)CS(=O)C(F)F Amb18979309 [0,2,0,0,0,0|2,0,0]=4 5699 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,2,0,0,0,0|1,0,1]=4 5700 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [0,2,0,0,0,0|0,0,0]=2 5701 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,2,0,0,0,0|1,0,1]=4 5702 B8R0.23 OC(=O)[C@@H](Cl)CC(Cl)Cl Amb25061364 [0,2,0,0,0,0|1,0,0]=3 5703 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,2,0,0,0,0|1,0,1]=4 5704 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,2,0,0,0,0|1,0,1]=4 5705 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,2,0,0,0,0|1,0,1]=4 5706 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,2,0,0,0,0|1,0,1]=4 5707 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,2,0,0,0,0|1,0,1]=4 5708 B8R0.23 OC(C(C)C)CC(=O)O Amb17231878 [0,2,0,0,0,0|0,0,0]=2 5709 B8R0.23 OC(CC(F)F)C(O)=O Amb25274709 [0,2,0,0,0,0|1,0,0]=3 5710 B8R0.23 OC(O)C[C@@H](O)C(O)=O Amb24524214 [0,2,0,0,0,0|1,0,0]=3 5711 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,2,0,0,0,0|1,0,1]=4 5712 B8R0.23 O[C@H](C(=O)O)CC(C)C Amb16232074 [0,2,0,0,0,0|0,0,0]=2 5713 B8R0.23 O[C@H](CC(F)F)C(O)=O Amb24641140 [0,2,0,0,0,0|1,0,0]=3 5714 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337118 [0,2,0,0,0,0|0,0,0]=2 5715 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,2,0,0,0,0|1,0,1]=4 5716 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,2,0,0,0,0|1,0,1]=4 5717 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,2,0,0,0,0|1,0,1]=4 5718 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,2,0,0,0,0|1,0,1]=4 5719 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,2,0,0,0,0|1,0,1]=4 5720 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,2,0,0,0,0|1,0,1]=4 5721 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,2,0,0,0,0|1,0,1]=4 5722 B8R0.23 [O-]C(=O)CC(O)C(O)=O Amb22734911 [0,2,0,0,0,0|1,0,1]=4 5723 B8R0.24 CCC(C)CC(C)(C)O Amb25045207 [0,2,0,0,0,0|1,0,1]=4 5724 B8R0.24 CCC(C)CS(=O)(=O)Cl Amb18295538 [0,2,0,0,0,0|1,0,1]=4 5725 B8R0.24 CCC(C)CS(=O)(=O)F Amb19373796 [0,2,0,0,0,0|1,0,1]=4 5726 B8R0.24 CCC(C)CS(N)(=O)=O Amb18180195 [0,2,0,0,0,0|1,0,1]=4 5727 B8R0.24 CCC(CS(=O)(=O)C)N Amb17485988 [0,2,0,0,0,0|1,0,1]=4 5728 B8R0.24 CCC(Cl)CP(O)(O)=O Amb25724957 [0,2,0,0,0,0|1,0,0]=3 5729 B8R0.24 CCC(Cl)CS(=O)(=O)F Amb25349720 [0,2,0,0,0,0|1,0,1]=4 5730 B8R0.24 CCC(F)CS(C)(=O)=O Amb24474745 [0,2,0,0,0,0|1,0,1]=4 5731 B8R0.24 CCC(N)CS(=O)(=O)Cl Amb24724737 [0,2,0,0,0,0|1,0,1]=4 5732 B8R0.24 CCC(N)CS(N)(=O)=O Amb25362079 [0,2,0,0,0,0|1,0,1]=4 5733 B8R0.24 CCC(O)CC(C)(C)O Amb24420727 [0,2,0,0,0,0|1,0,1]=4 5734 B8R0.24 CCC(O)CS(C)(=O)=O Amb18799417 [0,2,0,0,0,0|1,0,1]=4 5735 B8R0.24 CC[C@@H](N)CS(O)(=O)=O Amb24495132 [0,2,0,0,0,0|1,0,0]=3 5736 B8R0.24 CC[C@H](N)CS(=O)(=O)Cl Amb24367389 [0,2,0,0,0,0|1,0,1]=4 5737 B8R0.24 CC[C@H](N)CS(O)(=O)=O Amb25146380 [0,2,0,0,0,0|1,0,0]=3 5738 B8R0.24 CNC(C)CP(O)(O)=O Amb24381561 [0,2,0,0,0,0|2,0,0]=4 5739 B8R0.24 CP(O)(=O)CC(F)CN Amb24480226 [0,2,0,0,0,0|2,0,0]=4 5740 B8R0.24 CP(O)(=O)C[C@@H](O)CN Amb25273989 [0,2,0,0,0,0|2,0,0]=4 5741 B8R0.24 CP(O)(=O)C[C@H](F)CN Amb24543828 [0,2,0,0,0,0|2,0,0]=4 5742 B8R0.24 NCC(O)CP(O)(O)=O Amb24376767 [0,2,0,0,0,0|2,0,0]=4 5743 B8R0.24 NCC(O)CS(O)(=O)=O Amb24373242 [0,2,0,0,0,0|2,0,0]=4 5744 B8R0.24 NC[C@@H](F)CS(O)(=O)=O Amb25375836 [0,2,0,0,0,0|2,0,0]=4 5745 B8R0.24 NC[C@@H](O)CP(O)(O)=O Amb24443084 [0,2,0,0,0,0|2,0,0]=4 5746 B8R0.24 N[C@@H](CS(O)(=O)=O)CO Amb25083500 [0,2,0,0,0,0|2,0,0]=4 5747 B8R0.24 OC(CBr)CS(O)(=O)=O Amb25383408 [0,2,0,0,0,0|2,0,0]=4 5748 B8R0.24 OC(CCl)CS(O)(=O)=O Amb22338699 [0,2,0,0,0,0|2,0,0]=4 5749 B8R0.24 OC(CCl)CS(O)(=O)=O Amb24061946 [0,2,0,0,0,0|2,0,0]=4 5750 B8R0.24 OCC(O)CS(O)(=O)=O Amb25802047 [0,2,0,0,0,0|2,0,0]=4 5751 B8R0.24 O[C@H](CCl)CS(O)(=O)=O Amb25322010 [0,2,0,0,0,0|2,0,0]=4 5752 B8R0.24 SCC(CS(=O)(=O)O)O Amb17594311 [0,2,0,0,0,0|2,0,0]=4 5753 B8R0.34 CC(=O)CC(C)(C)CO Amb24689736 [0,2,0,0,0,0|2,0,0]=4 5754 B8R0.34 CC(C)(CBr)CC(O)=O Amb24480039 [0,2,0,0,0,0|1,0,0]=3 5755 B8R0.34 CC(C)(CC(O)=O)C#C Amb24554543 [0,2,0,0,0,0|0,0,2]=4 5756 B8R0.34 CC(C)(CC(O)=O)CO Amb24116870 [0,2,0,0,0,0|1,0,0]=3 5757 B8R0.34 CC(C)(CC(O)=O)NN Amb24670787 [0,2,0,0,0,0|2,0,0]=4 5758 B8R0.34 CC(C)(CO)CC(N)=O Amb25063938 [0,2,0,0,0,0|2,0,0]=4 5759 B8R0.34 CC(C)(CO)CC([O-])=O Amb24178915 [0,2,0,0,0,0|1,0,1]=4 5760 B8R0.34 CC(F)(CN)CC(O)=O Amb24481603 [0,2,0,0,0,0|1,0,0]=3 5761 B8R0.34 CC(N)(CC(O)=O)C=C Amb22641965 [0,2,0,0,0,0|0,0,2]=4 5762 B8R0.34 CC(N)(CCl)CC(O)=O Amb22641961 [0,2,0,0,0,0|1,0,0]=3 5763 B8R0.34 CC(O)(CC(O)=O)C=C Amb18642755 [0,2,0,0,0,0|0,0,2]=4 5764 B8R0.34 CC(O)(CN)CC(O)=O Amb25188898 [0,2,0,0,0,0|1,0,0]=3 5765 B8R0.34 CCC(C)(C)CC(=O)Cl Amb25032181 [0,2,0,0,0,0|1,0,0]=3 5766 B8R0.34 CCC(C)(C)CC(C)=C Amb22228307 [0,2,0,0,0,0|2,0,0]=4 5767 B8R0.34 CCC(C)(C)CC(C)=O Amb22388941 [0,2,0,0,0,0|1,0,0]=3 5768 B8R0.34 CCC(C)(C)C[N+]([O-])=O Amb24469650 [0,2,0,0,0,0|1,0,1]=4 5769 B8R0.34 CCC(C)(Cl)CC(O)=O Amb18644450 [0,2,0,0,0,0|0,0,0]=2 5770 B8R0.34 CCC(C)(N)CC(O)=O Amb25853863 [0,2,0,0,0,0|0,0,0]=2 5771 B8R0.34 CCC(C)(O)CC(N)=S Amb25189007 [0,2,0,0,0,0|1,1,0]=4 5772 B8R0.34 CCC(C)(O)CC(O)=O Amb18298122 [0,2,0,0,0,0|0,0,0]=2 5773 B8R0.34 CCC(C)(O)C[N+]([O-])=O Amb25270235 [0,2,0,0,0,0|1,0,1]=4 5774 B8R0.34 CCC(CC(=O)O)(C)C Amb10573669 [0,2,0,0,0,0|0,0,0]=2 5775 B8R0.34 CCC(NC(=O)N)(C)C Amb1139044 [0,2,0,0,0,0|2,0,0]=4 5776 B8R0.34 CCP(O)(=O)CC(O)=O Amb24480209 [0,2,0,0,0,0|1,0,0]=3 5777 B8R0.34 CCS(=O)(=O)CC(C)=O Amb19515195 [0,2,0,0,0,0|2,0,0]=4 5778 B8R0.34 CC[C@@](C)(N)CC(O)=O Amb25738026 [0,2,0,0,0,0|0,0,0]=2 5779 B8R0.34 CC[C@@](C)(O)CC(O)=O Amb25697894 [0,2,0,0,0,0|0,0,0]=2 5780 B8R0.34 CC[C@](C)(O)CC(O)=O Amb24746144 [0,2,0,0,0,0|0,0,0]=2 5781 B8R0.34 CC[N+](C)(C)CC(O)=O Amb24390383 [0,2,0,0,0,0|1,0,0]=3 5782 B8R0.34 CNC(C)(C)CC(O)=O Amb25710043 [0,2,0,0,0,0|1,0,0]=3 5783 B8R0.34 COC(C)(C)CC(N)=O Amb24473153 [0,2,0,0,0,0|2,0,0]=4 5784 B8R0.34 COP(O)(=O)CC(O)=O Amb24732061 [0,2,0,0,0,0|2,0,0]=4 5785 B8R0.34 CSC(C)(C)CC(O)=O Amb25304571 [0,2,0,0,0,0|1,0,0]=3 5786 B8R0.34 CSC(CC(=O)C)(C)C Amb16236855 [0,2,0,0,0,0|2,0,0]=4 5787 B8R0.34 C[C@@](N)(CC(O)=O)CO Amb25715205 [0,2,0,0,0,0|1,0,0]=3 5788 B8R0.34 C[C@@](O)(CN)CC(O)=O Amb24745092 [0,2,0,0,0,0|1,0,0]=3 5789 B8R0.34 C[Si](C)(CCl)CC(O)=O Amb25107199 [0,2,0,0,0,0|1,1,0]=4 5790 B8R0.34 NCC(F)(F)CC(O)=O Amb19148532 [0,2,0,0,0,0|1,0,0]=3 5791 B8R0.34 OC(=O)CS(=O)(=O)CF Amb24707946 [0,2,0,0,0,0|2,0,0]=4 5792 B8R0.1 BrCCNC(=O)OCC Amb10608869 [0,2,0,0,0,0|2,0,0]=4 5793 B8R0.1 C#CCCC(=O)CCO Amb24384003 [0,2,0,0,0,0|0,0,2]=4 5794 B8R0.1 C=CCC(=O)CCCCl Amb25138063 [0,2,0,0,0,0|2,0,0]=4 5795 B8R0.1 C=CCC(=O)CCCO Amb24633875 [0,2,0,0,0,0|2,0,0]=4 5796 B8R0.1 C=CCCC(=O)NCO Amb25090380 [0,2,0,0,0,0|0,0,2]=4 5797 B8R0.1 C=COC(=O)CCCBr Amb24576258 [0,2,0,0,0,0|1,0,0]=3 5798 B8R0.1 C=COC(=O)CCCCl Amb25113897 [0,2,0,0,0,0|1,0,0]=3 5799 B8R0.1 C=COC(=O)NCCO Amb25328650 [0,2,0,0,0,0|2,0,0]=4 5800 B8R0.1 CC#CC(=O)OCCC Amb25250647 [0,2,0,0,0,0|2,0,0]=4 5801 B8R0.1 CC#CC(O)CCCC Amb24457851 [0,2,0,0,0,0|1,0,1]=4 5802 B8R0.1 CC#CCC(=O)COC Amb24678739 [0,2,0,0,0,0|0,0,2]=4 5803 B8R0.1 CC#C[C@@H](O)CCCC Amb24544036 [0,2,0,0,0,0|1,0,1]=4 5804 B8R0.1 CC#C[C@H](O)CCCC Amb25106220 [0,2,0,0,0,0|1,0,1]=4 5805 B8R0.1 CC(CCCO)=CCO Amb24475813 [0,2,0,0,0,0|2,0,0]=4 5806 B8R0.1 CC=CC(=O)NCCC Amb22364983 [0,2,0,0,0,0|2,0,0]=4 5807 B8R0.1 CCCC(=O)CCCCl Amb24410674 [0,2,0,0,0,0|2,0,0]=4 5808 B8R0.1 CCCC(=O)CCNC Amb24605263 [0,2,0,0,0,0|2,0,0]=4 5809 B8R0.1 CCCC(=O)CCOC Amb25163114 [0,2,0,0,0,0|2,0,0]=4 5810 B8R0.1 CCCC(=O)CNCC Amb25142247 [0,2,0,0,0,0|2,0,0]=4 5811 B8R0.1 CCCC(=O)COCC Amb25823475 [0,2,0,0,0,0|2,0,0]=4 5812 B8R0.1 CCCC(=O)CSCC Amb25236661 [0,2,0,0,0,0|2,0,0]=4 5813 B8R0.1 CCCCC(=C)CCBr Amb24480099 [0,2,0,0,0,0|2,0,0]=4 5814 B8R0.1 CCCCC(=C)N=[N+]=[N-] Amb25772919 [0,2,0,0,0,0|2,0,0]=4 5815 B8R0.1 CCCCC(=C)\C=C/Br Amb24480295 [0,2,0,0,0,0|2,0,0]=4 5816 B8R0.1 CCCCC(=C)\C=C\Br Amb24540792 [0,2,0,0,0,0|2,0,0]=4 5817 B8R0.1 CCCCC(=N)NCC Amb24478689 [0,2,0,0,0,0|2,0,0]=4 5818 B8R0.1 CCCCC(=N)OCC Amb20673140 [0,2,0,0,0,0|1,0,0]=3 5819 B8R0.1 CCCCC(=O)CC=C Amb10567269 [0,2,0,0,0,0|1,0,0]=3 5820 B8R0.1 CCCCC(=O)CCCl Amb25705250 [0,2,0,0,0,0|1,0,0]=3 5821 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,2,0,0,0,0|1,0,0]=3 5822 B8R0.1 CCCCC(=O)COC Amb19374627 [0,2,0,0,0,0|0,0,0]=2 5823 B8R0.1 CCCCC(=O)N=C=O Amb17231844 [0,2,0,0,0,0|0,0,1]=3 5824 B8R0.1 CCCCC(=O)NC#N Amb24532849 [0,2,0,0,0,0|1,0,0]=3 5825 B8R0.1 CCCCC(=O)NC=C Amb24359898 [0,2,0,0,0,0|1,0,0]=3 5826 B8R0.1 CCCCC(=O)NCC Amb17787354 [0,2,0,0,0,0|1,0,0]=3 5827 B8R0.1 CCCCC(=O)NOC Amb24478571 [0,2,0,0,0,0|0,0,0]=2 5828 B8R0.1 CCCCC(=O)OC=C Amb17934207 [0,2,0,0,0,0|0,0,0]=2 5829 B8R0.1 CCCCC(=O)\C=C\Cl Amb24650002 [0,2,0,0,0,0|1,0,0]=3 5830 B8R0.1 CCCCC(=O)\C=C\S Amb24695018 [0,2,0,0,0,0|0,1,0]=3 5831 B8R0.1 CCCCC(Br)=CC=O Amb24540824 [0,2,0,0,0,0|1,0,0]=3 5832 B8R0.1 CCCCC(Br)=CCO Amb25163358 [0,2,0,0,0,0|1,0,0]=3 5833 B8R0.1 CCCCC(Br)COC Amb19062466 [0,2,0,0,0,0|1,0,1]=4 5834 B8R0.1 CCCCC(C)=C=CBr Amb25216939 [0,2,0,0,0,0|2,0,0]=4 5835 B8R0.1 CCCCC(C)=CC=O Amb24578506 [0,2,0,0,0,0|1,0,0]=3 5836 B8R0.1 CCCCC(C)=CCCl Amb24359596 [0,2,0,0,0,0|2,0,0]=4 5837 B8R0.1 CCCCC(C)=NNC Amb25225947 [0,2,0,0,0,0|2,0,0]=4 5838 B8R0.1 CCCCC(C)CC=O Amb18642676 [0,2,0,0,0,0|1,0,1]=4 5839 B8R0.1 CCCCC(C)CCO Amb22229364 [0,2,0,0,0,0|1,0,1]=4 5840 B8R0.1 CCCCC(C)N=C=O Amb24524293 [0,2,0,0,0,0|1,0,1]=4 5841 B8R0.1 CCCCC(C)NC=O Amb24562841 [0,2,0,0,0,0|1,0,1]=4 5842 B8R0.1 CCCCC(C)OC=O Amb22731654 [0,2,0,0,0,0|1,0,1]=4 5843 B8R0.1 CCCCC(C)OCO Amb24386900 [0,2,0,0,0,0|1,0,1]=4 5844 B8R0.1 CCCCC(C)\C=C\O Amb25747407 [0,2,0,0,0,0|1,0,1]=4 5845 B8R0.1 CCCCC(Cl)COC Amb18791840 [0,2,0,0,0,0|1,0,1]=4 5846 B8R0.1 CCCCC(Cl)OCC Amb25141240 [0,2,0,0,0,0|1,0,1]=4 5847 B8R0.1 CCCCC(N)CCO Amb18642854 [0,2,0,0,0,0|1,0,1]=4 5848 B8R0.1 CCCCC(N)CCO Amb24117271 [0,2,0,0,0,0|1,0,1]=4 5849 B8R0.1 CCCCC(N)COC Amb19374470 [0,2,0,0,0,0|1,0,1]=4 5850 B8R0.1 CCCCC(O)CC#N Amb18642535 [0,2,0,0,0,0|1,0,1]=4 5851 B8R0.1 CCCCC(O)CC=C Amb22052681 [0,2,0,0,0,0|1,0,1]=4 5852 B8R0.1 CCCCC(O)CCN Amb25784846 [0,2,0,0,0,0|1,0,1]=4 5853 B8R0.1 CCCCC(O)CCO Amb23456144 [0,2,0,0,0,0|0,0,2]=4 5854 B8R0.1 CCCCC(O)CNC Amb24351205 [0,2,0,0,0,0|1,0,1]=4 5855 B8R0.1 CCCCC(O)CNN Amb24735459 [0,2,0,0,0,0|1,0,1]=4 5856 B8R0.1 CCCCC(O)CSC Amb25790834 [0,2,0,0,0,0|0,1,1]=4 5857 B8R0.1 CCCCP(O)OCC Amb25675671 [0,2,0,0,0,0|1,0,1]=4 5858 B8R0.1 CCCCS(=O)CCCl Amb25809038 [0,2,0,0,0,0|2,0,0]=4 5859 B8R0.1 CCCCS(=O)CCN Amb24416134 [0,2,0,0,0,0|2,0,0]=4 5860 B8R0.1 CCCC[C@@H](C)CCO Amb24477883 [0,2,0,0,0,0|1,0,1]=4 5861 B8R0.1 CCCC[C@@H](C)N=C=O Amb22042694 [0,2,0,0,0,0|1,0,1]=4 5862 B8R0.1 CCCC[C@@H](N)CCO Amb22745144 [0,2,0,0,0,0|1,0,1]=4 5863 B8R0.1 CCCC[C@@H](N)CCO Amb22748774 [0,2,0,0,0,0|1,0,1]=4 5864 B8R0.1 CCCC[C@@H](O)CC=C Amb25698967 [0,2,0,0,0,0|1,0,1]=4 5865 B8R0.1 CCCC[C@@H](O)CCN Amb24716695 [0,2,0,0,0,0|1,0,1]=4 5866 B8R0.1 CCCC[C@@H](O)CCO Amb25185200 [0,2,0,0,0,0|0,0,2]=4 5867 B8R0.1 CCCC[C@@H](O)COC Amb24672476 [0,2,0,0,0,0|0,0,2]=4 5868 B8R0.1 CCCC[C@H](C)CC=O Amb25269517 [0,2,0,0,0,0|1,0,1]=4 5869 B8R0.1 CCCC[C@H](C)N=C=O Amb22042695 [0,2,0,0,0,0|1,0,1]=4 5870 B8R0.1 CCCC[C@H](O)CCO Amb25329636 [0,2,0,0,0,0|0,0,2]=4 5871 B8R0.1 CCCC[C@H](O)COC Amb25099350 [0,2,0,0,0,0|0,0,2]=4 5872 B8R0.1 CCCC\C(\Br)=C/C=O Amb18650691 [0,2,0,0,0,0|1,0,0]=3 5873 B8R0.1 CCCC\C(\C)=C/C=O Amb18642453 [0,2,0,0,0,0|1,0,0]=3 5874 B8R0.1 CCCC\C(\C)=C\C=O Amb25350233 [0,2,0,0,0,0|1,0,0]=3 5875 B8R0.1 CCCC\C(\C)=C\CN Amb25722291 [0,2,0,0,0,0|2,0,0]=4 5876 B8R0.1 CCCC\C(\O)=C\C=O Amb25103320 [0,2,0,0,0,0|0,0,0]=2 5877 B8R0.1 CCCNC(=O)CC#C Amb25343095 [0,2,0,0,0,0|2,0,0]=4 5878 B8R0.1 CCCNC(=O)CCBr Amb17333407 [0,2,0,0,0,0|2,0,0]=4 5879 B8R0.1 CCCNC(=O)CCCl Amb1128924 [0,2,0,0,0,0|2,0,0]=4 5880 B8R0.1 CCCNC(=O)CCN Amb1133966 [0,2,0,0,0,0|2,0,0]=4 5881 B8R0.1 CCCNC(=O)CCN Amb21957303 [0,2,0,0,0,0|2,0,0]=4 5882 B8R0.1 CCCNC(=O)CCO Amb17334123 [0,2,0,0,0,0|1,0,0]=3 5883 B8R0.1 CCCNC(=O)CNC Amb2370799 [0,2,0,0,0,0|2,0,0]=4 5884 B8R0.1 CCCNC(=O)CNO Amb24454974 [0,2,0,0,0,0|1,0,0]=3 5885 B8R0.1 CCCNC(=O)COC Amb22269187 [0,2,0,0,0,0|1,0,0]=3 5886 B8R0.1 CCCNC(=O)CON Amb24534199 [0,2,0,0,0,0|1,0,0]=3 5887 B8R0.1 CCCNC(=O)CSC Amb25145561 [0,2,0,0,0,0|1,1,0]=4 5888 B8R0.1 CCCNC(=O)NC=C Amb25836812 [0,2,0,0,0,0|2,0,0]=4 5889 B8R0.1 CCCNC(=O)NN=O Amb24699757 [0,2,0,0,0,0|1,0,1]=4 5890 B8R0.1 CCCNC(=O)OCC Amb17787091 [0,2,0,0,0,0|1,0,0]=3 5891 B8R0.1 CCCOC(=O)CC#C Amb25132621 [0,2,0,0,0,0|2,0,0]=4 5892 B8R0.1 CCCOC(=O)CC#N Amb16232992 [0,2,0,0,0,0|2,0,0]=4 5893 B8R0.1 CCCOC(=O)CC=O Amb24683609 [0,2,0,0,0,0|1,0,1]=4 5894 B8R0.1 CCCOC(=O)CCBr Amb25361170 [0,2,0,0,0,0|2,0,0]=4 5895 B8R0.1 CCCOC(=O)CCN Amb19409653 [0,2,0,0,0,0|2,0,0]=4 5896 B8R0.1 CCCOC(=O)CCO Amb22504631 [0,2,0,0,0,0|1,0,0]=3 5897 B8R0.1 CCCOC(=O)CCS Amb22053845 [0,2,0,0,0,0|1,1,0]=4 5898 B8R0.1 CCCOC(=O)CNN Amb24678012 [0,2,0,0,0,0|2,0,0]=4 5899 B8R0.1 CCCOC(=O)CSC Amb24471191 [0,2,0,0,0,0|1,1,0]=4 5900 B8R0.1 CCCOC(=O)N=C=O Amb25766484 [0,2,0,0,0,0|1,0,1]=4 5901 B8R0.1 CCCOC(=O)NC#N Amb25312948 [0,2,0,0,0,0|2,0,0]=4 5902 B8R0.1 CCCOC(=O)NCCl Amb25689686 [0,2,0,0,0,0|2,0,0]=4 5903 B8R0.1 CCCOC(=O)NCO Amb25082749 [0,2,0,0,0,0|1,0,0]=3 5904 B8R0.1 CCCOC(=O)OCCl Amb22054704 [0,2,0,0,0,0|1,0,0]=3 5905 B8R0.1 CCCOC(=O)OCI Amb25316012 [0,2,0,0,0,0|1,0,0]=3 5906 B8R0.1 CCCS(=O)CCCC Amb25173878 [0,2,0,0,0,0|2,0,0]=4 5907 B8R0.1 CCC[C@@H](O)CCCC Amb25266395 [0,2,0,0,0,0|1,0,1]=4 5908 B8R0.1 CCC\C=C(/C)\CC=O Amb25031857 [0,2,0,0,0,0|1,0,1]=4 5909 B8R0.1 CCC\C=C(\C)/CC=O Amb24550527 [0,2,0,0,0,0|1,0,1]=4 5910 B8R0.1 CCC\C=C(\C)/CCO Amb25681461 [0,2,0,0,0,0|1,0,1]=4 5911 B8R0.1 CCNC(=O)CCCS Amb25790014 [0,2,0,0,0,0|2,0,0]=4 5912 B8R0.1 CCNC(=O)CCOC Amb25027996 [0,2,0,0,0,0|2,0,0]=4 5913 B8R0.1 CCNC(=O)CCSC Amb24629856 [0,2,0,0,0,0|2,0,0]=4 5914 B8R0.1 CCNCC(=O)COC Amb25367078 [0,2,0,0,0,0|1,0,0]=3 5915 B8R0.1 CCNCC(=O)NC#N Amb25809015 [0,2,0,0,0,0|2,0,0]=4 5916 B8R0.1 CCOC(=N)CCCBr Amb20673080 [0,2,0,0,0,0|2,0,0]=4 5917 B8R0.1 CCOC(=N)CCNC Amb25367262 [0,2,0,0,0,0|2,0,0]=4 5918 B8R0.1 CCOC(=O)CCC#C Amb18636093 [0,2,0,0,0,0|0,0,2]=4 5919 B8R0.1 CCOC(=O)CCC=C Amb10601809 [0,2,0,0,0,0|0,0,2]=4 5920 B8R0.1 CCOC(=O)CCC=O Amb17593369 [0,2,0,0,0,0|1,0,1]=4 5921 B8R0.1 CCOC(=O)CCCF Amb24649863 [0,2,0,0,0,0|1,0,0]=3 5922 B8R0.1 CCOC(=O)CCCI Amb21520420 [0,2,0,0,0,0|1,0,0]=3 5923 B8R0.1 CCOC(=O)CCCO Amb22733346 [0,2,0,0,0,0|1,0,0]=3 5924 B8R0.1 CCOC(=O)CCNN Amb23504114 [0,2,0,0,0,0|2,0,0]=4 5925 B8R0.1 CCOC(=O)CCNN Amb24681733 [0,2,0,0,0,0|2,0,0]=4 5926 B8R0.1 CCOC(=O)CCON Amb24481776 [0,2,0,0,0,0|2,0,0]=4 5927 B8R0.1 CCOC(=O)CC[Zn]Br Amb22000404 [0,2,0,0,0,0|2,0,0]=4 5928 B8R0.1 CCOC(=O)CNCO Amb24693973 [0,2,0,0,0,0|2,0,0]=4 5929 B8R0.1 CCOC(=O)NCCN Amb18304505 [0,2,0,0,0,0|2,0,0]=4 5930 B8R0.1 CCOC(=O)NCCN Amb19290314 [0,2,0,0,0,0|2,0,0]=4 5931 B8R0.1 CCOC(=O)OCCBr Amb24480075 [0,2,0,0,0,0|2,0,0]=4 5932 B8R0.1 CCOC(=O)OCCCl Amb25369671 [0,2,0,0,0,0|2,0,0]=4 5933 B8R0.1 CCOC(=O)OCCN Amb25280455 [0,2,0,0,0,0|2,0,0]=4 5934 B8R0.1 CCOC(=O)SCCBr Amb25180551 [0,2,0,0,0,0|2,0,0]=4 5935 B8R0.1 CCOC(=O)\C=C\CC Amb22008263 [0,2,0,0,0,0|0,0,2]=4 5936 B8R0.1 CCOC(=S)NCCC Amb25146028 [0,2,0,0,0,0|1,1,0]=4 5937 B8R0.1 CCOC(N)=NCCC Amb25327214 [0,2,0,0,0,0|2,0,0]=4 5938 B8R0.1 CCOCC(=N)OCC Amb25095949 [0,2,0,0,0,0|2,0,0]=4 5939 B8R0.1 CCOCC(C)=CCO Amb25145312 [0,2,0,0,0,0|2,0,0]=4 5940 B8R0.1 CCOCC(O)CC=O Amb24611254 [0,2,0,0,0,0|1,0,1]=4 5941 B8R0.1 CCSC(=O)NCCC Amb25188916 [0,2,0,0,0,0|1,1,0]=4 5942 B8R0.1 CCSCC(=N)OCC Amb25236645 [0,2,0,0,0,0|2,0,0]=4 5943 B8R0.1 CCSCC(=O)CC#C Amb24520135 [0,2,0,0,0,0|2,0,0]=4 5944 B8R0.1 CCSCC(=O)COC Amb24643645 [0,2,0,0,0,0|1,0,0]=3 5945 B8R0.1 CCSCC(=O)NCC Amb25080742 [0,2,0,0,0,0|2,0,0]=4 5946 B8R0.1 CCSCC(C)=CCO Amb24396606 [0,2,0,0,0,0|2,0,0]=4 5947 B8R0.1 CCSCC(Cl)=CCO Amb25284515 [0,2,0,0,0,0|2,0,0]=4 5948 B8R0.1 CCSC\C(\C)=C/C=O Amb24723612 [0,2,0,0,0,0|2,0,0]=4 5949 B8R0.1 CCSC\C(\C)=C\C=O Amb24452203 [0,2,0,0,0,0|2,0,0]=4 5950 B8R0.1 CC\C=C\C(=O)C=CO Amb24690528 [0,2,0,0,0,0|0,0,2]=4 5951 B8R0.1 CNCCC(=O)NOC Amb25690170 [0,2,0,0,0,0|1,0,0]=3 5952 B8R0.1 COCC(=C)CCCN Amb25709741 [0,2,0,0,0,0|2,0,0]=4 5953 B8R0.1 COCC(=O)CCC=C Amb25341961 [0,2,0,0,0,0|0,0,2]=4 5954 B8R0.1 COCC(=O)CCCN Amb25291760 [0,2,0,0,0,0|1,0,0]=3 5955 B8R0.1 COCC(=O)CCSC Amb24625505 [0,2,0,0,0,0|1,0,0]=3 5956 B8R0.1 COCC(=O)COCC Amb24591446 [0,2,0,0,0,0|1,0,0]=3 5957 B8R0.1 COCC(=O)NCCN Amb1142190 [0,2,0,0,0,0|2,0,0]=4 5958 B8R0.1 COCC(=O)NCCO Amb25828239 [0,2,0,0,0,0|2,0,0]=4 5959 B8R0.1 COCC(=O)NOCC Amb25335272 [0,2,0,0,0,0|2,0,0]=4 5960 B8R0.1 COCC(=O)OCCC Amb20622000 [0,2,0,0,0,0|1,0,0]=3 5961 B8R0.1 COCC(=O)OCCF Amb25204548 [0,2,0,0,0,0|2,0,0]=4 5962 B8R0.1 COCCC(=N)OCC Amb25300008 [0,2,0,0,0,0|2,0,0]=4 5963 B8R0.1 COCCC(=O)CCCl Amb25077222 [0,2,0,0,0,0|2,0,0]=4 5964 B8R0.1 COCCC(=O)CSC Amb24457119 [0,2,0,0,0,0|1,1,0]=4 5965 B8R0.1 COCCC(=O)NC#N Amb24624552 [0,2,0,0,0,0|2,0,0]=4 5966 B8R0.1 COCCC(C)=NOC Amb25162580 [0,2,0,0,0,0|2,0,0]=4 5967 B8R0.1 COCOC(=O)COC Amb24672158 [0,2,0,0,0,0|2,0,0]=4 5968 B8R0.1 COCS(=O)CCCN Amb25068011 [0,2,0,0,0,0|2,0,0]=4 5969 B8R0.1 CON=C(C)COCC Amb25143707 [0,2,0,0,0,0|2,0,0]=4 5970 B8R0.1 CONC(=O)CCC#C Amb25720678 [0,2,0,0,0,0|0,0,2]=4 5971 B8R0.1 CONC(=O)CCCCl Amb25073130 [0,2,0,0,0,0|1,0,0]=3 5972 B8R0.1 CONC(=O)CCSC Amb25724779 [0,2,0,0,0,0|1,0,0]=3 5973 B8R0.1 CONCC(=O)OCC Amb25072690 [0,2,0,0,0,0|2,0,0]=4 5974 B8R0.1 CO\C=C(\C)/CCCO Amb25284497 [0,2,0,0,0,0|2,0,0]=4 5975 B8R0.1 CSCCC(=O)N=C=O Amb24701576 [0,2,0,0,0,0|1,0,1]=4 5976 B8R0.1 CSCCC(=O)NC#N Amb24746451 [0,2,0,0,0,0|2,0,0]=4 5977 B8R0.1 CSCCC(=O)ONN Amb24478796 [0,2,0,0,0,0|1,0,0]=3 5978 B8R0.1 C\C=C\C(=O)CCCBr Amb24479946 [0,2,0,0,0,0|2,0,0]=4 5979 B8R0.1 C\C=C\C(=O)CCCC Amb22043314 [0,2,0,0,0,0|1,0,0]=3 5980 B8R0.1 C\C=C\C(=O)COCC Amb25779716 [0,2,0,0,0,0|2,0,0]=4 5981 B8R0.1 C\C=C\C(=O)OCCC Amb22231396 [0,2,0,0,0,0|2,0,0]=4 5982 B8R0.1 C\C=C\CC(=O)OCC Amb24621820 [0,2,0,0,0,0|0,0,2]=4 5983 B8R0.1 C\C=C\[C@H](O)CCCC Amb25084504 [0,2,0,0,0,0|1,0,1]=4 5984 B8R0.1 ClCCCC(=O)N=C=O Amb17593678 [0,2,0,0,0,0|1,0,1]=4 5985 B8R0.1 ClCCCC(=O)NCC Amb1136094 [0,2,0,0,0,0|2,0,0]=4 5986 B8R0.1 ClCCCC(=O)OCC Amb1153203 [0,2,0,0,0,0|1,0,0]=3 5987 B8R0.1 ClCCNC(=O)OCC Amb10601693 [0,2,0,0,0,0|2,0,0]=4 5988 B8R0.1 N#CCCC(=O)OCCl Amb24562835 [0,2,0,0,0,0|1,0,1]=4 5989 B8R0.1 N#CNC(=O)CCCO Amb25677736 [0,2,0,0,0,0|2,0,0]=4 5990 B8R0.1 O=C(CCBr)CCCCl Amb24434557 [0,2,0,0,0,0|2,0,0]=4 5991 B8R0.1 O=C(CCCBr)N=C=S Amb25090251 [0,2,0,0,0,0|1,1,0]=4 5992 B8R0.1 O=C(CCCCl)N=C=S Amb25133802 [0,2,0,0,0,0|1,1,0]=4 5993 B8R0.1 OCCC(=O)NCCCl Amb25757022 [0,2,0,0,0,0|2,0,0]=4 5994 B8R0.1 OCCC(=O)NCCS Amb25756935 [0,2,0,0,0,0|2,0,0]=4 5995 B8R0.1 OCCCC(=O)NCC Amb17231872 [0,2,0,0,0,0|2,0,0]=4 5996 B8R0.1 OCCNC(=O)C=NO Amb24674203 [0,2,0,0,0,0|2,0,0]=4 5997 B8R0.1 [N-]=[N+]=NC(=O)CCCCl Amb25048963 [0,2,0,0,0,0|2,0,0]=4 5998 B8R0.3 CC(=CO)C(=O)CCC Amb24642051 [0,2,0,0,0,0|1,0,1]=4 5999 B8R0.3 CC(C(=O)NN)OCC Amb2081553 [0,2,0,0,0,0|2,0,0]=4 6000 B8R0.3 CC(C(=O)OC)CC#N Amb17334094 [0,2,0,0,0,0|1,0,1]=4 6001 B8R0.3 CC(C(=O)OC)CCCl Amb16230918 [0,2,0,0,0,0|1,0,0]=3 6002 B8R0.3 CC(C(CCC)O)C=O Amb17593375 [0,2,0,0,0,0|1,0,1]=4 6003 B8R0.3 CC(CC=C)C(=O)CO Amb25662371 [0,2,0,0,0,0|0,0,2]=4 6004 B8R0.3 CC(CCC)C(Cl)C=O Amb18643960 [0,2,0,0,0,0|1,0,1]=4 6005 B8R0.3 CC(CCC)C(F)C=O Amb24469379 [0,2,0,0,0,0|1,0,1]=4 6006 B8R0.3 CC(CCC)C(O)C=C Amb24461689 [0,2,0,0,0,0|1,0,1]=4 6007 B8R0.3 CC(CCC)C(O)C=O Amb25051559 [0,2,0,0,0,0|0,0,1]=3 6008 B8R0.3 CC(CCC)C(O)CN Amb24367529 [0,2,0,0,0,0|1,0,1]=4 6009 B8R0.3 CC(CCN)C(=O)C#C Amb25760304 [0,2,0,0,0,0|2,0,0]=4 6010 B8R0.3 CC(CCN)C(=O)C=C Amb25735659 [0,2,0,0,0,0|2,0,0]=4 6011 B8R0.3 CC(CCN)C(=O)CO Amb24478589 [0,2,0,0,0,0|1,0,0]=3 6012 B8R0.3 CC(CCN)C(=O)NO Amb24387287 [0,2,0,0,0,0|1,0,0]=3 6013 B8R0.3 CC(CCO)C(=O)NN Amb25084889 [0,2,0,0,0,0|2,0,0]=4 6014 B8R0.3 CC(CO)C(O)CCC Amb24554320 [0,2,0,0,0,0|1,0,1]=4 6015 B8R0.3 CC(NCC)C(O)C=O Amb25044487 [0,2,0,0,0,0|1,0,1]=4 6016 B8R0.3 CC(OC)C(N)CCC Amb24682154 [0,2,0,0,0,0|1,0,1]=4 6017 B8R0.3 CC(OC)[C@@H](N)CCC Amb25700484 [0,2,0,0,0,0|1,0,1]=4 6018 B8R0.3 CC(OC)[C@H](N)CCC Amb24382596 [0,2,0,0,0,0|1,0,1]=4 6019 B8R0.3 CCC(=O)C(C)CCN Amb18832550 [0,2,0,0,0,0|2,0,0]=4 6020 B8R0.3 CCC(=O)C(Cl)CCC Amb25708419 [0,2,0,0,0,0|1,0,0]=3 6021 B8R0.3 CCC(=O)C(F)CCC Amb25109187 [0,2,0,0,0,0|1,0,0]=3 6022 B8R0.3 CCC(=O)C(N)CCC Amb18203222 [0,2,0,0,0,0|1,0,0]=3 6023 B8R0.3 CCC(=O)N(O)CCC Amb24585325 [0,2,0,0,0,0|2,0,0]=4 6024 B8R0.3 CCC(=O)[C@H](C)CCC Amb24577767 [0,2,0,0,0,0|1,0,0]=3 6025 B8R0.3 CCC(=O)[C@H](F)CCC Amb25051344 [0,2,0,0,0,0|1,0,0]=3 6026 B8R0.3 CCCC(=C)C(=O)CC Amb25706643 [0,2,0,0,0,0|1,0,1]=4 6027 B8R0.3 CCCC(=C)C(=O)OC Amb25689366 [0,2,0,0,0,0|0,0,1]=3 6028 B8R0.3 CCCC(=O)C(=N)NO Amb25063289 [0,2,0,0,0,0|1,0,1]=4 6029 B8R0.3 CCCC(=O)C(=O)C#N Amb25334946 [0,2,0,0,0,0|1,0,1]=4 6030 B8R0.3 CCCC(=O)C(=O)C=C Amb24690817 [0,2,0,0,0,0|1,0,1]=4 6031 B8R0.3 CCCC(=O)C(=O)CBr Amb24753971 [0,2,0,0,0,0|1,0,1]=4 6032 B8R0.3 CCCC(=O)C(=O)OC Amb22755107 [0,2,0,0,0,0|0,0,1]=3 6033 B8R0.3 CCCC(=O)C(Br)=CO Amb25712107 [0,2,0,0,0,0|1,0,1]=4 6034 B8R0.3 CCCC(=O)\C(\O)=C\O Amb25032161 [0,2,0,0,0,0|0,0,2]=4 6035 B8R0.3 CCCC(Br)C(=O)OC Amb20621576 [0,2,0,0,0,0|0,0,0]=2 6036 B8R0.3 CCCC(Br)C(O)CO Amb25249200 [0,2,0,0,0,0|0,0,2]=4 6037 B8R0.3 CCCC(C(=O)CC)C Amb17593350 [0,2,0,0,0,0|1,0,0]=3 6038 B8R0.3 CCCC(C)C(=O)CBr Amb25075213 [0,2,0,0,0,0|1,0,0]=3 6039 B8R0.3 CCCC(C)C(=O)CCl Amb24568325 [0,2,0,0,0,0|1,0,0]=3 6040 B8R0.3 CCCC(C)C(=O)CN Amb25686985 [0,2,0,0,0,0|1,0,0]=3 6041 B8R0.3 CCCC(C)C(=O)CO Amb25134141 [0,2,0,0,0,0|0,0,0]=2 6042 B8R0.3 CCCC(C)C(F)=CO Amb25315656 [0,2,0,0,0,0|1,0,0]=3 6043 B8R0.3 CCCC(C)N(C)C=O Amb25713525 [0,2,0,0,0,0|2,0,0]=4 6044 B8R0.3 CCCC(Cl)=C(Cl)CO Amb25346249 [0,2,0,0,0,0|1,0,1]=4 6045 B8R0.3 CCCC(Cl)C(=O)NCl Amb24480013 [0,2,0,0,0,0|1,0,0]=3 6046 B8R0.3 CCCC(Cl)C(=O)OC Amb18182712 [0,2,0,0,0,0|0,0,0]=2 6047 B8R0.3 CCCC(Cl)C(Cl)CO Amb24400658 [0,2,0,0,0,0|1,0,1]=4 6048 B8R0.3 CCCC(Cl)C(O)CO Amb25320919 [0,2,0,0,0,0|0,0,2]=4 6049 B8R0.3 CCCC(Cl)\C(\C)=C\C Amb25109177 [0,2,0,0,0,0|2,0,0]=4 6050 B8R0.3 CCCC(F)C(O)CO Amb25057920 [0,2,0,0,0,0|0,0,2]=4 6051 B8R0.3 CCCC(N)C(=O)C#C Amb24376925 [0,2,0,0,0,0|1,0,0]=3 6052 B8R0.3 CCCC(N)C(=O)NN Amb24472604 [0,2,0,0,0,0|1,0,0]=3 6053 B8R0.3 CCCC(N)C(=O)NO Amb22059373 [0,2,0,0,0,0|0,0,0]=2 6054 B8R0.3 CCCC(N)C(=O)OC Amb21959980 [0,2,0,0,0,0|0,0,0]=2 6055 B8R0.3 CCCC(N)C(N)=NO Amb24749079 [0,2,0,0,0,0|1,0,0]=3 6056 B8R0.3 CCCC(N)C(O)=NO Amb20669260 [0,2,0,0,0,0|0,0,1]=3 6057 B8R0.3 CCCC(N)C(O)C=C Amb25811265 [0,2,0,0,0,0|1,0,1]=4 6058 B8R0.3 CCCC(N)C(O)CO Amb24469786 [0,2,0,0,0,0|0,0,2]=4 6059 B8R0.3 CCCC(O)=C(Br)C=O Amb25218270 [0,2,0,0,0,0|1,0,1]=4 6060 B8R0.3 CCCC(O)C(=C)C#N Amb18642324 [0,2,0,0,0,0|2,0,0]=4 6061 B8R0.3 CCCC(O)C(=N)OC Amb24430965 [0,2,0,0,0,0|1,0,0]=3 6062 B8R0.3 CCCC(O)C(=O)NN Amb25102133 [0,2,0,0,0,0|1,0,0]=3 6063 B8R0.3 CCCC(O)C(=O)OC Amb23454534 [0,2,0,0,0,0|0,0,0]=2 6064 B8R0.3 CCCC(O)C(=O)O[Na] Amb22360645 [0,2,0,0,0,0|0,0,0]=2 6065 B8R0.3 CCCC(O)C(Br)CO Amb24373842 [0,2,0,0,0,0|1,0,1]=4 6066 B8R0.3 CCCC(O)C(C)=C=C Amb24661101 [0,2,0,0,0,0|2,0,0]=4 6067 B8R0.3 CCCC(O)C(C)=CC Amb24355191 [0,2,0,0,0,0|2,0,0]=4 6068 B8R0.3 CCCC(O)C(Cl)=CF Amb25792416 [0,2,0,0,0,0|2,0,0]=4 6069 B8R0.3 CCCC(O)C(F)=CF Amb25284496 [0,2,0,0,0,0|2,0,0]=4 6070 B8R0.3 CCCC(O)C(F)CO Amb24372064 [0,2,0,0,0,0|1,0,1]=4 6071 B8R0.3 CCCC(O)C(N)CO Amb24478778 [0,2,0,0,0,0|1,0,1]=4 6072 B8R0.3 CCCC(O)C(O)CCl Amb24688488 [0,2,0,0,0,0|1,0,1]=4 6073 B8R0.3 CCCC(O)C(O)CN Amb25146191 [0,2,0,0,0,0|1,0,1]=4 6074 B8R0.3 CCCC(O)[C@H](N)CO Amb24476676 [0,2,0,0,0,0|1,0,1]=4 6075 B8R0.3 CCCN(C)C(=O)C#C Amb25080724 [0,2,0,0,0,0|2,0,0]=4 6076 B8R0.3 CCCN(C)C(=O)CO Amb25761673 [0,2,0,0,0,0|1,0,0]=3 6077 B8R0.3 CCCN(C)C(=O)OC Amb25044414 [0,2,0,0,0,0|1,0,0]=3 6078 B8R0.3 CCCN(O)C(=O)C=C Amb24561859 [0,2,0,0,0,0|2,0,0]=4 6079 B8R0.3 CCCN(O)C(=O)CCl Amb25259904 [0,2,0,0,0,0|2,0,0]=4 6080 B8R0.3 CCCN(O)C(=O)NC Amb24763884 [0,2,0,0,0,0|2,0,0]=4 6081 B8R0.3 CCCN(O)C(=O)OC Amb25214616 [0,2,0,0,0,0|1,0,0]=3 6082 B8R0.3 CCC[C@@H](C(=O)OC)N Amb10844887 [0,2,0,0,0,0|0,0,0]=2 6083 B8R0.3 CCC[C@@H](C)C(=O)C#C Amb24524205 [0,2,0,0,0,0|1,0,0]=3 6084 B8R0.3 CCC[C@@H](C)[C@@H](C)C=O Amb25239384 [0,2,0,0,0,0|1,0,1]=4 6085 B8R0.3 CCC[C@@H](F)[C@@H](O)CO Amb25077863 [0,2,0,0,0,0|0,0,2]=4 6086 B8R0.3 CCC[C@@H](N)C(=O)NC Amb25348827 [0,2,0,0,0,0|1,0,0]=3 6087 B8R0.3 CCC[C@@H](N)C(=O)OC Amb25146086 [0,2,0,0,0,0|0,0,0]=2 6088 B8R0.3 CCC[C@@H](N)[C@@H](O)C=C Amb25340837 [0,2,0,0,0,0|1,0,1]=4 6089 B8R0.3 CCC[C@@H](N)[C@@H](O)CO Amb25063932 [0,2,0,0,0,0|0,0,2]=4 6090 B8R0.3 CCC[C@@H](O)C(=C)C=C Amb25343864 [0,2,0,0,0,0|2,0,0]=4 6091 B8R0.3 CCC[C@@H](O)[C@@H](Br)CO Amb25362113 [0,2,0,0,0,0|1,0,1]=4 6092 B8R0.3 CCC[C@@H](O)[C@@H](N)CO Amb24120428 [0,2,0,0,0,0|1,0,1]=4 6093 B8R0.3 CCC[C@@H](O)[C@@H](O)CC Amb25763091 [0,2,0,0,0,0|1,0,1]=4 6094 B8R0.3 CCC[C@@H](O)[C@H](N)CO Amb24561952 [0,2,0,0,0,0|1,0,1]=4 6095 B8R0.3 CCC[C@@H](O)[C@H](O)CC Amb24532904 [0,2,0,0,0,0|1,0,1]=4 6096 B8R0.3 CCC[C@H](Cl)C(=O)OC Amb24480069 [0,2,0,0,0,0|0,0,0]=2 6097 B8R0.3 CCC[C@H](Cl)[C@@H](O)CO Amb25216999 [0,2,0,0,0,0|0,0,2]=4 6098 B8R0.3 CCC[C@H](N)C(=O)C=C Amb25200130 [0,2,0,0,0,0|1,0,0]=3 6099 B8R0.3 CCC[C@H](N)C(=O)NN Amb24465179 [0,2,0,0,0,0|1,0,0]=3 6100 B8R0.3 CCC[C@H](N)C(=O)NO Amb24460770 [0,2,0,0,0,0|0,0,0]=2 6101 B8R0.3 CCC[C@H](N)C(=O)OC Amb17942871 [0,2,0,0,0,0|0,0,0]=2 6102 B8R0.3 CCC[C@H](O)C(=O)OC Amb25318183 [0,2,0,0,0,0|0,0,0]=2 6103 B8R0.3 CCC[C@H](O)[C@@H](O)C=C Amb24623741 [0,2,0,0,0,0|1,0,1]=4 6104 B8R0.3 CCC[C@H](O)[C@H](N)CO Amb25113696 [0,2,0,0,0,0|1,0,1]=4 6105 B8R0.3 CCC[C@H](O)[C@H](O)C=C Amb25105997 [0,2,0,0,0,0|1,0,1]=4 6106 B8R0.3 CCC[C@H](O)[C@H](O)CO Amb25739608 [0,2,0,0,0,0|0,0,2]=4 6107 B8R0.3 CCC\C(\O)=C(/Br)\C=O Amb25309454 [0,2,0,0,0,0|1,0,1]=4 6108 B8R0.3 CCNC(=O)C(=O)NO Amb25757913 [0,2,0,0,0,0|1,0,1]=4 6109 B8R0.3 CCNC(C)C(=O)CCl Amb24655602 [0,2,0,0,0,0|2,0,0]=4 6110 B8R0.3 CCNC(C)C(=O)OC Amb19003120 [0,2,0,0,0,0|1,0,0]=3 6111 B8R0.3 CCNC(C)C(N)=NO Amb25147149 [0,2,0,0,0,0|2,0,0]=4 6112 B8R0.3 CCOC(=O)C(=O)CO Amb25333851 [0,2,0,0,0,0|1,0,1]=4 6113 B8R0.3 CCOC(=O)C(=O)O[K] Amb22043915 [0,2,0,0,0,0|1,0,1]=4 6114 B8R0.3 CCOC(C)C(=O)C#N Amb24536583 [0,2,0,0,0,0|2,0,0]=4 6115 B8R0.3 CCOC(C)C(=O)C=C Amb25720653 [0,2,0,0,0,0|2,0,0]=4 6116 B8R0.3 CCOC(C)C(=O)NC Amb25675822 [0,2,0,0,0,0|2,0,0]=4 6117 B8R0.3 CCOC(C)C(N)=NO Amb19515269 [0,2,0,0,0,0|2,0,0]=4 6118 B8R0.3 CCOC(O)C(=O)CBr Amb25702717 [0,2,0,0,0,0|2,0,0]=4 6119 B8R0.3 CCON(C)C(=O)CO Amb24631803 [0,2,0,0,0,0|2,0,0]=4 6120 B8R0.3 CCSC(C)C(=O)NC Amb25721048 [0,2,0,0,0,0|2,0,0]=4 6121 B8R0.3 CCSC(C)C(=O)OC Amb24457258 [0,2,0,0,0,0|1,0,0]=3 6122 B8R0.3 CC\C=C(/N)\C(=O)OC Amb24447011 [0,2,0,0,0,0|0,0,2]=4 6123 B8R0.3 CNC(=O)C(C)CNC Amb20623735 [0,2,0,0,0,0|2,0,0]=4 6124 B8R0.3 CNC(=O)C(C)COC Amb25059266 [0,2,0,0,0,0|2,0,0]=4 6125 B8R0.3 CNC(=O)C(Cl)COC Amb25276792 [0,2,0,0,0,0|2,0,0]=4 6126 B8R0.3 CNC(=O)C(N)COC Amb24466424 [0,2,0,0,0,0|2,0,0]=4 6127 B8R0.3 CNC(=O)C(O)CCO Amb24417912 [0,2,0,0,0,0|2,0,0]=4 6128 B8R0.3 CNC(=O)C(O)COC Amb24419361 [0,2,0,0,0,0|2,0,0]=4 6129 B8R0.3 CNC(=O)[C@@H](O)CCO Amb25272705 [0,2,0,0,0,0|2,0,0]=4 6130 B8R0.3 CNCC(Br)C(=O)OC Amb25711547 [0,2,0,0,0,0|1,0,0]=3 6131 B8R0.3 CNCC(C)C(=O)NN Amb24671128 [0,2,0,0,0,0|2,0,0]=4 6132 B8R0.3 CNCC(C)C(N)=NO Amb24707863 [0,2,0,0,0,0|2,0,0]=4 6133 B8R0.3 CNCC(Cl)C(=O)OC Amb25804470 [0,2,0,0,0,0|1,0,0]=3 6134 B8R0.3 CNCC(F)C(=O)OC Amb25365321 [0,2,0,0,0,0|1,0,0]=3 6135 B8R0.3 CNCC(I)C(=O)OC Amb25247168 [0,2,0,0,0,0|1,0,0]=3 6136 B8R0.3 COC(=N)C(C)COC Amb25102135 [0,2,0,0,0,0|2,0,0]=4 6137 B8R0.3 COC(=O)C(=C)CCBr Amb25190553 [0,2,0,0,0,0|1,0,1]=4 6138 B8R0.3 COC(=O)C(=N)OCC Amb24657206 [0,2,0,0,0,0|1,0,1]=4 6139 B8R0.3 COC(=O)C(=O)OCC Amb25245154 [0,2,0,0,0,0|1,0,1]=4 6140 B8R0.3 COC(=O)C(Br)CC=C Amb24529042 [0,2,0,0,0,0|0,0,2]=4 6141 B8R0.3 COC(=O)C(Br)CCO Amb25708416 [0,2,0,0,0,0|1,0,0]=3 6142 B8R0.3 COC(=O)C(C)CC#C Amb18115942 [0,2,0,0,0,0|0,0,2]=4 6143 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [0,2,0,0,0,0|1,0,1]=4 6144 B8R0.3 COC(=O)C(C)CNO Amb25698628 [0,2,0,0,0,0|2,0,0]=4 6145 B8R0.3 COC(=O)C(Cl)CC=C Amb25365264 [0,2,0,0,0,0|0,0,2]=4 6146 B8R0.3 COC(=O)C(Cl)CCN Amb25799672 [0,2,0,0,0,0|1,0,0]=3 6147 B8R0.3 COC(=O)C(Cl)CCO Amb25300346 [0,2,0,0,0,0|1,0,0]=3 6148 B8R0.3 COC(=O)C(Cl)CSC Amb25858109 [0,2,0,0,0,0|1,0,0]=3 6149 B8R0.3 COC(=O)C(Cl)CSCl Amb25690063 [0,2,0,0,0,0|2,0,0]=4 6150 B8R0.3 COC(=O)C(Cl)SCCl Amb24479992 [0,2,0,0,0,0|2,0,0]=4 6151 B8R0.3 COC(=O)C(F)CCN Amb22388532 [0,2,0,0,0,0|1,0,0]=3 6152 B8R0.3 COC(=O)C(N)CC#C Amb24426865 [0,2,0,0,0,0|0,0,2]=4 6153 B8R0.3 COC(=O)C(N)CC=C Amb18642703 [0,2,0,0,0,0|0,0,2]=4 6154 B8R0.3 COC(=O)C(N)CC=C Amb22757544 [0,2,0,0,0,0|0,0,2]=4 6155 B8R0.3 COC(=O)C(N)CCF Amb25066743 [0,2,0,0,0,0|1,0,0]=3 6156 B8R0.3 COC(=O)C(N)CCI Amb24689288 [0,2,0,0,0,0|1,0,0]=3 6157 B8R0.3 COC(=O)C(N)CCN Amb24113143 [0,2,0,0,0,0|1,0,0]=3 6158 B8R0.3 COC(=O)C(N)CCN Amb25733368 [0,2,0,0,0,0|1,0,0]=3 6159 B8R0.3 COC(=O)C(N)CCO Amb18305497 [0,2,0,0,0,0|1,0,0]=3 6160 B8R0.3 COC(=O)C(N)CCS Amb18304164 [0,2,0,0,0,0|1,0,0]=3 6161 B8R0.3 COC(=O)C(N)CNN Amb24469433 [0,2,0,0,0,0|2,0,0]=4 6162 B8R0.3 COC(=O)C(N)COC Amb23454660 [0,2,0,0,0,0|1,0,0]=3 6163 B8R0.3 COC(=O)C(N)CSC Amb19878256 [0,2,0,0,0,0|1,0,0]=3 6164 B8R0.3 COC(=O)C(N)CSC Amb22052594 [0,2,0,0,0,0|1,0,0]=3 6165 B8R0.3 COC(=O)C(N)CSCl Amb24629536 [0,2,0,0,0,0|2,0,0]=4 6166 B8R0.3 COC(=O)C(O)CC#N Amb25716720 [0,2,0,0,0,0|1,0,1]=4 6167 B8R0.3 COC(=O)C(O)CC=O Amb25357382 [0,2,0,0,0,0|1,0,1]=4 6168 B8R0.3 COC(=O)C(O)CCF Amb25114455 [0,2,0,0,0,0|1,0,0]=3 6169 B8R0.3 COC(=O)C(O)CCO Amb25846187 [0,2,0,0,0,0|1,0,0]=3 6170 B8R0.3 COC(=O)C(O)COC Amb23596463 [0,2,0,0,0,0|1,0,0]=3 6171 B8R0.3 COC(=O)C(O)CON Amb24360318 [0,2,0,0,0,0|2,0,0]=4 6172 B8R0.3 COC(=O)N(C)CCN Amb18975991 [0,2,0,0,0,0|2,0,0]=4 6173 B8R0.3 COC(=O)[C@@H](C)CC=O Amb25683366 [0,2,0,0,0,0|1,0,1]=4 6174 B8R0.3 COC(=O)[C@@H](C)C[Zn]Br Amb22336632 [0,2,0,0,0,0|2,0,0]=4 6175 B8R0.3 COC(=O)[C@@H](C)OCC Amb25113653 [0,2,0,0,0,0|1,0,0]=3 6176 B8R0.3 COC(=O)[C@@H](N)CC#C Amb22746034 [0,2,0,0,0,0|0,0,2]=4 6177 B8R0.3 COC(=O)[C@@H](N)CC#N Amb25292167 [0,2,0,0,0,0|1,0,1]=4 6178 B8R0.3 COC(=O)[C@@H](N)CC=C Amb22750599 [0,2,0,0,0,0|0,0,2]=4 6179 B8R0.3 COC(=O)[C@@H](N)CC=C Amb24120340 [0,2,0,0,0,0|0,0,2]=4 6180 B8R0.3 COC(=O)[C@@H](N)CCN Amb25727598 [0,2,0,0,0,0|1,0,0]=3 6181 B8R0.3 COC(=O)[C@@H](N)CCO Amb24183815 [0,2,0,0,0,0|1,0,0]=3 6182 B8R0.3 COC(=O)[C@@H](N)CCO Amb24746756 [0,2,0,0,0,0|1,0,0]=3 6183 B8R0.3 COC(=O)[C@@H](N)CCS Amb25679147 [0,2,0,0,0,0|1,0,0]=3 6184 B8R0.3 COC(=O)[C@@H](N)COC Amb24183609 [0,2,0,0,0,0|1,0,0]=3 6185 B8R0.3 COC(=O)[C@@H](O)CC=C Amb25146218 [0,2,0,0,0,0|0,0,2]=4 6186 B8R0.3 COC(=O)[C@@H](O)CCN Amb25146066 [0,2,0,0,0,0|1,0,0]=3 6187 B8R0.3 COC(=O)[C@H](C)CON Amb24604757 [0,2,0,0,0,0|2,0,0]=4 6188 B8R0.3 COC(=O)[C@H](C)C[Zn]Br Amb22336304 [0,2,0,0,0,0|2,0,0]=4 6189 B8R0.3 COC(=O)[C@H](Cl)CCN Amb24595014 [0,2,0,0,0,0|1,0,0]=3 6190 B8R0.3 COC(=O)[C@H](N)CC#N Amb24627258 [0,2,0,0,0,0|1,0,1]=4 6191 B8R0.3 COC(=O)[C@H](N)CC=C Amb24635550 [0,2,0,0,0,0|0,0,2]=4 6192 B8R0.3 COC(=O)[C@H](N)COC Amb24476668 [0,2,0,0,0,0|1,0,0]=3 6193 B8R0.3 COC(=O)[C@H](O)CC#C Amb24674438 [0,2,0,0,0,0|0,0,2]=4 6194 B8R0.3 COC(=O)[C@H](O)CCN Amb24476659 [0,2,0,0,0,0|1,0,0]=3 6195 B8R0.3 COCC(C(=O)OC)Br Amb10070673 [0,2,0,0,0,0|1,0,0]=3 6196 B8R0.3 COCC(C)C(=O)NN Amb25189246 [0,2,0,0,0,0|2,0,0]=4 6197 B8R0.3 COCC(C)C(Cl)=NO Amb25276568 [0,2,0,0,0,0|2,0,0]=4 6198 B8R0.3 COCC(N)C(=O)C#C Amb25264147 [0,2,0,0,0,0|2,0,0]=4 6199 B8R0.3 COCC(N)C(=O)C=C Amb24698409 [0,2,0,0,0,0|2,0,0]=4 6200 B8R0.3 COCC(N)C(=O)NN Amb24368965 [0,2,0,0,0,0|2,0,0]=4 6201 B8R0.3 COCC(O)C(=O)CO Amb25286582 [0,2,0,0,0,0|1,0,0]=3 6202 B8R0.3 COCC(O)C(=O)NN Amb24610375 [0,2,0,0,0,0|2,0,0]=4 6203 B8R0.3 COCC(O)C(O)C=O Amb25093758 [0,2,0,0,0,0|1,0,1]=4 6204 B8R0.3 COC[C@@H](O)[C@@H](O)C=O Amb24678218 [0,2,0,0,0,0|1,0,1]=4 6205 B8R0.3 COC[C@H](O)C(=O)CO Amb24422234 [0,2,0,0,0,0|1,0,0]=3 6206 B8R0.3 CSC[C@@H](C(=O)OC)N Amb15701265 [0,2,0,0,0,0|1,0,0]=3 6207 B8R0.3 CSC[C@@H](C(=O)OC)N Amb17322841 [0,2,0,0,0,0|1,0,0]=3 6208 B8R0.3 C[C@@H](CCC)[C@@H](O)CC Amb24733405 [0,2,0,0,0,0|1,0,1]=4 6209 B8R0.3 C[C@@H](CCC)[C@H](N)CO Amb25367220 [0,2,0,0,0,0|1,0,1]=4 6210 B8R0.3 C[C@@H](CCO)C(=O)NN Amb25215392 [0,2,0,0,0,0|2,0,0]=4 6211 B8R0.3 C[C@@H](CO)[C@H](O)CCC Amb24431343 [0,2,0,0,0,0|1,0,1]=4 6212 B8R0.3 C[C@H](CCC)[C@@H](O)C=C Amb25792419 [0,2,0,0,0,0|1,0,1]=4 6213 B8R0.3 C[C@H](CCC)[C@@H](O)CC Amb24704385 [0,2,0,0,0,0|1,0,1]=4 6214 B8R0.3 C[C@H](CCO)C(=O)NN Amb25741170 [0,2,0,0,0,0|2,0,0]=4 6215 B8R0.3 C[C@H](CO)[C@H](O)CCC Amb25806771 [0,2,0,0,0,0|1,0,1]=4 6216 B8R0.3 C[C@H](NCC)C(=O)NO Amb24700450 [0,2,0,0,0,0|1,0,0]=3 6217 B8R0.3 C\C(=C/CC)\C(=O)OC Amb22360680 [0,2,0,0,0,0|0,0,2]=4 6218 B8R0.3 C\C(=N/O)\C(=O)CCC Amb25114925 [0,2,0,0,0,0|1,0,1]=4 6219 B8R0.3 C\C(\C=O)=C(\O)/CCC Amb25313114 [0,2,0,0,0,0|1,0,1]=4 6220 B8R0.3 C\C=C/[C@@H](N)C(=O)OC Amb24744726 [0,2,0,0,0,0|0,0,2]=4 6221 B8R0.3 C\C=C\C(C)C(=O)CO Amb24723648 [0,2,0,0,0,0|0,0,2]=4 6222 B8R0.3 C\C=C\C(O)C(=O)OC Amb25091584 [0,2,0,0,0,0|0,0,2]=4 6223 B8R0.3 C\C=C\[C@H](O)C(=O)OC Amb24430980 [0,2,0,0,0,0|0,0,2]=4 6224 B8R0.3 N[C@H](CCO)[C@@H](O)C=O Amb24409981 [0,2,0,0,0,0|1,0,1]=4 6225 B8R0.3 OCC(=O)C(O)CC=O Amb25350826 [0,2,0,0,0,0|1,0,1]=4 6226 B8R0.3 OCC(=O)C(O)CCO Amb24364093 [0,2,0,0,0,0|1,0,0]=3 6227 B8R0.3 OCC(=O)[C@@H](O)CCO Amb25718359 [0,2,0,0,0,0|1,0,0]=3 6228 B8R0.3 OCCC(O)C(O)C=O Amb25694394 [0,2,0,0,0,0|1,0,1]=4 6229 B8R0.3 OCC[C@H](O)[C@H](O)C=O Amb25300385 [0,2,0,0,0,0|1,0,1]=4 6230 B8R0.6 BrCCCCC(=O)NC Amb17235862 [0,2,0,0,0,0|1,0,0]=3 6231 B8R0.6 C#CC(=O)CCCCO Amb25838830 [0,2,0,0,0,0|1,0,0]=3 6232 B8R0.6 C#CC(=O)NCCCN Amb18296191 [0,2,0,0,0,0|2,0,0]=4 6233 B8R0.6 C#CCCC\C(\N)=N\O Amb25084545 [0,2,0,0,0,0|1,0,1]=4 6234 B8R0.6 C=C(CCCC=O)C=O Amb25338086 [0,2,0,0,0,0|1,0,1]=4 6235 B8R0.6 C=C(CCCCBr)C=O Amb24480109 [0,2,0,0,0,0|1,0,0]=3 6236 B8R0.6 C=C(CCl)CCCCBr Amb24394731 [0,2,0,0,0,0|2,0,0]=4 6237 B8R0.6 C=C(CO)CCCCBr Amb24339522 [0,2,0,0,0,0|1,0,0]=3 6238 B8R0.6 C=C=CCCC(=O)OC Amb10605302 [0,2,0,0,0,0|0,0,2]=4 6239 B8R0.6 C=CC(=C)CCCCO Amb25281427 [0,2,0,0,0,0|2,0,0]=4 6240 B8R0.6 C=CC(=O)CCCCBr Amb24480228 [0,2,0,0,0,0|1,0,0]=3 6241 B8R0.6 C=CC(=O)CCCCCl Amb25711018 [0,2,0,0,0,0|1,0,0]=3 6242 B8R0.6 C=CC(=O)CCCCF Amb25743214 [0,2,0,0,0,0|1,0,0]=3 6243 B8R0.6 C=CC(=O)NCCCCl Amb25836279 [0,2,0,0,0,0|2,0,0]=4 6244 B8R0.6 C=CC(=O)NCCCN Amb18305779 [0,2,0,0,0,0|2,0,0]=4 6245 B8R0.6 C=CC(=O)OCCCF Amb22008270 [0,2,0,0,0,0|2,0,0]=4 6246 B8R0.6 C=CC(=O)OCCCN Amb24120374 [0,2,0,0,0,0|2,0,0]=4 6247 B8R0.6 C=CC(=O)OCCCO Amb22167329 [0,2,0,0,0,0|2,0,0]=4 6248 B8R0.6 C=CCCCC(=C)CO Amb25188985 [0,2,0,0,0,0|1,0,1]=4 6249 B8R0.6 C=CCCCC(=O)C#C Amb25251962 [0,2,0,0,0,0|1,0,1]=4 6250 B8R0.6 C=CCCCC(=O)C#N Amb25807418 [0,2,0,0,0,0|1,0,1]=4 6251 B8R0.6 C=CCCCC(=O)CO Amb25114937 [0,2,0,0,0,0|0,0,1]=3 6252 B8R0.6 C=CCCCC(=O)NN Amb24745072 [0,2,0,0,0,0|1,0,1]=4 6253 B8R0.6 C=CCCCC(=O)NN Amb25332027 [0,2,0,0,0,0|1,0,1]=4 6254 B8R0.6 C=CCCCC(=O)NO Amb25742329 [0,2,0,0,0,0|0,0,1]=3 6255 B8R0.6 CC#CCCC(=O)CC Amb25113725 [0,2,0,0,0,0|1,0,1]=4 6256 B8R0.6 CC#CCCC(=O)CN Amb25694472 [0,2,0,0,0,0|1,0,1]=4 6257 B8R0.6 CC#CCOC(=O)CO Amb25296198 [0,2,0,0,0,0|0,0,2]=4 6258 B8R0.6 CC(CCCCCl)C=O Amb24428839 [0,2,0,0,0,0|1,0,1]=4 6259 B8R0.6 CC(CCCCO)=NN Amb24475650 [0,2,0,0,0,0|2,0,0]=4 6260 B8R0.6 CC(CCCCO)C=O Amb25072654 [0,2,0,0,0,0|1,0,1]=4 6261 B8R0.6 CC(CO)CCCCBr Amb24649978 [0,2,0,0,0,0|1,0,1]=4 6262 B8R0.6 CC(CSCCO)=NO Amb25739741 [0,2,0,0,0,0|2,0,0]=4 6263 B8R0.6 CCC#CCC(=C)CO Amb25686334 [0,2,0,0,0,0|1,0,1]=4 6264 B8R0.6 CCC(=C)CCCCO Amb25057130 [0,2,0,0,0,0|2,0,0]=4 6265 B8R0.6 CCC(=C)CCCNC Amb25265577 [0,2,0,0,0,0|2,0,0]=4 6266 B8R0.6 CCC(=C)CCNCC Amb24472904 [0,2,0,0,0,0|2,0,0]=4 6267 B8R0.6 CCC(=O)CCCC#N Amb25139954 [0,2,0,0,0,0|1,0,1]=4 6268 B8R0.6 CCC(=O)CCCC=O Amb18642643 [0,2,0,0,0,0|1,0,1]=4 6269 B8R0.6 CCC(=O)CCCCF Amb25842980 [0,2,0,0,0,0|1,0,0]=3 6270 B8R0.6 CCC(=O)CCCCN Amb25757344 [0,2,0,0,0,0|1,0,0]=3 6271 B8R0.6 CCC(=O)CCCNC Amb24411172 [0,2,0,0,0,0|1,0,0]=3 6272 B8R0.6 CCC(=O)CCCSC Amb24433713 [0,2,0,0,0,0|1,0,0]=3 6273 B8R0.6 CCC(=O)COCCCl Amb25091814 [0,2,0,0,0,0|2,0,0]=4 6274 B8R0.6 CCC(=O)C\C=C\CC Amb25282725 [0,2,0,0,0,0|1,0,1]=4 6275 B8R0.6 CCC(=O)NCCCS Amb25081972 [0,2,0,0,0,0|2,0,0]=4 6276 B8R0.6 CCC(=O)NCCOC Amb17738048 [0,2,0,0,0,0|2,0,0]=4 6277 B8R0.6 CCC(=O)NCNCC Amb25146128 [0,2,0,0,0,0|2,0,0]=4 6278 B8R0.6 CCC(=O)NOCCC Amb25031184 [0,2,0,0,0,0|2,0,0]=4 6279 B8R0.6 CCC(=O)OCCCCl Amb25707031 [0,2,0,0,0,0|2,0,0]=4 6280 B8R0.6 CCC(=O)OCCCF Amb25345816 [0,2,0,0,0,0|2,0,0]=4 6281 B8R0.6 CCC(=O)OCCCI Amb25856256 [0,2,0,0,0,0|2,0,0]=4 6282 B8R0.6 CCC(=O)OCCCN Amb24652701 [0,2,0,0,0,0|2,0,0]=4 6283 B8R0.6 CCC(O)CCCCBr Amb25146987 [0,2,0,0,0,0|1,0,1]=4 6284 B8R0.6 CCC(O)CCCCF Amb25710820 [0,2,0,0,0,0|1,0,1]=4 6285 B8R0.6 CCC(O)CCCCN Amb24411425 [0,2,0,0,0,0|1,0,1]=4 6286 B8R0.6 CCC(O)CCSCC Amb24711817 [0,2,0,0,0,0|1,0,1]=4 6287 B8R0.6 CCCC#CC(=O)CC Amb25142621 [0,2,0,0,0,0|1,0,1]=4 6288 B8R0.6 CCCC=C=C(C)CO Amb25381424 [0,2,0,0,0,0|1,0,1]=4 6289 B8R0.6 CCCC=CC(=O)OC Amb24093828 [0,2,0,0,0,0|0,0,1]=3 6290 B8R0.6 CCCCCC(=C)C=O Amb18642442 [0,2,0,0,0,0|1,0,0]=3 6291 B8R0.6 CCCCCC(=C)CCl Amb24703635 [0,2,0,0,0,0|2,0,0]=4 6292 B8R0.6 CCCCCC(=C)CO Amb24556289 [0,2,0,0,0,0|1,0,0]=3 6293 B8R0.6 CCCCCC(=O)C#N Amb25767785 [0,2,0,0,0,0|1,0,0]=3 6294 B8R0.6 CCCCCC(=O)C=C Amb20671146 [0,2,0,0,0,0|1,0,0]=3 6295 B8R0.6 CCCCCC(=O)C=O Amb18642604 [0,2,0,0,0,0|0,0,1]=3 6296 B8R0.6 CCCCCC(=O)CBr Amb22276985 [0,2,0,0,0,0|1,0,0]=3 6297 B8R0.6 CCCCCC(=O)CCl Amb17593704 [0,2,0,0,0,0|1,0,0]=3 6298 B8R0.6 CCCCCC(=O)CI Amb22276984 [0,2,0,0,0,0|1,0,0]=3 6299 B8R0.6 CCCCCC(=O)CN Amb18642725 [0,2,0,0,0,0|1,0,0]=3 6300 B8R0.6 CCCCCC(=O)NC Amb24106949 [0,2,0,0,0,0|1,0,0]=3 6301 B8R0.6 CCCCCC(=O)SC Amb22168308 [0,2,0,0,0,0|0,1,0]=3 6302 B8R0.6 CCCCCC(C)=NO Amb22232375 [0,2,0,0,0,0|1,0,0]=3 6303 B8R0.6 CCCCCC(C)CO Amb21618749 [0,2,0,0,0,0|1,0,1]=4 6304 B8R0.6 CCCCCC(C)ON Amb25717019 [0,2,0,0,0,0|1,0,1]=4 6305 B8R0.6 CCCCCC(C=O)Br Amb17595055 [0,2,0,0,0,0|1,0,1]=4 6306 B8R0.6 CCCCCC(C=O)C Amb17593349 [0,2,0,0,0,0|1,0,1]=4 6307 B8R0.6 CCCCCC(Cl)=CCl Amb25124050 [0,2,0,0,0,0|2,0,0]=4 6308 B8R0.6 CCCCCC(Cl)=NO Amb25287496 [0,2,0,0,0,0|1,0,0]=3 6309 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [0,2,0,0,0,0|1,0,1]=4 6310 B8R0.6 CCCCCC(Cl)OC Amb24340104 [0,2,0,0,0,0|1,0,1]=4 6311 B8R0.6 CCCCCC(F)=CBr Amb24552014 [0,2,0,0,0,0|2,0,0]=4 6312 B8R0.6 CCCCCC(F)=CCl Amb24557827 [0,2,0,0,0,0|2,0,0]=4 6313 B8R0.6 CCCCCC(F)CO Amb24724495 [0,2,0,0,0,0|1,0,1]=4 6314 B8R0.6 CCCCCC(N)CO Amb24524295 [0,2,0,0,0,0|1,0,1]=4 6315 B8R0.6 CCCCCC(O)C=O Amb18642802 [0,2,0,0,0,0|0,0,1]=3 6316 B8R0.6 CCCCCC(O)CCl Amb21962884 [0,2,0,0,0,0|1,0,1]=4 6317 B8R0.6 CCCCCC(O)CF Amb22546481 [0,2,0,0,0,0|1,0,1]=4 6318 B8R0.6 CCCCCC(O)CO Amb22227711 [0,2,0,0,0,0|0,0,2]=4 6319 B8R0.6 CCCCCC(O)OC Amb25796374 [0,2,0,0,0,0|0,0,2]=4 6320 B8R0.6 CCCCCN(C)C=O Amb24524171 [0,2,0,0,0,0|2,0,0]=4 6321 B8R0.6 CCCCCN(C)OC Amb25295871 [0,2,0,0,0,0|2,0,0]=4 6322 B8R0.6 CCCCCN(N=O)C Amb10070585 [0,2,0,0,0,0|2,0,0]=4 6323 B8R0.6 CCCCC[C@@H](N)CO Amb24473164 [0,2,0,0,0,0|1,0,1]=4 6324 B8R0.6 CCCCC[C@@H](O)C=O Amb24653719 [0,2,0,0,0,0|0,0,1]=3 6325 B8R0.6 CCCCC[C@@H](O)CBr Amb24524540 [0,2,0,0,0,0|1,0,1]=4 6326 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,2,0,0,0,0|1,0,1]=4 6327 B8R0.6 CCCCC[C@@H](O)CCl Amb22736717 [0,2,0,0,0,0|1,0,1]=4 6328 B8R0.6 CCCCC[C@@H](O)CN Amb24476655 [0,2,0,0,0,0|1,0,1]=4 6329 B8R0.6 CCCCC[C@@H](O)CS Amb24735025 [0,2,0,0,0,0|0,1,1]=4 6330 B8R0.6 CCCCC[C@H](C)C=O Amb25717736 [0,2,0,0,0,0|1,0,1]=4 6331 B8R0.6 CCCCC[C@H](F)CO Amb25222193 [0,2,0,0,0,0|1,0,1]=4 6332 B8R0.6 CCCCC[C@H](O)C#N Amb24532826 [0,2,0,0,0,0|1,0,1]=4 6333 B8R0.6 CCCCC[C@H](O)CBr Amb24652638 [0,2,0,0,0,0|1,0,1]=4 6334 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,2,0,0,0,0|1,0,1]=4 6335 B8R0.6 CCCCC[C@H](O)CCl Amb22736718 [0,2,0,0,0,0|1,0,1]=4 6336 B8R0.6 CCCCC[C@H](O)CS Amb24748459 [0,2,0,0,0,0|0,1,1]=4 6337 B8R0.6 CCCCC\C(\C)=N\O Amb22338237 [0,2,0,0,0,0|1,0,0]=3 6338 B8R0.6 CCCCN=C(N)NCl Amb25836351 [0,2,0,0,0,0|2,0,0]=4 6339 B8R0.6 CCCCNC(=N)CCl Amb24477805 [0,2,0,0,0,0|2,0,0]=4 6340 B8R0.6 CCCCNC(=N)NBr Amb25363083 [0,2,0,0,0,0|2,0,0]=4 6341 B8R0.6 CCCCNC(=N)OC Amb25691671 [0,2,0,0,0,0|1,0,0]=3 6342 B8R0.6 CCCCNC(=O)C#C Amb25339961 [0,2,0,0,0,0|1,0,0]=3 6343 B8R0.6 CCCCNC(=O)CBr Amb17327510 [0,2,0,0,0,0|1,0,0]=3 6344 B8R0.6 CCCCNC(=O)CCl Amb1204239 [0,2,0,0,0,0|1,0,0]=3 6345 B8R0.6 CCCCNC(=O)CF Amb24585704 [0,2,0,0,0,0|1,0,0]=3 6346 B8R0.6 CCCCNC(=O)CI Amb23447330 [0,2,0,0,0,0|1,0,0]=3 6347 B8R0.6 CCCCNC(=O)CN Amb21958688 [0,2,0,0,0,0|1,0,0]=3 6348 B8R0.6 CCCCNC(=O)N=O Amb25825914 [0,2,0,0,0,0|0,0,1]=3 6349 B8R0.6 CCCCNC(=O)NC Amb1060752 [0,2,0,0,0,0|1,0,0]=3 6350 B8R0.6 CCCCNC(=S)NN Amb1104554 [0,2,0,0,0,0|1,1,0]=4 6351 B8R0.6 CCCCNC(=S)NO Amb10574487 [0,2,0,0,0,0|0,1,0]=3 6352 B8R0.6 CCCCNC(=S)OC Amb25757454 [0,2,0,0,0,0|0,1,0]=3 6353 B8R0.6 CCCCNC(=S)SC Amb24468347 [0,2,0,0,0,0|0,2,0]=4 6354 B8R0.6 CCCCNC(N)=NN Amb25090390 [0,2,0,0,0,0|2,0,0]=4 6355 B8R0.6 CCCCNC(N)=NO Amb24735707 [0,2,0,0,0,0|1,0,0]=3 6356 B8R0.6 CCCCNC(O)CC Amb25749396 [0,2,0,0,0,0|1,0,1]=4 6357 B8R0.6 CCCCOC(=C)C=O Amb18642623 [0,2,0,0,0,0|1,0,0]=3 6358 B8R0.6 CCCCOC(=C)CCl Amb25032095 [0,2,0,0,0,0|2,0,0]=4 6359 B8R0.6 CCCCOC(=N)C#N Amb24748600 [0,2,0,0,0,0|2,0,0]=4 6360 B8R0.6 CCCCOC(=O)C#C Amb25839203 [0,2,0,0,0,0|1,0,0]=3 6361 B8R0.6 CCCCOC(=O)C#N Amb25676361 [0,2,0,0,0,0|1,0,0]=3 6362 B8R0.6 CCCCOC(=O)C=C Amb22351622 [0,2,0,0,0,0|1,0,0]=3 6363 B8R0.6 CCCCOC(=O)CBr Amb10601879 [0,2,0,0,0,0|1,0,0]=3 6364 B8R0.6 CCCCOC(=O)CF Amb10838878 [0,2,0,0,0,0|1,0,0]=3 6365 B8R0.6 CCCCOC(=O)CN Amb19373374 [0,2,0,0,0,0|1,0,0]=3 6366 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [0,2,0,0,0,0|1,0,0]=3 6367 B8R0.6 CCCCOC(=O)NC Amb24680085 [0,2,0,0,0,0|1,0,0]=3 6368 B8R0.6 CCCCOC(=O)NN Amb25321437 [0,2,0,0,0,0|1,0,0]=3 6369 B8R0.6 CCCCOC(=S)NN Amb24710633 [0,2,0,0,0,0|1,1,0]=4 6370 B8R0.6 CCCCOC(C)C=O Amb18642805 [0,2,0,0,0,0|1,0,1]=4 6371 B8R0.6 CCCCOC(C)CO Amb24712962 [0,2,0,0,0,0|1,0,1]=4 6372 B8R0.6 CCCCOC(C)ON Amb25375946 [0,2,0,0,0,0|1,0,1]=4 6373 B8R0.6 CCCCOC(Cl)=CCl Amb25178995 [0,2,0,0,0,0|2,0,0]=4 6374 B8R0.6 CCCCOC(N)=NO Amb24555551 [0,2,0,0,0,0|1,0,0]=3 6375 B8R0.6 CCCCOC(O)CO Amb25144479 [0,2,0,0,0,0|0,0,2]=4 6376 B8R0.6 CCCCO[C@H](C)CO Amb24439158 [0,2,0,0,0,0|1,0,1]=4 6377 B8R0.6 CCCCSC(=C)CO Amb25716344 [0,2,0,0,0,0|1,0,0]=3 6378 B8R0.6 CCCCSC(C)C=O Amb18644295 [0,2,0,0,0,0|1,0,1]=4 6379 B8R0.6 CCCCSC(C)CO Amb24481648 [0,2,0,0,0,0|1,0,1]=4 6380 B8R0.6 CCCCSC(Cl)=CCl Amb24693917 [0,2,0,0,0,0|2,0,0]=4 6381 B8R0.6 CCCC\C=C(/C)\C=O Amb18642452 [0,2,0,0,0,0|1,0,0]=3 6382 B8R0.6 CCCC\C=C(/Cl)\CCl Amb25292215 [0,2,0,0,0,0|2,0,0]=4 6383 B8R0.6 CCCC\C=C(/F)\C=O Amb24378145 [0,2,0,0,0,0|1,0,0]=3 6384 B8R0.6 CCCC\C=C(\Br)/CO Amb24371336 [0,2,0,0,0,0|1,0,0]=3 6385 B8R0.6 CCCC\C=C(\C)/C=O Amb25785624 [0,2,0,0,0,0|1,0,0]=3 6386 B8R0.6 CCCC\C=C(\C)/CCl Amb25317209 [0,2,0,0,0,0|2,0,0]=4 6387 B8R0.6 CCCC\C=C(\C)/CO Amb24556106 [0,2,0,0,0,0|1,0,0]=3 6388 B8R0.6 CCCC\C=C(\F)/CCl Amb24528616 [0,2,0,0,0,0|2,0,0]=4 6389 B8R0.6 CCCNCC(=O)C#C Amb24680523 [0,2,0,0,0,0|1,0,0]=3 6390 B8R0.6 CCCNCC(=O)C=C Amb25215155 [0,2,0,0,0,0|1,0,0]=3 6391 B8R0.6 CCCNCC(=O)CC Amb24715612 [0,2,0,0,0,0|1,0,0]=3 6392 B8R0.6 CCCNCC(C)CO Amb24388936 [0,2,0,0,0,0|1,0,1]=4 6393 B8R0.6 CCCNCC(N)=NO Amb25147147 [0,2,0,0,0,0|1,0,0]=3 6394 B8R0.6 CCCNCC(O)C=C Amb24477690 [0,2,0,0,0,0|1,0,1]=4 6395 B8R0.6 CCCNC[C@H](O)CC Amb25146113 [0,2,0,0,0,0|1,0,1]=4 6396 B8R0.6 CCCOCC(=C)C=O Amb25198952 [0,2,0,0,0,0|1,0,0]=3 6397 B8R0.6 CCCOCC(=C)NN Amb24528399 [0,2,0,0,0,0|2,0,0]=4 6398 B8R0.6 CCCOCC(=N)NC Amb24340084 [0,2,0,0,0,0|2,0,0]=4 6399 B8R0.6 CCCOCC(=O)C#C Amb25698675 [0,2,0,0,0,0|1,0,0]=3 6400 B8R0.6 CCCOCC(=O)C=C Amb24360271 [0,2,0,0,0,0|1,0,0]=3 6401 B8R0.6 CCCOCC(=O)CO Amb24416729 [0,2,0,0,0,0|0,0,0]=2 6402 B8R0.6 CCCOCC(=O)NN Amb19960407 [0,2,0,0,0,0|1,0,0]=3 6403 B8R0.6 CCCOCC(=O)NO Amb25261947 [0,2,0,0,0,0|0,0,0]=2 6404 B8R0.6 CCCOCC(CO)O Amb10071476 [0,2,0,0,0,0|0,0,2]=4 6405 B8R0.6 CCCOCC(N)=NN Amb25710700 [0,2,0,0,0,0|2,0,0]=4 6406 B8R0.6 CCCOCC(N)CO Amb24681930 [0,2,0,0,0,0|1,0,1]=4 6407 B8R0.6 CCCOCC(O)C#C Amb24591414 [0,2,0,0,0,0|1,0,1]=4 6408 B8R0.6 CCCOCC(O)C=O Amb25217476 [0,2,0,0,0,0|0,0,1]=3 6409 B8R0.6 CCCOCN(C)C=O Amb24096760 [0,2,0,0,0,0|2,0,0]=4 6410 B8R0.6 CCCOC[C@@H](N)CO Amb25363717 [0,2,0,0,0,0|1,0,1]=4 6411 B8R0.6 CCCOC[C@@H](O)CN Amb24596176 [0,2,0,0,0,0|1,0,1]=4 6412 B8R0.6 CCCOC[C@@H](O)CO Amb25144456 [0,2,0,0,0,0|0,0,2]=4 6413 B8R0.6 CCCOC[C@H](O)CN Amb25032338 [0,2,0,0,0,0|1,0,1]=4 6414 B8R0.6 CCCONC(=O)C=C Amb25101856 [0,2,0,0,0,0|2,0,0]=4 6415 B8R0.6 CCCONC(=O)CN Amb24340270 [0,2,0,0,0,0|2,0,0]=4 6416 B8R0.6 CCCO\C=C(/C)\C=O Amb24679011 [0,2,0,0,0,0|1,0,1]=4 6417 B8R0.6 CCCSCC(=C)CC Amb25331591 [0,2,0,0,0,0|2,0,0]=4 6418 B8R0.6 CCCSCC(=C)CS Amb25222547 [0,2,0,0,0,0|1,1,0]=4 6419 B8R0.6 CCCSCC(=O)NN Amb25190080 [0,2,0,0,0,0|1,0,0]=3 6420 B8R0.6 CCCSCC(=O)NO Amb24457617 [0,2,0,0,0,0|0,0,0]=2 6421 B8R0.6 CCCSCC(C)OC Amb25344458 [0,2,0,0,0,0|1,0,1]=4 6422 B8R0.6 CCCSCC(Cl)=CCl Amb25317171 [0,2,0,0,0,0|2,0,0]=4 6423 B8R0.6 CCCSCC(O)CBr Amb24610498 [0,2,0,0,0,0|1,0,1]=4 6424 B8R0.6 CCCSCC(O)CCl Amb24709373 [0,2,0,0,0,0|1,0,1]=4 6425 B8R0.6 CCCSCC(O)CF Amb24573949 [0,2,0,0,0,0|1,0,1]=4 6426 B8R0.6 CCCSC[C@H](O)CC Amb25344752 [0,2,0,0,0,0|1,0,1]=4 6427 B8R0.6 CCCSC[C@H](O)CN Amb24431306 [0,2,0,0,0,0|1,0,1]=4 6428 B8R0.6 CCC\C=C\C(=N)NO Amb25305751 [0,2,0,0,0,0|1,0,1]=4 6429 B8R0.6 CCC\C=C\C(=O)C#C Amb25746662 [0,2,0,0,0,0|1,0,1]=4 6430 B8R0.6 CCC\C=C\C(=O)CCl Amb24633372 [0,2,0,0,0,0|1,0,1]=4 6431 B8R0.6 CCC\C=C\C(=O)CF Amb25288551 [0,2,0,0,0,0|1,0,1]=4 6432 B8R0.6 CCC\C=C\C(=O)NC Amb24744883 [0,2,0,0,0,0|1,0,1]=4 6433 B8R0.6 CCC\C=C\C(=O)NN Amb25852581 [0,2,0,0,0,0|1,0,1]=4 6434 B8R0.6 CCNCCC(=O)C=C Amb24550936 [0,2,0,0,0,0|1,0,0]=3 6435 B8R0.6 CCNCCC(=O)NO Amb25251897 [0,2,0,0,0,0|0,0,0]=2 6436 B8R0.6 CCNCCC(C)CO Amb24697609 [0,2,0,0,0,0|1,0,1]=4 6437 B8R0.6 CCNCCC(O)CO Amb24424060 [0,2,0,0,0,0|0,0,2]=4 6438 B8R0.6 CCNCC[C@H](O)CO Amb24478395 [0,2,0,0,0,0|0,0,2]=4 6439 B8R0.6 CCNCC\C(\N)=N/O Amb19981295 [0,2,0,0,0,0|1,0,0]=3 6440 B8R0.6 CCN\C=C\C(=O)OC Amb2386650 [0,2,0,0,0,0|0,0,2]=4 6441 B8R0.6 CCOCCC(=N)NC Amb25784909 [0,2,0,0,0,0|2,0,0]=4 6442 B8R0.6 CCOCCC(=O)CO Amb24478622 [0,2,0,0,0,0|0,0,0]=2 6443 B8R0.6 CCOCCC(=O)NC Amb25302984 [0,2,0,0,0,0|1,0,0]=3 6444 B8R0.6 CCOCCC(C)CO Amb25303340 [0,2,0,0,0,0|1,0,1]=4 6445 B8R0.6 CCOCCC(N)C=O Amb25743805 [0,2,0,0,0,0|1,0,1]=4 6446 B8R0.6 CCOCCC(N)CO Amb24388796 [0,2,0,0,0,0|1,0,1]=4 6447 B8R0.6 CCOCCC(O)C#N Amb25085640 [0,2,0,0,0,0|1,0,1]=4 6448 B8R0.6 CCOCCC(O)CN Amb25147160 [0,2,0,0,0,0|1,0,1]=4 6449 B8R0.6 CCOC\C=C(\C)/C=O Amb25218240 [0,2,0,0,0,0|1,0,1]=4 6450 B8R0.6 CCONCC(N)=NO Amb24495462 [0,2,0,0,0,0|2,0,0]=4 6451 B8R0.6 CCS(=O)CCCCO Amb24354490 [0,2,0,0,0,0|2,0,0]=4 6452 B8R0.6 CCS(=O)CCCNC Amb25188926 [0,2,0,0,0,0|2,0,0]=4 6453 B8R0.6 CCS(=O)CCNCC Amb24650548 [0,2,0,0,0,0|2,0,0]=4 6454 B8R0.6 CCSCCC(C)=NO Amb24672386 [0,2,0,0,0,0|1,0,0]=3 6455 B8R0.6 CCSCCC(N)CO Amb25820753 [0,2,0,0,0,0|1,0,1]=4 6456 B8R0.6 CCSCCC(O)C#C Amb24678288 [0,2,0,0,0,0|1,0,1]=4 6457 B8R0.6 CCSCCC(O)CN Amb24581930 [0,2,0,0,0,0|1,0,1]=4 6458 B8R0.6 CCSCCC(O)CO Amb24470380 [0,2,0,0,0,0|0,0,2]=4 6459 B8R0.6 CCSC\C=C(\C)/CO Amb24529088 [0,2,0,0,0,0|1,0,1]=4 6460 B8R0.6 CCS\C=C\C(=O)OC Amb24387094 [0,2,0,0,0,0|0,0,2]=4 6461 B8R0.6 CC\C=C\CC(=N)NO Amb24410051 [0,2,0,0,0,0|1,0,1]=4 6462 B8R0.6 CC\C=C\CC(=O)C=C Amb24574125 [0,2,0,0,0,0|1,0,1]=4 6463 B8R0.6 CC\C=C\CC(=O)CCl Amb24611212 [0,2,0,0,0,0|1,0,1]=4 6464 B8R0.6 CC\C=C\CC(=O)NC Amb25328971 [0,2,0,0,0,0|1,0,1]=4 6465 B8R0.6 CN(CCCCO)N=O Amb25709435 [0,2,0,0,0,0|2,0,0]=4 6466 B8R0.6 CNC(=O)CCCSC Amb18411875 [0,2,0,0,0,0|1,0,0]=3 6467 B8R0.6 CNC(=O)CCNOC Amb24608579 [0,2,0,0,0,0|2,0,0]=4 6468 B8R0.6 CNC(=O)CNCCF Amb24636629 [0,2,0,0,0,0|2,0,0]=4 6469 B8R0.6 CNC(=O)CNCCN Amb24456298 [0,2,0,0,0,0|2,0,0]=4 6470 B8R0.6 CNC(=O)CNOCC Amb25723721 [0,2,0,0,0,0|2,0,0]=4 6471 B8R0.6 CNC(=O)COCCCl Amb25844524 [0,2,0,0,0,0|2,0,0]=4 6472 B8R0.6 CNC(=O)COCCN Amb19016737 [0,2,0,0,0,0|2,0,0]=4 6473 B8R0.6 CNC(=O)COCCN Amb24271094 [0,2,0,0,0,0|2,0,0]=4 6474 B8R0.6 CNC(=O)CSCCCl Amb24742987 [0,2,0,0,0,0|2,0,0]=4 6475 B8R0.6 CNC(=O)CSCCS Amb24663591 [0,2,0,0,0,0|2,0,0]=4 6476 B8R0.6 CNC(=O)NCCCCl Amb13951257 [0,2,0,0,0,0|2,0,0]=4 6477 B8R0.6 CNC(=O)NCCCN Amb18908303 [0,2,0,0,0,0|2,0,0]=4 6478 B8R0.6 CNC(=O)NOCCC Amb25330024 [0,2,0,0,0,0|2,0,0]=4 6479 B8R0.6 CNC(=O)OCCCBr Amb24635809 [0,2,0,0,0,0|2,0,0]=4 6480 B8R0.6 CNC(=O)OCCCCl Amb25357949 [0,2,0,0,0,0|2,0,0]=4 6481 B8R0.6 CNCCCC(=O)NC Amb18303609 [0,2,0,0,0,0|1,0,0]=3 6482 B8R0.6 CNCCCC(=O)NC Amb22098814 [0,2,0,0,0,0|1,0,0]=3 6483 B8R0.6 CNCCCC(CO)C Amb17569924 [0,2,0,0,0,0|1,0,1]=4 6484 B8R0.6 CNCCCC(O)CO Amb25185204 [0,2,0,0,0,0|0,0,2]=4 6485 B8R0.6 CNCCCC(OC)C Amb17569936 [0,2,0,0,0,0|1,0,1]=4 6486 B8R0.6 CNCCCN(C)C=O Amb24644856 [0,2,0,0,0,0|2,0,0]=4 6487 B8R0.6 CNCCCN(C)N=O Amb24611717 [0,2,0,0,0,0|2,0,0]=4 6488 B8R0.6 CNCCCN(C)OC Amb25357801 [0,2,0,0,0,0|2,0,0]=4 6489 B8R0.6 CNCCC[C@@H](O)CO Amb24745507 [0,2,0,0,0,0|0,0,2]=4 6490 B8R0.6 CNCCC[C@H](O)CO Amb25747324 [0,2,0,0,0,0|0,0,2]=4 6491 B8R0.6 CNCCNC(=O)C#C Amb18523797 [0,2,0,0,0,0|2,0,0]=4 6492 B8R0.6 CNCCNC(=O)C=C Amb19027445 [0,2,0,0,0,0|2,0,0]=4 6493 B8R0.6 CNCCNC(=O)CC Amb18311203 [0,2,0,0,0,0|2,0,0]=4 6494 B8R0.6 CNCCNC(=O)CN Amb25321734 [0,2,0,0,0,0|2,0,0]=4 6495 B8R0.6 CNCCNC(=O)OC Amb19027453 [0,2,0,0,0,0|1,0,0]=3 6496 B8R0.6 COC(=N)CCCCCl Amb25300747 [0,2,0,0,0,0|1,0,0]=3 6497 B8R0.6 COC(=N)COCCC Amb25783562 [0,2,0,0,0,0|1,0,0]=3 6498 B8R0.6 COC(=O)C#CCCBr Amb25691842 [0,2,0,0,0,0|0,0,2]=4 6499 B8R0.6 COC(=O)C#CCCO Amb22230912 [0,2,0,0,0,0|0,0,2]=4 6500 B8R0.6 COC(=O)CCCC=C Amb22730759 [0,2,0,0,0,0|0,0,1]=3 6501 B8R0.6 COC(=O)CCCCN Amb18642844 [0,2,0,0,0,0|0,0,0]=2 6502 B8R0.6 COC(=O)CCCCO Amb22641583 [0,2,0,0,0,0|0,0,0]=2 6503 B8R0.6 COC(=O)CCCON Amb25266351 [0,2,0,0,0,0|1,0,0]=3 6504 B8R0.6 COC(=O)CCCSC Amb19878350 [0,2,0,0,0,0|0,0,0]=2 6505 B8R0.6 COC(=O)CCC[Zn]Br Amb22898091 [0,2,0,0,0,0|1,0,0]=3 6506 B8R0.6 COC(=O)CCN=[N+]=[N-] Amb22900901 [0,2,0,0,0,0|2,0,0]=4 6507 B8R0.6 COC(=O)CCNC=O Amb22234963 [0,2,0,0,0,0|1,0,1]=4 6508 B8R0.6 COC(=O)CNOCC Amb24739353 [0,2,0,0,0,0|1,0,0]=3 6509 B8R0.6 COC(=O)COCC=O Amb25094456 [0,2,0,0,0,0|1,0,1]=4 6510 B8R0.6 COC(=O)COCCN Amb24401799 [0,2,0,0,0,0|1,0,0]=3 6511 B8R0.6 COC(=O)COCCO Amb24113538 [0,2,0,0,0,0|1,0,0]=3 6512 B8R0.6 COC(=O)CSCCBr Amb25662052 [0,2,0,0,0,0|1,0,0]=3 6513 B8R0.6 COC(=O)CSCCCl Amb24340126 [0,2,0,0,0,0|1,0,0]=3 6514 B8R0.6 COC(=O)CSCCF Amb25821146 [0,2,0,0,0,0|1,0,0]=3 6515 B8R0.6 COC(=O)CSCCN Amb19268671 [0,2,0,0,0,0|1,0,0]=3 6516 B8R0.6 COC(=O)C\C=C\CCl Amb25084500 [0,2,0,0,0,0|0,0,2]=4 6517 B8R0.6 COC(=O)C\C=C\CN Amb25146041 [0,2,0,0,0,0|0,0,2]=4 6518 B8R0.6 COC(=O)C\C=C\CO Amb24404592 [0,2,0,0,0,0|0,0,2]=4 6519 B8R0.6 COC(=O)NCCC#C Amb24477847 [0,2,0,0,0,0|0,0,2]=4 6520 B8R0.6 COC(=O)NCCC=O Amb18642833 [0,2,0,0,0,0|1,0,1]=4 6521 B8R0.6 COC(=O)NCCSC Amb24379130 [0,2,0,0,0,0|1,0,0]=3 6522 B8R0.6 COC(=O)NCOCC Amb24606808 [0,2,0,0,0,0|1,0,0]=3 6523 B8R0.6 COC(=O)NOCCC Amb24381046 [0,2,0,0,0,0|1,0,0]=3 6524 B8R0.6 COC(=O)NOCCO Amb24570213 [0,2,0,0,0,0|2,0,0]=4 6525 B8R0.6 COC(=O)OCCCBr Amb25361096 [0,2,0,0,0,0|1,0,0]=3 6526 B8R0.6 COC(=O)OCCCF Amb24088642 [0,2,0,0,0,0|1,0,0]=3 6527 B8R0.6 COC(=O)SSCCN Amb24443106 [0,2,0,0,0,0|2,0,0]=4 6528 B8R0.6 COC(=O)\C=C\CCBr Amb22756459 [0,2,0,0,0,0|0,0,2]=4 6529 B8R0.6 COC(=O)\C=C\CCCl Amb24514923 [0,2,0,0,0,0|0,0,2]=4 6530 B8R0.6 COC(=O)\C=C\CSC Amb25710380 [0,2,0,0,0,0|0,0,2]=4 6531 B8R0.6 COC(=S)CCCCCl Amb25145676 [0,2,0,0,0,0|0,1,0]=3 6532 B8R0.6 COC(C)CCCCO Amb25835593 [0,2,0,0,0,0|1,0,1]=4 6533 B8R0.6 COCCCC(=N)OC Amb25127148 [0,2,0,0,0,0|1,0,0]=3 6534 B8R0.6 COCCCC(=O)C=C Amb24479926 [0,2,0,0,0,0|1,0,0]=3 6535 B8R0.6 COCCCC(C)=NN Amb25847725 [0,2,0,0,0,0|2,0,0]=4 6536 B8R0.6 COCCCC(C)CO Amb24478636 [0,2,0,0,0,0|1,0,1]=4 6537 B8R0.6 COCCCC(C)NO Amb24739871 [0,2,0,0,0,0|1,0,1]=4 6538 B8R0.6 COCCCC(N)=NN Amb25739824 [0,2,0,0,0,0|2,0,0]=4 6539 B8R0.6 COCCCC(O)C=O Amb25792325 [0,2,0,0,0,0|0,0,1]=3 6540 B8R0.6 COCCCC(O)CCl Amb24594734 [0,2,0,0,0,0|1,0,1]=4 6541 B8R0.6 COCCNC(=O)C#N Amb25084589 [0,2,0,0,0,0|2,0,0]=4 6542 B8R0.6 COCCNC(=O)CBr Amb2090677 [0,2,0,0,0,0|2,0,0]=4 6543 B8R0.6 COCCNC(=O)CCl Amb1151070 [0,2,0,0,0,0|2,0,0]=4 6544 B8R0.6 COCCNC(=O)CN Amb1155607 [0,2,0,0,0,0|2,0,0]=4 6545 B8R0.6 COCCNC(=O)CN Amb19515050 [0,2,0,0,0,0|2,0,0]=4 6546 B8R0.6 COCCNC(=O)NC Amb2132783 [0,2,0,0,0,0|2,0,0]=4 6547 B8R0.6 COCCOC(=O)CBr Amb18602737 [0,2,0,0,0,0|2,0,0]=4 6548 B8R0.6 COCCOC(=O)CCl Amb18090807 [0,2,0,0,0,0|2,0,0]=4 6549 B8R0.6 COCCOC(=O)NC Amb24598834 [0,2,0,0,0,0|2,0,0]=4 6550 B8R0.6 COCCO\C(\N)=N/O Amb24476699 [0,2,0,0,0,0|2,0,0]=4 6551 B8R0.6 COCCSC(=S)OC Amb25355506 [0,2,0,0,0,0|1,1,0]=4 6552 B8R0.6 COCOCC(=C)CO Amb24647254 [0,2,0,0,0,0|2,0,0]=4 6553 B8R0.6 COCOCC(=O)CC Amb24588919 [0,2,0,0,0,0|2,0,0]=4 6554 B8R0.6 COCOCC(=O)CCl Amb25106927 [0,2,0,0,0,0|2,0,0]=4 6555 B8R0.6 CSC(=O)NCCCO Amb24680355 [0,2,0,0,0,0|1,1,0]=4 6556 B8R0.6 CSC(=S)CCCCCl Amb25162182 [0,2,0,0,0,0|0,2,0]=4 6557 B8R0.6 CSCCCC(=O)NN Amb24618925 [0,2,0,0,0,0|1,0,0]=3 6558 B8R0.6 CSCCCC(=O)NO Amb25805629 [0,2,0,0,0,0|0,0,0]=2 6559 B8R0.6 CSCCCC(N)=NO Amb25324485 [0,2,0,0,0,0|1,0,0]=3 6560 B8R0.6 CSCCCC(O)C#C Amb24469508 [0,2,0,0,0,0|1,0,1]=4 6561 B8R0.6 CSCCCC(O)C#N Amb24610383 [0,2,0,0,0,0|1,0,1]=4 6562 B8R0.6 CSCCCC(O)C=C Amb25327172 [0,2,0,0,0,0|1,0,1]=4 6563 B8R0.6 CSCCCC(O)CN Amb25809175 [0,2,0,0,0,0|1,0,1]=4 6564 B8R0.6 CSCCCN(C)C=O Amb25784553 [0,2,0,0,0,0|2,0,0]=4 6565 B8R0.6 CSCCNC(=O)C#C Amb25758097 [0,2,0,0,0,0|2,0,0]=4 6566 B8R0.6 CSCCNC(=O)CBr Amb17324267 [0,2,0,0,0,0|2,0,0]=4 6567 B8R0.6 CSCCNC(=O)CN Amb24700731 [0,2,0,0,0,0|2,0,0]=4 6568 B8R0.6 CSCCOC(=O)C=C Amb17940077 [0,2,0,0,0,0|2,0,0]=4 6569 B8R0.6 CSCCOC(=O)CBr Amb24480366 [0,2,0,0,0,0|2,0,0]=4 6570 B8R0.6 CSCCOC(=O)CN Amb24386088 [0,2,0,0,0,0|2,0,0]=4 6571 B8R0.6 CSCCSC(=S)OC Amb25334460 [0,2,0,0,0,0|1,1,0]=4 6572 B8R0.6 CSCSCC(=O)NC Amb24516247 [0,2,0,0,0,0|2,0,0]=4 6573 B8R0.6 CSCSCC(=O)OC Amb25162165 [0,2,0,0,0,0|1,0,0]=3 6574 B8R0.6 C[C@H](CCCCO)CO Amb24407518 [0,2,0,0,0,0|1,0,1]=4 6575 B8R0.6 C[ClH]C(=O)CCCCBr Amb25242949 [0,2,0,0,0,0|1,0,0]=3 6576 B8R0.6 C\C(\CO)=C/CCCN Amb24555629 [0,2,0,0,0,0|1,0,1]=4 6577 B8R0.6 C\C(\CO)=C\CCCBr Amb25288077 [0,2,0,0,0,0|1,0,1]=4 6578 B8R0.6 C\C=C\CCC(=O)C=C Amb25179659 [0,2,0,0,0,0|1,0,1]=4 6579 B8R0.6 C\C=C\CCC(=O)NC Amb25339401 [0,2,0,0,0,0|1,0,1]=4 6580 B8R0.6 ClCCCNC(=O)CCl Amb2125567 [0,2,0,0,0,0|2,0,0]=4 6581 B8R0.6 F\C=C(\F)/CCCCBr Amb25180560 [0,2,0,0,0,0|2,0,0]=4 6582 B8R0.6 N#CC(O)CCCCBr Amb24739035 [0,2,0,0,0,0|1,0,1]=4 6583 B8R0.6 N#CCCCC(=O)CS Amb24378946 [0,2,0,0,0,0|0,1,1]=4 6584 B8R0.6 N#CCSCC(=O)NO Amb25740144 [0,2,0,0,0,0|1,0,1]=4 6585 B8R0.6 N#C[C@@H](O)CCCCBr Amb25361872 [0,2,0,0,0,0|1,0,1]=4 6586 B8R0.6 N#C[C@H](O)CCCCBr Amb25361107 [0,2,0,0,0,0|1,0,1]=4 6587 B8R0.6 NC(CCCCO)=NO Amb25250686 [0,2,0,0,0,0|1,0,0]=3 6588 B8R0.6 NC(CNCCO)=NO Amb24620471 [0,2,0,0,0,0|2,0,0]=4 6589 B8R0.6 NC(CO)CCCCF Amb24689590 [0,2,0,0,0,0|1,0,1]=4 6590 B8R0.6 NCC(=O)NCCCF Amb24659357 [0,2,0,0,0,0|2,0,0]=4 6591 B8R0.6 NCC(=O)NCCCO Amb21953700 [0,2,0,0,0,0|2,0,0]=4 6592 B8R0.6 NCCCCC(=O)NN Amb18061874 [0,2,0,0,0,0|1,0,0]=3 6593 B8R0.6 NCCCCC(=O)NO Amb24333337 [0,2,0,0,0,0|0,0,0]=2 6594 B8R0.6 NCCCCC(=O)OC Amb13951283 [0,2,0,0,0,0|0,0,0]=2 6595 B8R0.6 NCCCCC(O)CN Amb25237523 [0,2,0,0,0,0|1,0,1]=4 6596 B8R0.6 NCCCCC(O)CO Amb25146035 [0,2,0,0,0,0|0,0,2]=4 6597 B8R0.6 NCCCCC(OC)C Amb17569941 [0,2,0,0,0,0|1,0,1]=4 6598 B8R0.6 NCCCC[C@@H](N)CO Amb22745902 [0,2,0,0,0,0|1,0,1]=4 6599 B8R0.6 NCCCC[C@@H](N)CO Amb22899644 [0,2,0,0,0,0|1,0,1]=4 6600 B8R0.6 NCCCC[C@@H](N)CO Amb22899645 [0,2,0,0,0,0|1,0,1]=4 6601 B8R0.6 NCCCNC(=O)CCl Amb19011378 [0,2,0,0,0,0|2,0,0]=4 6602 B8R0.6 NCCCNC(=O)CN Amb19011430 [0,2,0,0,0,0|2,0,0]=4 6603 B8R0.6 NCCSCC(=O)NN Amb25132244 [0,2,0,0,0,0|2,0,0]=4 6604 B8R0.6 NNC(=O)CNCCO Amb18115220 [0,2,0,0,0,0|2,0,0]=4 6605 B8R0.6 NNC(=O)COCCO Amb24674170 [0,2,0,0,0,0|2,0,0]=4 6606 B8R0.6 NNC(=O)OCCCO Amb24365593 [0,2,0,0,0,0|2,0,0]=4 6607 B8R0.6 N[C@@H](CCCCO)CO Amb25146173 [0,2,0,0,0,0|1,0,1]=4 6608 B8R0.6 O=C(CBr)CCCCCl Amb25339355 [0,2,0,0,0,0|1,0,0]=3 6609 B8R0.6 O=C(CBr)OCCCCl Amb25117915 [0,2,0,0,0,0|2,0,0]=4 6610 B8R0.6 O=C(CCl)NCCCBr Amb25766846 [0,2,0,0,0,0|2,0,0]=4 6611 B8R0.6 O=C(CS)NCCCS Amb24393457 [0,2,0,0,0,0|1,1,0]=4 6612 B8R0.6 O=CCCCC(=O)C=O Amb25093725 [0,2,0,0,0,0|0,0,2]=4 6613 B8R0.6 OC(CCCC=O)C=O Amb18642788 [0,2,0,0,0,0|0,0,2]=4 6614 B8R0.6 OCC(F)CCCCCl Amb24480364 [0,2,0,0,0,0|1,0,1]=4 6615 B8R0.6 OCCCCC(=O)NC Amb17231874 [0,2,0,0,0,0|1,0,0]=3 6616 B8R0.6 OCCCCC(C#N)O Amb17593356 [0,2,0,0,0,0|1,0,1]=4 6617 B8R0.6 OCCCCC(CO)N Amb17593402 [0,2,0,0,0,0|1,0,1]=4 6618 B8R0.6 OCCCC[C@@H](O)CO Amb25800817 [0,2,0,0,0,0|0,0,2]=4 6619 B8R0.6 OCCCNC(=O)CBr Amb17329705 [0,2,0,0,0,0|2,0,0]=4 6620 B8R0.6 OCCCNC(=O)CS Amb24671061 [0,2,0,0,0,0|1,1,0]=4 6621 B8R0.6 OCCCOC(=O)CBr Amb25300340 [0,2,0,0,0,0|2,0,0]=4 6622 B8R0.6 OCCNNC(=O)CO Amb25823052 [0,2,0,0,0,0|2,0,0]=4 6623 B8R0.6 OCCOCC(=O)CO Amb25357331 [0,2,0,0,0,0|1,0,0]=3 6624 B8R0.6 OCCSCC(=O)C=O Amb25857344 [0,2,0,0,0,0|1,0,1]=4 6625 B8R0.6 OC[C@@H](F)CCCCCl Amb25068378 [0,2,0,0,0,0|1,0,1]=4 6626 B8R0.6 [C-]#[N+]CCNC(=O)OC Amb24728450 [0,2,0,0,0,0|1,0,1]=4 6627 B8R0.8 C#CCCC(=O)C(O)=O Amb24657416 [0,2,0,0,0,0|0,0,2]=4 6628 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [0,2,0,0,0,0|1,0,1]=4 6629 B8R0.8 C#CCC[C@@H](N)C(N)=O Amb25368154 [0,2,0,0,0,0|1,0,1]=4 6630 B8R0.8 C#CCC[C@@H](N)C(O)=O Amb24088809 [0,2,0,0,0,0|0,0,1]=3 6631 B8R0.8 C#CCC[C@H](N)C(O)=O Amb24088866 [0,2,0,0,0,0|0,0,1]=3 6632 B8R0.8 C=C(CCC=C)C(O)=O Amb18642395 [0,2,0,0,0,0|0,0,2]=4 6633 B8R0.8 C=C(CCCN)C(O)=O Amb18642697 [0,2,0,0,0,0|0,0,1]=3 6634 B8R0.8 C=C(CCON)C(O)=O Amb25859256 [0,2,0,0,0,0|1,0,1]=4 6635 B8R0.8 C=C=CCC(N)C(O)=O Amb25843448 [0,2,0,0,0,0|0,0,2]=4 6636 B8R0.8 C=C=CC[C@H](N)C(O)=O Amb24355608 [0,2,0,0,0,0|0,0,2]=4 6637 B8R0.8 C=CCCC(=O)C(O)=O Amb25738669 [0,2,0,0,0,0|0,0,2]=4 6638 B8R0.8 C=CCCC(Cl)C(O)=O Amb25041973 [0,2,0,0,0,0|0,0,1]=3 6639 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [0,2,0,0,0,0|1,0,1]=4 6640 B8R0.8 C=CCCC(N)C(O)=O Amb24383848 [0,2,0,0,0,0|0,0,1]=3 6641 B8R0.8 C=CCC[C@@H](N)C(O)=O Amb23439045 [0,2,0,0,0,0|0,0,1]=3 6642 B8R0.8 C=CCOC(F)C(O)=O Amb24478688 [0,2,0,0,0,0|0,0,2]=4 6643 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [0,2,0,0,0,0|1,0,1]=4 6644 B8R0.8 CC#CCC(N)C(O)=O Amb18988250 [0,2,0,0,0,0|0,0,1]=3 6645 B8R0.8 CC#CCC(O)C(O)=O Amb25213344 [0,2,0,0,0,0|0,0,1]=3 6646 B8R0.8 CC#CC[C@@H](C)C(O)=O Amb24589724 [0,2,0,0,0,0|0,0,1]=3 6647 B8R0.8 CC#CC[C@@H](N)C(N)=O Amb25324867 [0,2,0,0,0,0|1,0,1]=4 6648 B8R0.8 CC#CC[C@@H](N)C(O)=O Amb22746783 [0,2,0,0,0,0|0,0,1]=3 6649 B8R0.8 CC#CC[C@H](O)C(C)=O Amb24340259 [0,2,0,0,0,0|1,0,1]=4 6650 B8R0.8 CC(=C)C(=O)CCCCl Amb24618121 [0,2,0,0,0,0|2,0,0]=4 6651 B8R0.8 CC(=C)C(=O)CCNC Amb24671028 [0,2,0,0,0,0|2,0,0]=4 6652 B8R0.8 CC(=C)C(=O)CCOC Amb24399603 [0,2,0,0,0,0|2,0,0]=4 6653 B8R0.8 CC(=C)C(=O)CCSC Amb25830271 [0,2,0,0,0,0|2,0,0]=4 6654 B8R0.8 CC(=C)C(=O)CNCC Amb24460074 [0,2,0,0,0,0|2,0,0]=4 6655 B8R0.8 CC(=C)C(=O)COCC Amb24478676 [0,2,0,0,0,0|2,0,0]=4 6656 B8R0.8 CC(=C)C(=O)OCCC Amb17933169 [0,2,0,0,0,0|2,0,0]=4 6657 B8R0.8 CC(=C)C(Br)CCCCl Amb25240770 [0,2,0,0,0,0|2,0,0]=4 6658 B8R0.8 CC(=C)C(O)CCCCl Amb24417085 [0,2,0,0,0,0|2,0,0]=4 6659 B8R0.8 CC(=CCCF)C(O)=O Amb24359141 [0,2,0,0,0,0|0,0,2]=4 6660 B8R0.8 CC(=NCCC)C(N)=O Amb25372262 [0,2,0,0,0,0|1,0,1]=4 6661 B8R0.8 CC(=O)C(=C)COCC Amb25202647 [0,2,0,0,0,0|1,0,1]=4 6662 B8R0.8 CC(=O)C(=O)CSCC Amb24378469 [0,2,0,0,0,0|1,0,1]=4 6663 B8R0.8 CC(=O)C(=O)OCCC Amb25838665 [0,2,0,0,0,0|1,0,1]=4 6664 B8R0.8 CC(=O)C(Br)CCCO Amb25146214 [0,2,0,0,0,0|1,0,0]=3 6665 B8R0.8 CC(=O)C(Cl)CCC#N Amb25116247 [0,2,0,0,0,0|1,0,1]=4 6666 B8R0.8 CC(=O)C(Cl)CCCCl Amb24340131 [0,2,0,0,0,0|1,0,0]=3 6667 B8R0.8 CC(=O)C(Cl)OCCO Amb25696998 [0,2,0,0,0,0|2,0,0]=4 6668 B8R0.8 CC(=O)C(O)CCCO Amb24364072 [0,2,0,0,0,0|1,0,0]=3 6669 B8R0.8 CC(=O)\C(\Cl)=C\CCC Amb24388360 [0,2,0,0,0,0|1,0,1]=4 6670 B8R0.8 CC(C(=O)O)CNCC Amb13952782 [0,2,0,0,0,0|0,0,0]=2 6671 B8R0.8 CC(C(=O)O)SCCN Amb17500447 [0,2,0,0,0,0|1,0,0]=3 6672 B8R0.8 CC(C(=S)N)CNCC Amb17232021 [0,2,0,0,0,0|1,1,0]=4 6673 B8R0.8 CC(C)=C(C)CCCC Amb22228294 [0,2,0,0,0,0|2,0,0]=4 6674 B8R0.8 CC(C)C(=O)CCCBr Amb25059196 [0,2,0,0,0,0|2,0,0]=4 6675 B8R0.8 CC(C)C(=O)CCCCl Amb24340262 [0,2,0,0,0,0|2,0,0]=4 6676 B8R0.8 CC(C)C(=O)CCCF Amb25736515 [0,2,0,0,0,0|2,0,0]=4 6677 B8R0.8 CC(C)C(=O)CCCO Amb25077525 [0,2,0,0,0,0|2,0,0]=4 6678 B8R0.8 CC(C)[C@@H](O)CCCC Amb24704256 [0,2,0,0,0,0|1,0,1]=4 6679 B8R0.8 CC(CCC#N)C(N)=O Amb18642432 [0,2,0,0,0,0|1,0,1]=4 6680 B8R0.8 CC(CCC#N)C(O)=O Amb24462559 [0,2,0,0,0,0|0,0,1]=3 6681 B8R0.8 CC(CCC=C)C(O)=O Amb18642656 [0,2,0,0,0,0|0,0,1]=3 6682 B8R0.8 CC(CCC=O)C(C)=O Amb18642650 [0,2,0,0,0,0|1,0,1]=4 6683 B8R0.8 CC(CCC=O)C(O)=O Amb18642767 [0,2,0,0,0,0|0,0,1]=3 6684 B8R0.8 CC(CCCBr)C(=O)Cl Amb24722839 [0,2,0,0,0,0|1,0,0]=3 6685 B8R0.8 CC(CCCBr)C(C)=O Amb25362168 [0,2,0,0,0,0|1,0,0]=3 6686 B8R0.8 CC(CCCBr)C(O)=O Amb25321670 [0,2,0,0,0,0|0,0,0]=2 6687 B8R0.8 CC(CCCF)C(O)=O Amb25244585 [0,2,0,0,0,0|0,0,0]=2 6688 B8R0.8 CC(CCCN)C(C)=O Amb25774001 [0,2,0,0,0,0|1,0,0]=3 6689 B8R0.8 CC(CCCN)C(O)=O Amb25146072 [0,2,0,0,0,0|0,0,0]=2 6690 B8R0.8 CC(CCCO)C(=O)S Amb25221473 [0,2,0,0,0,0|0,1,0]=3 6691 B8R0.8 CC(CCCS)C(C)=O Amb25807409 [0,2,0,0,0,0|1,0,0]=3 6692 B8R0.8 CC(CN=[N+]=[N-])C(O)=O Amb25786485 [0,2,0,0,0,0|2,0,0]=4 6693 B8R0.8 CC(CNC=O)C(O)=O Amb18299693 [0,2,0,0,0,0|1,0,1]=4 6694 B8R0.8 CC(N)C(O)CCCC Amb25145481 [0,2,0,0,0,0|1,0,1]=4 6695 B8R0.8 CC(NCCCl)C(O)=O Amb25145942 [0,2,0,0,0,0|1,0,0]=3 6696 B8R0.8 CC(NCCN)C(O)=O Amb18523860 [0,2,0,0,0,0|1,0,0]=3 6697 B8R0.8 CC(NCCO)C(C)=O Amb18627404 [0,2,0,0,0,0|2,0,0]=4 6698 B8R0.8 CC(O)C(=O)CCC#C Amb25298620 [0,2,0,0,0,0|0,0,2]=4 6699 B8R0.8 CC(O)C(=O)CCC=C Amb25137415 [0,2,0,0,0,0|0,0,2]=4 6700 B8R0.8 CC(O)C(=O)NCCF Amb24393789 [0,2,0,0,0,0|2,0,0]=4 6701 B8R0.8 CC(O)C(=O)NCCN Amb24611735 [0,2,0,0,0,0|2,0,0]=4 6702 B8R0.8 CC(O)C(=O)OCCO Amb24061251 [0,2,0,0,0,0|2,0,0]=4 6703 B8R0.8 CC(O)C(N)CCCC Amb24351619 [0,2,0,0,0,0|1,0,1]=4 6704 B8R0.8 CC(O)C(O)CCCC Amb25128970 [0,2,0,0,0,0|0,0,2]=4 6705 B8R0.8 CC(O)C(O)COCC Amb25297486 [0,2,0,0,0,0|1,0,1]=4 6706 B8R0.8 CC(OCCCl)C(O)=O Amb24481693 [0,2,0,0,0,0|1,0,0]=3 6707 B8R0.8 CC(OCCN)C(C)=O Amb18111235 [0,2,0,0,0,0|2,0,0]=4 6708 B8R0.8 CC(OCCN)C(N)=O Amb19020756 [0,2,0,0,0,0|2,0,0]=4 6709 B8R0.8 CC(OCCN)C(O)=O Amb18630157 [0,2,0,0,0,0|1,0,0]=3 6710 B8R0.8 CC(OCCN)C(O)=O Amb22546285 [0,2,0,0,0,0|1,0,0]=3 6711 B8R0.8 CC(SCCCl)C(C)=O Amb25726472 [0,2,0,0,0,0|2,0,0]=4 6712 B8R0.8 CC(SCCF)C(C)=O Amb25315458 [0,2,0,0,0,0|2,0,0]=4 6713 B8R0.8 CC(SCCF)C(O)=O Amb25314013 [0,2,0,0,0,0|1,0,0]=3 6714 B8R0.8 CCC#CC(O)C(O)=O Amb25245439 [0,2,0,0,0,0|0,0,1]=3 6715 B8R0.8 CCCCC(=C)C(N)=O Amb24574376 [0,2,0,0,0,0|1,0,0]=3 6716 B8R0.8 CCCCC(=C)C(O)=O Amb18642649 [0,2,0,0,0,0|0,0,0]=2 6717 B8R0.8 CCCCC(=N)C(C)C Amb25680717 [0,2,0,0,0,0|2,0,0]=4 6718 B8R0.8 CCCCC(=O)C(=C)F Amb25298399 [0,2,0,0,0,0|1,0,0]=3 6719 B8R0.8 CCCCC(=O)C(C)Br Amb24692778 [0,2,0,0,0,0|1,0,0]=3 6720 B8R0.8 CCCCC(=O)C(Cl)C Amb17593705 [0,2,0,0,0,0|1,0,0]=3 6721 B8R0.8 CCCCC(=O)C(Cl)Cl Amb17594228 [0,2,0,0,0,0|1,0,0]=3 6722 B8R0.8 CCCCC(=O)C(N)=N Amb24543892 [0,2,0,0,0,0|1,0,0]=3 6723 B8R0.8 CCCCC(=O)C(O)=O Amb18642761 [0,2,0,0,0,0|0,0,0]=2 6724 B8R0.8 CCCCC(=O)C(O)=O Amb22348245 [0,2,0,0,0,0|0,0,0]=2 6725 B8R0.8 CCCCC(=O)[C@@H](C)N Amb22748987 [0,2,0,0,0,0|1,0,0]=3 6726 B8R0.8 CCCCC(=O)[C@@H](C)O Amb25829551 [0,2,0,0,0,0|0,0,0]=2 6727 B8R0.8 CCCCC(=O)[C@H](C)O Amb25097116 [0,2,0,0,0,0|0,0,0]=2 6728 B8R0.8 CCCCC(=O)[C@H](C)[NH3+] Amb22503703 [0,2,0,0,0,0|1,0,0]=3 6729 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [0,2,0,0,0,0|1,0,0]=3 6730 B8R0.8 CCCCC(Br)C(C)=C Amb25718999 [0,2,0,0,0,0|2,0,0]=4 6731 B8R0.8 CCCCC(Br)C(N)=N Amb25109246 [0,2,0,0,0,0|2,0,0]=4 6732 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [0,2,0,0,0,0|1,0,0]=3 6733 B8R0.8 CCCCC(Br)[N+]([O-])=O Amb24626944 [0,2,0,0,0,0|1,0,1]=4 6734 B8R0.8 CCCCC(C(=O)C)N Amb1099238 [0,2,0,0,0,0|1,0,0]=3 6735 B8R0.8 CCCCC(C(=O)Cl)Br Amb17569836 [0,2,0,0,0,0|1,0,0]=3 6736 B8R0.8 CCCCC(C(=O)O)Cl Amb17593750 [0,2,0,0,0,0|0,0,0]=2 6737 B8R0.8 CCCCC(C)C(N)=N Amb24452705 [0,2,0,0,0,0|2,0,0]=4 6738 B8R0.8 CCCCC(Cl)B(O)O Amb25102593 [0,2,0,0,0,0|1,0,1]=4 6739 B8R0.8 CCCCC(Cl)C(=O)Cl Amb24634189 [0,2,0,0,0,0|1,0,0]=3 6740 B8R0.8 CCCCC(F)C(O)=O Amb25238781 [0,2,0,0,0,0|0,0,0]=2 6741 B8R0.8 CCCCC(I)C(C)=O Amb25314130 [0,2,0,0,0,0|1,0,0]=3 6742 B8R0.8 CCCCC(N)C(C)=C Amb24353636 [0,2,0,0,0,0|2,0,0]=4 6743 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [0,2,0,0,0,0|1,0,0]=3 6744 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [0,2,0,0,0,0|1,0,0]=3 6745 B8R0.8 CCCCC(N)C(N)=S Amb24764229 [0,2,0,0,0,0|1,1,0]=4 6746 B8R0.8 CCCCC(N)P(O)O Amb24433379 [0,2,0,0,0,0|1,0,1]=4 6747 B8R0.8 CCCCC(O)C(=C)Cl Amb24379883 [0,2,0,0,0,0|1,0,1]=4 6748 B8R0.8 CCCCC(O)C(F)Br Amb25853521 [0,2,0,0,0,0|1,0,1]=4 6749 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [0,2,0,0,0,0|0,0,1]=3 6750 B8R0.8 CCCCC(O)N(C)C Amb24478022 [0,2,0,0,0,0|1,0,1]=4 6751 B8R0.8 CCCCC(S)C(O)=O Amb25323873 [0,2,0,0,0,0|0,0,0]=2 6752 B8R0.8 CCCCN(C)C(C)=N Amb24638724 [0,2,0,0,0,0|2,0,0]=4 6753 B8R0.8 CCCCN(Cl)C(N)=O Amb25147019 [0,2,0,0,0,0|1,0,0]=3 6754 B8R0.8 CCCCN(N)C(N)=S Amb24383128 [0,2,0,0,0,0|1,1,0]=4 6755 B8R0.8 CCCC[C@@H](Br)C(=O)Cl Amb24695956 [0,2,0,0,0,0|1,0,0]=3 6756 B8R0.8 CCCC[C@@H](Br)C(O)=O Amb24377169 [0,2,0,0,0,0|0,0,0]=2 6757 B8R0.8 CCCC[C@@H](C(=O)O)N Amb1995007 [0,2,0,0,0,0|0,0,0]=2 6758 B8R0.8 CCCC[C@@H](C)C(C)=O Amb25318801 [0,2,0,0,0,0|1,0,0]=3 6759 B8R0.8 CCCC[C@@H](C)C(O)=O Amb24590691 [0,2,0,0,0,0|0,0,0]=2 6760 B8R0.8 CCCC[C@@H](C)[C@@H](C)O Amb24332094 [0,2,0,0,0,0|1,0,1]=4 6761 B8R0.8 CCCC[C@@H](N)C(N)=O Amb23438981 [0,2,0,0,0,0|1,0,0]=3 6762 B8R0.8 CCCC[C@@H](S)C(O)=O Amb24478188 [0,2,0,0,0,0|0,0,0]=2 6763 B8R0.8 CCCC[C@H](C(=O)O)N Amb1995006 [0,2,0,0,0,0|0,0,0]=2 6764 B8R0.8 CCCC[C@H](C)C(C)=O Amb25767789 [0,2,0,0,0,0|1,0,0]=3 6765 B8R0.8 CCCC[C@H](C)C(O)=O Amb25850678 [0,2,0,0,0,0|0,0,0]=2 6766 B8R0.8 CCCC[C@H](N)C(N)=O Amb25361837 [0,2,0,0,0,0|1,0,0]=3 6767 B8R0.8 CCCC[C@H](O)C(C)=O Amb24691364 [0,2,0,0,0,0|0,0,1]=3 6768 B8R0.8 CCCN=C(C)C(C)O Amb24583723 [0,2,0,0,0,0|2,0,0]=4 6769 B8R0.8 CCCNC(=O)C(=O)C Amb17399819 [0,2,0,0,0,0|1,0,1]=4 6770 B8R0.8 CCCNC(=O)C(Br)C Amb17324530 [0,2,0,0,0,0|2,0,0]=4 6771 B8R0.8 CCCNC(=O)C(C)I Amb24452513 [0,2,0,0,0,0|2,0,0]=4 6772 B8R0.8 CCCNC(=O)C(C)N Amb21958679 [0,2,0,0,0,0|2,0,0]=4 6773 B8R0.8 CCCNC(=O)C(C)S Amb24513596 [0,2,0,0,0,0|1,1,0]=4 6774 B8R0.8 CCCNC(=O)N(F)F Amb25737128 [0,2,0,0,0,0|2,0,0]=4 6775 B8R0.8 CCCNC(=O)[C@@H](C)N Amb17987726 [0,2,0,0,0,0|2,0,0]=4 6776 B8R0.8 CCCNC(=O)[C@@H](C)O Amb25317170 [0,2,0,0,0,0|1,0,0]=3 6777 B8R0.8 CCCNC(=S)N(C)O Amb25255438 [0,2,0,0,0,0|1,1,0]=4 6778 B8R0.8 CCCNC(C)C(C)=O Amb18642716 [0,2,0,0,0,0|1,0,0]=3 6779 B8R0.8 CCCNC(C)C(C)O Amb25368854 [0,2,0,0,0,0|1,0,1]=4 6780 B8R0.8 CCCOC(=C)C(O)=O Amb18642781 [0,2,0,0,0,0|0,0,1]=3 6781 B8R0.8 CCCOC(=O)C(C)Br Amb24351605 [0,2,0,0,0,0|2,0,0]=4 6782 B8R0.8 CCCOC(=O)C(Cl)Cl Amb24480074 [0,2,0,0,0,0|2,0,0]=4 6783 B8R0.8 CCCOC(=O)C(F)Cl Amb24524182 [0,2,0,0,0,0|2,0,0]=4 6784 B8R0.8 CCCOC(=O)C(F)F Amb25121678 [0,2,0,0,0,0|2,0,0]=4 6785 B8R0.8 CCCOC(=O)C(N)=O Amb25146150 [0,2,0,0,0,0|1,0,1]=4 6786 B8R0.8 CCCOC(=O)N(C)O Amb24605999 [0,2,0,0,0,0|1,0,0]=3 6787 B8R0.8 CCCOC(=O)[C@@H](C)O Amb22746511 [0,2,0,0,0,0|1,0,0]=3 6788 B8R0.8 CCCOC(C)C(N)=S Amb25374593 [0,2,0,0,0,0|1,1,0]=4 6789 B8R0.8 CCCOC(C)[C@H](C)O Amb25350058 [0,2,0,0,0,0|1,0,1]=4 6790 B8R0.8 CCCO[C@@H](C)[C@H](C)O Amb25205054 [0,2,0,0,0,0|1,0,1]=4 6791 B8R0.8 CCCO[C@H](C)C(O)=O Amb25721817 [0,2,0,0,0,0|0,0,0]=2 6792 B8R0.8 CCCSC(=O)C(Cl)Cl Amb24634173 [0,2,0,0,0,0|2,0,0]=4 6793 B8R0.8 CCCSC(C)C(N)=N Amb24502242 [0,2,0,0,0,0|2,0,0]=4 6794 B8R0.8 CCC\C=C(/C)\[N+]([O-])=O Amb24732512 [0,2,0,0,0,0|1,0,1]=4 6795 B8R0.8 CCC\C=C(/N)\C(N)=O Amb25146004 [0,2,0,0,0,0|1,0,1]=4 6796 B8R0.8 CCC\C=C(\C(=O)C)/C Amb17593317 [0,2,0,0,0,0|1,0,1]=4 6797 B8R0.8 CCC\C=C(\F)/C(C)O Amb25215839 [0,2,0,0,0,0|1,0,1]=4 6798 B8R0.8 CCC\C=C(\N)/C(N)=O Amb24515061 [0,2,0,0,0,0|1,0,1]=4 6799 B8R0.8 CCNCC(=C)C(O)=O Amb24368916 [0,2,0,0,0,0|0,0,1]=3 6800 B8R0.8 CCNCC(C)C(C)=O Amb18642729 [0,2,0,0,0,0|1,0,0]=3 6801 B8R0.8 CCNCC(C)S(C)=O Amb25048742 [0,2,0,0,0,0|2,0,0]=4 6802 B8R0.8 CCNCC(N)C(N)=O Amb25841908 [0,2,0,0,0,0|1,0,0]=3 6803 B8R0.8 CCOCC(=C)B(O)O Amb24528629 [0,2,0,0,0,0|2,0,0]=4 6804 B8R0.8 CCOCC(=C)C(N)=O Amb25190415 [0,2,0,0,0,0|1,0,1]=4 6805 B8R0.8 CCOCC(=O)C(Cl)Cl Amb25210501 [0,2,0,0,0,0|2,0,0]=4 6806 B8R0.8 CCOCC(=O)C(F)F Amb25043974 [0,2,0,0,0,0|2,0,0]=4 6807 B8R0.8 CCOCC(C)C(C)=O Amb24621069 [0,2,0,0,0,0|1,0,0]=3 6808 B8R0.8 CCOCC(C)C(C)O Amb24529048 [0,2,0,0,0,0|1,0,1]=4 6809 B8R0.8 CCOCC(Cl)C(O)=O Amb24481790 [0,2,0,0,0,0|0,0,0]=2 6810 B8R0.8 CCOCC(O)C(=C)Cl Amb24569972 [0,2,0,0,0,0|2,0,0]=4 6811 B8R0.8 CCOCC(O)C(C)=C Amb24737020 [0,2,0,0,0,0|2,0,0]=4 6812 B8R0.8 CCOCC(O)C(O)=O Amb25804394 [0,2,0,0,0,0|0,0,0]=2 6813 B8R0.8 CCOC[C@@H](C)C(O)=O Amb25790635 [0,2,0,0,0,0|0,0,0]=2 6814 B8R0.8 CCOC[C@H](N)C(O)=O Amb22737184 [0,2,0,0,0,0|0,0,0]=2 6815 B8R0.8 CCOC[C@H](N)C(O)=O Amb24478577 [0,2,0,0,0,0|0,0,0]=2 6816 B8R0.8 CCOC[C@H](O)C(O)=O Amb24340099 [0,2,0,0,0,0|0,0,0]=2 6817 B8R0.8 CCO\C=C(/F)\C(O)=O Amb25128018 [0,2,0,0,0,0|0,0,2]=4 6818 B8R0.8 CCSCC(=O)C(O)=O Amb24670679 [0,2,0,0,0,0|0,0,1]=3 6819 B8R0.8 CCSCC(=O)N(C)C Amb25115896 [0,2,0,0,0,0|2,0,0]=4 6820 B8R0.8 CCSCC(N)C(N)=O Amb24761235 [0,2,0,0,0,0|1,0,0]=3 6821 B8R0.8 CCSC[C@@H](N)C(O)=O Amb22800347 [0,2,0,0,0,0|0,0,0]=2 6822 B8R0.8 CCSC[C@H](N)C(N)=O Amb24393154 [0,2,0,0,0,0|1,0,0]=3 6823 B8R0.8 CC\C=C\C(=O)C(C)O Amb24565712 [0,2,0,0,0,0|0,0,2]=4 6824 B8R0.8 CC\C=C\C(Br)C(=O)Cl Amb24480332 [0,2,0,0,0,0|1,0,1]=4 6825 B8R0.8 CC\C=C\C(C)C(C)=O Amb25295311 [0,2,0,0,0,0|1,0,1]=4 6826 B8R0.8 CC\C=C\C(C)C(O)=O Amb18642633 [0,2,0,0,0,0|0,0,1]=3 6827 B8R0.8 CC\C=C\C(N)C(O)=O Amb18642708 [0,2,0,0,0,0|0,0,1]=3 6828 B8R0.8 CN(C(=O)Cl)CCCC Amb17563097 [0,2,0,0,0,0|1,0,0]=3 6829 B8R0.8 CN(C)C(=O)CCCI Amb25147164 [0,2,0,0,0,0|2,0,0]=4 6830 B8R0.8 CN(C)C(=O)CCCS Amb25120375 [0,2,0,0,0,0|2,0,0]=4 6831 B8R0.8 CN(O)C(=O)CCCO Amb24611871 [0,2,0,0,0,0|1,0,0]=3 6832 B8R0.8 CNCCC(=O)C(C)C Amb18642727 [0,2,0,0,0,0|2,0,0]=4 6833 B8R0.8 CNCCC(=O)N(C)C Amb22757530 [0,2,0,0,0,0|2,0,0]=4 6834 B8R0.8 CNCCC(C)C(O)=O Amb24641803 [0,2,0,0,0,0|0,0,0]=2 6835 B8R0.8 CNCCC(C)S(C)=O Amb24481747 [0,2,0,0,0,0|2,0,0]=4 6836 B8R0.8 CNCCC(O)C(O)=O Amb24540612 [0,2,0,0,0,0|0,0,0]=2 6837 B8R0.8 CNCCN(C)C(C)=O Amb20669225 [0,2,0,0,0,0|2,0,0]=4 6838 B8R0.8 CNCC[C@H](N)C(O)=O Amb24427654 [0,2,0,0,0,0|0,0,0]=2 6839 B8R0.8 COCCC(=O)C(C)C Amb19514652 [0,2,0,0,0,0|2,0,0]=4 6840 B8R0.8 COCCC(=O)N(C)C Amb25147229 [0,2,0,0,0,0|2,0,0]=4 6841 B8R0.8 COCCC(C)C(N)=O Amb24760323 [0,2,0,0,0,0|1,0,0]=3 6842 B8R0.8 COCCC(C)C(N)=S Amb25320570 [0,2,0,0,0,0|1,1,0]=4 6843 B8R0.8 COCCC(C)C(O)=O Amb18523823 [0,2,0,0,0,0|0,0,0]=2 6844 B8R0.8 COCCC(Cl)C(C)=O Amb25707829 [0,2,0,0,0,0|1,0,0]=3 6845 B8R0.8 COCCC(N)C(C)=C Amb24532850 [0,2,0,0,0,0|2,0,0]=4 6846 B8R0.8 COCCC(N)C(C)=O Amb24496676 [0,2,0,0,0,0|1,0,0]=3 6847 B8R0.8 COCCC(N)C(N)=O Amb18311365 [0,2,0,0,0,0|1,0,0]=3 6848 B8R0.8 COCCC(O)C(=O)Cl Amb25781911 [0,2,0,0,0,0|1,0,0]=3 6849 B8R0.8 COCCN(C)C(C)=O Amb24072025 [0,2,0,0,0,0|2,0,0]=4 6850 B8R0.8 COCC[C@@H](C(=O)O)N Amb16183872 [0,2,0,0,0,0|0,0,0]=2 6851 B8R0.8 COCC[C@H](C(=O)O)N Amb16183870 [0,2,0,0,0,0|0,0,0]=2 6852 B8R0.8 COCC[C@H](C)C(O)=O Amb24392969 [0,2,0,0,0,0|0,0,0]=2 6853 B8R0.8 COCC[C@H](N)C(O)=O Amb24054991 [0,2,0,0,0,0|0,0,0]=2 6854 B8R0.8 COCOC(=O)[C@H](C)O Amb25073267 [0,2,0,0,0,0|2,0,0]=4 6855 B8R0.8 COCOC(C)C(C)=O Amb24563208 [0,2,0,0,0,0|2,0,0]=4 6856 B8R0.8 COCO[C@@H](C)C(C)=O Amb25096675 [0,2,0,0,0,0|2,0,0]=4 6857 B8R0.8 COCO[C@@H](C)C(O)=O Amb25682837 [0,2,0,0,0,0|1,0,0]=3 6858 B8R0.8 COCO[C@H](C)C(O)=O Amb25706272 [0,2,0,0,0,0|1,0,0]=3 6859 B8R0.8 COC\C=C(\Br)/C(O)=O Amb24580462 [0,2,0,0,0,0|0,0,2]=4 6860 B8R0.8 CONCC(C)C(N)=O Amb24440524 [0,2,0,0,0,0|2,0,0]=4 6861 B8R0.8 CONCC(N)C(O)=O Amb24392137 [0,2,0,0,0,0|1,0,0]=3 6862 B8R0.8 CONC[C@H](N)C(O)=O Amb25376688 [0,2,0,0,0,0|1,0,0]=3 6863 B8R0.8 CO\C=C/C(C)C(O)=O Amb18642780 [0,2,0,0,0,0|0,0,2]=4 6864 B8R0.8 CO\C=C\C(C)C(O)=O Amb25188040 [0,2,0,0,0,0|0,0,2]=4 6865 B8R0.8 CO\C=C\C(N)C(O)=O Amb18642835 [0,2,0,0,0,0|0,0,2]=4 6866 B8R0.8 CO\C=C\[C@H](N)C(O)=O Amb24478831 [0,2,0,0,0,0|0,0,2]=4 6867 B8R0.8 CPOCC(N)C(O)=O Amb24423934 [0,2,0,0,0,0|1,0,0]=3 6868 B8R0.8 CSCCC(=O)C(C)C Amb25303233 [0,2,0,0,0,0|2,0,0]=4 6869 B8R0.8 CSCCC(=O)C(F)F Amb25343014 [0,2,0,0,0,0|2,0,0]=4 6870 B8R0.8 CSCCC(=O)C(O)=O Amb18643588 [0,2,0,0,0,0|0,0,1]=3 6871 B8R0.8 CSCCC(=O)C(O)=O Amb22274154 [0,2,0,0,0,0|0,0,1]=3 6872 B8R0.8 CSCCC(Br)C(O)=O Amb24682715 [0,2,0,0,0,0|0,0,0]=2 6873 B8R0.8 CSCCC(C(=O)Cl)N Amb17142908 [0,2,0,0,0,0|1,0,0]=3 6874 B8R0.8 CSCCC(C(=O)N)N Amb17142872 [0,2,0,0,0,0|1,0,0]=3 6875 B8R0.8 CSCCC(C(=O)O)N Amb1154122 [0,2,0,0,0,0|0,0,0]=2 6876 B8R0.8 CSCCC(C)C(C)=O Amb24650560 [0,2,0,0,0,0|1,0,0]=3 6877 B8R0.8 CSCCC(C)C(O)=O Amb24739356 [0,2,0,0,0,0|0,0,0]=2 6878 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [0,2,0,0,0,0|1,0,0]=3 6879 B8R0.8 CSCCC(N)C(=O)S Amb24407336 [0,2,0,0,0,0|0,1,0]=3 6880 B8R0.8 CSCCC(N)C(C)=C Amb25042760 [0,2,0,0,0,0|2,0,0]=4 6881 B8R0.8 CSCCC(N)C(O)=O Amb22168296 [0,2,0,0,0,0|0,0,0]=2 6882 B8R0.8 CSCCC(N)C(O)=O Amb22732346 [0,2,0,0,0,0|0,0,0]=2 6883 B8R0.8 CSCCC(N)P(O)=O Amb25362071 [0,2,0,0,0,0|1,0,0]=3 6884 B8R0.8 CSCCC(N)P(O)O Amb24594969 [0,2,0,0,0,0|1,0,1]=4 6885 B8R0.8 CSCCC(N)[13C](O)=O Amb22336208 [0,2,0,0,0,0|0,0,0]=2 6886 B8R0.8 CSCCC(O)C(C)=O Amb24741882 [0,2,0,0,0,0|1,0,0]=3 6887 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [0,2,0,0,0,0|1,0,0]=3 6888 B8R0.8 CSCCC(O)C(O)=O Amb18304609 [0,2,0,0,0,0|0,0,0]=2 6889 B8R0.8 CSCCN(C)C(=O)Cl Amb25214303 [0,2,0,0,0,0|2,0,0]=4 6890 B8R0.8 CSCCN(C)C(C)=O Amb24096774 [0,2,0,0,0,0|2,0,0]=4 6891 B8R0.8 CSCC[C@@H](Cl)C(=O)Cl Amb24544524 [0,2,0,0,0,0|1,0,0]=3 6892 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [0,2,0,0,0,0|1,0,0]=3 6893 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [0,2,0,0,0,0|1,0,0]=3 6894 B8R0.8 CSCC[C@@H](O)C(O)=O Amb25124092 [0,2,0,0,0,0|0,0,0]=2 6895 B8R0.8 CSCC[C@@H](S)C(O)=O Amb24340077 [0,2,0,0,0,0|0,0,0]=2 6896 B8R0.8 CSCC[C@H](Br)C(O)=O Amb25239326 [0,2,0,0,0,0|0,0,0]=2 6897 B8R0.8 CSCC[C@H](Cl)C(=O)Cl Amb25135376 [0,2,0,0,0,0|1,0,0]=3 6898 B8R0.8 CSCC[C@H](N)C(O)=O Amb17942996 [0,2,0,0,0,0|0,0,0]=2 6899 B8R0.8 CSCC[C@H](N)C(O)=O Amb22351191 [0,2,0,0,0,0|0,0,0]=2 6900 B8R0.8 CSCC[C@H](N)P(O)=O Amb25826489 [0,2,0,0,0,0|1,0,0]=3 6901 B8R0.8 CSCC[C@H]([15NH2])C(O)=O Amb22353588 [0,2,0,0,0,0|0,0,0]=2 6902 B8R0.8 CSCSC(C)C(C)=O Amb25162557 [0,2,0,0,0,0|2,0,0]=4 6903 B8R0.8 CSOC[C@H](N)C(O)=O Amb24428229 [0,2,0,0,0,0|1,0,0]=3 6904 B8R0.8 CS[13CH2][13CH2][13CH]([13C](=O)O)O Amb17615592 [0,2,0,0,0,0|0,0,0]=2 6905 B8R0.8 C[C@@H](CCC=C)C(C)=O Amb25114180 [0,2,0,0,0,0|1,0,1]=4 6906 B8R0.8 C[C@@H](CCCBr)C(O)=O Amb24480227 [0,2,0,0,0,0|0,0,0]=2 6907 B8R0.8 C[C@@H](NCC#N)C(O)=O Amb24481672 [0,2,0,0,0,0|1,0,1]=4 6908 B8R0.8 C[C@@H](NCC=C)C(O)=O Amb24481671 [0,2,0,0,0,0|0,0,2]=4 6909 B8R0.8 C[C@@H](O)C(=O)NCCN Amb25771555 [0,2,0,0,0,0|2,0,0]=4 6910 B8R0.8 C[C@@H](O)C(=O)NCCO Amb25107552 [0,2,0,0,0,0|2,0,0]=4 6911 B8R0.8 C[C@@H](O)C(=O)OCCF Amb24704558 [0,2,0,0,0,0|2,0,0]=4 6912 B8R0.8 C[C@@H](O)[C@@H](O)CCCO Amb24466205 [0,2,0,0,0,0|1,0,1]=4 6913 B8R0.8 C[C@@H](O)[C@H](Br)CCCC Amb25124035 [0,2,0,0,0,0|1,0,1]=4 6914 B8R0.8 C[C@@H](O)[C@H](C)CCCO Amb25233241 [0,2,0,0,0,0|1,0,1]=4 6915 B8R0.8 C[C@@H](OCC#N)C(O)=O Amb25050099 [0,2,0,0,0,0|1,0,1]=4 6916 B8R0.8 C[C@H](C(=O)O)CSCC Amb10844108 [0,2,0,0,0,0|0,0,0]=2 6917 B8R0.8 C[C@H](CCC#N)C(O)=O Amb25790580 [0,2,0,0,0,0|0,0,1]=3 6918 B8R0.8 C[C@H](CCC=C)C(O)=O Amb24337306 [0,2,0,0,0,0|0,0,1]=3 6919 B8R0.8 C[C@H](CCCBr)C(O)=O Amb24480175 [0,2,0,0,0,0|0,0,0]=2 6920 B8R0.8 C[C@H](CN=[N+]=[N-])C(O)=O Amb24399279 [0,2,0,0,0,0|2,0,0]=4 6921 B8R0.8 C[C@H](NCC#C)C(O)=O Amb25697652 [0,2,0,0,0,0|0,0,2]=4 6922 B8R0.8 C[C@H](O)C(=O)CCC=O Amb25069752 [0,2,0,0,0,0|1,0,1]=4 6923 B8R0.8 C[C@H](O)C(=O)NCCF Amb25335049 [0,2,0,0,0,0|2,0,0]=4 6924 B8R0.8 C[C@H](O)C(=O)NCCO Amb25744701 [0,2,0,0,0,0|2,0,0]=4 6925 B8R0.8 C[C@H](O)[C@@H](O)CCCC Amb24334203 [0,2,0,0,0,0|0,0,2]=4 6926 B8R0.8 C[C@H](O)[C@@H](O)CCCO Amb24575511 [0,2,0,0,0,0|1,0,1]=4 6927 B8R0.8 C[C@H](O)[C@H](Br)CCCC Amb25064520 [0,2,0,0,0,0|1,0,1]=4 6928 B8R0.8 C[C@H](O)[C@H](N)CCCC Amb25378726 [0,2,0,0,0,0|1,0,1]=4 6929 B8R0.8 C[C@H](O)[C@H](O)CCCO Amb24686400 [0,2,0,0,0,0|1,0,1]=4 6930 B8R0.8 C[C@H](OCC#C)C(O)=O Amb25852095 [0,2,0,0,0,0|0,0,2]=4 6931 B8R0.8 C[Se]CCC(N)C(O)=O Amb20619393 [0,2,0,0,0,0|0,0,0]=2 6932 B8R0.8 C[Se]CC[C@H](C(=O)O)N Amb10601590 [0,2,0,0,0,0|0,0,0]=2 6933 B8R0.8 C\C(=C/CCC)\C(=O)O Amb10844998 [0,2,0,0,0,0|0,0,1]=3 6934 B8R0.8 C\C(=C\CCC)\C(O)=O Amb25032199 [0,2,0,0,0,0|0,0,1]=3 6935 B8R0.8 C\C(=C\OCC)\C(O)=O Amb25741753 [0,2,0,0,0,0|0,0,2]=4 6936 B8R0.8 C\C=C/CC(F)C(C)=O Amb25829411 [0,2,0,0,0,0|1,0,1]=4 6937 B8R0.8 C\C=C/CC(O)C(C)=O Amb24551722 [0,2,0,0,0,0|1,0,1]=4 6938 B8R0.8 C\C=C/C[C@H](N)C(O)=O Amb24713154 [0,2,0,0,0,0|0,0,1]=3 6939 B8R0.8 C\C=C/C[C@H](O)C(C)=O Amb25087742 [0,2,0,0,0,0|1,0,1]=4 6940 B8R0.8 C\C=C\CC(=O)C(O)=O Amb18642583 [0,2,0,0,0,0|0,0,2]=4 6941 B8R0.8 C\C=C\CC(C)C(O)=O Amb18642630 [0,2,0,0,0,0|0,0,1]=3 6942 B8R0.8 C\C=C\CC(F)C(C)=O Amb24516319 [0,2,0,0,0,0|1,0,1]=4 6943 B8R0.8 C\C=C\CC(O)C(C)=O Amb25707027 [0,2,0,0,0,0|1,0,1]=4 6944 B8R0.8 C\C=C\CC(O)C(O)=O Amb18642742 [0,2,0,0,0,0|0,0,1]=3 6945 B8R0.8 C\C=C\C[C@@H](N)C(O)=O Amb24632390 [0,2,0,0,0,0|0,0,1]=3 6946 B8R0.8 ClCCCC(=O)N(C)C Amb1128819 [0,2,0,0,0,0|2,0,0]=4 6947 B8R0.8 N=C(NCCO)C(O)=O Amb18124348 [0,2,0,0,0,0|1,0,1]=4 6948 B8R0.8 NC(=O)C(Cl)CCCCl Amb24480056 [0,2,0,0,0,0|1,0,0]=3 6949 B8R0.8 NC(=O)C(O)CCCO Amb25104583 [0,2,0,0,0,0|1,0,0]=3 6950 B8R0.8 NC(=O)[C@@H](O)CCCO Amb25804971 [0,2,0,0,0,0|1,0,0]=3 6951 B8R0.8 NC(C#CCO)C(O)=O Amb24585112 [0,2,0,0,0,0|0,0,2]=4 6952 B8R0.8 NC(C(=O)O)CCON Amb17593409 [0,2,0,0,0,0|1,0,0]=3 6953 B8R0.8 NC(C(=O)O)CSC#N Amb17593655 [0,2,0,0,0,0|1,0,1]=4 6954 B8R0.8 NC(CCC#N)C(O)=O Amb18642589 [0,2,0,0,0,0|0,0,1]=3 6955 B8R0.8 NC(CCC=O)C(O)=O Amb24340141 [0,2,0,0,0,0|0,0,1]=3 6956 B8R0.8 NC(CCCBr)B(O)O Amb24607340 [0,2,0,0,0,0|1,0,1]=4 6957 B8R0.8 NC(CCCBr)C(O)=O Amb24480263 [0,2,0,0,0,0|0,0,0]=2 6958 B8R0.8 NC(CCCBr)P(O)=O Amb24377501 [0,2,0,0,0,0|1,0,0]=3 6959 B8R0.8 NC(CCCCl)C(O)=O Amb24472387 [0,2,0,0,0,0|0,0,0]=2 6960 B8R0.8 NC(CCCF)C(O)=O Amb25366994 [0,2,0,0,0,0|0,0,0]=2 6961 B8R0.8 NC(CCCO)C(O)=O Amb18642915 [0,2,0,0,0,0|0,0,0]=2 6962 B8R0.8 NC(CCCO)C(O)=O Amb22900028 [0,2,0,0,0,0|0,0,0]=2 6963 B8R0.8 NC(CCCO)P(O)=O Amb25726221 [0,2,0,0,0,0|1,0,0]=3 6964 B8R0.8 NC(CN=C=O)C(O)=O Amb24423805 [0,2,0,0,0,0|1,0,1]=4 6965 B8R0.8 NC(COCO)C(O)=O Amb24731952 [0,2,0,0,0,0|1,0,0]=3 6966 B8R0.8 NC(CSC=O)C(O)=O Amb24670042 [0,2,0,0,0,0|1,0,1]=4 6967 B8R0.8 NC(\C=C\CO)C(O)=O Amb24586215 [0,2,0,0,0,0|0,0,2]=4 6968 B8R0.8 NC(\C=C\CP)C(O)=O Amb24351617 [0,2,0,0,0,0|0,0,2]=4 6969 B8R0.8 NCCCC(=O)C(O)=O Amb24081348 [0,2,0,0,0,0|0,0,1]=3 6970 B8R0.8 NCCCC(=O)N(C)C Amb10610208 [0,2,0,0,0,0|2,0,0]=4 6971 B8R0.8 NCCCC(=O)N(C)C Amb10610229 [0,2,0,0,0,0|2,0,0]=4 6972 B8R0.8 NCCCC(C(=O)O)Br Amb17595166 [0,2,0,0,0,0|0,0,0]=2 6973 B8R0.8 NCCCC(Cl)C(O)=O Amb24626933 [0,2,0,0,0,0|0,0,0]=2 6974 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [0,2,0,0,0,0|1,0,0]=3 6975 B8R0.8 NCCCC(N)C(O)=O Amb22489477 [0,2,0,0,0,0|0,0,0]=2 6976 B8R0.8 NCCCC(N)C(O)=O Amb22492665 [0,2,0,0,0,0|0,0,0]=2 6977 B8R0.8 NCCCC(O)C(O)=O Amb18124377 [0,2,0,0,0,0|0,0,0]=2 6978 B8R0.8 NCCC[C@@H](N)C(O)=O Amb22801212 [0,2,0,0,0,0|0,0,0]=2 6979 B8R0.8 NCCC[C@@H](O)C(O)=O Amb24459740 [0,2,0,0,0,0|0,0,0]=2 6980 B8R0.8 NCCC[C@@H]([NH3+])C(=O)O Amb10807472 [0,2,0,0,0,0|0,0,0]=2 6981 B8R0.8 NCCC[C@H](N)C(N)=O Amb24658293 [0,2,0,0,0,0|1,0,0]=3 6982 B8R0.8 NCCC[C@H](N)C(O)=O Amb20240598 [0,2,0,0,0,0|0,0,0]=2 6983 B8R0.8 NCCNC(=O)C(O)=O Amb18977789 [0,2,0,0,0,0|1,0,1]=4 6984 B8R0.8 NCCSC(F)C(O)=O Amb24478685 [0,2,0,0,0,0|1,0,0]=3 6985 B8R0.8 NC\C=C\C(N)C(O)=O Amb18642793 [0,2,0,0,0,0|0,0,2]=4 6986 B8R0.8 NC\C=C\[C@H](N)C(O)=O Amb24580033 [0,2,0,0,0,0|0,0,2]=4 6987 B8R0.8 NOCCC(N)C(O)=O Amb21858490 [0,2,0,0,0,0|1,0,0]=3 6988 B8R0.8 NOCC[C@@H](N)C(O)=O Amb22745427 [0,2,0,0,0,0|1,0,0]=3 6989 B8R0.8 NOCC[C@@H](N)C(O)=O Amb22751695 [0,2,0,0,0,0|1,0,0]=3 6990 B8R0.8 N[C@@H](CCC=O)C(O)=O Amb25378080 [0,2,0,0,0,0|0,0,1]=3 6991 B8R0.8 N[C@@H](CCCN)C(O)=O Amb22746434 [0,2,0,0,0,0|0,0,0]=2 6992 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24117852 [0,2,0,0,0,0|1,0,0]=3 6993 B8R0.8 N[C@@H](CCNO)C(O)=O Amb24666196 [0,2,0,0,0,0|1,0,0]=3 6994 B8R0.8 N[C@@H](CN=C=S)C(O)=O Amb24473247 [0,2,0,0,0,0|1,0,1]=4 6995 B8R0.8 N[C@@H](CNC#N)C(O)=O Amb24551015 [0,2,0,0,0,0|1,0,1]=4 6996 B8R0.8 N[C@@H](C\C=C\Cl)C(O)=O Amb25774032 [0,2,0,0,0,0|0,0,2]=4 6997 B8R0.8 N[C@H](C(=O)O)CCC#N Amb16183912 [0,2,0,0,0,0|0,0,1]=3 6998 B8R0.8 N[C@H](CCC#N)C(O)=O Amb25063958 [0,2,0,0,0,0|0,0,1]=3 6999 B8R0.8 N[C@H](CCC=O)C(O)=O Amb24477812 [0,2,0,0,0,0|0,0,1]=3 7000 B8R0.8 N[C@H](C\C=C\Cl)C(O)=O Amb25114338 [0,2,0,0,0,0|0,0,2]=4 7001 B8R0.8 O=C(Cl)C(Br)CCCBr Amb24387005 [0,2,0,0,0,0|1,0,0]=3 7002 B8R0.8 OC(=O)C(=O)CCCBr Amb24711405 [0,2,0,0,0,0|0,0,1]=3 7003 B8R0.8 OC(=O)C(=O)CCCCl Amb25274323 [0,2,0,0,0,0|0,0,1]=3 7004 B8R0.8 OC(=O)C(=O)NCCO Amb24117944 [0,2,0,0,0,0|1,0,1]=4 7005 B8R0.8 OC(=O)C(=O)OCCCl Amb25378823 [0,2,0,0,0,0|1,0,1]=4 7006 B8R0.8 OC(=O)C(Br)CCCBr Amb22001929 [0,2,0,0,0,0|0,0,0]=2 7007 B8R0.8 OC(=O)C(CCCCl)Br Amb17595866 [0,2,0,0,0,0|0,0,0]=2 7008 B8R0.8 OC(=O)C(F)CCCCl Amb24683810 [0,2,0,0,0,0|0,0,0]=2 7009 B8R0.8 OC(CNC=O)C(O)=O Amb25126146 [0,2,0,0,0,0|1,0,1]=4 7010 B8R0.8 OCCCC(=O)N(C)C Amb17231873 [0,2,0,0,0,0|2,0,0]=4 7011 B8R0.8 OCCCC(Cl)C(O)=O Amb25760339 [0,2,0,0,0,0|0,0,0]=2 7012 B8R0.8 OCCCC(O)C(O)=O Amb18642939 [0,2,0,0,0,0|0,0,0]=2 7013 B8R0.8 OCCC[C@@H](C(=O)O)N Amb16183887 [0,2,0,0,0,0|0,0,0]=2 7014 B8R0.8 OCCC[C@H](O)C(O)=O Amb24744314 [0,2,0,0,0,0|0,0,0]=2 7015 B8R0.8 O[C@@H](CNC=O)C(O)=O Amb24453193 [0,2,0,0,0,0|1,0,1]=4 7016 B8R0.8 [13CH3]SCCC(N)C(O)=O Amb22351494 [0,2,0,0,0,0|0,0,0]=2 7017 B8R0.8 [13CH3][Se]CCC(N)C(O)=O Amb22367237 [0,2,0,0,0,0|0,0,0]=2 7018 B8R0.8 [N-]=[N+]=NC[C@H](N)C(O)=O Amb25072668 [0,2,0,0,0,0|2,0,0]=4 7019 B8R0.8 [O-][N+](=O)C(Cl)CCCF Amb24340292 [0,2,0,0,0,0|1,0,1]=4 7020 B8R0.9 BrCC(=O)NCC(C)C Amb10608023 [0,2,0,0,0,0|2,0,0]=4 7021 B8R0.9 C#CC(N)CCC(O)=O Amb22352566 [0,2,0,0,0,0|0,0,1]=3 7022 B8R0.9 C=C(CCC(O)=O)C#N Amb24465180 [0,2,0,0,0,0|0,0,2]=4 7023 B8R0.9 C=C(CCC(O)=O)C=C Amb18642412 [0,2,0,0,0,0|0,0,2]=4 7024 B8R0.9 C=CC(=O)CCC(O)=O Amb22055999 [0,2,0,0,0,0|0,0,2]=4 7025 B8R0.9 C=CC(N)CCC(O)=O Amb22056347 [0,2,0,0,0,0|0,0,1]=3 7026 B8R0.9 C=CC(O)CCC(O)=O Amb25785193 [0,2,0,0,0,0|0,0,1]=3 7027 B8R0.9 C=C[C@H](N)CCC(O)=O Amb25694354 [0,2,0,0,0,0|0,0,1]=3 7028 B8R0.9 CC(=C)CCC(N)CO Amb25775333 [0,2,0,0,0,0|2,0,0]=4 7029 B8R0.9 CC(=C)CCC(O)CBr Amb25101568 [0,2,0,0,0,0|2,0,0]=4 7030 B8R0.9 CC(=C)CCC(O)CCl Amb25378826 [0,2,0,0,0,0|2,0,0]=4 7031 B8R0.9 CC(=C)CC[C@@H](O)CO Amb25099425 [0,2,0,0,0,0|2,0,0]=4 7032 B8R0.9 CC(=C)CC[C@H](O)CO Amb24732167 [0,2,0,0,0,0|2,0,0]=4 7033 B8R0.9 CC(=CCC(O)=O)C#N Amb25175102 [0,2,0,0,0,0|0,0,2]=4 7034 B8R0.9 CC(=O)CCC(=C)C=O Amb24640352 [0,2,0,0,0,0|1,0,1]=4 7035 B8R0.9 CC(=O)CCC(=C)CC Amb24433642 [0,2,0,0,0,0|1,0,0]=3 7036 B8R0.9 CC(=O)CCC(=O)C=C Amb10562681 [0,2,0,0,0,0|1,0,1]=4 7037 B8R0.9 CC(=O)CCC(=O)C=O Amb25224384 [0,2,0,0,0,0|0,0,2]=4 7038 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,2,0,0,0,0|1,0,1]=4 7039 B8R0.9 CC(=O)CCC(Br)CCl Amb24480346 [0,2,0,0,0,0|1,0,0]=3 7040 B8R0.9 CC(=O)CCC(Cl)C=O Amb25275061 [0,2,0,0,0,0|1,0,1]=4 7041 B8R0.9 CC(=O)CCC(Cl)CO Amb25274671 [0,2,0,0,0,0|1,0,0]=3 7042 B8R0.9 CC(=O)CCC(F)CBr Amb25201516 [0,2,0,0,0,0|1,0,0]=3 7043 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,2,0,0,0,0|1,0,0]=3 7044 B8R0.9 CC(=O)CCC(N)CO Amb25257834 [0,2,0,0,0,0|1,0,0]=3 7045 B8R0.9 CC(=O)CCC(O)C=C Amb24614737 [0,2,0,0,0,0|1,0,1]=4 7046 B8R0.9 CC(=O)CCC(O)CCl Amb25118823 [0,2,0,0,0,0|1,0,0]=3 7047 B8R0.9 CC(=O)CNC(=O)CC Amb25292227 [0,2,0,0,0,0|1,0,1]=4 7048 B8R0.9 CC(=O)COC(=O)OC Amb25177471 [0,2,0,0,0,0|1,0,1]=4 7049 B8R0.9 CC(=O)CSC(=O)OC Amb25318847 [0,2,0,0,0,0|1,0,1]=4 7050 B8R0.9 CC(=O)NCC(=O)CC Amb23555728 [0,2,0,0,0,0|1,0,1]=4 7051 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,2,0,0,0,0|1,0,1]=4 7052 B8R0.9 CC(=O)NCC(F)CBr Amb24676009 [0,2,0,0,0,0|2,0,0]=4 7053 B8R0.9 CC(=O)NCC(N)CO Amb25276356 [0,2,0,0,0,0|2,0,0]=4 7054 B8R0.9 CC(=O)NCC(O)CCl Amb22235217 [0,2,0,0,0,0|2,0,0]=4 7055 B8R0.9 CC(=O)NCC(O)CN Amb25139837 [0,2,0,0,0,0|2,0,0]=4 7056 B8R0.9 CC(=O)NCC(O)CO Amb24359036 [0,2,0,0,0,0|2,0,0]=4 7057 B8R0.9 CC(=O)NC[C@@H](O)CCl Amb22746506 [0,2,0,0,0,0|2,0,0]=4 7058 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,2,0,0,0,0|2,0,0]=4 7059 B8R0.9 CC(=O)OCC(=C)CC Amb24571642 [0,2,0,0,0,0|1,0,1]=4 7060 B8R0.9 CC(=O)OCC(Br)CCl Amb24713634 [0,2,0,0,0,0|2,0,0]=4 7061 B8R0.9 CC(=O)OCC(CCl)O Amb17593815 [0,2,0,0,0,0|2,0,0]=4 7062 B8R0.9 CC(=O)OCC(Cl)CBr Amb25113223 [0,2,0,0,0,0|2,0,0]=4 7063 B8R0.9 CC(=O)OCC(Cl)CCl Amb24415406 [0,2,0,0,0,0|2,0,0]=4 7064 B8R0.9 CC(=O)OCC(F)CBr Amb25275153 [0,2,0,0,0,0|2,0,0]=4 7065 B8R0.9 CC(=O)OCC(O)CBr Amb24443015 [0,2,0,0,0,0|2,0,0]=4 7066 B8R0.9 CC(=O)OCC(O)CF Amb24386984 [0,2,0,0,0,0|2,0,0]=4 7067 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,2,0,0,0,0|2,0,0]=4 7068 B8R0.9 CC(=O)OC[C@@H](Cl)CCl Amb24470042 [0,2,0,0,0,0|2,0,0]=4 7069 B8R0.9 CC(=O)OC[C@@H](O)CBr Amb25232647 [0,2,0,0,0,0|2,0,0]=4 7070 B8R0.9 CC(=O)OC[C@H](Cl)CCl Amb25300289 [0,2,0,0,0,0|2,0,0]=4 7071 B8R0.9 CC(=O)SCC(Cl)CCl Amb24572286 [0,2,0,0,0,0|2,0,0]=4 7072 B8R0.9 CC(=O)SCC(N)CO Amb25245383 [0,2,0,0,0,0|2,0,0]=4 7073 B8R0.9 CC(=O)SCC(O)CO Amb25105864 [0,2,0,0,0,0|2,0,0]=4 7074 B8R0.9 CC(Br)COC(=O)CCl Amb25301888 [0,2,0,0,0,0|2,0,0]=4 7075 B8R0.9 CC(Br)COC(=O)CS Amb24680305 [0,2,0,0,0,0|1,1,0]=4 7076 B8R0.9 CC(C#C)OCC(O)=O Amb25092433 [0,2,0,0,0,0|1,0,0]=3 7077 B8R0.9 CC(C#N)NCC(N)=O Amb18981185 [0,2,0,0,0,0|2,0,0]=4 7078 B8R0.9 CC(C#N)NCC(O)=O Amb18293465 [0,2,0,0,0,0|1,0,0]=3 7079 B8R0.9 CC(C#N)SCC(C)=O Amb25134370 [0,2,0,0,0,0|2,0,0]=4 7080 B8R0.9 CC(C#N)SCC(N)=O Amb25691103 [0,2,0,0,0,0|2,0,0]=4 7081 B8R0.9 CC(C#N)SCC(O)=O Amb18293809 [0,2,0,0,0,0|1,0,0]=3 7082 B8R0.9 CC(C)CCC(=O)C=C Amb25341966 [0,2,0,0,0,0|1,0,0]=3 7083 B8R0.9 CC(C)CCC(=O)CBr Amb24374602 [0,2,0,0,0,0|1,0,0]=3 7084 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,2,0,0,0,0|1,0,0]=3 7085 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,2,0,0,0,0|0,0,0]=2 7086 B8R0.9 CC(C)CCC(Br)C=O Amb24480019 [0,2,0,0,0,0|1,0,1]=4 7087 B8R0.9 CC(C)CCC(C)=CBr Amb24425146 [0,2,0,0,0,0|2,0,0]=4 7088 B8R0.9 CC(C)CCC(C)=NN Amb25256965 [0,2,0,0,0,0|2,0,0]=4 7089 B8R0.9 CC(C)CCC(C)=NO Amb25235824 [0,2,0,0,0,0|1,0,0]=3 7090 B8R0.9 CC(C)CCC(C)C=O Amb24478638 [0,2,0,0,0,0|1,0,1]=4 7091 B8R0.9 CC(C)CCC(C)CO Amb24478637 [0,2,0,0,0,0|1,0,1]=4 7092 B8R0.9 CC(C)CCC(C)NO Amb25778747 [0,2,0,0,0,0|1,0,1]=4 7093 B8R0.9 CC(C)CCC(N)CO Amb18832528 [0,2,0,0,0,0|1,0,1]=4 7094 B8R0.9 CC(C)CCC(O)C#C Amb25207509 [0,2,0,0,0,0|1,0,1]=4 7095 B8R0.9 CC(C)CCC(O)C=O Amb24607253 [0,2,0,0,0,0|0,0,1]=3 7096 B8R0.9 CC(C)CCC(O)CC Amb19944686 [0,2,0,0,0,0|1,0,1]=4 7097 B8R0.9 CC(C)CCC(O)OC Amb25320255 [0,2,0,0,0,0|0,0,2]=4 7098 B8R0.9 CC(C)CCN(C)C=O Amb24725180 [0,2,0,0,0,0|2,0,0]=4 7099 B8R0.9 CC(C)CC[C@@H](O)C#C Amb24353164 [0,2,0,0,0,0|1,0,1]=4 7100 B8R0.9 CC(C)CC[C@@H](O)CC Amb25267597 [0,2,0,0,0,0|1,0,1]=4 7101 B8R0.9 CC(C)CC[C@H](C)CO Amb25781634 [0,2,0,0,0,0|1,0,1]=4 7102 B8R0.9 CC(C)CC[C@H](O)C#C Amb24532923 [0,2,0,0,0,0|1,0,1]=4 7103 B8R0.9 CC(C)CC\C(\C)=N/O Amb24547350 [0,2,0,0,0,0|1,0,0]=3 7104 B8R0.9 CC(C)CC\C(\C)=N\O Amb22732538 [0,2,0,0,0,0|1,0,0]=3 7105 B8R0.9 CC(C)CNC(=N)CO Amb23515001 [0,2,0,0,0,0|2,0,0]=4 7106 B8R0.9 CC(C)CNC(=O)CI Amb23447333 [0,2,0,0,0,0|2,0,0]=4 7107 B8R0.9 CC(C)CNC(=O)NCl Amb24465680 [0,2,0,0,0,0|2,0,0]=4 7108 B8R0.9 CC(C)COC(=O)CBr Amb22036611 [0,2,0,0,0,0|2,0,0]=4 7109 B8R0.9 CC(C)COC(=O)CN Amb19011993 [0,2,0,0,0,0|2,0,0]=4 7110 B8R0.9 CC(C)COC(=O)NN Amb25145008 [0,2,0,0,0,0|2,0,0]=4 7111 B8R0.9 CC(C)COC(=O)NO Amb24481916 [0,2,0,0,0,0|1,0,0]=3 7112 B8R0.9 CC(C)C\C=C(/C)\C=O Amb25055531 [0,2,0,0,0,0|1,0,1]=4 7113 B8R0.9 CC(C)C\C=C(/F)\C=O Amb24631174 [0,2,0,0,0,0|1,0,1]=4 7114 B8R0.9 CC(C)C\C=C(\C)/C=O Amb24573481 [0,2,0,0,0,0|1,0,1]=4 7115 B8R0.9 CC(C)NCC(=O)C#C Amb24746396 [0,2,0,0,0,0|2,0,0]=4 7116 B8R0.9 CC(C)OCC(=C)C=O Amb25294437 [0,2,0,0,0,0|2,0,0]=4 7117 B8R0.9 CC(C)OCC(=O)C=C Amb24614526 [0,2,0,0,0,0|2,0,0]=4 7118 B8R0.9 CC(C)OCC(=O)CCl Amb24481789 [0,2,0,0,0,0|2,0,0]=4 7119 B8R0.9 CC(C)OCC(=O)CN Amb24481788 [0,2,0,0,0,0|2,0,0]=4 7120 B8R0.9 CC(C)SCC(=O)C#C Amb24479927 [0,2,0,0,0,0|2,0,0]=4 7121 B8R0.9 CC(C)SCC(=O)NO Amb25741291 [0,2,0,0,0,0|1,0,0]=3 7122 B8R0.9 CC(C)SCC(N)=NO Amb25771404 [0,2,0,0,0,0|2,0,0]=4 7123 B8R0.9 CC(C=C)NCC(N)=O Amb24592190 [0,2,0,0,0,0|2,0,0]=4 7124 B8R0.9 CC(C=C)NCC(O)=O Amb18310594 [0,2,0,0,0,0|1,0,0]=3 7125 B8R0.9 CC(C=C)OCC(O)=O Amb18642764 [0,2,0,0,0,0|1,0,0]=3 7126 B8R0.9 CC(C=C)SCC(O)=O Amb18311113 [0,2,0,0,0,0|1,0,0]=3 7127 B8R0.9 CC(CBr)CCC(O)=O Amb25806134 [0,2,0,0,0,0|0,0,0]=2 7128 B8R0.9 CC(CBr)COC(C)=O Amb22386917 [0,2,0,0,0,0|2,0,0]=4 7129 B8R0.9 CC(CC)=C=CC(O)=O Amb25378500 [0,2,0,0,0,0|0,0,2]=4 7130 B8R0.9 CC(CCC(=C)Cl)C=O Amb24532891 [0,2,0,0,0,0|2,0,0]=4 7131 B8R0.9 CC(CCC(C)=C)C=O Amb18642470 [0,2,0,0,0,0|2,0,0]=4 7132 B8R0.9 CC(CCC(C)=C)NN Amb24360588 [0,2,0,0,0,0|2,0,0]=4 7133 B8R0.9 CC(CCC(C)=O)=CCl Amb24581923 [0,2,0,0,0,0|1,0,1]=4 7134 B8R0.9 CC(CCC(C)=O)=NO Amb24760824 [0,2,0,0,0,0|1,0,1]=4 7135 B8R0.9 CC(CCC(C)=O)C#N Amb18642304 [0,2,0,0,0,0|1,0,0]=3 7136 B8R0.9 CC(CCC(C)=O)C=O Amb18642612 [0,2,0,0,0,0|1,0,0]=3 7137 B8R0.9 CC(CCC(C)N)OC Amb25093976 [0,2,0,0,0,0|1,0,1]=4 7138 B8R0.9 CC(CCC(C)O)C=C Amb25345251 [0,2,0,0,0,0|1,0,1]=4 7139 B8R0.9 CC(CCC(C)O)C=O Amb25781383 [0,2,0,0,0,0|1,0,1]=4 7140 B8R0.9 CC(CCC(N)=O)C#N Amb25146074 [0,2,0,0,0,0|1,0,0]=3 7141 B8R0.9 CC(CCC(N)=O)CN Amb24745140 [0,2,0,0,0,0|1,0,0]=3 7142 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [0,2,0,0,0,0|0,0,1]=3 7143 B8R0.9 CC(CCC(O)=O)=NO Amb25138471 [0,2,0,0,0,0|0,0,1]=3 7144 B8R0.9 CC(CCC(O)=O)C#N Amb18642500 [0,2,0,0,0,0|0,0,0]=2 7145 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [0,2,0,0,0,0|0,0,0]=2 7146 B8R0.9 CC(CC\C(=N/O)\N)C Amb10608991 [0,2,0,0,0,0|1,0,0]=3 7147 B8R0.9 CC(CC\C(=N\O)\N)C Amb10205331 [0,2,0,0,0,0|1,0,0]=3 7148 B8R0.9 CC(CCl)CCC(C)=C Amb25068704 [0,2,0,0,0,0|2,0,0]=4 7149 B8R0.9 CC(CCl)OCC(C)=O Amb25118198 [0,2,0,0,0,0|2,0,0]=4 7150 B8R0.9 CC(CCl)OCC(N)=O Amb25789772 [0,2,0,0,0,0|2,0,0]=4 7151 B8R0.9 CC(CN)CCC(O)=O Amb22059189 [0,2,0,0,0,0|0,0,0]=2 7152 B8R0.9 CC(CN)CNC(C)=O Amb18300590 [0,2,0,0,0,0|2,0,0]=4 7153 B8R0.9 CC(CN)OCC(C)=O Amb18110559 [0,2,0,0,0,0|2,0,0]=4 7154 B8R0.9 CC(CN)OCC(O)=O Amb18629591 [0,2,0,0,0,0|1,0,0]=3 7155 B8R0.9 CC(CN)SCC(N)=O Amb24753382 [0,2,0,0,0,0|2,0,0]=4 7156 B8R0.9 CC(CNC(=O)CBr)O Amb17322852 [0,2,0,0,0,0|2,0,0]=4 7157 B8R0.9 CC(CNC(=O)CCl)O Amb17324265 [0,2,0,0,0,0|2,0,0]=4 7158 B8R0.9 CC(CNC(N)=O)CN Amb18994081 [0,2,0,0,0,0|2,0,0]=4 7159 B8R0.9 CC(CO)CCC(C)=C Amb24389869 [0,2,0,0,0,0|2,0,0]=4 7160 B8R0.9 CC(CO)CNC(C)=O Amb25050315 [0,2,0,0,0,0|2,0,0]=4 7161 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,2,0,0,0,0|2,0,0]=4 7162 B8R0.9 CC(CO)CSC(C)=O Amb24466300 [0,2,0,0,0,0|2,0,0]=4 7163 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [0,2,0,0,0,0|1,0,0]=3 7164 B8R0.9 CC(CO)SCC(C)=O Amb25195670 [0,2,0,0,0,0|2,0,0]=4 7165 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [0,2,0,0,0,0|1,0,0]=3 7166 B8R0.9 CC(COC(C)=O)C#N Amb24395253 [0,2,0,0,0,0|2,0,0]=4 7167 B8R0.9 CC(COC(C)=O)C=O Amb18642789 [0,2,0,0,0,0|2,0,0]=4 7168 B8R0.9 CC(COC(C)=O)NN Amb24439584 [0,2,0,0,0,0|2,0,0]=4 7169 B8R0.9 CC(Cl)CNC(=O)CCl Amb24480042 [0,2,0,0,0,0|2,0,0]=4 7170 B8R0.9 CC(Cl)COC(=O)CCl Amb24710935 [0,2,0,0,0,0|2,0,0]=4 7171 B8R0.9 CC(Cl)COC(=O)CS Amb25061264 [0,2,0,0,0,0|1,1,0]=4 7172 B8R0.9 CC(N)CCC(=O)C#C Amb24401215 [0,2,0,0,0,0|1,0,0]=3 7173 B8R0.9 CC(N)CCC(C)=CBr Amb24692736 [0,2,0,0,0,0|2,0,0]=4 7174 B8R0.9 CC(N)CNC(=O)CN Amb24721129 [0,2,0,0,0,0|2,0,0]=4 7175 B8R0.9 CC(O)CCC(=O)NN Amb19748590 [0,2,0,0,0,0|1,0,0]=3 7176 B8R0.9 CC(O)CCC(C)=CCl Amb25762077 [0,2,0,0,0,0|2,0,0]=4 7177 B8R0.9 CC(O)CCC(C)=NO Amb24749620 [0,2,0,0,0,0|1,0,0]=3 7178 B8R0.9 CC(O)CCC(Cl)CC Amb24480214 [0,2,0,0,0,0|1,0,1]=4 7179 B8R0.9 CC(O)CCC(O)C=O Amb18642880 [0,2,0,0,0,0|0,0,1]=3 7180 B8R0.9 CC(O)CCC(O)CC Amb25090764 [0,2,0,0,0,0|1,0,1]=4 7181 B8R0.9 CC(O)CCC(O)CF Amb24536636 [0,2,0,0,0,0|1,0,1]=4 7182 B8R0.9 CC(O)CNC(=O)CO Amb25703101 [0,2,0,0,0,0|1,0,0]=3 7183 B8R0.9 CC(O)CNC(=O)CS Amb24744011 [0,2,0,0,0,0|1,1,0]=4 7184 B8R0.9 CC(O)COC(=O)CBr Amb25253067 [0,2,0,0,0,0|2,0,0]=4 7185 B8R0.9 CC(O)C\C=C(/Br)\C=O Amb24388944 [0,2,0,0,0,0|1,0,1]=4 7186 B8R0.9 CC(ON)CNC(=O)C Amb17138377 [0,2,0,0,0,0|2,0,0]=4 7187 B8R0.9 CCC(=O)CCB(O)O Amb24736642 [0,2,0,0,0,0|1,0,1]=4 7188 B8R0.9 CCC(=O)CCC(=O)C Amb17593347 [0,2,0,0,0,0|1,0,0]=3 7189 B8R0.9 CCC(=O)CCC(=O)Cl Amb24420925 [0,2,0,0,0,0|1,0,0]=3 7190 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,2,0,0,0,0|0,0,0]=2 7191 B8R0.9 CCC(=O)CCC(C)Cl Amb24571703 [0,2,0,0,0,0|1,0,0]=3 7192 B8R0.9 CCC(=O)CCC(Cl)Cl Amb24711496 [0,2,0,0,0,0|2,0,0]=4 7193 B8R0.9 CCC(=O)CCC(N)=O Amb24669836 [0,2,0,0,0,0|1,0,0]=3 7194 B8R0.9 CCC(=O)CCN(C)C Amb24444934 [0,2,0,0,0,0|2,0,0]=4 7195 B8R0.9 CCC(=O)CCP(O)=O Amb24748238 [0,2,0,0,0,0|1,0,0]=3 7196 B8R0.9 CCC(=O)CC[N+]([O-])=O Amb25236332 [0,2,0,0,0,0|1,0,1]=4 7197 B8R0.9 CCC(=O)NCC(=O)N Amb17231864 [0,2,0,0,0,0|1,0,1]=4 7198 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,2,0,0,0,0|0,0,1]=3 7199 B8R0.9 CCC(=O)NCC(C)C Amb17798304 [0,2,0,0,0,0|2,0,0]=4 7200 B8R0.9 CCC(=O)NCC(C)N Amb18631378 [0,2,0,0,0,0|2,0,0]=4 7201 B8R0.9 CCC(=O)NC[C@@H](C)O Amb25297640 [0,2,0,0,0,0|2,0,0]=4 7202 B8R0.9 CCC(=O)OCC(C)Cl Amb24729543 [0,2,0,0,0,0|2,0,0]=4 7203 B8R0.9 CCC(=O)OCC(O)=O Amb18642872 [0,2,0,0,0,0|0,0,1]=3 7204 B8R0.9 CCC(=O)SCC(C)Br Amb24398920 [0,2,0,0,0,0|2,0,0]=4 7205 B8R0.9 CCC(=O)\C=C\C(O)=O Amb18642585 [0,2,0,0,0,0|0,0,2]=4 7206 B8R0.9 CCC(=S)SCC(O)=O Amb24480232 [0,2,0,0,0,0|0,0,1]=3 7207 B8R0.9 CCC(Br)CCC(=O)Cl Amb25352038 [0,2,0,0,0,0|1,0,0]=3 7208 B8R0.9 CCC(Br)CCC(C)=O Amb24480025 [0,2,0,0,0,0|1,0,0]=3 7209 B8R0.9 CCC(Br)\C=C\C(C)=O Amb25800220 [0,2,0,0,0,0|1,0,1]=4 7210 B8R0.9 CCC(Br)\C=C\C(O)=O Amb18651360 [0,2,0,0,0,0|0,0,1]=3 7211 B8R0.9 CCC(C)=CCC(C)=O Amb24736154 [0,2,0,0,0,0|1,0,1]=4 7212 B8R0.9 CCC(C)C=CC(C)=O Amb24062970 [0,2,0,0,0,0|1,0,1]=4 7213 B8R0.9 CCC(C)CCB(O)O Amb25063737 [0,2,0,0,0,0|1,0,1]=4 7214 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,2,0,0,0,0|1,0,0]=3 7215 B8R0.9 CCC(C)CCC(C)O Amb22732215 [0,2,0,0,0,0|1,0,1]=4 7216 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,2,0,0,0,0|0,0,0]=2 7217 B8R0.9 CCC(C)CNC(C)=N Amb25770210 [0,2,0,0,0,0|2,0,0]=4 7218 B8R0.9 CCC(C)CNC(N)=N Amb25810483 [0,2,0,0,0,0|2,0,0]=4 7219 B8R0.9 CCC(C)CNC(N)=S Amb24436213 [0,2,0,0,0,0|1,1,0]=4 7220 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,2,0,0,0,0|1,0,0]=3 7221 B8R0.9 CCC(C)COC(C)=O Amb20621577 [0,2,0,0,0,0|1,0,0]=3 7222 B8R0.9 CCC(C)COC(N)=O Amb25188918 [0,2,0,0,0,0|1,0,0]=3 7223 B8R0.9 CCC(C)CSC(N)=N Amb25306741 [0,2,0,0,0,0|2,0,0]=4 7224 B8R0.9 CCC(C)NCC(=C)Br Amb19005214 [0,2,0,0,0,0|2,0,0]=4 7225 B8R0.9 CCC(C)NCC(=C)Cl Amb19004829 [0,2,0,0,0,0|2,0,0]=4 7226 B8R0.9 CCC(C)NCC(C)=O Amb25062894 [0,2,0,0,0,0|1,0,0]=3 7227 B8R0.9 CCC(C)OCC(=C)Br Amb24740504 [0,2,0,0,0,0|2,0,0]=4 7228 B8R0.9 CCC(C)OCC(N)=N Amb24501524 [0,2,0,0,0,0|2,0,0]=4 7229 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,2,0,0,0,0|0,0,0]=2 7230 B8R0.9 CCC(C)ONC(C)=O Amb24360136 [0,2,0,0,0,0|2,0,0]=4 7231 B8R0.9 CCC(C)ONC(N)=O Amb24618660 [0,2,0,0,0,0|2,0,0]=4 7232 B8R0.9 CCC(C)SCC(=C)Br Amb25696158 [0,2,0,0,0,0|2,0,0]=4 7233 B8R0.9 CCC(C)SCC(C)O Amb24738776 [0,2,0,0,0,0|1,0,1]=4 7234 B8R0.9 CCC(C)SC[C@@H](C)O Amb25283171 [0,2,0,0,0,0|1,0,1]=4 7235 B8R0.9 CCC(C)\C=C\C(O)=O Amb18988312 [0,2,0,0,0,0|0,0,1]=3 7236 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [0,2,0,0,0,0|0,0,1]=3 7237 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,2,0,0,0,0|1,0,0]=3 7238 B8R0.9 CCC(Cl)CCC(C)=C Amb24387453 [0,2,0,0,0,0|2,0,0]=4 7239 B8R0.9 CCC(Cl)CNC(C)=O Amb25292231 [0,2,0,0,0,0|1,0,0]=3 7240 B8R0.9 CCC(Cl)COC(N)=O Amb22274267 [0,2,0,0,0,0|1,0,0]=3 7241 B8R0.9 CCC(Cl)\C=C\C(C)=O Amb25060704 [0,2,0,0,0,0|1,0,1]=4 7242 B8R0.9 CCC(Cl)\C=C\C(O)=O Amb24714953 [0,2,0,0,0,0|0,0,1]=3 7243 B8R0.9 CCC(F)COC(C)=O Amb24361428 [0,2,0,0,0,0|1,0,0]=3 7244 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,2,0,0,0,0|0,0,0]=2 7245 B8R0.9 CCC(N)CCS(C)=O Amb25281105 [0,2,0,0,0,0|2,0,0]=4 7246 B8R0.9 CCC(N)CNC(C)=O Amb25256213 [0,2,0,0,0,0|1,0,0]=3 7247 B8R0.9 CCC(N)CNS(C)=O Amb25263509 [0,2,0,0,0,0|2,0,0]=4 7248 B8R0.9 CCC(NCC(=C)C)C Amb17308623 [0,2,0,0,0,0|2,0,0]=4 7249 B8R0.9 CCC(O)C#CC(N)=O Amb25070339 [0,2,0,0,0,0|1,0,1]=4 7250 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,2,0,0,0,0|1,0,1]=4 7251 B8R0.9 CCC(O)CCC(C)=C Amb25073903 [0,2,0,0,0,0|2,0,0]=4 7252 B8R0.9 CCC(O)CCC(C)=O Amb24586292 [0,2,0,0,0,0|1,0,0]=3 7253 B8R0.9 CCC(O)CNC(C)=O Amb24715716 [0,2,0,0,0,0|1,0,0]=3 7254 B8R0.9 CCC(O)CNS(C)=O Amb25176378 [0,2,0,0,0,0|2,0,0]=4 7255 B8R0.9 CCC(O)NCC(O)=O Amb24445948 [0,2,0,0,0,0|0,0,0]=2 7256 B8R0.9 CCC(O)\C=C\C(C)=O Amb25107127 [0,2,0,0,0,0|1,0,1]=4 7257 B8R0.9 CCC(O)\C=C\C(O)=O Amb25328660 [0,2,0,0,0,0|0,0,1]=3 7258 B8R0.9 CCC(S)\C=C\C(O)=O Amb18124688 [0,2,0,0,0,0|0,0,1]=3 7259 B8R0.9 CCN(C)CCC(C)=C Amb24501501 [0,2,0,0,0,0|2,0,0]=4 7260 B8R0.9 CCN(C)CCC(C)O Amb25306759 [0,2,0,0,0,0|1,0,1]=4 7261 B8R0.9 CCS(=O)CCC(C)=O Amb25765620 [0,2,0,0,0,0|1,0,0]=3 7262 B8R0.9 CCS(=O)CCC(C)C Amb24448788 [0,2,0,0,0,0|2,0,0]=4 7263 B8R0.9 CCS(=O)CCC(C)N Amb24383525 [0,2,0,0,0,0|2,0,0]=4 7264 B8R0.9 CCS(=O)NCC(C)=O Amb25177389 [0,2,0,0,0,0|2,0,0]=4 7265 B8R0.9 CC[C@@H](C)CCC(C)=O Amb24749043 [0,2,0,0,0,0|1,0,0]=3 7266 B8R0.9 CC[C@@H](C)CC[C@@H](C)O Amb22896942 [0,2,0,0,0,0|1,0,1]=4 7267 B8R0.9 CC[C@@H](C)CC[C@H](C)O Amb22896941 [0,2,0,0,0,0|1,0,1]=4 7268 B8R0.9 CC[C@@H](C)COC(N)=O Amb24586795 [0,2,0,0,0,0|1,0,0]=3 7269 B8R0.9 CC[C@@H](C)\C=C\C(O)=O Amb24117189 [0,2,0,0,0,0|0,0,1]=3 7270 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,2,0,0,0,0|0,0,0]=2 7271 B8R0.9 CC[C@@H](O)C#CC(O)=O Amb25785824 [0,2,0,0,0,0|0,0,1]=3 7272 B8R0.9 CC[C@H](C)CC[C@@H](C)O Amb25055436 [0,2,0,0,0,0|1,0,1]=4 7273 B8R0.9 CC[C@H](C)COC(N)=O Amb24333141 [0,2,0,0,0,0|1,0,0]=3 7274 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,2,0,0,0,0|0,0,0]=2 7275 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,2,0,0,0,0|0,0,0]=2 7276 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,2,0,0,0,0|0,0,0]=2 7277 B8R0.9 CC[C@H](N)CSC(N)=N Amb25328324 [0,2,0,0,0,0|2,0,0]=4 7278 B8R0.9 CC[C@H](O)CCC(N)=O Amb25785287 [0,2,0,0,0,0|1,0,0]=3 7279 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,2,0,0,0,0|0,0,0]=2 7280 B8R0.9 CC\C(\C)=C/CC(C)=O Amb24333826 [0,2,0,0,0,0|1,0,1]=4 7281 B8R0.9 CC\C(\C)=C\CC(C)=O Amb25773428 [0,2,0,0,0,0|1,0,1]=4 7282 B8R0.9 CN(C)CCC(=O)CS Amb25217335 [0,2,0,0,0,0|1,1,0]=4 7283 B8R0.9 CN(CCC(N)=O)C=O Amb25146008 [0,2,0,0,0,0|2,0,0]=4 7284 B8R0.9 CN(CCC(O)=O)C=O Amb18984989 [0,2,0,0,0,0|1,0,0]=3 7285 B8R0.9 CN(CCC(O)=O)N=O Amb22729196 [0,2,0,0,0,0|1,0,0]=3 7286 B8R0.9 CNC(=N)CCC(C)C Amb25303718 [0,2,0,0,0,0|2,0,0]=4 7287 B8R0.9 CNC(=N)NCC(O)=O Amb24655458 [0,2,0,0,0,0|1,0,1]=4 7288 B8R0.9 CNC(=N)SCC(O)=O Amb24403395 [0,2,0,0,0,0|1,0,1]=4 7289 B8R0.9 CNC(=O)CCC(=O)C Amb17334107 [0,2,0,0,0,0|1,0,1]=4 7290 B8R0.9 CNC(=O)CCC(=O)N Amb17334114 [0,2,0,0,0,0|1,0,1]=4 7291 B8R0.9 CNC(=O)CCC(C)Cl Amb25851798 [0,2,0,0,0,0|1,0,0]=3 7292 B8R0.9 CNC(=O)CCC(C)N Amb24477857 [0,2,0,0,0,0|1,0,0]=3 7293 B8R0.9 CNC(=O)CCC(O)C Amb17334125 [0,2,0,0,0,0|1,0,0]=3 7294 B8R0.9 CNC(=O)CCN(C)C Amb24735586 [0,2,0,0,0,0|2,0,0]=4 7295 B8R0.9 CNC(=O)CCS(C)=O Amb24476726 [0,2,0,0,0,0|2,0,0]=4 7296 B8R0.9 CNC(=O)CNC(O)=O Amb24740399 [0,2,0,0,0,0|1,0,1]=4 7297 B8R0.9 CNC(=O)COC(C)C Amb24481787 [0,2,0,0,0,0|2,0,0]=4 7298 B8R0.9 CNC(=O)CSC(C)C Amb25146039 [0,2,0,0,0,0|2,0,0]=4 7299 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,2,0,0,0,0|1,0,1]=4 7300 B8R0.9 CNC(=O)NCC(C)C Amb2132759 [0,2,0,0,0,0|2,0,0]=4 7301 B8R0.9 CNC(=O)SCC(C)C Amb24454948 [0,2,0,0,0,0|2,0,0]=4 7302 B8R0.9 CNC(=O)SCC(O)=O Amb24763198 [0,2,0,0,0,0|1,0,1]=4 7303 B8R0.9 CNC(=S)SCC(O)=O Amb24649902 [0,2,0,0,0,0|1,0,1]=4 7304 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,2,0,0,0,0|0,0,0]=2 7305 B8R0.9 CNC(C)CNC(N)=O Amb24405703 [0,2,0,0,0,0|2,0,0]=4 7306 B8R0.9 COC(=N)CCN(C)C Amb25278317 [0,2,0,0,0,0|2,0,0]=4 7307 B8R0.9 COC(=N)COC(C)C Amb25725252 [0,2,0,0,0,0|2,0,0]=4 7308 B8R0.9 COC(=N)CSC(C)C Amb25321840 [0,2,0,0,0,0|2,0,0]=4 7309 B8R0.9 COC(=O)C#CC(C)O Amb24475136 [0,2,0,0,0,0|0,0,2]=4 7310 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,2,0,0,0,0|2,0,0]=4 7311 B8R0.9 COC(=O)CCC(=O)C Amb13777321 [0,2,0,0,0,0|0,0,1]=3 7312 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,2,0,0,0,0|0,0,0]=2 7313 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,2,0,0,0,0|0,0,0]=2 7314 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,2,0,0,0,0|0,0,0]=2 7315 B8R0.9 COC(=O)CCC(Cl)Cl Amb25295532 [0,2,0,0,0,0|1,0,0]=3 7316 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,2,0,0,0,0|1,0,1]=4 7317 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,2,0,0,0,0|1,0,1]=4 7318 B8R0.9 COC(=O)CCS([O-])=O Amb21520328 [0,2,0,0,0,0|2,0,0]=4 7319 B8R0.9 COC(=O)CC[C@@H](C)Cl Amb24480241 [0,2,0,0,0,0|0,0,0]=2 7320 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,2,0,0,0,0|0,0,0]=2 7321 B8R0.9 COC(=O)CC[C@@H](C)O Amb22388487 [0,2,0,0,0,0|0,0,0]=2 7322 B8R0.9 COC(=O)CC[C@H](C)O Amb24351118 [0,2,0,0,0,0|0,0,0]=2 7323 B8R0.9 COC(=O)CNN(C)C Amb24693623 [0,2,0,0,0,0|2,0,0]=4 7324 B8R0.9 COC(=O)CNS(C)=O Amb24536728 [0,2,0,0,0,0|2,0,0]=4 7325 B8R0.9 COC(=O)COC(Cl)Cl Amb22230457 [0,2,0,0,0,0|2,0,0]=4 7326 B8R0.9 COC(=O)CSC(C)O Amb25032211 [0,2,0,0,0,0|1,0,0]=3 7327 B8R0.9 COC(=O)CSC(F)F Amb25834011 [0,2,0,0,0,0|2,0,0]=4 7328 B8R0.9 COC(=O)N=NC(C)N Amb25062994 [0,2,0,0,0,0|2,0,0]=4 7329 B8R0.9 COC(=O)NCC(C)C Amb17861777 [0,2,0,0,0,0|1,0,0]=3 7330 B8R0.9 COC(=O)NCC(F)F Amb24657916 [0,2,0,0,0,0|2,0,0]=4 7331 B8R0.9 COC(=O)NC[C@H](C)O Amb25111936 [0,2,0,0,0,0|1,0,0]=3 7332 B8R0.9 COC(=O)NNC(C)C Amb22496456 [0,2,0,0,0,0|2,0,0]=4 7333 B8R0.9 COC(=O)OCC(C)C Amb24416487 [0,2,0,0,0,0|1,0,0]=3 7334 B8R0.9 COC(=O)OCC(F)F Amb24088551 [0,2,0,0,0,0|2,0,0]=4 7335 B8R0.9 COC(=O)\C=C/C(C)C Amb10842318 [0,2,0,0,0,0|0,0,2]=4 7336 B8R0.9 COC(=O)\C=C\C(C)Br Amb25326817 [0,2,0,0,0,0|0,0,2]=4 7337 B8R0.9 COC(=O)\C=C\C(C)N Amb25212213 [0,2,0,0,0,0|0,0,2]=4 7338 B8R0.9 COC(=O)\C=C\[C@@H](C)O Amb24446167 [0,2,0,0,0,0|0,0,2]=4 7339 B8R0.9 COC(=O)\C=C\[C@H](C)N Amb25797312 [0,2,0,0,0,0|0,0,2]=4 7340 B8R0.9 COC(=S)NCC(C)C Amb24400051 [0,2,0,0,0,0|1,1,0]=4 7341 B8R0.9 COC(=S)NCC(O)=O Amb25146013 [0,2,0,0,0,0|1,0,1]=4 7342 B8R0.9 COC(=S)SCC(C)O Amb24575769 [0,2,0,0,0,0|1,1,0]=4 7343 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,2,0,0,0,0|0,0,0]=2 7344 B8R0.9 COC(C)CNC(C)=O Amb24574997 [0,2,0,0,0,0|2,0,0]=4 7345 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,2,0,0,0,0|2,0,0]=4 7346 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,2,0,0,0,0|2,0,0]=4 7347 B8R0.9 COC(C)OCC(O)=O Amb24417299 [0,2,0,0,0,0|1,0,0]=3 7348 B8R0.9 CON(C)CCC(C)N Amb24706009 [0,2,0,0,0,0|2,0,0]=4 7349 B8R0.9 COP(O)CCC(O)=O Amb22734636 [0,2,0,0,0,0|1,0,0]=3 7350 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,2,0,0,0,0|0,0,0]=2 7351 B8R0.9 CSC(=O)CCC(C)C Amb25743840 [0,2,0,0,0,0|0,1,0]=3 7352 B8R0.9 CSC(=O)NCC(C)C Amb24476657 [0,2,0,0,0,0|1,1,0]=4 7353 B8R0.9 CSC(=S)OCC(O)=O Amb25065342 [0,2,0,0,0,0|1,0,1]=4 7354 B8R0.9 CSC(=S)SCC(O)=O Amb24479938 [0,2,0,0,0,0|1,0,1]=4 7355 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,2,0,0,0,0|0,0,0]=2 7356 B8R0.9 CSC(C)CNC(C)=O Amb25744770 [0,2,0,0,0,0|2,0,0]=4 7357 B8R0.9 CSC(C)CNC(N)=O Amb25688045 [0,2,0,0,0,0|2,0,0]=4 7358 B8R0.9 C[C@@H](CBr)CCC(O)=O Amb24458738 [0,2,0,0,0,0|0,0,0]=2 7359 B8R0.9 C[C@@H](CBr)COC(C)=O Amb24373843 [0,2,0,0,0,0|2,0,0]=4 7360 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,2,0,0,0,0|0,0,0]=2 7361 B8R0.9 C[C@@H](CCC(C)=O)C=O Amb24441758 [0,2,0,0,0,0|1,0,0]=3 7362 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [0,2,0,0,0,0|0,0,0]=2 7363 B8R0.9 C[C@@H](CC[C@@H](C)O)C=C Amb25369343 [0,2,0,0,0,0|1,0,1]=4 7364 B8R0.9 C[C@@H](CC[C@H](C)O)C=C Amb24502362 [0,2,0,0,0,0|1,0,1]=4 7365 B8R0.9 C[C@@H](CO)NCC(C)=O Amb24693447 [0,2,0,0,0,0|2,0,0]=4 7366 B8R0.9 C[C@@H](N)COC(=O)CN Amb25848264 [0,2,0,0,0,0|2,0,0]=4 7367 B8R0.9 C[C@@H](O)CC[C@H](C)CO Amb25271414 [0,2,0,0,0,0|1,0,1]=4 7368 B8R0.9 C[C@@H](O)CC[C@H](O)CO Amb25346392 [0,2,0,0,0,0|0,0,2]=4 7369 B8R0.9 C[C@@H](O)CNC(=O)C#C Amb25185202 [0,2,0,0,0,0|2,0,0]=4 7370 B8R0.9 C[C@H](CCC(O)=O)C#C Amb25250566 [0,2,0,0,0,0|0,0,0]=2 7371 B8R0.9 C[C@H](CO)CNC(N)=O Amb25715034 [0,2,0,0,0,0|2,0,0]=4 7372 B8R0.9 C[C@H](CO)COC(C)=O Amb25846526 [0,2,0,0,0,0|2,0,0]=4 7373 B8R0.9 C[C@H](O)CCC(=O)NN Amb24395110 [0,2,0,0,0,0|1,0,0]=3 7374 B8R0.9 C[C@H](O)CCC(C)=C=C Amb25256642 [0,2,0,0,0,0|2,0,0]=4 7375 B8R0.9 C[C@H](O)CC[C@H](O)CC Amb25794691 [0,2,0,0,0,0|1,0,1]=4 7376 B8R0.9 C[C@H](O)CC[C@H](O)CO Amb24363660 [0,2,0,0,0,0|0,0,2]=4 7377 B8R0.9 C[C@H](O)CNC(=O)C#C Amb25731135 [0,2,0,0,0,0|2,0,0]=4 7378 B8R0.9 C[C@H](O)CNC(=O)C=C Amb24702296 [0,2,0,0,0,0|2,0,0]=4 7379 B8R0.9 C[C@H](O)CNC(=O)CBr Amb24567754 [0,2,0,0,0,0|2,0,0]=4 7380 B8R0.9 C[C@H](O)COC(=O)C=C Amb25284367 [0,2,0,0,0,0|2,0,0]=4 7381 B8R0.9 C\C(\C=C)=C/CC(O)=O Amb25305754 [0,2,0,0,0,0|0,0,2]=4 7382 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [0,2,0,0,0,0|0,0,1]=3 7383 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [0,2,0,0,0,0|1,0,1]=4 7384 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [0,2,0,0,0,0|1,0,1]=4 7385 B8R0.9 C\C(\CCC(C)=O)=N/O Amb24422445 [0,2,0,0,0,0|1,0,1]=4 7386 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [0,2,0,0,0,0|0,0,1]=3 7387 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [0,2,0,0,0,0|0,0,1]=3 7388 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [0,2,0,0,0,0|0,0,1]=3 7389 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [0,2,0,0,0,0|0,0,1]=3 7390 B8R0.9 C\C=C(\C)/CCC(C)O Amb24646058 [0,2,0,0,0,0|2,0,0]=4 7391 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [0,2,0,0,0,0|0,0,1]=3 7392 B8R0.9 ClCC(=O)NCC(C)C Amb1160207 [0,2,0,0,0,0|2,0,0]=4 7393 B8R0.9 NC(=O)CCC(=O)NO Amb24340146 [0,2,0,0,0,0|1,0,1]=4 7394 B8R0.9 NC(=O)NCC(O)CO Amb25146091 [0,2,0,0,0,0|2,0,0]=4 7395 B8R0.9 NC(=O)NCC(S)CS Amb25337646 [0,2,0,0,0,0|2,0,0]=4 7396 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,2,0,0,0,0|2,0,0]=4 7397 B8R0.9 NC(=O)OCC(O)CO Amb24683881 [0,2,0,0,0,0|2,0,0]=4 7398 B8R0.9 NC(C=C)CCC(=O)O Amb10843623 [0,2,0,0,0,0|0,0,1]=3 7399 B8R0.9 NC(CCC(N)=O)C#N Amb24340237 [0,2,0,0,0,0|1,0,1]=4 7400 B8R0.9 NC(CCC(O)=O)CO Amb18642916 [0,2,0,0,0,0|0,0,0]=2 7401 B8R0.9 NC(CF)CCC(N)=O Amb24599972 [0,2,0,0,0,0|1,0,0]=3 7402 B8R0.9 NC(CF)CCC(O)=O Amb19148378 [0,2,0,0,0,0|0,0,0]=2 7403 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,2,0,0,0,0|0,0,1]=3 7404 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,2,0,0,0,0|1,0,1]=4 7405 B8R0.9 NCC(=O)NCC(C)C Amb13951745 [0,2,0,0,0,0|2,0,0]=4 7406 B8R0.9 NCC(=O)OCC(O)=O Amb25710415 [0,2,0,0,0,0|1,0,1]=4 7407 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,2,0,0,0,0|0,0,1]=3 7408 B8R0.9 NCC(=S)NCC(O)=O Amb25077168 [0,2,0,0,0,0|1,0,1]=4 7409 B8R0.9 NCC(N)CCC(O)=O Amb19328773 [0,2,0,0,0,0|0,0,0]=2 7410 B8R0.9 NCC(O)CCC(N)=O Amb24340194 [0,2,0,0,0,0|1,0,0]=3 7411 B8R0.9 NCC(O)CCC(O)=O Amb18124376 [0,2,0,0,0,0|0,0,0]=2 7412 B8R0.9 NCC(O)CCP(O)=O Amb24760103 [0,2,0,0,0,0|1,0,0]=3 7413 B8R0.9 NC[C@H](O)CCC(O)=O Amb24383262 [0,2,0,0,0,0|0,0,0]=2 7414 B8R0.9 NNC(=O)CCC(F)F Amb22896655 [0,2,0,0,0,0|2,0,0]=4 7415 B8R0.9 NNC(=O)CCC(O)=O Amb22270256 [0,2,0,0,0,0|1,0,1]=4 7416 B8R0.9 NNC(=O)COC(C)C Amb2089067 [0,2,0,0,0,0|2,0,0]=4 7417 B8R0.9 NNC(=O)COC(C)C Amb2189164 [0,2,0,0,0,0|2,0,0]=4 7418 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,2,0,0,0,0|0,0,1]=3 7419 B8R0.9 N[C@@H](CCC(N)=O)C=O Amb25104754 [0,2,0,0,0,0|1,0,1]=4 7420 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [0,2,0,0,0,0|0,0,1]=3 7421 B8R0.9 N[C@@H](CCC(O)=O)CO Amb24685421 [0,2,0,0,0,0|0,0,0]=2 7422 B8R0.9 N[C@H](C=C)CCC(=O)O Amb17621248 [0,2,0,0,0,0|0,0,1]=3 7423 B8R0.9 N[C@H](CCC(O)=O)CO Amb25352213 [0,2,0,0,0,0|0,0,0]=2 7424 B8R0.9 N[C@H](CF)CCC(O)=O Amb25339395 [0,2,0,0,0,0|0,0,0]=2 7425 B8R0.9 N[C@H](CO)CCC(N)=O Amb24368577 [0,2,0,0,0,0|1,0,0]=3 7426 B8R0.9 N[C@H](CS)CCC(O)=O Amb25348403 [0,2,0,0,0,0|0,0,0]=2 7427 B8R0.9 O=NN(CCC(=O)O)C Amb17618592 [0,2,0,0,0,0|1,0,0]=3 7428 B8R0.9 OC(=O)CCC(=O)C=O Amb18642737 [0,2,0,0,0,0|0,0,2]=4 7429 B8R0.9 OC(=O)CCC(=O)CBr Amb18652012 [0,2,0,0,0,0|0,0,1]=3 7430 B8R0.9 OC(=O)CCC(=O)CCl Amb25736440 [0,2,0,0,0,0|0,0,1]=3 7431 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,2,0,0,0,0|0,0,1]=3 7432 B8R0.9 OC(=O)CCC(Br)CBr Amb24575822 [0,2,0,0,0,0|0,0,0]=2 7433 B8R0.9 OC(=O)CCC([NH3+])C=C Amb10845648 [0,2,0,0,0,0|0,0,1]=3 7434 B8R0.9 OC(=O)CNC(=O)CBr Amb18130258 [0,2,0,0,0,0|1,0,1]=4 7435 B8R0.9 OC(=O)CNC(=O)CCl Amb1144436 [0,2,0,0,0,0|1,0,1]=4 7436 B8R0.9 OC(=O)CNC(=O)CO Amb18124375 [0,2,0,0,0,0|1,0,1]=4 7437 B8R0.9 OC(=O)COC(=O)CCl Amb18644547 [0,2,0,0,0,0|1,0,1]=4 7438 B8R0.9 OC(CBr)\C=C\C(O)=O Amb18647817 [0,2,0,0,0,0|0,0,2]=4 7439 B8R0.9 OC(CCC(O)=O)=NO Amb24745795 [0,2,0,0,0,0|1,0,1]=4 7440 B8R0.9 OC(CCl)COS(O)=O Amb24726370 [0,2,0,0,0,0|2,0,0]=4 7441 B8R0.9 OC(CS)COP(O)=O Amb24523020 [0,2,0,0,0,0|2,0,0]=4 7442 B8R0.9 OCC(O)CCC(O)=O Amb18124400 [0,2,0,0,0,0|0,0,0]=2 7443 B8R0.9 OCC(O)COP(O)=O Amb25071391 [0,2,0,0,0,0|2,0,0]=4 7444 B8R0.9 OCC(O)\C=C\C(O)=O Amb18642875 [0,2,0,0,0,0|0,0,2]=4 7445 B8R0.9 OC[C@H](O)CCC(O)=O Amb24528896 [0,2,0,0,0,0|0,0,0]=2 7446 B8R0.9 ONC(=O)CCC(F)F Amb24414532 [0,2,0,0,0,0|1,0,0]=3 7447 B8R0.9 ONC(=O)COC(F)F Amb24457485 [0,2,0,0,0,0|2,0,0]=4 7448 B8R0.9 O\N=C(\CCN(C)C)/N Amb1118599 [0,2,0,0,0,0|2,0,0]=4 7449 B8R0.9 [O-][N+](=O)CC[C@H](CO)C Amb13883660 [0,2,0,0,0,0|1,0,1]=4 7450 B8R0.11 CC=C(CCCC)C=O Amb25245395 [0,2,0,0,0,0|1,0,0]=3 7451 B8R0.11 CCC(CCOC)=NO Amb24359778 [0,2,0,0,0,0|2,0,0]=4 7452 B8R0.11 CCCC=C(CO)CO Amb25145401 [0,2,0,0,0,0|0,0,2]=4 7453 B8R0.11 CCCCC(C#N)OC Amb24478747 [0,2,0,0,0,0|1,0,1]=4 7454 B8R0.11 CCCCC(C=C)C=O Amb18642451 [0,2,0,0,0,0|1,0,1]=4 7455 B8R0.11 CCCCC(C=O)C=O Amb24365233 [0,2,0,0,0,0|0,0,2]=4 7456 B8R0.11 CCCCC(C=O)ON Amb24378311 [0,2,0,0,0,0|0,0,1]=3 7457 B8R0.11 CCCCC(C=O)SC Amb18124546 [0,2,0,0,0,0|0,1,1]=4 7458 B8R0.11 CCCCC(CBr)=C=C Amb24652312 [0,2,0,0,0,0|2,0,0]=4 7459 B8R0.11 CCCCC(CC)=CN Amb24392940 [0,2,0,0,0,0|2,0,0]=4 7460 B8R0.11 CCCCC(CC)=NN Amb24705332 [0,2,0,0,0,0|2,0,0]=4 7461 B8R0.11 CCCCC(CC)=NO Amb25785906 [0,2,0,0,0,0|1,0,0]=3 7462 B8R0.11 CCCCC(CC)NO Amb25776700 [0,2,0,0,0,0|1,0,1]=4 7463 B8R0.11 CCCCC(CCl)=NO Amb24359795 [0,2,0,0,0,0|1,0,0]=3 7464 B8R0.11 CCCCC(CN)=C=C Amb25105005 [0,2,0,0,0,0|2,0,0]=4 7465 B8R0.11 CCCCC(CO)C#N Amb18642523 [0,2,0,0,0,0|1,0,1]=4 7466 B8R0.11 CCCCC(CO)CBr Amb24692854 [0,2,0,0,0,0|1,0,1]=4 7467 B8R0.11 CCCCC(CO)CCl Amb25736310 [0,2,0,0,0,0|1,0,1]=4 7468 B8R0.11 CCCCC(CO)CS Amb25353589 [0,2,0,0,0,0|0,1,1]=4 7469 B8R0.11 CCCCC(CO)NC Amb24120141 [0,2,0,0,0,0|1,0,1]=4 7470 B8R0.11 CCCCC(CO)NN Amb24641344 [0,2,0,0,0,0|1,0,1]=4 7471 B8R0.11 CCCCC(NC)=NN Amb24690366 [0,2,0,0,0,0|2,0,0]=4 7472 B8R0.11 CCCCC(NC)=NO Amb25107830 [0,2,0,0,0,0|1,0,0]=3 7473 B8R0.11 CCCCN(CC)C=O Amb25147037 [0,2,0,0,0,0|2,0,0]=4 7474 B8R0.11 CCCCN(CC)N=O Amb22055949 [0,2,0,0,0,0|2,0,0]=4 7475 B8R0.11 CCCC[C@H](CO)NC Amb25737791 [0,2,0,0,0,0|1,0,1]=4 7476 B8R0.11 CCCC\C(=C/O)\C=O Amb25258703 [0,2,0,0,0,0|0,0,0]=2 7477 B8R0.11 CCCC\C(=C\Cl)\OC Amb25684728 [0,2,0,0,0,0|1,0,0]=3 7478 B8R0.11 CCCC\C(\C=O)=C/Cl Amb25137175 [0,2,0,0,0,0|1,0,0]=3 7479 B8R0.11 CCCC\C(\C=O)=N/O Amb24706996 [0,2,0,0,0,0|0,0,0]=2 7480 B8R0.11 CCCC\C(\CC)=C\Br Amb25116108 [0,2,0,0,0,0|2,0,0]=4 7481 B8R0.11 CCCC\C(\CC)=C\Cl Amb24725097 [0,2,0,0,0,0|2,0,0]=4 7482 B8R0.11 CCC\C=C(/C=O)\OC Amb24604797 [0,2,0,0,0,0|0,0,1]=3 7483 B8R0.11 CCC\C=C(\CC)/C=O Amb24553023 [0,2,0,0,0,0|1,0,1]=4 7484 B8R0.11 CCC\C=C(\CCl)/C=O Amb25177240 [0,2,0,0,0,0|1,0,1]=4 7485 B8R0.11 CCOCC(=CO)C#N Amb25741449 [0,2,0,0,0,0|2,0,0]=4 7486 B8R0.11 COC(CCSC)C=O Amb24678003 [0,2,0,0,0,0|1,0,1]=4 7487 B8R0.11 COCCC(C=O)OC Amb25081460 [0,2,0,0,0,0|1,0,1]=4 7488 B8R0.11 CO\C(\C=O)=C\OCC Amb24513208 [0,2,0,0,0,0|1,0,1]=4 7489 B8R0.11 C\C=C(/CCCC)\C=O Amb25116171 [0,2,0,0,0,0|1,0,0]=3 7490 B8R0.11 C\C=C(/CCCO)\C=O Amb18642662 [0,2,0,0,0,0|2,0,0]=4 7491 B8R0.11 N\C=C(\CCCO)/C=O Amb25307863 [0,2,0,0,0,0|2,0,0]=4 7492 B8R0.25 CC(C#C)(CCCC)O Amb1063489 [0,2,0,0,0,0|1,0,1]=4 7493 B8R0.25 CC(C=O)(CCCC)O Amb10558485 [0,2,0,0,0,0|0,0,1]=3 7494 B8R0.25 CCCCC(C)(C)C=O Amb18642677 [0,2,0,0,0,0|1,0,1]=4 7495 B8R0.25 CCCCC(C)(C)CO Amb22228162 [0,2,0,0,0,0|1,0,1]=4 7496 B8R0.25 CCCCC(C)(O)C#N Amb25278419 [0,2,0,0,0,0|1,0,1]=4 7497 B8R0.25 CCCCC(C)(O)C=C Amb24590087 [0,2,0,0,0,0|1,0,1]=4 7498 B8R0.25 CCCCC(C)(O)CCl Amb25760612 [0,2,0,0,0,0|1,0,1]=4 7499 B8R0.25 CCCCC(C)(O)CN Amb22713404 [0,2,0,0,0,0|1,0,1]=4 7500 B8R0.25 CCCCC(C)(O)CO Amb24705628 [0,2,0,0,0,0|0,0,2]=4 7501 B8R0.25 CCCCC(Cl)(Cl)CO Amb25246220 [0,2,0,0,0,0|1,0,1]=4 7502 B8R0.25 CCCCP(=O)(Cl)OC Amb25288638 [0,2,0,0,0,0|1,0,0]=3 7503 B8R0.25 CCCCS(=O)(=O)C=C Amb1085957 [0,2,0,0,0,0|1,0,1]=4 7504 B8R0.25 CCCCS(=O)(=O)NC Amb1134930 [0,2,0,0,0,0|1,0,1]=4 7505 B8R0.25 CCCCS(=O)(=O)NO Amb17232119 [0,2,0,0,0,0|1,0,0]=3 7506 B8R0.25 CCCCS(=O)(=O)OF Amb22232398 [0,2,0,0,0,0|1,0,0]=3 7507 B8R0.25 CCCC[C@@](C)(N)CO Amb24477829 [0,2,0,0,0,0|1,0,1]=4 7508 B8R0.25 CCCC[C@@](C)(O)C#N Amb25844469 [0,2,0,0,0,0|1,0,1]=4 7509 B8R0.25 CCCC[C@](C)(O)C=O Amb25338064 [0,2,0,0,0,0|0,0,1]=3 7510 B8R0.25 CCCC[C@](C)(O)CO Amb25279866 [0,2,0,0,0,0|0,0,2]=4 7511 B8R0.25 CCCC[Si](C)(C)CO Amb25235773 [0,2,0,0,0,0|1,1,0]=4 7512 B8R0.25 CCCOP(O)(=O)CCl Amb24724250 [0,2,0,0,0,0|2,0,0]=4 7513 B8R0.25 COP(O)(=O)CCCN Amb24353336 [0,2,0,0,0,0|2,0,0]=4 7514 B8R0.25 COP(O)(=O)CCCO Amb25317434 [0,2,0,0,0,0|2,0,0]=4 7515 B8R0.25 NCCCP(O)(=O)CN Amb25697100 [0,2,0,0,0,0|2,0,0]=4 7516 B8R0.7 BrCCCCCC(=O)O Amb2081955 [0,2,0,0,0,0|0,0,0]=2 7517 B8R0.7 C#CCCC#CC(O)=O Amb24424350 [0,2,0,0,0,0|0,0,2]=4 7518 B8R0.7 C#CCCCCC(N)=N Amb24569257 [0,2,0,0,0,0|2,0,0]=4 7519 B8R0.7 C#CCCCCC(N)=O Amb25112030 [0,2,0,0,0,0|1,0,0]=3 7520 B8R0.7 C#CCCCNC(N)=O Amb25682160 [0,2,0,0,0,0|1,0,1]=4 7521 B8R0.7 C#CCCNCC(N)=O Amb25362968 [0,2,0,0,0,0|1,0,1]=4 7522 B8R0.7 C#CCC\C=C\C(O)=O Amb24622206 [0,2,0,0,0,0|0,0,2]=4 7523 B8R0.7 C#CCONCC(O)=O Amb25084161 [0,2,0,0,0,0|0,0,2]=4 7524 B8R0.7 C=C(Br)CNCCCN Amb18330318 [0,2,0,0,0,0|2,0,0]=4 7525 B8R0.7 C=C(Br)CNCCCO Amb19051448 [0,2,0,0,0,0|2,0,0]=4 7526 B8R0.7 C=C(Br)COCCCN Amb18324685 [0,2,0,0,0,0|2,0,0]=4 7527 B8R0.7 C=C(Br)COCCCO Amb24534702 [0,2,0,0,0,0|2,0,0]=4 7528 B8R0.7 C=C(Cl)CNCCCN Amb25180017 [0,2,0,0,0,0|2,0,0]=4 7529 B8R0.7 C=C(Cl)CNCCCO Amb25363015 [0,2,0,0,0,0|2,0,0]=4 7530 B8R0.7 C=C(Cl)COCCCO Amb25240270 [0,2,0,0,0,0|2,0,0]=4 7531 B8R0.7 C=C(Cl)CSCCCN Amb25094992 [0,2,0,0,0,0|2,0,0]=4 7532 B8R0.7 C=CCCCCB(O)O Amb20171333 [0,2,0,0,0,0|1,0,1]=4 7533 B8R0.7 C=CCCCCC(=O)Cl Amb24528269 [0,2,0,0,0,0|1,0,0]=3 7534 B8R0.7 C=CCCCCC(N)=N Amb24622060 [0,2,0,0,0,0|2,0,0]=4 7535 B8R0.7 C=CCCCNC(N)=O Amb25834820 [0,2,0,0,0,0|1,0,1]=4 7536 B8R0.7 C=CCCNCC(N)=O Amb25746697 [0,2,0,0,0,0|1,0,1]=4 7537 B8R0.7 C=CCCNCC(O)=O Amb25308652 [0,2,0,0,0,0|0,0,1]=3 7538 B8R0.7 C=CCCOCC(N)=O Amb24502598 [0,2,0,0,0,0|1,0,1]=4 7539 B8R0.7 C=CCC\C=C\C(O)=O Amb25756053 [0,2,0,0,0,0|0,0,2]=4 7540 B8R0.7 C=CCNCCC(N)=O Amb19960043 [0,2,0,0,0,0|1,0,1]=4 7541 B8R0.7 C=CCSCCC(N)=O Amb25828040 [0,2,0,0,0,0|1,0,1]=4 7542 B8R0.7 C=CC\C=C\CC(O)=O Amb18642408 [0,2,0,0,0,0|0,0,2]=4 7543 B8R0.7 C=CNCCCC(O)=O Amb25146209 [0,2,0,0,0,0|0,0,1]=3 7544 B8R0.7 CC#CCCCC(C)=O Amb24591411 [0,2,0,0,0,0|1,0,0]=3 7545 B8R0.7 CC#CCCCC(C)O Amb25280700 [0,2,0,0,0,0|1,0,1]=4 7546 B8R0.7 CC#CCCC[C@H](C)O Amb25794779 [0,2,0,0,0,0|1,0,1]=4 7547 B8R0.7 CC#CCCNC(N)=O Amb25829038 [0,2,0,0,0,0|1,0,1]=4 7548 B8R0.7 CC#CCCOC(N)=O Amb24658255 [0,2,0,0,0,0|1,0,1]=4 7549 B8R0.7 CC#CCNCC(N)=O Amb24759029 [0,2,0,0,0,0|1,0,1]=4 7550 B8R0.7 CC#CCOCC(C)=O Amb25112537 [0,2,0,0,0,0|1,0,1]=4 7551 B8R0.7 CC#CCSCC(O)=O Amb19021078 [0,2,0,0,0,0|0,0,1]=3 7552 B8R0.7 CC(=C)CCCCCN Amb24481805 [0,2,0,0,0,0|2,0,0]=4 7553 B8R0.7 CC(=C)CCNCCF Amb25315419 [0,2,0,0,0,0|2,0,0]=4 7554 B8R0.7 CC(=C)CCNCCN Amb24481806 [0,2,0,0,0,0|2,0,0]=4 7555 B8R0.7 CC(=C)CCNCCO Amb25189006 [0,2,0,0,0,0|2,0,0]=4 7556 B8R0.7 CC(=C)CCOCCCl Amb24684688 [0,2,0,0,0,0|2,0,0]=4 7557 B8R0.7 CC(=C)CCOCCS Amb25331620 [0,2,0,0,0,0|2,0,0]=4 7558 B8R0.7 CC(=C)COCCCO Amb25185310 [0,2,0,0,0,0|2,0,0]=4 7559 B8R0.7 CC(=C)CSCCCF Amb24424364 [0,2,0,0,0,0|2,0,0]=4 7560 B8R0.7 CC(=N)NCCCCF Amb24528163 [0,2,0,0,0,0|2,0,0]=4 7561 B8R0.7 CC(=N)NCCCCN Amb25716162 [0,2,0,0,0,0|2,0,0]=4 7562 B8R0.7 CC(=O)CCCC=C=C Amb24620056 [0,2,0,0,0,0|1,0,1]=4 7563 B8R0.7 CC(=O)CCCCC#C Amb25303675 [0,2,0,0,0,0|1,0,0]=3 7564 B8R0.7 CC(=O)CCCCC#N Amb18642300 [0,2,0,0,0,0|1,0,0]=3 7565 B8R0.7 CC(=O)CCCCC=C Amb24546961 [0,2,0,0,0,0|1,0,0]=3 7566 B8R0.7 CC(=O)CCCCC=O Amb18642609 [0,2,0,0,0,0|1,0,0]=3 7567 B8R0.7 CC(=O)CCCCCF Amb25373197 [0,2,0,0,0,0|1,0,0]=3 7568 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,2,0,0,0,0|1,0,0]=3 7569 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,2,0,0,0,0|1,0,0]=3 7570 B8R0.7 CC(=O)CCNCC=C Amb18642536 [0,2,0,0,0,0|1,0,1]=4 7571 B8R0.7 CC(=O)CCNCCO Amb24481900 [0,2,0,0,0,0|1,0,0]=3 7572 B8R0.7 CC(=O)CCOCCN Amb18628609 [0,2,0,0,0,0|1,0,0]=3 7573 B8R0.7 CC(=O)CCOCCO Amb24691100 [0,2,0,0,0,0|1,0,0]=3 7574 B8R0.7 CC(=O)CCSCC#N Amb18927970 [0,2,0,0,0,0|1,0,1]=4 7575 B8R0.7 CC(=O)CC\C=C/CBr Amb24480047 [0,2,0,0,0,0|1,0,1]=4 7576 B8R0.7 CC(=O)CC\C=C\CBr Amb24650377 [0,2,0,0,0,0|1,0,1]=4 7577 B8R0.7 CC(=O)CC\C=C\CO Amb24614693 [0,2,0,0,0,0|1,0,1]=4 7578 B8R0.7 CC(=O)COCCC#N Amb24357135 [0,2,0,0,0,0|1,0,1]=4 7579 B8R0.7 CC(=O)COCCCF Amb24696366 [0,2,0,0,0,0|1,0,0]=3 7580 B8R0.7 CC(=O)COCCCN Amb18630475 [0,2,0,0,0,0|1,0,0]=3 7581 B8R0.7 CC(=O)CSCCC=C Amb24481903 [0,2,0,0,0,0|1,0,1]=4 7582 B8R0.7 CC(=O)C\C=C\CCBr Amb24357455 [0,2,0,0,0,0|1,0,1]=4 7583 B8R0.7 CC(=O)C\C=C\CCCl Amb25729220 [0,2,0,0,0,0|1,0,1]=4 7584 B8R0.7 CC(=O)NCCCC#C Amb24477716 [0,2,0,0,0,0|1,0,1]=4 7585 B8R0.7 CC(=O)NCCCC=O Amb22896811 [0,2,0,0,0,0|1,0,1]=4 7586 B8R0.7 CC(=O)NCCCCN Amb21520291 [0,2,0,0,0,0|1,0,0]=3 7587 B8R0.7 CC(=O)NNCCCN Amb25726088 [0,2,0,0,0,0|2,0,0]=4 7588 B8R0.7 CC(=O)OCCCCF Amb24393797 [0,2,0,0,0,0|1,0,0]=3 7589 B8R0.7 CC(=O)OCCCCN Amb24657282 [0,2,0,0,0,0|1,0,0]=3 7590 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,2,0,0,0,0|1,0,0]=3 7591 B8R0.7 CC(=O)OCCCCS Amb24431588 [0,2,0,0,0,0|1,0,0]=3 7592 B8R0.7 CC(=O)OCOCCCl Amb25145955 [0,2,0,0,0,0|2,0,0]=4 7593 B8R0.7 CC(=O)OCSCCO Amb24733466 [0,2,0,0,0,0|2,0,0]=4 7594 B8R0.7 CC(=O)SCCCC=O Amb22524698 [0,2,0,0,0,0|1,0,1]=4 7595 B8R0.7 CC(=O)SCCCCBr Amb22641871 [0,2,0,0,0,0|1,0,0]=3 7596 B8R0.7 CC(=O)SCCCCN Amb24117263 [0,2,0,0,0,0|1,0,0]=3 7597 B8R0.7 CC(=O)SCCCCO Amb25049205 [0,2,0,0,0,0|1,0,0]=3 7598 B8R0.7 CC(=O)\C=C\CCCBr Amb24480224 [0,2,0,0,0,0|1,0,1]=4 7599 B8R0.7 CC(=S)SCCCCCl Amb25708465 [0,2,0,0,0,0|1,1,0]=4 7600 B8R0.7 CC(Br)=CCCCCO Amb24592453 [0,2,0,0,0,0|2,0,0]=4 7601 B8R0.7 CC(O)CCCCC=C Amb25724721 [0,2,0,0,0,0|1,0,1]=4 7602 B8R0.7 CC(O)CCCCC=O Amb25366189 [0,2,0,0,0,0|1,0,1]=4 7603 B8R0.7 CC(O)CCCCCN Amb24761457 [0,2,0,0,0,0|1,0,1]=4 7604 B8R0.7 CC(O)CCNCCO Amb25274565 [0,2,0,0,0,0|1,0,1]=4 7605 B8R0.7 CC(O)CCSCCN Amb25347026 [0,2,0,0,0,0|1,0,1]=4 7606 B8R0.7 CC(O)CNCCCS Amb24524151 [0,2,0,0,0,0|1,0,1]=4 7607 B8R0.7 CC(O)COCCCO Amb25266204 [0,2,0,0,0,0|1,0,1]=4 7608 B8R0.7 CC(O)CSCCCN Amb25188929 [0,2,0,0,0,0|1,0,1]=4 7609 B8R0.7 CC(O)CSCCCO Amb25188928 [0,2,0,0,0,0|1,0,1]=4 7610 B8R0.7 CCCC#CCC(=O)O Amb17593307 [0,2,0,0,0,0|0,0,0]=2 7611 B8R0.7 CCCC/C=C/C(O)=O Amb17778752 [0,2,0,0,0,0|0,0,0]=2 7612 B8R0.7 CCCC/C=C/C([O-])=O Amb17778116 [0,2,0,0,0,0|0,0,1]=3 7613 B8R0.7 CCCC=C=CC(C)=O Amb24061645 [0,2,0,0,0,0|1,0,1]=4 7614 B8R0.7 CCCC=C=CC(N)=O Amb25307861 [0,2,0,0,0,0|1,0,1]=4 7615 B8R0.7 CCCC=C=CC(O)=O Amb24407382 [0,2,0,0,0,0|0,0,1]=3 7616 B8R0.7 CCCC=NNC(N)=O Amb25690939 [0,2,0,0,0,0|1,0,1]=4 7617 B8R0.7 CCCCC#CC(=O)C Amb17593278 [0,2,0,0,0,0|1,0,0]=3 7618 B8R0.7 CCCCC#CC(O)O Amb24372063 [0,2,0,0,0,0|0,0,2]=4 7619 B8R0.7 CCCCC#C[C@H](C)O Amb25333630 [0,2,0,0,0,0|1,0,1]=4 7620 B8R0.7 CCCCCC=C(C)C Amb22730264 [0,2,0,0,0,0|2,0,0]=4 7621 B8R0.7 CCCCCC=C(F)F Amb10840486 [0,2,0,0,0,0|2,0,0]=4 7622 B8R0.7 CCCCCCC(N)O Amb25368398 [0,2,0,0,0,0|1,0,1]=4 7623 B8R0.7 CCCCCCC([O-])=O Amb22729026 [0,2,0,0,0,0|0,0,1]=3 7624 B8R0.7 CCCCCCS(O)=O Amb25213753 [0,2,0,0,0,0|1,0,0]=3 7625 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [0,2,0,0,0,0|1,0,1]=4 7626 B8R0.7 CCCCCNC(=O)Cl Amb25087634 [0,2,0,0,0,0|1,0,0]=3 7627 B8R0.7 CCCCCNC(C)=O Amb17797593 [0,2,0,0,0,0|1,0,0]=3 7628 B8R0.7 CCCCCNC(C)=S Amb24364558 [0,2,0,0,0,0|1,1,0]=4 7629 B8R0.7 CCCCCNC(N)=N Amb19416708 [0,2,0,0,0,0|2,0,0]=4 7630 B8R0.7 CCCCCNC(S)=S Amb25032265 [0,2,0,0,0,0|0,2,0]=4 7631 B8R0.7 CCCCCOB(O)O Amb24716868 [0,2,0,0,0,0|1,0,1]=4 7632 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [0,2,0,0,0,0|1,0,0]=3 7633 B8R0.7 CCCCCOC(C)=O Amb22351262 [0,2,0,0,0,0|1,0,0]=3 7634 B8R0.7 CCCCCOC([S-])=S Amb22334083 [0,2,0,0,0,0|0,2,0]=4 7635 B8R0.7 CCCCCOS(O)=O Amb22730504 [0,2,0,0,0,0|1,0,0]=3 7636 B8R0.7 CCCCCO[N+]([O-])=O Amb22729008 [0,2,0,0,0,0|1,0,1]=4 7637 B8R0.7 CCCCCSC(N)=N Amb20675976 [0,2,0,0,0,0|2,0,0]=4 7638 B8R0.7 CCCCCSC(N)=N Amb23590643 [0,2,0,0,0,0|2,0,0]=4 7639 B8R0.7 CCCCNCC(=C)Br Amb1772531 [0,2,0,0,0,0|2,0,0]=4 7640 B8R0.7 CCCCNCC(=C)Br Amb18320824 [0,2,0,0,0,0|2,0,0]=4 7641 B8R0.7 CCCCNCC(=C)C Amb17308646 [0,2,0,0,0,0|2,0,0]=4 7642 B8R0.7 CCCCNCC(=C)Cl Amb25717833 [0,2,0,0,0,0|2,0,0]=4 7643 B8R0.7 CCCCNCC(=O)N Amb1126543 [0,2,0,0,0,0|1,0,0]=3 7644 B8R0.7 CCCCNC[C@@H](C)O Amb25330080 [0,2,0,0,0,0|1,0,1]=4 7645 B8R0.7 CCCCNNC(N)=N Amb25105209 [0,2,0,0,0,0|2,0,0]=4 7646 B8R0.7 CCCCNNC(N)=S Amb23590674 [0,2,0,0,0,0|1,1,0]=4 7647 B8R0.7 CCCCOCC(=O)Cl Amb25806749 [0,2,0,0,0,0|1,0,0]=3 7648 B8R0.7 CCCCOCC(C)=C Amb22641495 [0,2,0,0,0,0|2,0,0]=4 7649 B8R0.7 CCCCOC[C@H](C)O Amb25780304 [0,2,0,0,0,0|1,0,1]=4 7650 B8R0.7 CCCCONC(C)=O Amb25057412 [0,2,0,0,0,0|1,0,0]=3 7651 B8R0.7 CCCCONC(N)=N Amb25041461 [0,2,0,0,0,0|2,0,0]=4 7652 B8R0.7 CCCCSCC(=C)Br Amb25804377 [0,2,0,0,0,0|2,0,0]=4 7653 B8R0.7 CCCCSCC(=C)Cl Amb24403543 [0,2,0,0,0,0|2,0,0]=4 7654 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,2,0,0,0,0|0,0,0]=2 7655 B8R0.7 CCCCSC[C@@H](C)O Amb24644245 [0,2,0,0,0,0|1,0,1]=4 7656 B8R0.7 CCCCSC[C@H](C)O Amb25283172 [0,2,0,0,0,0|1,0,1]=4 7657 B8R0.7 CCCCSNC(N)=O Amb24744550 [0,2,0,0,0,0|1,0,0]=3 7658 B8R0.7 CCCCSSC(N)=N Amb24532843 [0,2,0,0,0,0|2,0,0]=4 7659 B8R0.7 CCCC[Hg]OC(C)=O Amb22360223 [0,2,0,0,0,0|1,0,0]=3 7660 B8R0.7 CCCC\C=C/B(O)O Amb25727222 [0,2,0,0,0,0|1,0,1]=4 7661 B8R0.7 CCCC\C=C/C(N)=O Amb25839420 [0,2,0,0,0,0|1,0,0]=3 7662 B8R0.7 CCCC\C=C\B(O)O Amb10068585 [0,2,0,0,0,0|1,0,1]=4 7663 B8R0.7 CCCC\C=C\C(C)=C Amb24559388 [0,2,0,0,0,0|2,0,0]=4 7664 B8R0.7 CCCC\C=C\C(C)=O Amb22043236 [0,2,0,0,0,0|1,0,0]=3 7665 B8R0.7 CCCC\C=C\C(C)O Amb22052697 [0,2,0,0,0,0|1,0,1]=4 7666 B8R0.7 CCCC\C=C\C(N)=O Amb24616435 [0,2,0,0,0,0|1,0,0]=3 7667 B8R0.7 CCCNCC=C(C)C Amb24477771 [0,2,0,0,0,0|2,0,0]=4 7668 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,2,0,0,0,0|0,0,0]=2 7669 B8R0.7 CCCNCCC(=S)N Amb17232015 [0,2,0,0,0,0|1,1,0]=4 7670 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,2,0,0,0,0|1,0,0]=3 7671 B8R0.7 CCCNCCC(C)O Amb25361918 [0,2,0,0,0,0|1,0,1]=4 7672 B8R0.7 CCCNCCC(N)=N Amb24426195 [0,2,0,0,0,0|2,0,0]=4 7673 B8R0.7 CCCNCCC(N)=O Amb19960057 [0,2,0,0,0,0|1,0,0]=3 7674 B8R0.7 CCCNCCC(O)=O Amb18633174 [0,2,0,0,0,0|0,0,0]=2 7675 B8R0.7 CCCNCSC(C)=O Amb25190302 [0,2,0,0,0,0|1,0,0]=3 7676 B8R0.7 CCCNN=CC(C)=O Amb24739997 [0,2,0,0,0,0|1,0,1]=4 7677 B8R0.7 CCCNOCC(N)=O Amb25694035 [0,2,0,0,0,0|1,0,0]=3 7678 B8R0.7 CCCN\C=C/C(C)=O Amb25749455 [0,2,0,0,0,0|1,0,1]=4 7679 B8R0.7 CCCN\C=C\C(C)=O Amb25254846 [0,2,0,0,0,0|1,0,1]=4 7680 B8R0.7 CCCN\N=C\C(C)=O Amb24633726 [0,2,0,0,0,0|1,0,1]=4 7681 B8R0.7 CCCOCNC(N)=O Amb24349738 [0,2,0,0,0,0|1,0,0]=3 7682 B8R0.7 CCCOCSC(N)=N Amb25064257 [0,2,0,0,0,0|2,0,0]=4 7683 B8R0.7 CCCON=CC(N)=O Amb25324154 [0,2,0,0,0,0|1,0,1]=4 7684 B8R0.7 CCCONCC(=C)Cl Amb24697743 [0,2,0,0,0,0|2,0,0]=4 7685 B8R0.7 CCCONCC(C)=C Amb25708080 [0,2,0,0,0,0|2,0,0]=4 7686 B8R0.7 CCCONCC(C)O Amb24711848 [0,2,0,0,0,0|1,0,1]=4 7687 B8R0.7 CCCONCC(N)=O Amb24678243 [0,2,0,0,0,0|1,0,0]=3 7688 B8R0.7 CCCONC[C@@H](C)O Amb25349543 [0,2,0,0,0,0|1,0,1]=4 7689 B8R0.7 CCCONC[C@H](C)O Amb25749182 [0,2,0,0,0,0|1,0,1]=4 7690 B8R0.7 CCCO\C=C\C(C)=O Amb24647800 [0,2,0,0,0,0|1,0,1]=4 7691 B8R0.7 CCCO\C=C\C(O)=O Amb18642782 [0,2,0,0,0,0|0,0,1]=3 7692 B8R0.7 CCCSCCC(=S)N Amb17503250 [0,2,0,0,0,0|1,1,0]=4 7693 B8R0.7 CCCSCCC(C)=C Amb25780872 [0,2,0,0,0,0|2,0,0]=4 7694 B8R0.7 CCCSCCC(C)O Amb25773881 [0,2,0,0,0,0|1,0,1]=4 7695 B8R0.7 CCCSCCC(N)=O Amb24333543 [0,2,0,0,0,0|1,0,0]=3 7696 B8R0.7 CCCSCNC(C)=O Amb24681262 [0,2,0,0,0,0|1,0,0]=3 7697 B8R0.7 CCCSSCC(O)=O Amb25209982 [0,2,0,0,0,0|0,0,0]=2 7698 B8R0.7 CCCS\C=C/C(O)=O Amb18644291 [0,2,0,0,0,0|0,0,1]=3 7699 B8R0.7 CCCS\C=C/C([O-])=O Amb19816096 [0,2,0,0,0,0|0,0,2]=4 7700 B8R0.7 CCCS\C=C\C(O)=O Amb25051625 [0,2,0,0,0,0|0,0,1]=3 7701 B8R0.7 CCC\C=C\CC(C)=O Amb24736384 [0,2,0,0,0,0|1,0,0]=3 7702 B8R0.7 CCC\C=C\CC(N)=O Amb25328428 [0,2,0,0,0,0|1,0,0]=3 7703 B8R0.7 CCC\C=C\CC(O)=O Amb18642602 [0,2,0,0,0,0|0,0,0]=2 7704 B8R0.7 CCC\C=C\C[C@H](C)O Amb24458574 [0,2,0,0,0,0|1,0,1]=4 7705 B8R0.7 CCC\C=C\NC(C)=O Amb25785327 [0,2,0,0,0,0|1,0,1]=4 7706 B8R0.7 CCNCCC=C(C)C Amb18312577 [0,2,0,0,0,0|2,0,0]=4 7707 B8R0.7 CCNCCCC(C)=C Amb24478670 [0,2,0,0,0,0|2,0,0]=4 7708 B8R0.7 CCNCCCC(C)=O Amb24093735 [0,2,0,0,0,0|1,0,0]=3 7709 B8R0.7 CCNCCCC(N)=O Amb24709859 [0,2,0,0,0,0|1,0,0]=3 7710 B8R0.7 CCNCCNC(N)=N Amb25265557 [0,2,0,0,0,0|2,0,0]=4 7711 B8R0.7 CCNCCNC(N)=O Amb18312910 [0,2,0,0,0,0|1,0,0]=3 7712 B8R0.7 CCNCCNS(C)=O Amb24647641 [0,2,0,0,0,0|2,0,0]=4 7713 B8R0.7 CCNCCOC(C)=O Amb25313154 [0,2,0,0,0,0|1,0,0]=3 7714 B8R0.7 CCNCCOC(N)=O Amb24402750 [0,2,0,0,0,0|1,0,0]=3 7715 B8R0.7 CCNCCSC(N)=N Amb25265150 [0,2,0,0,0,0|2,0,0]=4 7716 B8R0.7 CCOCC#CC(O)=O Amb24409938 [0,2,0,0,0,0|0,0,1]=3 7717 B8R0.7 CCOCCCB(O)O Amb25286037 [0,2,0,0,0,0|1,0,1]=4 7718 B8R0.7 CCOCCCC(C)O Amb24414472 [0,2,0,0,0,0|1,0,1]=4 7719 B8R0.7 CCOCCCC(N)=O Amb25841206 [0,2,0,0,0,0|1,0,0]=3 7720 B8R0.7 CCOCCNC(C)=O Amb24389255 [0,2,0,0,0,0|1,0,0]=3 7721 B8R0.7 CCOCCOC(=O)Cl Amb22228804 [0,2,0,0,0,0|1,0,0]=3 7722 B8R0.7 CCOCCOC(N)=N Amb25327328 [0,2,0,0,0,0|2,0,0]=4 7723 B8R0.7 CCOCCSC(N)=N Amb20675990 [0,2,0,0,0,0|2,0,0]=4 7724 B8R0.7 CCOCCSC(N)=N Amb24744421 [0,2,0,0,0,0|2,0,0]=4 7725 B8R0.7 CCOCOCC(O)=O Amb25682215 [0,2,0,0,0,0|0,0,0]=2 7726 B8R0.7 CCOCOC[C@H](C)O Amb25810260 [0,2,0,0,0,0|1,0,1]=4 7727 B8R0.7 CCOCSCC(C)=O Amb24582309 [0,2,0,0,0,0|1,0,0]=3 7728 B8R0.7 CCOCSCC(O)=O Amb25147004 [0,2,0,0,0,0|0,0,0]=2 7729 B8R0.7 CCOC\C=C\C(C)=O Amb25347398 [0,2,0,0,0,0|1,0,1]=4 7730 B8R0.7 CCOC\C=C\C(O)=O Amb19020649 [0,2,0,0,0,0|0,0,1]=3 7731 B8R0.7 CCONCCC(C)=O Amb24614074 [0,2,0,0,0,0|1,0,0]=3 7732 B8R0.7 CCONCCC(C)O Amb24687129 [0,2,0,0,0,0|1,0,1]=4 7733 B8R0.7 CCSCCCB(O)O Amb24351131 [0,2,0,0,0,0|1,0,1]=4 7734 B8R0.7 CCSCCNC(C)=N Amb24442516 [0,2,0,0,0,0|2,0,0]=4 7735 B8R0.7 CCSCCOC(=O)Cl Amb24382779 [0,2,0,0,0,0|1,0,0]=3 7736 B8R0.7 CCSCCOC(C)=O Amb24459072 [0,2,0,0,0,0|1,0,0]=3 7737 B8R0.7 CCSC\C=C\C(O)=O Amb19020657 [0,2,0,0,0,0|0,0,1]=3 7738 B8R0.7 CC\C=C/CCC(C)=O Amb25691996 [0,2,0,0,0,0|1,0,0]=3 7739 B8R0.7 CC\C=C/CCC(N)=O Amb24658221 [0,2,0,0,0,0|1,0,0]=3 7740 B8R0.7 CC\C=C/CCC(O)=O Amb25831265 [0,2,0,0,0,0|0,0,0]=2 7741 B8R0.7 CC\C=C/CCC(O)Cl Amb24740597 [0,2,0,0,0,0|1,0,1]=4 7742 B8R0.7 CC\C=C/SCC(C)=O Amb24615236 [0,2,0,0,0,0|1,0,1]=4 7743 B8R0.7 CC\C=C\C=CC(O)=O Amb24552622 [0,2,0,0,0,0|0,0,2]=4 7744 B8R0.7 CC\C=C\C=C\C(O)=O Amb18642407 [0,2,0,0,0,0|0,0,2]=4 7745 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [0,2,0,0,0,0|1,0,0]=3 7746 B8R0.7 CC\C=C\CCC(C)O Amb22055975 [0,2,0,0,0,0|1,0,1]=4 7747 B8R0.7 CC\C=C\CCC(O)=O Amb18642608 [0,2,0,0,0,0|0,0,0]=2 7748 B8R0.7 CC\C=C\OCC(C)=O Amb25235223 [0,2,0,0,0,0|1,0,1]=4 7749 B8R0.7 CC\C=C\SCC(O)=O Amb25188909 [0,2,0,0,0,0|0,0,1]=3 7750 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,2,0,0,0,0|0,0,0]=2 7751 B8R0.7 CNCCCCC(C)=O Amb18642717 [0,2,0,0,0,0|1,0,0]=3 7752 B8R0.7 CNCCCCC(O)=O Amb24340485 [0,2,0,0,0,0|0,0,0]=2 7753 B8R0.7 CNCCCCC(O)C Amb17569923 [0,2,0,0,0,0|1,0,1]=4 7754 B8R0.7 CNCCCCS(C)=O Amb25250841 [0,2,0,0,0,0|2,0,0]=4 7755 B8R0.7 CNCCCN=C(C)C Amb25113072 [0,2,0,0,0,0|2,0,0]=4 7756 B8R0.7 CNCCCNC(C)=O Amb19346187 [0,2,0,0,0,0|1,0,0]=3 7757 B8R0.7 CNCCCNC(C)=S Amb25222760 [0,2,0,0,0,0|1,1,0]=4 7758 B8R0.7 CNCCCNC(N)=N Amb25301744 [0,2,0,0,0,0|2,0,0]=4 7759 B8R0.7 CNCCCSC(C)=O Amb25197778 [0,2,0,0,0,0|1,0,0]=3 7760 B8R0.7 CNCCCSC(N)=N Amb24713893 [0,2,0,0,0,0|2,0,0]=4 7761 B8R0.7 CNCCNCC(O)=O Amb25211792 [0,2,0,0,0,0|0,0,0]=2 7762 B8R0.7 CNCCOCC(=C)Br Amb18324681 [0,2,0,0,0,0|2,0,0]=4 7763 B8R0.7 CNCCOCC(=C)Cl Amb25716286 [0,2,0,0,0,0|2,0,0]=4 7764 B8R0.7 CNCCOCC(C)=O Amb18111838 [0,2,0,0,0,0|1,0,0]=3 7765 B8R0.7 CNCCOCC(C)O Amb25822559 [0,2,0,0,0,0|1,0,1]=4 7766 B8R0.7 CNCCOCC(O)=O Amb18630741 [0,2,0,0,0,0|0,0,0]=2 7767 B8R0.7 CNCCSCC(=C)Br Amb25180138 [0,2,0,0,0,0|2,0,0]=4 7768 B8R0.7 COCCCCC(C)O Amb25235448 [0,2,0,0,0,0|1,0,1]=4 7769 B8R0.7 COCCCCC(N)=N Amb25761704 [0,2,0,0,0,0|2,0,0]=4 7770 B8R0.7 COCCCCC(N)=S Amb25762220 [0,2,0,0,0,0|1,1,0]=4 7771 B8R0.7 COCCCNC(=O)N Amb1105274 [0,2,0,0,0,0|1,0,0]=3 7772 B8R0.7 COCCCNC(C)=S Amb25187817 [0,2,0,0,0,0|1,1,0]=4 7773 B8R0.7 COCCCNC(N)=N Amb19515413 [0,2,0,0,0,0|2,0,0]=4 7774 B8R0.7 COCCCNC(N)=N Amb22058724 [0,2,0,0,0,0|2,0,0]=4 7775 B8R0.7 COCCCOC(C)=O Amb22732978 [0,2,0,0,0,0|1,0,0]=3 7776 B8R0.7 COCCCSC(N)=N Amb25046904 [0,2,0,0,0,0|2,0,0]=4 7777 B8R0.7 COCCNCC(=C)Br Amb19051447 [0,2,0,0,0,0|2,0,0]=4 7778 B8R0.7 COCCNCC(=C)C Amb17308973 [0,2,0,0,0,0|2,0,0]=4 7779 B8R0.7 COCCNCC(=C)Cl Amb25235791 [0,2,0,0,0,0|2,0,0]=4 7780 B8R0.7 COCCNCC(=O)N Amb13951972 [0,2,0,0,0,0|1,0,0]=3 7781 B8R0.7 COCCNCC(=S)N Amb17232047 [0,2,0,0,0,0|1,1,0]=4 7782 B8R0.7 COCCNCC(N)=N Amb25046238 [0,2,0,0,0,0|2,0,0]=4 7783 B8R0.7 COCCNCC(O)=O Amb19514667 [0,2,0,0,0,0|0,0,0]=2 7784 B8R0.7 COCCNC[C@@H](C)O Amb25330006 [0,2,0,0,0,0|1,0,1]=4 7785 B8R0.7 COCCSCC(=C)Br Amb25248642 [0,2,0,0,0,0|2,0,0]=4 7786 B8R0.7 COCCSCC(C)=C Amb25271717 [0,2,0,0,0,0|2,0,0]=4 7787 B8R0.7 COCCSCC(C)O Amb18179365 [0,2,0,0,0,0|1,0,1]=4 7788 B8R0.7 COCC[Hg]OC(C)=O Amb22734640 [0,2,0,0,0,0|2,0,0]=4 7789 B8R0.7 COCC\C=C\C(O)=O Amb24532833 [0,2,0,0,0,0|0,0,1]=3 7790 B8R0.7 COCOCCC(C)=O Amb25809981 [0,2,0,0,0,0|1,0,0]=3 7791 B8R0.7 COCOCCC(C)O Amb25265793 [0,2,0,0,0,0|1,0,1]=4 7792 B8R0.7 COC\C=C\CC(C)=O Amb24621937 [0,2,0,0,0,0|1,0,1]=4 7793 B8R0.7 CONCCCC(C)O Amb24361285 [0,2,0,0,0,0|1,0,1]=4 7794 B8R0.7 CONCCCC(O)=O Amb24647348 [0,2,0,0,0,0|0,0,0]=2 7795 B8R0.7 CS(=O)CCCCC#N Amb25711714 [0,2,0,0,0,0|2,0,0]=4 7796 B8R0.7 CS(=O)CCCCCN Amb25133466 [0,2,0,0,0,0|2,0,0]=4 7797 B8R0.7 CS(=O)CCCCCO Amb25243806 [0,2,0,0,0,0|2,0,0]=4 7798 B8R0.7 CS(=O)CCNCCBr Amb24538846 [0,2,0,0,0,0|2,0,0]=4 7799 B8R0.7 CS(=O)CCNCCI Amb24538847 [0,2,0,0,0,0|2,0,0]=4 7800 B8R0.7 CS(=O)CCNCCN Amb25140378 [0,2,0,0,0,0|2,0,0]=4 7801 B8R0.7 CS(=O)CCSCCCl Amb24538537 [0,2,0,0,0,0|2,0,0]=4 7802 B8R0.7 CS(=O)CCSCCO Amb24538899 [0,2,0,0,0,0|2,0,0]=4 7803 B8R0.7 CS(=O)NCCCCN Amb24565136 [0,2,0,0,0,0|2,0,0]=4 7804 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,2,0,0,0,0|0,0,0]=2 7805 B8R0.7 CSCCCCC(N)=N Amb24332089 [0,2,0,0,0,0|2,0,0]=4 7806 B8R0.7 CSCCCNC(C)=O Amb24546713 [0,2,0,0,0,0|1,0,0]=3 7807 B8R0.7 CSCCCNC(N)=N Amb25255905 [0,2,0,0,0,0|2,0,0]=4 7808 B8R0.7 CSCCCNC(N)=O Amb25265571 [0,2,0,0,0,0|1,0,0]=3 7809 B8R0.7 CSCCCNC(N)=S Amb25742221 [0,2,0,0,0,0|1,1,0]=4 7810 B8R0.7 CSCCCNC(S)=S Amb25200265 [0,2,0,0,0,0|0,2,0]=4 7811 B8R0.7 CSCCCOC(=O)Cl Amb25810712 [0,2,0,0,0,0|1,0,0]=3 7812 B8R0.7 CSCCCSC(N)=N Amb24481620 [0,2,0,0,0,0|2,0,0]=4 7813 B8R0.7 CSCCNCC(C)O Amb25681928 [0,2,0,0,0,0|1,0,1]=4 7814 B8R0.7 CSCCNCC(O)=O Amb24401934 [0,2,0,0,0,0|0,0,0]=2 7815 B8R0.7 CSCCNC[C@H](C)O Amb25758316 [0,2,0,0,0,0|1,0,1]=4 7816 B8R0.7 CSCCOCC(=C)Br Amb25095072 [0,2,0,0,0,0|2,0,0]=4 7817 B8R0.7 CSCCOCC(C)=O Amb24333557 [0,2,0,0,0,0|1,0,0]=3 7818 B8R0.7 CSCCOCC(N)=O Amb24730448 [0,2,0,0,0,0|1,0,0]=3 7819 B8R0.7 CSCCSCC(C)O Amb24504419 [0,2,0,0,0,0|1,0,1]=4 7820 B8R0.7 CSCCSC[C@@H](C)O Amb25110231 [0,2,0,0,0,0|1,0,1]=4 7821 B8R0.7 CSC\C=C/CC(O)=O Amb18644292 [0,2,0,0,0,0|0,0,1]=3 7822 B8R0.7 CSSCCCC(O)=O Amb25269470 [0,2,0,0,0,0|0,0,0]=2 7823 B8R0.7 CSSCCNC(N)=O Amb24748373 [0,2,0,0,0,0|2,0,0]=4 7824 B8R0.7 C[C@@H](O)CCCCC#N Amb24642619 [0,2,0,0,0,0|1,0,1]=4 7825 B8R0.7 C[C@@H](O)CCCCC=O Amb22896766 [0,2,0,0,0,0|1,0,1]=4 7826 B8R0.7 C[C@@H](O)CNCCCO Amb25031240 [0,2,0,0,0,0|1,0,1]=4 7827 B8R0.7 C[C@H](O)CCCCC#N Amb24592518 [0,2,0,0,0,0|1,0,1]=4 7828 B8R0.7 C[C@H](O)CNCCCO Amb25352476 [0,2,0,0,0,0|1,0,1]=4 7829 B8R0.7 C[C@H](O)CSCCCO Amb24672393 [0,2,0,0,0,0|1,0,1]=4 7830 B8R0.7 C\C=C/CCCC(O)=O Amb25314407 [0,2,0,0,0,0|0,0,0]=2 7831 B8R0.7 C\C=C/OCCC(C)=O Amb25188590 [0,2,0,0,0,0|1,0,1]=4 7832 B8R0.7 C\C=C\CC#CC(O)=O Amb24599409 [0,2,0,0,0,0|0,0,2]=4 7833 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [0,2,0,0,0,0|1,0,0]=3 7834 B8R0.7 C\C=C\CCCC(N)=O Amb24358851 [0,2,0,0,0,0|1,0,0]=3 7835 B8R0.7 C\C=C\CCCC(O)=O Amb18642615 [0,2,0,0,0,0|0,0,0]=2 7836 B8R0.7 C\C=C\COCC(C)=O Amb25771575 [0,2,0,0,0,0|1,0,1]=4 7837 B8R0.7 C\C=C\COCC(N)=O Amb24573219 [0,2,0,0,0,0|1,0,1]=4 7838 B8R0.7 C\C=C\C\C=C\C(O)=O Amb24688696 [0,2,0,0,0,0|0,0,2]=4 7839 B8R0.7 C\C=C\OCCC(C)=O Amb24631670 [0,2,0,0,0,0|1,0,1]=4 7840 B8R0.7 ClCCCCC=C(Cl)Cl Amb25707298 [0,2,0,0,0,0|2,0,0]=4 7841 B8R0.7 ClCCCCCC(=O)Cl Amb10844967 [0,2,0,0,0,0|1,0,0]=3 7842 B8R0.7 ClCCCCN=C(Cl)Cl Amb25162199 [0,2,0,0,0,0|2,0,0]=4 7843 B8R0.7 N#CCCCCB(O)O Amb24481981 [0,2,0,0,0,0|1,0,1]=4 7844 B8R0.7 N#CCCCCC(=O)O Amb17593332 [0,2,0,0,0,0|0,0,0]=2 7845 B8R0.7 N#CCCCCC(=O)[Zn+] Amb24062904 [0,2,0,0,0,0|1,0,0]=3 7846 B8R0.7 N#CCCCSC(=O)C Amb17607671 [0,2,0,0,0,0|1,0,1]=4 7847 B8R0.7 N#CCCSCC(=O)C Amb17502392 [0,2,0,0,0,0|1,0,1]=4 7848 B8R0.7 N#CCCSCC(=O)O Amb17502363 [0,2,0,0,0,0|0,0,1]=3 7849 B8R0.7 N#CCC\C=C\C(O)=O Amb24425060 [0,2,0,0,0,0|0,0,2]=4 7850 B8R0.7 NC(=N)CCCCCF Amb24693216 [0,2,0,0,0,0|2,0,0]=4 7851 B8R0.7 NC(=N)NCCCCF Amb24504709 [0,2,0,0,0,0|2,0,0]=4 7852 B8R0.7 NC(=N)NCCCCO Amb25145971 [0,2,0,0,0,0|2,0,0]=4 7853 B8R0.7 NC(=N)SCCCCO Amb25213983 [0,2,0,0,0,0|2,0,0]=4 7854 B8R0.7 NC(=O)CCCCC#N Amb24108037 [0,2,0,0,0,0|1,0,0]=3 7855 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,2,0,0,0,0|1,0,0]=3 7856 B8R0.7 NC(=O)CCCN=C=S Amb19514658 [0,2,0,0,0,0|1,0,1]=4 7857 B8R0.7 NC(=O)CCCNC#N Amb25137903 [0,2,0,0,0,0|1,0,1]=4 7858 B8R0.7 NC(=O)CCCNC=O Amb24725181 [0,2,0,0,0,0|1,0,1]=4 7859 B8R0.7 NC(=O)CCC\C=C\Br Amb24480015 [0,2,0,0,0,0|1,0,1]=4 7860 B8R0.7 NC(=O)CCC\C=C\Cl Amb24409832 [0,2,0,0,0,0|1,0,1]=4 7861 B8R0.7 NC(=O)CCNCCF Amb25073678 [0,2,0,0,0,0|1,0,0]=3 7862 B8R0.7 NC(=O)CCNCCO Amb19960060 [0,2,0,0,0,0|1,0,0]=3 7863 B8R0.7 NC(=O)CCNCCS Amb18644377 [0,2,0,0,0,0|1,0,0]=3 7864 B8R0.7 NC(=O)CCSCCS Amb25248299 [0,2,0,0,0,0|1,0,0]=3 7865 B8R0.7 NC(=O)CNCCCF Amb24687040 [0,2,0,0,0,0|1,0,0]=3 7866 B8R0.7 NC(=O)CONCCO Amb25133744 [0,2,0,0,0,0|2,0,0]=4 7867 B8R0.7 NC(=O)CSCCC#N Amb18263954 [0,2,0,0,0,0|1,0,1]=4 7868 B8R0.7 NC(=O)CSCCC=O Amb25784424 [0,2,0,0,0,0|1,0,1]=4 7869 B8R0.7 NC(=O)NCCCCO Amb25146104 [0,2,0,0,0,0|1,0,0]=3 7870 B8R0.7 NC(=O)NOCCCF Amb25739360 [0,2,0,0,0,0|2,0,0]=4 7871 B8R0.7 NC(=S)CCCCCBr Amb24596794 [0,2,0,0,0,0|1,1,0]=4 7872 B8R0.7 NC(=S)CCCCCO Amb24562810 [0,2,0,0,0,0|1,1,0]=4 7873 B8R0.7 NC(=S)NCCCCO Amb25236767 [0,2,0,0,0,0|1,1,0]=4 7874 B8R0.7 NCCCCC=C(Cl)Cl Amb25786790 [0,2,0,0,0,0|2,0,0]=4 7875 B8R0.7 NCCCCC=C(F)F Amb25063284 [0,2,0,0,0,0|2,0,0]=4 7876 B8R0.7 NCCCCCB(O)O Amb25049233 [0,2,0,0,0,0|1,0,1]=4 7877 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [0,2,0,0,0,0|1,0,0]=3 7878 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,2,0,0,0,0|0,0,0]=2 7879 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,2,0,0,0,0|0,0,0]=2 7880 B8R0.7 NCCCCN=C(N)N Amb16184046 [0,2,0,0,0,0|2,0,0]=4 7881 B8R0.7 NCCCCNC(=O)C Amb17053700 [0,2,0,0,0,0|1,0,0]=3 7882 B8R0.7 NCCCCNC(=O)S Amb25328775 [0,2,0,0,0,0|0,1,0]=3 7883 B8R0.7 NCCCCNC(N)=N Amb19929571 [0,2,0,0,0,0|2,0,0]=4 7884 B8R0.7 NCCCCNC(N)=N Amb22264641 [0,2,0,0,0,0|2,0,0]=4 7885 B8R0.7 NCCCCNC(N)=O Amb19026975 [0,2,0,0,0,0|1,0,0]=3 7886 B8R0.7 NCCCCNC(N)=O Amb19374296 [0,2,0,0,0,0|1,0,0]=3 7887 B8R0.7 NCCCCOC(=O)Cl Amb25320806 [0,2,0,0,0,0|1,0,0]=3 7888 B8R0.7 NCCCCSC(N)=N Amb25349389 [0,2,0,0,0,0|2,0,0]=4 7889 B8R0.7 NCCCNCC(O)=O Amb22733138 [0,2,0,0,0,0|0,0,0]=2 7890 B8R0.7 NCCCNCC(O)=O Amb25848815 [0,2,0,0,0,0|0,0,0]=2 7891 B8R0.7 NCCCOCC(N)=O Amb24433775 [0,2,0,0,0,0|1,0,0]=3 7892 B8R0.7 NCCCOCC(O)=O Amb18111435 [0,2,0,0,0,0|0,0,0]=2 7893 B8R0.7 NCCCSCC(=C)C Amb17500707 [0,2,0,0,0,0|2,0,0]=4 7894 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,2,0,0,0,0|0,0,0]=2 7895 B8R0.7 NCCCSCC(N)=O Amb25194513 [0,2,0,0,0,0|1,0,0]=3 7896 B8R0.7 NCCC\C=C\C(O)=O Amb22054306 [0,2,0,0,0,0|0,0,1]=3 7897 B8R0.7 NCCC\C=C\C(O)=O Amb25221789 [0,2,0,0,0,0|0,0,1]=3 7898 B8R0.7 NCCNCCC(O)=O Amb20668304 [0,2,0,0,0,0|0,0,0]=2 7899 B8R0.7 NCCNCCC(O)=O Amb22058790 [0,2,0,0,0,0|0,0,0]=2 7900 B8R0.7 NCCNOCC(N)=O Amb25257314 [0,2,0,0,0,0|2,0,0]=4 7901 B8R0.7 NCCOCCC(O)=O Amb18630461 [0,2,0,0,0,0|0,0,0]=2 7902 B8R0.7 NCCSCCB(O)O Amb25041580 [0,2,0,0,0,0|1,0,1]=4 7903 B8R0.7 NCCSCCC(O)=O Amb21988844 [0,2,0,0,0,0|0,0,0]=2 7904 B8R0.7 NCCS\C=C\C(O)=O Amb18644341 [0,2,0,0,0,0|0,0,2]=4 7905 B8R0.7 NC\C=C\CCC(O)=O Amb24411351 [0,2,0,0,0,0|0,0,1]=3 7906 B8R0.7 NOCCCCC(=O)O Amb10975955 [0,2,0,0,0,0|0,0,0]=2 7907 B8R0.7 NOCCCNC(=O)C Amb17138378 [0,2,0,0,0,0|2,0,0]=4 7908 B8R0.7 O=C(Cl)CCSCCCl Amb25361104 [0,2,0,0,0,0|1,0,0]=3 7909 B8R0.7 O=C(Cl)COCCCCl Amb25059159 [0,2,0,0,0,0|1,0,0]=3 7910 B8R0.7 O=C(Cl)CSCCCCl Amb24479935 [0,2,0,0,0,0|1,0,0]=3 7911 B8R0.7 O=C(Cl)\C=C\CCCBr Amb24707452 [0,2,0,0,0,0|1,0,1]=4 7912 B8R0.7 O=C(F)OCCCCCl Amb24416872 [0,2,0,0,0,0|1,0,0]=3 7913 B8R0.7 O=CCCCOC(=O)C Amb17593367 [0,2,0,0,0,0|1,0,1]=4 7914 B8R0.7 O=COCCCC(=O)C Amb1033032 [0,2,0,0,0,0|1,0,1]=4 7915 B8R0.7 OB(O)CCCCCBr Amb21856239 [0,2,0,0,0,0|1,0,1]=4 7916 B8R0.7 OB(O)CCCCCCl Amb25047934 [0,2,0,0,0,0|1,0,1]=4 7917 B8R0.7 OC(=O)C#CCCC=O Amb24549556 [0,2,0,0,0,0|0,0,2]=4 7918 B8R0.7 OC(=O)C#CCCCCl Amb24347497 [0,2,0,0,0,0|0,0,1]=3 7919 B8R0.7 OC(=O)CCCCC=O Amb18642763 [0,2,0,0,0,0|0,0,0]=2 7920 B8R0.7 OC(=O)CCCCCCl Amb18796646 [0,2,0,0,0,0|0,0,0]=2 7921 B8R0.7 OC(=O)CCCCCI Amb22736492 [0,2,0,0,0,0|0,0,0]=2 7922 B8R0.7 OC(=O)CCCCCS Amb18644374 [0,2,0,0,0,0|0,0,0]=2 7923 B8R0.7 OC(=O)CCCNC=O Amb18305404 [0,2,0,0,0,0|0,0,1]=3 7924 B8R0.7 OC(=O)CCC\C=C\Br Amb24518554 [0,2,0,0,0,0|0,0,1]=3 7925 B8R0.7 OC(=O)CCC\C=C\Cl Amb18644381 [0,2,0,0,0,0|0,0,1]=3 7926 B8R0.7 OC(=O)CCNCN=O Amb25311838 [0,2,0,0,0,0|1,0,0]=3 7927 B8R0.7 OC(=O)CCOCCBr Amb24057757 [0,2,0,0,0,0|0,0,0]=2 7928 B8R0.7 OC(=O)CCSCCCl Amb24097450 [0,2,0,0,0,0|0,0,0]=2 7929 B8R0.7 OC(=O)CCSCCS Amb18126456 [0,2,0,0,0,0|0,0,0]=2 7930 B8R0.7 OC(=O)CC\C=C\C#C Amb10605297 [0,2,0,0,0,0|0,0,2]=4 7931 B8R0.7 OC(=O)CC\C=C\C=C Amb10605294 [0,2,0,0,0,0|0,0,2]=4 7932 B8R0.7 OC(=O)CC\C=C\CBr Amb24635578 [0,2,0,0,0,0|0,0,1]=3 7933 B8R0.7 OC(=O)CNCCCBr Amb25765814 [0,2,0,0,0,0|0,0,0]=2 7934 B8R0.7 OC(=O)CNCCCS Amb25268354 [0,2,0,0,0,0|0,0,0]=2 7935 B8R0.7 OC(=O)COCCCBr Amb24594816 [0,2,0,0,0,0|0,0,0]=2 7936 B8R0.7 OC(=O)COCCCF Amb24481828 [0,2,0,0,0,0|0,0,0]=2 7937 B8R0.7 OC(=O)CON=CCCl Amb24674209 [0,2,0,0,0,0|1,0,1]=4 7938 B8R0.7 OC(=O)CO\N=C\CBr Amb25146992 [0,2,0,0,0,0|1,0,1]=4 7939 B8R0.7 OC(=O)CO\N=C\CCl Amb24376147 [0,2,0,0,0,0|1,0,1]=4 7940 B8R0.7 OC(=O)CSCCCBr Amb25771711 [0,2,0,0,0,0|0,0,0]=2 7941 B8R0.7 OC(=O)CSCCCCl Amb18126548 [0,2,0,0,0,0|0,0,0]=2 7942 B8R0.7 OC(=O)CSCCCF Amb25676986 [0,2,0,0,0,0|0,0,0]=2 7943 B8R0.7 OC(=O)C\C=C/CC=O Amb25050861 [0,2,0,0,0,0|0,0,2]=4 7944 B8R0.7 OC(=O)\C=C\CCCBr Amb24446659 [0,2,0,0,0,0|0,0,1]=3 7945 B8R0.7 OC(=O)\C=C\CCCCl Amb18644386 [0,2,0,0,0,0|0,0,1]=3 7946 B8R0.7 OC(=O)\C=C\NCCF Amb25850814 [0,2,0,0,0,0|0,0,2]=4 7947 B8R0.7 OCCCCNC(=O)C Amb17102977 [0,2,0,0,0,0|1,0,0]=3 7948 B8R0.7 OCCCCOP(O)O Amb24412977 [0,2,0,0,0,0|1,0,1]=4 7949 B8R0.7 OCCCNCC(O)C Amb17308669 [0,2,0,0,0,0|1,0,1]=4 7950 B8R0.7 OCCCSCC(=C)C Amb17502851 [0,2,0,0,0,0|2,0,0]=4 7951 B8R0.7 OCCCSCC(=O)C Amb17502845 [0,2,0,0,0,0|1,0,0]=3 7952 B8R0.7 OCCC\C=C\C(O)=O Amb18642790 [0,2,0,0,0,0|0,0,1]=3 7953 B8R0.7 OCCNCCC(=O)O Amb1110010 [0,2,0,0,0,0|0,0,0]=2 7954 B8R0.7 OC\C=C\CCC(O)=O Amb24639124 [0,2,0,0,0,0|0,0,1]=3 7955 B8R0.7 OP(=O)OCCCCBr Amb25322865 [0,2,0,0,0,0|1,0,0]=3 7956 B8R0.7 OP(O)OCCCCCl Amb24425542 [0,2,0,0,0,0|1,0,1]=4 7957 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [0,2,0,0,0,0|1,0,0]=3 7958 B8R0.7 [N-]=[N+]=NCSCC(O)=O Amb25253142 [0,2,0,0,0,0|2,0,0]=4 7959 B8R0.7 [O-]C(=O)CCCCCO Amb22491268 [0,2,0,0,0,0|0,0,1]=3 7960 B8R0.7 [O-]P(=O)CCOCCCl Amb25232545 [0,2,0,0,0,0|1,0,1]=4 7961 B8R0.7 [O-][N+](=O)OCCCCO Amb21929397 [0,2,0,0,0,0|1,0,1]=4 7962 B8R0.21 BrCCCCS(=O)(=O)N Amb10601761 [0,2,0,0,0,0|1,0,1]=4 7963 B8R0.21 BrCCCCS(=O)(=O)O Amb10601732 [0,2,0,0,0,0|1,0,0]=3 7964 B8R0.21 CC(C)(O)CCCCBr Amb25213849 [0,2,0,0,0,0|1,0,1]=4 7965 B8R0.21 CC(C)(O)CCCCCl Amb24427255 [0,2,0,0,0,0|1,0,1]=4 7966 B8R0.21 CCCCCS(=O)(=O)N Amb16191925 [0,2,0,0,0,0|1,0,1]=4 7967 B8R0.21 CCCCCS(=O)(=O)O Amb10844728 [0,2,0,0,0,0|1,0,0]=3 7968 B8R0.21 CCCCCS(O)(=O)=O Amb22348176 [0,2,0,0,0,0|1,0,0]=3 7969 B8R0.21 CCCCNP(=O)(Cl)Cl Amb22054608 [0,2,0,0,0,0|2,0,0]=4 7970 B8R0.21 CCCCNP(=O)(N)N Amb17610387 [0,2,0,0,0,0|2,0,0]=4 7971 B8R0.21 CCCCNP(O)(O)=S Amb24612022 [0,2,0,0,0,0|1,0,1]=4 7972 B8R0.21 CCCCNS(=O)(=O)Cl Amb17193917 [0,2,0,0,0,0|1,0,1]=4 7973 B8R0.21 CCCCNS(N)(=O)=O Amb22436420 [0,2,0,0,0,0|1,0,1]=4 7974 B8R0.21 CCCCOP(=O)(Cl)Cl Amb25369293 [0,2,0,0,0,0|2,0,0]=4 7975 B8R0.21 CCCCOP(C)(O)=O Amb25249300 [0,2,0,0,0,0|1,0,0]=3 7976 B8R0.21 CCCCOP(O)(O)=O Amb24419212 [0,2,0,0,0,0|1,0,0]=3 7977 B8R0.21 CCCCOP([O-])([O-])=O Amb24090708 [0,2,0,0,0,0|1,0,1]=4 7978 B8R0.21 CCCCOS(O)(=O)=O Amb22169780 [0,2,0,0,0,0|1,0,0]=3 7979 B8R0.21 CCCCSS(=O)(=O)C Amb17610372 [0,2,0,0,0,0|1,0,1]=4 7980 B8R0.21 CCCNCC(C)(C)O Amb18033968 [0,2,0,0,0,0|1,0,1]=4 7981 B8R0.21 CCCNCP(C)(C)=O Amb25146176 [0,2,0,0,0,0|2,0,0]=4 7982 B8R0.21 CCCNCP(C)(O)=O Amb25109293 [0,2,0,0,0,0|1,0,0]=3 7983 B8R0.21 CCCNCP(O)(O)=O Amb25691405 [0,2,0,0,0,0|1,0,0]=3 7984 B8R0.21 CCCNCS(O)(=O)=O Amb25363927 [0,2,0,0,0,0|1,0,0]=3 7985 B8R0.21 CCCOCC(C)(C)O Amb24356319 [0,2,0,0,0,0|1,0,1]=4 7986 B8R0.21 CCCSCC(C)(C)O Amb24565646 [0,2,0,0,0,0|1,0,1]=4 7987 B8R0.21 CCNCCS(C)(=O)=O Amb18523815 [0,2,0,0,0,0|1,0,1]=4 7988 B8R0.21 CCNCCS(O)(=O)=O Amb25771837 [0,2,0,0,0,0|1,0,0]=3 7989 B8R0.21 CCOCCS(=O)(=O)Br Amb24391976 [0,2,0,0,0,0|1,0,1]=4 7990 B8R0.21 CCOCCS(=O)(=O)F Amb25722585 [0,2,0,0,0,0|1,0,1]=4 7991 B8R0.21 CCOCCS(C)(=O)=O Amb24422227 [0,2,0,0,0,0|1,0,1]=4 7992 B8R0.21 CNCCCC(O)(C)C Amb17569928 [0,2,0,0,0,0|1,0,1]=4 7993 B8R0.21 CNCCCS(C)(=O)=O Amb18304934 [0,2,0,0,0,0|1,0,1]=4 7994 B8R0.21 CNCCCS(O)(=O)=O Amb25690771 [0,2,0,0,0,0|1,0,0]=3 7995 B8R0.21 CNCCOP(C)(O)=O Amb25691478 [0,2,0,0,0,0|2,0,0]=4 7996 B8R0.21 CNCCOP(O)(O)=O Amb25785079 [0,2,0,0,0,0|2,0,0]=4 7997 B8R0.21 CNCCSS(O)(=O)=O Amb25772807 [0,2,0,0,0,0|2,0,0]=4 7998 B8R0.21 COCCCS(=O)(=O)Cl Amb18538494 [0,2,0,0,0,0|1,0,1]=4 7999 B8R0.21 COCCCS(=O)(=O)F Amb20623730 [0,2,0,0,0,0|1,0,1]=4 8000 B8R0.21 COCCCS(N)(=O)=O Amb18791542 [0,2,0,0,0,0|1,0,1]=4 8001 B8R0.21 COCCCS(O)(=O)=O Amb22523485 [0,2,0,0,0,0|1,0,0]=3 8002 B8R0.21 COCCOP(O)(O)=O Amb25366442 [0,2,0,0,0,0|2,0,0]=4 8003 B8R0.21 CP(C)(=O)CCCCBr Amb25076331 [0,2,0,0,0,0|2,0,0]=4 8004 B8R0.21 CS(=O)(=O)CCCCBr Amb24401565 [0,2,0,0,0,0|1,0,1]=4 8005 B8R0.21 CS(=O)(=O)CCCCO Amb18180175 [0,2,0,0,0,0|1,0,1]=4 8006 B8R0.21 CSCCCS(N)(=O)=O Amb25032148 [0,2,0,0,0,0|1,0,1]=4 8007 B8R0.21 ClCCCCS(=O)(=O)C Amb17138674 [0,2,0,0,0,0|1,0,1]=4 8008 B8R0.21 ICCCCS(=O)(=O)[O-] Amb10880692 [0,2,0,0,0,0|1,0,1]=4 8009 B8R0.21 N#CCCCS(O)(=O)=O Amb24428958 [0,2,0,0,0,0|1,0,1]=4 8010 B8R0.21 NCCCCC(O)(C)C Amb17569932 [0,2,0,0,0,0|1,0,1]=4 8011 B8R0.21 NCCCCS(=O)(=O)C Amb17138437 [0,2,0,0,0,0|1,0,1]=4 8012 B8R0.21 NCCCCS(N)(=O)=O Amb19016662 [0,2,0,0,0,0|1,0,1]=4 8013 B8R0.21 NCCCOP(N)(O)=O Amb24664220 [0,2,0,0,0,0|2,0,0]=4 8014 B8R0.21 NCCCOP(O)(O)=O Amb20242514 [0,2,0,0,0,0|2,0,0]=4 8015 B8R0.21 NCCCOS(O)(=O)=O Amb24754027 [0,2,0,0,0,0|2,0,0]=4 8016 B8R0.21 NCCCSS(O)(=O)=O Amb25147112 [0,2,0,0,0,0|2,0,0]=4 8017 B8R0.21 NCCNCP(O)(O)=O Amb24479949 [0,2,0,0,0,0|2,0,0]=4 8018 B8R0.21 NP(N)(=O)CCCCCl Amb25362835 [0,2,0,0,0,0|2,0,0]=4 8019 B8R0.21 O=S(=O)(Cl)CCCCBr Amb24476654 [0,2,0,0,0,0|1,0,1]=4 8020 B8R0.21 O=S(=O)(Cl)CCCCF Amb25325507 [0,2,0,0,0,0|1,0,1]=4 8021 B8R0.21 O=S(=O)([S-])CCCCCl Amb25366296 [0,2,0,0,0,0|1,0,1]=4 8022 B8R0.21 OCCCCP(O)(O)=O Amb25188984 [0,2,0,0,0,0|1,0,0]=3 8023 B8R0.21 OCCCNS(O)(=O)=O Amb19651459 [0,2,0,0,0,0|2,0,0]=4 8024 B8R0.21 OCCCOS(O)(=O)=O Amb25357672 [0,2,0,0,0,0|2,0,0]=4 8025 B8R0.21 OCCNCP(O)(O)=O Amb24479951 [0,2,0,0,0,0|2,0,0]=4 8026 B8R0.21 OCNCCS(O)(=O)=O Amb24478715 [0,2,0,0,0,0|2,0,0]=4 8027 B8R0.21 ONCCCP(=O)(O)O Amb17615049 [0,2,0,0,0,0|2,0,0]=4 8028 B8R0.21 OP(O)(=O)CCCCBr Amb22832006 [0,2,0,0,0,0|1,0,0]=3 8029 B8R0.21 OP(O)(=O)CCCCCl Amb22388731 [0,2,0,0,0,0|1,0,0]=3 8030 B8R0.21 OP(O)(=O)OCCCCl Amb24602485 [0,2,0,0,0,0|2,0,0]=4 8031 B8R0.21 OS(=O)(=O)CCCCBr Amb24467015 [0,2,0,0,0,0|1,0,0]=3 8032 B8R0.21 OS(=O)(=O)OCCCBr Amb24428667 [0,2,0,0,0,0|2,0,0]=4 8033 B8R0.21 [O-]S(=O)(=O)CCCCI Amb25352406 [0,2,0,0,0,0|1,0,1]=4 8034 B8R0.28 C=C(Br)CNCC(O)=O Amb18303844 [0,2,0,0,0,0|0,0,2]=4 8035 B8R0.28 C=C(Br)CSCC(O)=O Amb25369923 [0,2,0,0,0,0|0,0,2]=4 8036 B8R0.28 C=C(F)CCCC(O)=O Amb22641515 [0,2,0,0,0,0|0,0,1]=3 8037 B8R0.28 CC(=C)CCCC(C)=C Amb22228385 [0,2,0,0,0,0|2,0,0]=4 8038 B8R0.28 CC(=C)CCCC(C)=O Amb17739959 [0,2,0,0,0,0|1,0,0]=3 8039 B8R0.28 CC(=C)CCOC(N)=O Amb24760559 [0,2,0,0,0,0|1,0,1]=4 8040 B8R0.28 CC(=C)\C=C\CC(O)=O Amb18642409 [0,2,0,0,0,0|0,0,2]=4 8041 B8R0.28 CC(=N)NCCC(O)=O Amb25836109 [0,2,0,0,0,0|0,0,1]=3 8042 B8R0.28 CC(=O)CCCB(O)O Amb24068595 [0,2,0,0,0,0|1,0,1]=4 8043 B8R0.28 CC(=O)CCCC(=C)O Amb24422924 [0,2,0,0,0,0|1,0,0]=3 8044 B8R0.28 CC(=O)CCCC(=O)Cl Amb24752758 [0,2,0,0,0,0|1,0,0]=3 8045 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,2,0,0,0,0|0,0,0]=2 8046 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,2,0,0,0,0|1,0,0]=3 8047 B8R0.28 CC(=O)CCCC(Cl)Cl Amb24480288 [0,2,0,0,0,0|1,0,0]=3 8048 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,2,0,0,0,0|1,0,0]=3 8049 B8R0.28 CC(=O)CCC[N+]([O-])=O Amb18203187 [0,2,0,0,0,0|1,0,1]=4 8050 B8R0.28 CC(=O)CCNC(=O)C Amb17102868 [0,2,0,0,0,0|1,0,1]=4 8051 B8R0.28 CC(=O)CCOC(F)F Amb25276866 [0,2,0,0,0,0|2,0,0]=4 8052 B8R0.28 CC(=O)CCO[SiH](C)C Amb25233637 [0,2,0,0,0,0|1,1,0]=4 8053 B8R0.28 CC(=O)CC\C=C(/Cl)\C Amb17593664 [0,2,0,0,0,0|1,0,1]=4 8054 B8R0.28 CC(=O)CNCC(C)=O Amb22168687 [0,2,0,0,0,0|1,0,1]=4 8055 B8R0.28 CC(=O)CNCC(O)=O Amb24375747 [0,2,0,0,0,0|0,0,1]=3 8056 B8R0.28 CC(=O)COCC(F)F Amb24396675 [0,2,0,0,0,0|2,0,0]=4 8057 B8R0.28 CC(=O)COCC(N)=O Amb24070191 [0,2,0,0,0,0|1,0,1]=4 8058 B8R0.28 CC(=O)CSCC(C)=O Amb25244895 [0,2,0,0,0,0|1,0,1]=4 8059 B8R0.28 CC(=O)CSCC([O-])=O Amb20622616 [0,2,0,0,0,0|0,0,2]=4 8060 B8R0.28 CC(=O)C\C=C\C(=O)O Amb16232091 [0,2,0,0,0,0|0,0,2]=4 8061 B8R0.28 CC(=O)NCCC(F)F Amb24534489 [0,2,0,0,0,0|2,0,0]=4 8062 B8R0.28 CC(=O)OCCC(O)=O Amb18642866 [0,2,0,0,0,0|0,0,1]=3 8063 B8R0.28 CC(=O)OCCS(C)=O Amb24481662 [0,2,0,0,0,0|2,0,0]=4 8064 B8R0.28 CC(=O)SCCC(N)=O Amb24552735 [0,2,0,0,0,0|1,0,1]=4 8065 B8R0.28 CC(=O)\C=N/CC(O)=O Amb25347610 [0,2,0,0,0,0|0,0,2]=4 8066 B8R0.28 CC(=S)NCCC(C)=O Amb24682550 [0,2,0,0,0,0|1,0,1]=4 8067 B8R0.28 CC(=S)SCCC(O)=O Amb24480281 [0,2,0,0,0,0|0,0,1]=3 8068 B8R0.28 CC(Br)=CCCC(O)=O Amb25200944 [0,2,0,0,0,0|0,0,1]=3 8069 B8R0.28 CC(Br)CCCC(=O)Cl Amb25364942 [0,2,0,0,0,0|1,0,0]=3 8070 B8R0.28 CC(Br)CCCC(C)=O Amb24340312 [0,2,0,0,0,0|1,0,0]=3 8071 B8R0.28 CC(Br)CCCC(O)=O Amb24480052 [0,2,0,0,0,0|0,0,0]=2 8072 B8R0.28 CC(Br)CCCS(C)=O Amb24549111 [0,2,0,0,0,0|2,0,0]=4 8073 B8R0.28 CC(Br)CCNC(C)=O Amb24618949 [0,2,0,0,0,0|1,0,0]=3 8074 B8R0.28 CC(Br)CCOC(C)=O Amb24626624 [0,2,0,0,0,0|1,0,0]=3 8075 B8R0.28 CC(C)/C=C/CC(O)=O Amb17844074 [0,2,0,0,0,0|0,0,1]=3 8076 B8R0.28 CC(C)=CCCC(N)=O Amb24655596 [0,2,0,0,0,0|1,0,1]=4 8077 B8R0.28 CC(C)CCCB(O)O Amb24593360 [0,2,0,0,0,0|1,0,1]=4 8078 B8R0.28 CC(C)CCCC(=O)Cl Amb24477882 [0,2,0,0,0,0|1,0,0]=3 8079 B8R0.28 CC(C)CCCC(C)=C Amb22228386 [0,2,0,0,0,0|2,0,0]=4 8080 B8R0.28 CC(C)CCCC(N)=N Amb23569433 [0,2,0,0,0,0|2,0,0]=4 8081 B8R0.28 CC(C)CCCC(N)=O Amb24579456 [0,2,0,0,0,0|1,0,0]=3 8082 B8R0.28 CC(C)CCCS(C)=O Amb24577266 [0,2,0,0,0,0|2,0,0]=4 8083 B8R0.28 CC(C)CCC[C@@H](C)O Amb22746847 [0,2,0,0,0,0|1,0,1]=4 8084 B8R0.28 CC(C)CCNC(=O)Cl Amb25378849 [0,2,0,0,0,0|1,0,0]=3 8085 B8R0.28 CC(C)CCNC(C)=S Amb25298880 [0,2,0,0,0,0|1,1,0]=4 8086 B8R0.28 CC(C)CCNC(N)=N Amb20631267 [0,2,0,0,0,0|2,0,0]=4 8087 B8R0.28 CC(C)CCNC(N)=N Amb24524670 [0,2,0,0,0,0|2,0,0]=4 8088 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,2,0,0,0,0|1,0,0]=3 8089 B8R0.28 CC(C)CCOC(N)=S Amb25785397 [0,2,0,0,0,0|1,1,0]=4 8090 B8R0.28 CC(C)CCOC([S-])=S Amb19748289 [0,2,0,0,0,0|0,2,0]=4 8091 B8R0.28 CC(C)CCOS([O-])=O Amb24524507 [0,2,0,0,0,0|1,0,1]=4 8092 B8R0.28 CC(C)CCSC(N)=N Amb20676007 [0,2,0,0,0,0|2,0,0]=4 8093 B8R0.28 CC(C)CCSC(N)=O Amb24680835 [0,2,0,0,0,0|1,0,0]=3 8094 B8R0.28 CC(C)CNCC(=C)Br Amb19005215 [0,2,0,0,0,0|2,0,0]=4 8095 B8R0.28 CC(C)CNCC(=C)Cl Amb19004837 [0,2,0,0,0,0|2,0,0]=4 8096 B8R0.28 CC(C)CNCC(C)=O Amb25067661 [0,2,0,0,0,0|1,0,0]=3 8097 B8R0.28 CC(C)CNCC(O)=O Amb19373106 [0,2,0,0,0,0|0,0,0]=2 8098 B8R0.28 CC(C)CNCS(O)=O Amb24478690 [0,2,0,0,0,0|1,0,0]=3 8099 B8R0.28 CC(C)CNC[C@@H](C)O Amb25135487 [0,2,0,0,0,0|1,0,1]=4 8100 B8R0.28 CC(C)CNC[C@H](C)O Amb25079110 [0,2,0,0,0,0|1,0,1]=4 8101 B8R0.28 CC(C)CNNC(N)=O Amb24359844 [0,2,0,0,0,0|2,0,0]=4 8102 B8R0.28 CC(C)COC[C@@H](C)O Amb24423772 [0,2,0,0,0,0|1,0,1]=4 8103 B8R0.28 CC(C)CSCC(C)=C Amb24371809 [0,2,0,0,0,0|2,0,0]=4 8104 B8R0.28 CC(C)CSCC(N)=O Amb25283648 [0,2,0,0,0,0|1,0,0]=3 8105 B8R0.28 CC(C)C\C=C\C(N)=O Amb25731688 [0,2,0,0,0,0|1,0,1]=4 8106 B8R0.28 CC(C)N=CCC(C)=O Amb25198123 [0,2,0,0,0,0|1,0,1]=4 8107 B8R0.28 CC(C)NCCC(C)=C Amb19025196 [0,2,0,0,0,0|2,0,0]=4 8108 B8R0.28 CC(C)NCCC(C)O Amb24117028 [0,2,0,0,0,0|1,0,1]=4 8109 B8R0.28 CC(C)NCCC(N)=N Amb25162018 [0,2,0,0,0,0|2,0,0]=4 8110 B8R0.28 CC(C)NCC[C@@H](C)O Amb24351618 [0,2,0,0,0,0|1,0,1]=4 8111 B8R0.28 CC(C)NCSC(C)=O Amb25314413 [0,2,0,0,0,0|2,0,0]=4 8112 B8R0.28 CC(C)N\C=C\C(O)=O Amb24623070 [0,2,0,0,0,0|0,0,2]=4 8113 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,2,0,0,0,0|1,0,0]=3 8114 B8R0.28 CC(C)OCCC(C)=O Amb22229804 [0,2,0,0,0,0|1,0,0]=3 8115 B8R0.28 CC(C)OCCC(N)=O Amb25783535 [0,2,0,0,0,0|1,0,0]=3 8116 B8R0.28 CC(C)OCCS(O)=O Amb24551322 [0,2,0,0,0,0|1,0,0]=3 8117 B8R0.28 CC(C)OCC[C@H](C)O Amb25090046 [0,2,0,0,0,0|1,0,1]=4 8118 B8R0.28 CC(C)ONCC(O)=O Amb24690245 [0,2,0,0,0,0|1,0,0]=3 8119 B8R0.28 CC(C)O\C=C\C(O)=O Amb25731158 [0,2,0,0,0,0|0,0,2]=4 8120 B8R0.28 CC(C)SCCC(N)=O Amb25739954 [0,2,0,0,0,0|1,0,0]=3 8121 B8R0.28 CC(C)SCC[N+]([O-])=O Amb24407962 [0,2,0,0,0,0|1,0,1]=4 8122 B8R0.28 CC(C)SNCC(N)=O Amb25118863 [0,2,0,0,0,0|2,0,0]=4 8123 B8R0.28 CC(C)SSCC(O)=O Amb24425479 [0,2,0,0,0,0|1,0,0]=3 8124 B8R0.28 CC(C)\N=C\CC(C)=O Amb25773461 [0,2,0,0,0,0|1,0,1]=4 8125 B8R0.28 CC(CCCC(=O)O)O Amb2371277 [0,2,0,0,0,0|0,0,0]=2 8126 B8R0.28 CC(CCCC(=O)[O-])O Amb17615415 [0,2,0,0,0,0|0,0,1]=3 8127 B8R0.28 CC(CCNC(=O)N)C Amb1104833 [0,2,0,0,0,0|1,0,0]=3 8128 B8R0.28 CC(CCOC(=S)[S-])C Amb13777309 [0,2,0,0,0,0|0,2,0]=4 8129 B8R0.28 CC(CNCC(=C)C)C Amb17308640 [0,2,0,0,0,0|2,0,0]=4 8130 B8R0.28 CC(CNCC(=C)C)O Amb17308667 [0,2,0,0,0,0|2,0,0]=4 8131 B8R0.28 CC(CNCC(=O)N)C Amb1118171 [0,2,0,0,0,0|1,0,0]=3 8132 B8R0.28 CC(COCC(=O)N)C Amb2131093 [0,2,0,0,0,0|1,0,0]=3 8133 B8R0.28 CC(CSCC(=O)O)C Amb1134811 [0,2,0,0,0,0|0,0,0]=2 8134 B8R0.28 CC(Cl)=CCCC(C)=O Amb25274421 [0,2,0,0,0,0|1,0,1]=4 8135 B8R0.28 CC(Cl)CCC=C(C)C Amb25032126 [0,2,0,0,0,0|2,0,0]=4 8136 B8R0.28 CC(Cl)CCCC(C)=O Amb25724389 [0,2,0,0,0,0|1,0,0]=3 8137 B8R0.28 CC(Cl)CCCC(O)=O Amb24740888 [0,2,0,0,0,0|0,0,0]=2 8138 B8R0.28 CC(Cl)CCSC(C)=O Amb25146226 [0,2,0,0,0,0|1,0,0]=3 8139 B8R0.28 CC(Cl)COCC(O)=O Amb24480258 [0,2,0,0,0,0|0,0,0]=2 8140 B8R0.28 CC(F)CCOC(C)=O Amb24481945 [0,2,0,0,0,0|1,0,0]=3 8141 B8R0.28 CC(F)COCC(C)=O Amb25178543 [0,2,0,0,0,0|1,0,0]=3 8142 B8R0.28 CC(I)CCSC(N)=N Amb22364948 [0,2,0,0,0,0|2,0,0]=4 8143 B8R0.28 CC(I)CCSC(N)=N Amb24542719 [0,2,0,0,0,0|2,0,0]=4 8144 B8R0.28 CC(N)CCCC(O)=O Amb22059416 [0,2,0,0,0,0|0,0,0]=2 8145 B8R0.28 CC(N)CCNC(C)=O Amb24384456 [0,2,0,0,0,0|1,0,0]=3 8146 B8R0.28 CC(N)COCC(O)=O Amb25368702 [0,2,0,0,0,0|0,0,0]=2 8147 B8R0.28 CC(N)CSCC(=C)Cl Amb24653169 [0,2,0,0,0,0|2,0,0]=4 8148 B8R0.28 CC(N)CSCC(C)=C Amb24478766 [0,2,0,0,0,0|2,0,0]=4 8149 B8R0.28 CC(NCCC(=O)O)C Amb1106349 [0,2,0,0,0,0|0,0,0]=2 8150 B8R0.28 CC(NCCC(=S)N)C Amb17232016 [0,2,0,0,0,0|1,1,0]=4 8151 B8R0.28 CC(O)CCCB(O)O Amb24389636 [0,2,0,0,0,0|1,0,1]=4 8152 B8R0.28 CC(O)CCCC(=C)Br Amb25058566 [0,2,0,0,0,0|2,0,0]=4 8153 B8R0.28 CC(O)CCCC(C)=C Amb24478673 [0,2,0,0,0,0|1,0,1]=4 8154 B8R0.28 CC(O)CCCC(C)=O Amb24340114 [0,2,0,0,0,0|1,0,0]=3 8155 B8R0.28 CC(O)CCCC(N)=O Amb24622764 [0,2,0,0,0,0|1,0,0]=3 8156 B8R0.28 CC(O)CCCN(C)C Amb24271102 [0,2,0,0,0,0|1,0,1]=4 8157 B8R0.28 CC(O)CCNC(N)=N Amb24726602 [0,2,0,0,0,0|2,0,0]=4 8158 B8R0.28 CC(O)CCNS(C)=O Amb25176978 [0,2,0,0,0,0|2,0,0]=4 8159 B8R0.28 CC(O)CCOC(N)=O Amb25293990 [0,2,0,0,0,0|1,0,0]=3 8160 B8R0.28 CC(O)CCSC(C)=O Amb25846896 [0,2,0,0,0,0|1,0,0]=3 8161 B8R0.28 CC(O)CC\C=C(\C)/Br Amb24430963 [0,2,0,0,0,0|2,0,0]=4 8162 B8R0.28 CC(O)CNCC(=C)Br Amb18303322 [0,2,0,0,0,0|2,0,0]=4 8163 B8R0.28 CC(O)CNCC(=C)Cl Amb19004839 [0,2,0,0,0,0|2,0,0]=4 8164 B8R0.28 CC(O)CNCC(C)=O Amb24589662 [0,2,0,0,0,0|1,0,0]=3 8165 B8R0.28 CC(O)CNCC(C)N Amb24117888 [0,2,0,0,0,0|1,0,1]=4 8166 B8R0.28 CC(O)CONC(N)=O Amb24604387 [0,2,0,0,0,0|2,0,0]=4 8167 B8R0.28 CC(O)CSCC(C)O Amb25144450 [0,2,0,0,0,0|1,0,1]=4 8168 B8R0.28 CC(O)CSCC(N)=O Amb25690591 [0,2,0,0,0,0|1,0,0]=3 8169 B8R0.28 CC(O)CSCC(O)=O Amb19005278 [0,2,0,0,0,0|0,0,0]=2 8170 B8R0.28 CC(O)C\C=C\C(O)=O Amb18642771 [0,2,0,0,0,0|0,0,1]=3 8171 B8R0.28 CC(O)NCCC(N)=O Amb24446895 [0,2,0,0,0,0|1,0,0]=3 8172 B8R0.28 CC(S)CCOC(C)=O Amb25077156 [0,2,0,0,0,0|1,0,0]=3 8173 B8R0.28 CC(S)\C=C/CC(O)=O Amb18644289 [0,2,0,0,0,0|0,0,1]=3 8174 B8R0.28 CC(S)\C=C\CC(O)=O Amb24514919 [0,2,0,0,0,0|0,0,1]=3 8175 B8R0.28 CC(SCCC(=S)N)C Amb17307561 [0,2,0,0,0,0|1,1,0]=4 8176 B8R0.28 CN(C)C=NCC(O)=O Amb24740176 [0,2,0,0,0,0|1,0,1]=4 8177 B8R0.28 CN(C)CC#CC(O)=O Amb24471923 [0,2,0,0,0,0|0,0,2]=4 8178 B8R0.28 CN(C)CCCB(O)O Amb24069054 [0,2,0,0,0,0|1,0,1]=4 8179 B8R0.28 CN(C)CCCC(O)O Amb24544945 [0,2,0,0,0,0|0,0,2]=4 8180 B8R0.28 CN(C)CCC[SiH](O)O Amb24739265 [0,2,0,0,0,0|0,1,1]=4 8181 B8R0.28 CN(C)CCNC(O)=S Amb25106929 [0,2,0,0,0,0|1,1,0]=4 8182 B8R0.28 CN(C)NCCC(O)=O Amb24113891 [0,2,0,0,0,0|1,0,0]=3 8183 B8R0.28 CN(CCNC(=O)N)C Amb1129425 [0,2,0,0,0,0|2,0,0]=4 8184 B8R0.28 CN(C\C=C\C(=O)O)C Amb15695416 [0,2,0,0,0,0|0,0,2]=4 8185 B8R0.28 CS(=O)CCCC(N)=S Amb24629819 [0,2,0,0,0,0|1,1,0]=4 8186 B8R0.28 CS(=O)CCCC(O)=O Amb18306076 [0,2,0,0,0,0|0,0,0]=2 8187 B8R0.28 CS(=O)C\C=C\C(O)=O Amb24586059 [0,2,0,0,0,0|0,0,2]=4 8188 B8R0.28 CS(=O)NOCC(O)=O Amb24588744 [0,2,0,0,0,0|2,0,0]=4 8189 B8R0.28 C[C@@H](N)CCCC(O)=O Amb24435680 [0,2,0,0,0,0|0,0,0]=2 8190 B8R0.28 C[C@@H](N)COCC(O)=O Amb24641471 [0,2,0,0,0,0|0,0,0]=2 8191 B8R0.28 C[C@@H](O)CCC=C(C)C Amb22049561 [0,2,0,0,0,0|2,0,0]=4 8192 B8R0.28 C[C@@H](O)CCCC(C)O Amb24412846 [0,2,0,0,0,0|1,0,1]=4 8193 B8R0.28 C[C@@H](O)CCOC(C)=O Amb25357488 [0,2,0,0,0,0|1,0,0]=3 8194 B8R0.28 C[C@@H](O)CNCC(C)O Amb25032285 [0,2,0,0,0,0|1,0,1]=4 8195 B8R0.28 C[C@@H](O)CNCC(N)=O Amb25260382 [0,2,0,0,0,0|1,0,0]=3 8196 B8R0.28 C[C@@H](O)COCC(C)O Amb25796323 [0,2,0,0,0,0|1,0,1]=4 8197 B8R0.28 C[C@@H](O)CSCC(N)=O Amb25799456 [0,2,0,0,0,0|1,0,0]=3 8198 B8R0.28 C[C@@H](O)C\C=C\C(O)=O Amb25250610 [0,2,0,0,0,0|0,0,1]=3 8199 B8R0.28 C[C@H](Br)CCC=C(C)C Amb25374451 [0,2,0,0,0,0|2,0,0]=4 8200 B8R0.28 C[C@H](N)COCC(O)=O Amb25305053 [0,2,0,0,0,0|0,0,0]=2 8201 B8R0.28 C[C@H](N)CSCC(N)=O Amb25054209 [0,2,0,0,0,0|1,0,0]=3 8202 B8R0.28 C[C@H](O)CC#CC(O)=O Amb24627681 [0,2,0,0,0,0|0,0,1]=3 8203 B8R0.28 C[C@H](O)CCC=C(C)C Amb22049564 [0,2,0,0,0,0|2,0,0]=4 8204 B8R0.28 C[C@H](O)CCCC(O)=O Amb25842809 [0,2,0,0,0,0|0,0,0]=2 8205 B8R0.28 C[C@H](O)CCC[C@@H](C)O Amb25803331 [0,2,0,0,0,0|1,0,1]=4 8206 B8R0.28 C[C@H](O)CCC[C@H](C)O Amb25097837 [0,2,0,0,0,0|1,0,1]=4 8207 B8R0.28 C[C@H](O)CCNC(N)=O Amb25272281 [0,2,0,0,0,0|1,0,0]=3 8208 B8R0.28 C[C@H](O)COC[C@@H](C)O Amb25801708 [0,2,0,0,0,0|1,0,1]=4 8209 B8R0.28 C[C@H](O)CSCC(N)=O Amb25202527 [0,2,0,0,0,0|1,0,0]=3 8210 B8R0.28 NC(=N)CCCC(O)=O Amb25757878 [0,2,0,0,0,0|0,0,1]=3 8211 B8R0.28 NC(=N)CNCC(O)=O Amb25062019 [0,2,0,0,0,0|1,0,1]=4 8212 B8R0.28 NC(=O)CCCC(N)=N Amb25173064 [0,2,0,0,0,0|1,0,1]=4 8213 B8R0.28 NC(=O)CCCC(N)=O Amb24098550 [0,2,0,0,0,0|1,0,1]=4 8214 B8R0.28 NC(=O)CCC[N+]([O-])=O Amb22432425 [0,2,0,0,0,0|2,0,0]=4 8215 B8R0.28 NC(=O)CNCC(F)F Amb25325661 [0,2,0,0,0,0|2,0,0]=4 8216 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,2,0,0,0,0|1,0,1]=4 8217 B8R0.28 NC(=O)NCCC(F)F Amb25369231 [0,2,0,0,0,0|2,0,0]=4 8218 B8R0.28 O=C(Cl)CCCC(Cl)Cl Amb24602174 [0,2,0,0,0,0|1,0,0]=3 8219 B8R0.28 OC(=O)CCC=C(C)C Amb10601609 [0,2,0,0,0,0|0,0,1]=3 8220 B8R0.28 OC(=O)CCC=C(F)F Amb25224993 [0,2,0,0,0,0|0,0,2]=4 8221 B8R0.28 OC(=O)CCCC(=O)Br Amb24480005 [0,2,0,0,0,0|0,0,1]=3 8222 B8R0.28 OC(=O)CCCC(Cl)Cl Amb24479944 [0,2,0,0,0,0|0,0,0]=2 8223 B8R0.28 OC(=O)CCCC(F)F Amb24117996 [0,2,0,0,0,0|0,0,0]=2 8224 B8R0.28 OC(=O)CCCC(O)=O Amb22351480 [0,2,0,0,0,0|0,0,1]=3 8225 B8R0.28 OC(=O)CCCC(O)=O Amb22351829 [0,2,0,0,0,0|0,0,1]=3 8226 B8R0.28 OC(=O)CCCP(O)=O Amb24480161 [0,2,0,0,0,0|1,0,0]=3 8227 B8R0.28 OC(=O)CCNC(=O)C Amb1104704 [0,2,0,0,0,0|0,0,1]=3 8228 B8R0.28 OC(=O)CCNC(S)=S Amb25765722 [0,2,0,0,0,0|1,0,1]=4 8229 B8R0.28 OC(=O)CCOC(F)F Amb25342869 [0,2,0,0,0,0|1,0,0]=3 8230 B8R0.28 OC(=O)CCSC(=N)N Amb1043190 [0,2,0,0,0,0|1,0,1]=4 8231 B8R0.28 OC(=O)CCSC(=O)C Amb17607685 [0,2,0,0,0,0|0,0,1]=3 8232 B8R0.28 OC(=O)CNCC(F)F Amb24433048 [0,2,0,0,0,0|1,0,0]=3 8233 B8R0.28 OC(=O)CNCP(O)=O Amb24557425 [0,2,0,0,0,0|2,0,0]=4 8234 B8R0.28 OC(=O)COCC(=O)Cl Amb25372456 [0,2,0,0,0,0|1,0,1]=4 8235 B8R0.28 OC(=O)CSCC(F)F Amb18791606 [0,2,0,0,0,0|1,0,0]=3 8236 B8R0.28 OC(=O)CSSC(Cl)Cl Amb24390437 [0,2,0,0,0,0|2,0,0]=4 8237 B8R0.28 OC(=S)COCC(O)=O Amb22262972 [0,2,0,0,0,0|1,0,1]=4 8238 B8R0.28 OC(O)CCCC(O)=O Amb25205498 [0,2,0,0,0,0|0,0,0]=2 8239 B8R0.28 O[13C](=O)CCC[13C](=O)O Amb17614793 [0,2,0,0,0,0|0,0,1]=3 8240 B8R0.28 [O-]C(=O)CCCC([O-])=O Amb22729768 [0,2,0,0,0,0|0,0,2]=4 8241 B8R0.28 [O-][N+](=O)CCCC(O)=O Amb24711043 [0,2,0,0,0,0|1,0,0]=3 8242 B8R0.28 [O-][N+](=O)OCCC(O)=O Amb21953424 [0,2,0,0,0,0|2,0,0]=4 8243 B8R0.12 C=CCC(C(=O)O)(C)C Amb10603495 [0,2,0,0,0,0|0,0,2]=4 8244 B8R0.12 C=CCC(C(=O)O)(F)F Amb10982503 [0,2,0,0,0,0|0,0,2]=4 8245 B8R0.12 C=CCC(Cl)(Cl)C(O)=O Amb24479939 [0,2,0,0,0,0|0,0,2]=4 8246 B8R0.12 C=CCC(F)(Cl)C(O)=O Amb24373901 [0,2,0,0,0,0|0,0,2]=4 8247 B8R0.12 CC(=O)C(C)(O)CCO Amb25710178 [0,2,0,0,0,0|2,0,0]=4 8248 B8R0.12 CC(C(=O)O)(CCC)Cl Amb17593751 [0,2,0,0,0,0|0,0,0]=2 8249 B8R0.12 CC(C)(CC#C)C(O)=O Amb18636154 [0,2,0,0,0,0|0,0,2]=4 8250 B8R0.12 CC(C)(CC=O)C(O)=O Amb24340256 [0,2,0,0,0,0|1,0,1]=4 8251 B8R0.12 CC(C)(CCBr)C(=O)Cl Amb24375779 [0,2,0,0,0,0|2,0,0]=4 8252 B8R0.12 CC(C)(CCBr)C(O)=O Amb24739595 [0,2,0,0,0,0|1,0,0]=3 8253 B8R0.12 CC(C)(CCCl)C(=O)Cl Amb25824469 [0,2,0,0,0,0|2,0,0]=4 8254 B8R0.12 CC(C)(CCO)C(O)=O Amb24763728 [0,2,0,0,0,0|1,0,0]=3 8255 B8R0.12 CC(C)(CNO)C(O)=O Amb25204097 [0,2,0,0,0,0|2,0,0]=4 8256 B8R0.12 CC(C)(CON)C(O)=O Amb25188999 [0,2,0,0,0,0|2,0,0]=4 8257 B8R0.12 CC(N)(CC=C)C(O)=O Amb22733281 [0,2,0,0,0,0|0,0,2]=4 8258 B8R0.12 CC(N)(CC=C)C(O)=O Amb22898994 [0,2,0,0,0,0|0,0,2]=4 8259 B8R0.12 CC(N)(CCN)C(O)=O Amb24060975 [0,2,0,0,0,0|1,0,0]=3 8260 B8R0.12 CC(N)(CCO)C(O)=O Amb24340273 [0,2,0,0,0,0|1,0,0]=3 8261 B8R0.12 CC(O)(CC#C)C(O)=O Amb24680889 [0,2,0,0,0,0|0,0,2]=4 8262 B8R0.12 CC(O)(CC=C)C(O)=O Amb25077172 [0,2,0,0,0,0|0,0,2]=4 8263 B8R0.12 CC(O)(CCO)C(O)=O Amb25250520 [0,2,0,0,0,0|1,0,0]=3 8264 B8R0.12 CC(O)(CNO)C(O)=O Amb25032323 [0,2,0,0,0,0|2,0,0]=4 8265 B8R0.12 CC(O)(CON)C(O)=O Amb25853079 [0,2,0,0,0,0|2,0,0]=4 8266 B8R0.12 CCCC(C(=S)N)(C)C Amb17466471 [0,2,0,0,0,0|1,1,0]=4 8267 B8R0.12 CCCC(C)(Br)C(=O)Cl Amb25757613 [0,2,0,0,0,0|1,0,0]=3 8268 B8R0.12 CCCC(C)(Br)C(O)=O Amb25772819 [0,2,0,0,0,0|0,0,0]=2 8269 B8R0.12 CCCC(C)(C)C(=O)Cl Amb22168276 [0,2,0,0,0,0|1,0,0]=3 8270 B8R0.12 CCCC(C)(N)C(C)=O Amb25340167 [0,2,0,0,0,0|1,0,0]=3 8271 B8R0.12 CCCC(C)(N)C(N)=O Amb18288983 [0,2,0,0,0,0|1,0,0]=3 8272 B8R0.12 CCCC(C)(N)C(N)=S Amb19148046 [0,2,0,0,0,0|1,1,0]=4 8273 B8R0.12 CCCC(C)(O)C(C)=C Amb25727392 [0,2,0,0,0,0|2,0,0]=4 8274 B8R0.12 CCCC(C)(O)C(N)=O Amb24116806 [0,2,0,0,0,0|1,0,0]=3 8275 B8R0.12 CCCC(C)(O)C(O)=O Amb18288835 [0,2,0,0,0,0|0,0,0]=2 8276 B8R0.12 CCCC(F)(F)C(N)=O Amb24459558 [0,2,0,0,0,0|1,0,0]=3 8277 B8R0.12 CCCC(F)(F)C(O)=O Amb19929277 [0,2,0,0,0,0|0,0,0]=2 8278 B8R0.12 CCC[C@](C)(F)C(O)=O Amb24579970 [0,2,0,0,0,0|0,0,0]=2 8279 B8R0.12 CCC[C@](C)(O)C(O)=O Amb25114242 [0,2,0,0,0,0|0,0,0]=2 8280 B8R0.12 CCNC(C(=O)O)(C)C Amb13952777 [0,2,0,0,0,0|1,0,0]=3 8281 B8R0.12 CCNC(C)(C)C(C)=O Amb24742035 [0,2,0,0,0,0|2,0,0]=4 8282 B8R0.12 CCNC(C)(C)C(N)=O Amb18301842 [0,2,0,0,0,0|2,0,0]=4 8283 B8R0.12 CCOC(C)(C)C(N)=O Amb25024965 [0,2,0,0,0,0|2,0,0]=4 8284 B8R0.12 CCOC(C)(C)C(O)=O Amb18976723 [0,2,0,0,0,0|1,0,0]=3 8285 B8R0.12 CCOC(C)(Cl)C(C)=O Amb24643549 [0,2,0,0,0,0|2,0,0]=4 8286 B8R0.12 CCSC(C(=O)O)(C)C Amb17501487 [0,2,0,0,0,0|1,0,0]=3 8287 B8R0.12 CCSC(C)(C)C(C)=O Amb25318804 [0,2,0,0,0,0|2,0,0]=4 8288 B8R0.12 CCSC(C)(C)C(N)=O Amb24347695 [0,2,0,0,0,0|2,0,0]=4 8289 B8R0.12 CCSC(C)(Cl)C(C)=O Amb24425386 [0,2,0,0,0,0|2,0,0]=4 8290 B8R0.12 CNCC(C)(C)C(C)=O Amb24470000 [0,2,0,0,0,0|2,0,0]=4 8291 B8R0.12 CNCC(C)(N)C(O)=O Amb24061057 [0,2,0,0,0,0|1,0,0]=3 8292 B8R0.12 CNCC(F)(F)C(O)=O Amb22497225 [0,2,0,0,0,0|1,0,0]=3 8293 B8R0.12 CNCC(F)(F)C(O)=O Amb22523480 [0,2,0,0,0,0|1,0,0]=3 8294 B8R0.12 CNNC(C)(C)C(O)=O Amb25252974 [0,2,0,0,0,0|2,0,0]=4 8295 B8R0.12 CNOC(C)(C)C(O)=O Amb24472643 [0,2,0,0,0,0|2,0,0]=4 8296 B8R0.12 COCC(C(=O)O)(C)C Amb10608195 [0,2,0,0,0,0|1,0,0]=3 8297 B8R0.12 COCC(C)(Cl)C(C)=O Amb25833577 [0,2,0,0,0,0|2,0,0]=4 8298 B8R0.12 COCC(C)(Cl)C(O)=O Amb24692925 [0,2,0,0,0,0|1,0,0]=3 8299 B8R0.12 COCC(C)(N)C(C)=O Amb24376983 [0,2,0,0,0,0|2,0,0]=4 8300 B8R0.12 COCC(C)(N)C(N)=O Amb18298766 [0,2,0,0,0,0|2,0,0]=4 8301 B8R0.12 COCC(C)(N)C(N)=O Amb19515079 [0,2,0,0,0,0|2,0,0]=4 8302 B8R0.12 COCC(C)(N)C(O)=O Amb18990135 [0,2,0,0,0,0|1,0,0]=3 8303 B8R0.12 COCC(C)(N)C(O)=O Amb20622455 [0,2,0,0,0,0|1,0,0]=3 8304 B8R0.12 COCC(C)(O)C(O)=O Amb18992608 [0,2,0,0,0,0|1,0,0]=3 8305 B8R0.12 COCC(F)(F)C(O)=O Amb24518571 [0,2,0,0,0,0|1,0,0]=3 8306 B8R0.12 COC[C@](C)(N)C(O)=O Amb24568285 [0,2,0,0,0,0|1,0,0]=3 8307 B8R0.12 CSCC(C)(C)C(C)=O Amb25128208 [0,2,0,0,0,0|2,0,0]=4 8308 B8R0.12 CSCC(C)(C)C(N)=O Amb25352902 [0,2,0,0,0,0|2,0,0]=4 8309 B8R0.12 CSCC(C)(C)C(O)=O Amb18124874 [0,2,0,0,0,0|1,0,0]=3 8310 B8R0.12 CSCC(C)(Cl)C(N)=O Amb25295333 [0,2,0,0,0,0|2,0,0]=4 8311 B8R0.12 CSCC(C)(N)C(N)=O Amb18294540 [0,2,0,0,0,0|2,0,0]=4 8312 B8R0.12 CSCC(C)(N)C(O)=O Amb18294541 [0,2,0,0,0,0|1,0,0]=3 8313 B8R0.12 CSCC(C)(O)C(N)=O Amb25777208 [0,2,0,0,0,0|2,0,0]=4 8314 B8R0.12 CSCC(C)(O)C(O)=O Amb18644426 [0,2,0,0,0,0|1,0,0]=3 8315 B8R0.12 CSCC(F)(F)C(N)=O Amb23590988 [0,2,0,0,0,0|2,0,0]=4 8316 B8R0.12 CSCC(F)(F)C(O)=O Amb23590987 [0,2,0,0,0,0|1,0,0]=3 8317 B8R0.12 CSSC(C)(C)C(O)=O Amb24481616 [0,2,0,0,0,0|2,0,0]=4 8318 B8R0.12 C[C@@](C(=O)O)(CC#C)N Amb16183909 [0,2,0,0,0,0|0,0,2]=4 8319 B8R0.12 C[C@@](C(=O)O)(CCC)N Amb16232632 [0,2,0,0,0,0|0,0,0]=2 8320 B8R0.12 C[C@@](F)(CC=C)C(O)=O Amb25032094 [0,2,0,0,0,0|0,0,2]=4 8321 B8R0.12 C[C@@](N)(CC=C)C(O)=O Amb23402145 [0,2,0,0,0,0|0,0,2]=4 8322 B8R0.12 C[C@@](N)(CCF)C(O)=O Amb25146094 [0,2,0,0,0,0|1,0,0]=3 8323 B8R0.12 C[C@](C(=O)O)(CC#C)N Amb16183908 [0,2,0,0,0,0|0,0,2]=4 8324 B8R0.12 C[C@](F)(CC=C)C(O)=O Amb25251491 [0,2,0,0,0,0|0,0,2]=4 8325 B8R0.12 C[C@](N)(CC#N)C(O)=O Amb25078617 [0,2,0,0,0,0|1,0,1]=4 8326 B8R0.12 C[C@](N)(CCF)C(O)=O Amb24383347 [0,2,0,0,0,0|1,0,0]=3 8327 B8R0.12 C[C@](N)(CCN)C(O)=O Amb25348479 [0,2,0,0,0,0|1,0,0]=3 8328 B8R0.12 C[C@](N)(CCO)C(O)=O Amb24720458 [0,2,0,0,0,0|1,0,0]=3 8329 B8R0.12 C\C=C\C(C)(C)C(O)=O Amb18642634 [0,2,0,0,0,0|0,0,2]=4 8330 B8R0.12 C\C=C\C(C)(N)C(O)=O Amb24671255 [0,2,0,0,0,0|0,0,2]=4 8331 B8R0.12 N#CCC(C(=O)O)(C)C Amb17334096 [0,2,0,0,0,0|1,0,1]=4 8332 B8R0.12 O=C(Cl)C(Cl)(Cl)CCCl Amb24357417 [0,2,0,0,0,0|2,0,0]=4 8333 B8R0.12 OCCC(Cl)(Cl)C(O)=O Amb24692691 [0,2,0,0,0,0|1,0,0]=3 8334 B8R0.14 CC(CCBr)S(O)(=O)=O Amb24598786 [0,2,0,0,0,0|2,0,0]=4 8335 B8R0.14 CC(CCCl)S(O)(=O)=O Amb25321647 [0,2,0,0,0,0|2,0,0]=4 8336 B8R0.14 CC(CCN)P(C)(O)=O Amb25295334 [0,2,0,0,0,0|2,0,0]=4 8337 B8R0.14 CCCC(C)S(N)(=O)=O Amb18793305 [0,2,0,0,0,0|1,0,1]=4 8338 B8R0.14 CCCC(Cl)P(O)(O)=O Amb25810769 [0,2,0,0,0,0|1,0,0]=3 8339 B8R0.14 CCCC(Cl)S(=O)(=O)Cl Amb24715240 [0,2,0,0,0,0|1,0,1]=4 8340 B8R0.14 CCCC(N)C(N)(O)O Amb25366915 [0,2,0,0,0,0|0,0,2]=4 8341 B8R0.14 CCCC(O)C(O)(O)O Amb25731015 [0,2,0,0,0,0|0,0,2]=4 8342 B8R0.14 CCCC(O)P(C)(C)=O Amb24471744 [0,2,0,0,0,0|2,0,0]=4 8343 B8R0.14 CCC[C@@H](Cl)P(O)(O)=O Amb24649962 [0,2,0,0,0,0|1,0,0]=3 8344 B8R0.14 CCC[C@@H](N)P(O)(O)=O Amb25097147 [0,2,0,0,0,0|1,0,0]=3 8345 B8R0.14 CCC[C@H](O)P(O)(O)=O Amb25052190 [0,2,0,0,0,0|1,0,0]=3 8346 B8R0.14 CNCC(N)P(O)(O)=O Amb25829146 [0,2,0,0,0,0|2,0,0]=4 8347 B8R0.14 CNC[C@@H](N)P(O)(O)=O Amb25118760 [0,2,0,0,0,0|2,0,0]=4 8348 B8R0.14 COCC(N)P(O)(O)=O Amb25682729 [0,2,0,0,0,0|2,0,0]=4 8349 B8R0.14 CP(O)(=O)C(O)CCN Amb24469986 [0,2,0,0,0,0|2,0,0]=4 8350 B8R0.14 CSCC(N)S(O)(=O)=O Amb25111012 [0,2,0,0,0,0|2,0,0]=4 8351 B8R0.14 NC(CCS)P(O)(O)=O Amb25088296 [0,2,0,0,0,0|2,0,0]=4 8352 B8R0.14 N[C@H](CCO)P(O)(O)=O Amb24443042 [0,2,0,0,0,0|2,0,0]=4 8353 B8R0.14 OC(CCF)P(O)(O)=O Amb24395313 [0,2,0,0,0,0|2,0,0]=4 8354 B8R0.14 OCCC(Cl)P(O)(O)=O Amb24528737 [0,2,0,0,0,0|2,0,0]=4 8355 B8R0.15 C=CC(CC#N)C(O)=O Amb25047315 [0,2,0,0,0,0|1,0,1]=4 8356 B8R0.15 C=CCC(CO)C(O)=O Amb24763754 [0,2,0,0,0,0|0,0,2]=4 8357 B8R0.15 C=CC[C@@H](NO)C(O)=O Amb25328715 [0,2,0,0,0,0|0,0,2]=4 8358 B8R0.15 C=CC[C@H](CN)C(O)=O Amb24679707 [0,2,0,0,0,0|0,0,2]=4 8359 B8R0.15 CC#CC(CC)C(O)=O Amb25119285 [0,2,0,0,0,0|0,0,2]=4 8360 B8R0.15 CC(=O)C(CCC)=CBr Amb25173007 [0,2,0,0,0,0|1,0,1]=4 8361 B8R0.15 CC(=O)C(CCC)=C[O-] Amb25322896 [0,2,0,0,0,0|1,0,1]=4 8362 B8R0.15 CC(=O)C(CCC)=NO Amb24712653 [0,2,0,0,0,0|1,0,1]=4 8363 B8R0.15 CC(=O)\C(\CCC)=C/[O-] Amb24647177 [0,2,0,0,0,0|1,0,1]=4 8364 B8R0.15 CC(=O)\C(\CCC)=C\C Amb25347402 [0,2,0,0,0,0|1,0,1]=4 8365 B8R0.15 CC(=O)\C(\CCC)=N\O Amb24687410 [0,2,0,0,0,0|1,0,1]=4 8366 B8R0.15 CC(O)C(CCl)CCC Amb24562834 [0,2,0,0,0,0|1,0,1]=4 8367 B8R0.15 CC=NC(CO)C(O)=O Amb24740970 [0,2,0,0,0,0|1,0,1]=4 8368 B8R0.15 CCC(CC#C)C(O)=O Amb18115864 [0,2,0,0,0,0|0,0,2]=4 8369 B8R0.15 CCC(CC#N)C(O)=O Amb25760267 [0,2,0,0,0,0|1,0,1]=4 8370 B8R0.15 CCC(CC=C)C(O)=O Amb18642632 [0,2,0,0,0,0|0,0,2]=4 8371 B8R0.15 CCC(CCBr)C(C)=O Amb25109972 [0,2,0,0,0,0|2,0,0]=4 8372 B8R0.15 CCC(CCC)B(O)O Amb24464750 [0,2,0,0,0,0|1,0,1]=4 8373 B8R0.15 CCC(CCC)C(C)=O Amb25683405 [0,2,0,0,0,0|1,0,0]=3 8374 B8R0.15 CCC(CCC)C(N)=O Amb24678022 [0,2,0,0,0,0|1,0,0]=3 8375 B8R0.15 CCC(CCC)C(O)=O Amb19009626 [0,2,0,0,0,0|0,0,0]=2 8376 B8R0.15 CCC(CCC)S(C)=O Amb24592289 [0,2,0,0,0,0|2,0,0]=4 8377 B8R0.15 CCC(CCCl)C(C)=O Amb25112721 [0,2,0,0,0,0|2,0,0]=4 8378 B8R0.15 CCC(CCN)C(O)=O Amb24699884 [0,2,0,0,0,0|1,0,0]=3 8379 B8R0.15 CCC(CCN)P(O)=O Amb24478799 [0,2,0,0,0,0|2,0,0]=4 8380 B8R0.15 CCC(CCO)C(O)=O Amb18642884 [0,2,0,0,0,0|1,0,0]=3 8381 B8R0.15 CCC(COC)C(O)=O Amb18124352 [0,2,0,0,0,0|1,0,0]=3 8382 B8R0.15 CCC(NCC)C(N)=O Amb19006590 [0,2,0,0,0,0|2,0,0]=4 8383 B8R0.15 CCC(SCC)C(N)=O Amb25858352 [0,2,0,0,0,0|2,0,0]=4 8384 B8R0.15 CCCC(=CC)C(N)=O Amb25174852 [0,2,0,0,0,0|1,0,1]=4 8385 B8R0.15 CCCC(=NO)C(N)=O Amb25174964 [0,2,0,0,0,0|1,0,1]=4 8386 B8R0.15 CCCC(C#C)C(O)=O Amb25280471 [0,2,0,0,0,0|0,0,0]=2 8387 B8R0.15 CCCC(C#N)C(C)=O Amb24053569 [0,2,0,0,0,0|1,0,0]=3 8388 B8R0.15 CCCC(C#N)C(N)=O Amb24410513 [0,2,0,0,0,0|1,0,0]=3 8389 B8R0.15 CCCC(C=O)C(C)=C Amb25205457 [0,2,0,0,0,0|2,0,0]=4 8390 B8R0.15 CCCC(CN)C(C)=O Amb25756244 [0,2,0,0,0,0|1,0,0]=3 8391 B8R0.15 CCCC(CN)C(O)=O Amb19373497 [0,2,0,0,0,0|0,0,0]=2 8392 B8R0.15 CCCC(NBr)C(O)=O Amb24634034 [0,2,0,0,0,0|0,0,0]=2 8393 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [0,2,0,0,0,0|1,0,0]=3 8394 B8R0.15 CCCC(NC)C(O)=O Amb21961534 [0,2,0,0,0,0|0,0,0]=2 8395 B8R0.15 CCCC(NC)C(O)=O Amb22587444 [0,2,0,0,0,0|0,0,0]=2 8396 B8R0.15 CCCC(NCl)C(O)=O Amb25032132 [0,2,0,0,0,0|0,0,0]=2 8397 B8R0.15 CCCC(NO)C(O)=O Amb22372057 [0,2,0,0,0,0|0,0,0]=2 8398 B8R0.15 CCCC(OC)C(N)=S Amb25773947 [0,2,0,0,0,0|1,1,0]=4 8399 B8R0.15 CCCN(C(=O)N)N=O Amb17618621 [0,2,0,0,0,0|2,0,0]=4 8400 B8R0.15 CCCN(CCl)C(=O)Cl Amb25361016 [0,2,0,0,0,0|2,0,0]=4 8401 B8R0.15 CCCN(CCl)C(C)=O Amb25348552 [0,2,0,0,0,0|2,0,0]=4 8402 B8R0.15 CCC[C@@H](CO)C(O)=O Amb24571859 [0,2,0,0,0,0|0,0,0]=2 8403 B8R0.15 CCC[C@@H](NC)C(O)=O Amb25771939 [0,2,0,0,0,0|0,0,0]=2 8404 B8R0.15 CCC[C@H](CO)C(O)=O Amb25063310 [0,2,0,0,0,0|0,0,0]=2 8405 B8R0.15 CCC[C@H](NC)C(O)=O Amb25062610 [0,2,0,0,0,0|0,0,0]=2 8406 B8R0.15 CCC[C@H](NO)C(O)=O Amb25744829 [0,2,0,0,0,0|0,0,0]=2 8407 B8R0.15 CCC\C(=C/C)\C(N)=O Amb25295458 [0,2,0,0,0,0|1,0,1]=4 8408 B8R0.15 CCC\C(=N\O)\C(N)=O Amb24760666 [0,2,0,0,0,0|1,0,1]=4 8409 B8R0.15 CCN(CCC)C(C)=O Amb24570821 [0,2,0,0,0,0|2,0,0]=4 8410 B8R0.15 CCNC(C=C)C(O)=O Amb25346510 [0,2,0,0,0,0|1,0,0]=3 8411 B8R0.15 CCNC(CN)C(O)=O Amb25825729 [0,2,0,0,0,0|1,0,0]=3 8412 B8R0.15 CCNC(CO)C(N)=O Amb25075770 [0,2,0,0,0,0|2,0,0]=4 8413 B8R0.15 CCNC(CO)C(O)=O Amb24477808 [0,2,0,0,0,0|1,0,0]=3 8414 B8R0.15 CCNC(CS)C(O)=O Amb25694444 [0,2,0,0,0,0|1,0,0]=3 8415 B8R0.15 CCN[C@@H](CO)C(O)=O Amb24477673 [0,2,0,0,0,0|1,0,0]=3 8416 B8R0.15 CCN[C@@H](CS)C(O)=O Amb25801938 [0,2,0,0,0,0|1,0,0]=3 8417 B8R0.15 CCN[C@H](CO)C(O)=O Amb25328424 [0,2,0,0,0,0|1,0,0]=3 8418 B8R0.15 CCN[C@H](CS)C(O)=O Amb24692505 [0,2,0,0,0,0|1,0,0]=3 8419 B8R0.15 CCOC(=CC)C(O)=O Amb24622222 [0,2,0,0,0,0|1,0,1]=4 8420 B8R0.15 CCOC(C=C)C(C)=O Amb25691894 [0,2,0,0,0,0|2,0,0]=4 8421 B8R0.15 CCOC(C=C)C(O)=O Amb18642775 [0,2,0,0,0,0|1,0,0]=3 8422 B8R0.15 CCOC(CO)C(O)=O Amb18316294 [0,2,0,0,0,0|1,0,0]=3 8423 B8R0.15 CCOC(CS)C(O)=O Amb19037339 [0,2,0,0,0,0|1,0,0]=3 8424 B8R0.15 CCO\C(=C/C)\C(O)=O Amb18642768 [0,2,0,0,0,0|1,0,1]=4 8425 B8R0.15 CCSC(C#N)C(C)=O Amb24101292 [0,2,0,0,0,0|2,0,0]=4 8426 B8R0.15 CCSC(C=O)C(C)=O Amb18124530 [0,2,0,0,0,0|2,0,0]=4 8427 B8R0.15 CCSC(CCl)C(O)=O Amb25837308 [0,2,0,0,0,0|1,0,0]=3 8428 B8R0.15 CCSC(CN)C(N)=O Amb25801244 [0,2,0,0,0,0|2,0,0]=4 8429 B8R0.15 CCSC(CN)C(O)=O Amb25808987 [0,2,0,0,0,0|1,0,0]=3 8430 B8R0.15 CCSC(CO)C(O)=O Amb25803319 [0,2,0,0,0,0|1,0,0]=3 8431 B8R0.15 CC[C@@H](CCC)C(N)=O Amb24393313 [0,2,0,0,0,0|1,0,0]=3 8432 B8R0.15 CC[C@@H](CCC)C(O)=O Amb24529114 [0,2,0,0,0,0|0,0,0]=2 8433 B8R0.15 CC[C@H](CC#N)C(O)=O Amb24358365 [0,2,0,0,0,0|1,0,1]=4 8434 B8R0.15 CC[C@H](CC=C)C(O)=O Amb25145662 [0,2,0,0,0,0|0,0,2]=4 8435 B8R0.15 CC[C@H](CCC)C(O)=O Amb24376457 [0,2,0,0,0,0|0,0,0]=2 8436 B8R0.15 CC\C=C(/C#N)\C(O)=O Amb25360217 [0,2,0,0,0,0|0,0,2]=4 8437 B8R0.15 CC\C=C(/CC)\C(O)=O Amb24446994 [0,2,0,0,0,0|0,0,2]=4 8438 B8R0.15 CC\C=C(/OC)\C(O)=O Amb25294112 [0,2,0,0,0,0|0,0,2]=4 8439 B8R0.15 CC\C=C(\C#N)/C(O)=O Amb24334329 [0,2,0,0,0,0|0,0,2]=4 8440 B8R0.15 CC\C=C(\OC)/C(O)=O Amb24592549 [0,2,0,0,0,0|0,0,2]=4 8441 B8R0.15 CNC(CNC)C(O)=O Amb25066748 [0,2,0,0,0,0|1,0,0]=3 8442 B8R0.15 CNC(COC)C(N)=O Amb24120142 [0,2,0,0,0,0|2,0,0]=4 8443 B8R0.15 CNC(COC)C(O)=O Amb19304133 [0,2,0,0,0,0|1,0,0]=3 8444 B8R0.15 CNC(COC)C(O)=O Amb22059040 [0,2,0,0,0,0|1,0,0]=3 8445 B8R0.15 CNCC(C#N)C(O)=O Amb25756304 [0,2,0,0,0,0|1,0,0]=3 8446 B8R0.15 CNCC(OC)C(=O)Cl Amb25804756 [0,2,0,0,0,0|2,0,0]=4 8447 B8R0.15 CNCC(OC)C(O)=O Amb25744334 [0,2,0,0,0,0|1,0,0]=3 8448 B8R0.15 CN[C@@H](CCS)C(O)=O Amb24533728 [0,2,0,0,0,0|1,0,0]=3 8449 B8R0.15 CN[C@@H](CNC)C(O)=O Amb24361748 [0,2,0,0,0,0|1,0,0]=3 8450 B8R0.15 CN[C@@H](COC)C(O)=O Amb25075397 [0,2,0,0,0,0|1,0,0]=3 8451 B8R0.15 CN[C@@H](CSC)C(O)=O Amb24377120 [0,2,0,0,0,0|1,0,0]=3 8452 B8R0.15 COC(CC=C)C(O)=O Amb24428233 [0,2,0,0,0,0|0,0,2]=4 8453 B8R0.15 COC(CCN)C(N)=O Amb25219688 [0,2,0,0,0,0|2,0,0]=4 8454 B8R0.15 COC(CCO)C([O-])=O Amb24362009 [0,2,0,0,0,0|1,0,1]=4 8455 B8R0.15 COC(CSC)C(O)=O Amb25309562 [0,2,0,0,0,0|1,0,0]=3 8456 B8R0.15 COC(OCC)C(O)=O Amb25367206 [0,2,0,0,0,0|1,0,0]=3 8457 B8R0.15 COCC(C#N)C(O)=O Amb24382899 [0,2,0,0,0,0|1,0,0]=3 8458 B8R0.15 COCC(C=O)C(O)=O Amb24640433 [0,2,0,0,0,0|1,0,0]=3 8459 B8R0.15 COC[C@H](NO)C(O)=O Amb24671375 [0,2,0,0,0,0|1,0,0]=3 8460 B8R0.15 CONC(C=C)C(O)=O Amb25705766 [0,2,0,0,0,0|2,0,0]=4 8461 B8R0.15 CONC(CN)C(O)=O Amb25688022 [0,2,0,0,0,0|2,0,0]=4 8462 B8R0.15 CO[C@@H](CCN)C(O)=O Amb25146111 [0,2,0,0,0,0|1,0,0]=3 8463 B8R0.15 CO[C@@H](CCO)C([O-])=O Amb24421624 [0,2,0,0,0,0|1,0,1]=4 8464 B8R0.15 CO[C@H](COC)C(N)=O Amb25338210 [0,2,0,0,0,0|2,0,0]=4 8465 B8R0.15 CO[C@H](COC)C(O)=O Amb25122791 [0,2,0,0,0,0|1,0,0]=3 8466 B8R0.15 CSC(CC=C)C(O)=O Amb18644287 [0,2,0,0,0,0|0,0,2]=4 8467 B8R0.15 CSC(CSC)C(O)=O Amb24595007 [0,2,0,0,0,0|1,0,0]=3 8468 B8R0.15 C[C@@H](O)[C@@H](CCC)C#C Amb24407500 [0,2,0,0,0,0|1,0,1]=4 8469 B8R0.15 C\C=C(/CCO)\C(O)=O Amb18642783 [0,2,0,0,0,0|1,0,1]=4 8470 B8R0.15 C\C=C(\CCO)/C(O)=O Amb24568883 [0,2,0,0,0,0|1,0,1]=4 8471 B8R0.15 C\C=C\C(CC)C(O)=O Amb18642657 [0,2,0,0,0,0|0,0,2]=4 8472 B8R0.15 C\C=C\C(SC)C(O)=O Amb18643349 [0,2,0,0,0,0|0,0,2]=4 8473 B8R0.15 NCCC(=NO)C(O)=O Amb25174966 [0,2,0,0,0,0|1,0,1]=4 8474 B8R0.15 NCCC(CF)C(N)=O Amb24559123 [0,2,0,0,0,0|2,0,0]=4 8475 B8R0.15 NCCC(CF)C(O)=O Amb25174518 [0,2,0,0,0,0|1,0,0]=3 8476 B8R0.15 OC(=O)\C(\CCO)=N/O Amb25104712 [0,2,0,0,0,0|1,0,1]=4 8477 B8R0.15 OCNC(CS)C(O)=O Amb24369164 [0,2,0,0,0,0|2,0,0]=4 8478 B8R0.29 C([2H])(NCC(=O)O)([2H])[2H] Amb17620034 [0,2,0,0,0,0|2,0,0]=4 8479 B8R0.29 CC(=C)CCC(C)(C)C Amb24712961 [0,2,0,0,0,0|2,0,0]=4 8480 B8R0.29 CC(=O)CCC(F)(F)F Amb24055935 [0,2,0,0,0,0|2,0,0]=4 8481 B8R0.29 CC(=O)CCS(C)(=O)=O Amb18181020 [0,2,0,0,0,0|2,0,0]=4 8482 B8R0.29 CC(=O)CNC(C)(C)C Amb1091895 [0,2,0,0,0,0|2,0,0]=4 8483 B8R0.29 CC(=O)CNC(C)(C)C Amb22283961 [0,2,0,0,0,0|2,0,0]=4 8484 B8R0.29 CC(=O)NCC(C)(C)C Amb23247439 [0,2,0,0,0,0|2,0,0]=4 8485 B8R0.29 CC(=O)NCC(C)(C)N Amb18642812 [0,2,0,0,0,0|2,0,0]=4 8486 B8R0.29 CC(=O)NCC(C)(C)O Amb25082896 [0,2,0,0,0,0|2,0,0]=4 8487 B8R0.29 CC(=O)OCC(C)(C)F Amb24748637 [0,2,0,0,0,0|2,0,0]=4 8488 B8R0.29 CC(=O)OCC(C)(C)N Amb25843473 [0,2,0,0,0,0|2,0,0]=4 8489 B8R0.29 CC(C)(Br)\C=C\C(O)=O Amb25178813 [0,2,0,0,0,0|0,0,2]=4 8490 B8R0.29 CC(C)(C)C#CC(O)=O Amb22496786 [0,2,0,0,0,0|0,0,2]=4 8491 B8R0.29 CC(C)(C)CCB(O)O Amb24502180 [0,2,0,0,0,0|1,0,1]=4 8492 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [0,2,0,0,0,0|1,0,0]=3 8493 B8R0.29 CC(C)(C)CCC(N)=N Amb24412583 [0,2,0,0,0,0|2,0,0]=4 8494 B8R0.29 CC(C)(C)CNC(N)=O Amb20623709 [0,2,0,0,0,0|2,0,0]=4 8495 B8R0.29 CC(C)(C)COC(N)=O Amb25190252 [0,2,0,0,0,0|2,0,0]=4 8496 B8R0.29 CC(C)(C)NCC(=O)Cl Amb22739730 [0,2,0,0,0,0|2,0,0]=4 8497 B8R0.29 CC(C)(C)OCC(=O)Cl Amb24414017 [0,2,0,0,0,0|2,0,0]=4 8498 B8R0.29 CC(C)(C)OCC(N)=O Amb22228918 [0,2,0,0,0,0|2,0,0]=4 8499 B8R0.29 CC(C)(C)OCC([O-])=O Amb22754771 [0,2,0,0,0,0|1,0,1]=4 8500 B8R0.29 CC(C)(Cl)CCC(O)=O Amb18644451 [0,2,0,0,0,0|0,0,0]=2 8501 B8R0.29 CC(C)(Cl)COC(N)=O Amb25188841 [0,2,0,0,0,0|2,0,0]=4 8502 B8R0.29 CC(C)(N)CCC(=C)Cl Amb25265259 [0,2,0,0,0,0|2,0,0]=4 8503 B8R0.29 CC(C)(N)COP(O)=O Amb25111079 [0,2,0,0,0,0|2,0,0]=4 8504 B8R0.29 CC(C)(O)CCB(O)O Amb24544502 [0,2,0,0,0,0|1,0,1]=4 8505 B8R0.29 CC(C)(O)CCC(N)=S Amb25777865 [0,2,0,0,0,0|1,1,0]=4 8506 B8R0.29 CC(C)(O)CCC([O-])=O Amb24271108 [0,2,0,0,0,0|0,0,1]=3 8507 B8R0.29 CC(C)(O)\C=C\C(O)=O Amb18642770 [0,2,0,0,0,0|0,0,2]=4 8508 B8R0.29 CC(C)(S)CCC(O)=O Amb22489759 [0,2,0,0,0,0|0,0,0]=2 8509 B8R0.29 CC(C)([NH3+])CCC(O)=O Amb22372040 [0,2,0,0,0,0|0,0,0]=2 8510 B8R0.29 CC(C)CCS(=O)(=O)Br Amb23555504 [0,2,0,0,0,0|1,0,1]=4 8511 B8R0.29 CC(C)CCS(=O)(=O)Cl Amb18289340 [0,2,0,0,0,0|1,0,1]=4 8512 B8R0.29 CC(C)CCS(C)(=O)=O Amb25049892 [0,2,0,0,0,0|1,0,1]=4 8513 B8R0.29 CC(C)CCS(N)(=O)=O Amb18791482 [0,2,0,0,0,0|1,0,1]=4 8514 B8R0.29 CC(C)COP(C)(O)=O Amb24117879 [0,2,0,0,0,0|2,0,0]=4 8515 B8R0.29 CC(C)COP(O)(O)=O Amb25264732 [0,2,0,0,0,0|2,0,0]=4 8516 B8R0.29 CC(C)COS(O)(=O)=O Amb25200264 [0,2,0,0,0,0|2,0,0]=4 8517 B8R0.29 CC(Cl)CCP(=O)(Cl)Cl Amb24640281 [0,2,0,0,0,0|2,0,0]=4 8518 B8R0.29 CC(Cl)CCS(C)(=O)=O Amb24407021 [0,2,0,0,0,0|1,0,1]=4 8519 B8R0.29 CC(Cl)CCS(N)(=O)=O Amb25774525 [0,2,0,0,0,0|1,0,1]=4 8520 B8R0.29 CC(Cl)COS(O)(=O)=O Amb24479974 [0,2,0,0,0,0|2,0,0]=4 8521 B8R0.29 CC(F)(F)CCC(=O)Cl Amb25086105 [0,2,0,0,0,0|1,0,0]=3 8522 B8R0.29 CC(F)(F)\C=C\C(O)=O Amb22295928 [0,2,0,0,0,0|0,0,2]=4 8523 B8R0.29 CC(N)(F)CCC(O)=O Amb24672870 [0,2,0,0,0,0|0,0,0]=2 8524 B8R0.29 CC(N)CCC(C)(C)O Amb18642846 [0,2,0,0,0,0|1,0,1]=4 8525 B8R0.29 CC(N)CCP(C)(O)=O Amb25765644 [0,2,0,0,0,0|1,0,0]=3 8526 B8R0.29 CC(N)CCS(C)(=O)=O Amb18300587 [0,2,0,0,0,0|1,0,1]=4 8527 B8R0.29 CC(N)CCS(O)(=O)=O Amb24522970 [0,2,0,0,0,0|1,0,0]=3 8528 B8R0.29 CC(N)CSP(O)(O)=O Amb24649696 [0,2,0,0,0,0|2,0,0]=4 8529 B8R0.29 CC(O)(O)NCC(O)=O Amb24715373 [0,2,0,0,0,0|1,0,0]=3 8530 B8R0.29 CC(O)CCC(C)(C)Cl Amb24355214 [0,2,0,0,0,0|1,0,1]=4 8531 B8R0.29 CC(O)CCC(C)(C)F Amb24757018 [0,2,0,0,0,0|1,0,1]=4 8532 B8R0.29 CC(O)CCC(C)(C)N Amb18642848 [0,2,0,0,0,0|1,0,1]=4 8533 B8R0.29 CC(O)CCS(C)(=O)=O Amb18180142 [0,2,0,0,0,0|1,0,1]=4 8534 B8R0.29 CC(O)COP(O)(O)=O Amb17673332 [0,2,0,0,0,0|2,0,0]=4 8535 B8R0.29 CS(=O)(=O)OCC(O)=O Amb25783884 [0,2,0,0,0,0|2,0,0]=4 8536 B8R0.29 CS(=O)CCC(C)(C)N Amb24538977 [0,2,0,0,0,0|2,0,0]=4 8537 B8R0.29 C[C@@H](N)CCS(O)(=O)=O Amb22799661 [0,2,0,0,0,0|1,0,0]=3 8538 B8R0.29 C[C@H](N)CCS(O)(=O)=O Amb25342455 [0,2,0,0,0,0|1,0,0]=3 8539 B8R0.29 C[C@H](O)COP(O)(O)=O Amb25687780 [0,2,0,0,0,0|2,0,0]=4 8540 B8R0.29 C[N+](C)(C)CCC(N)=O Amb24482186 [0,2,0,0,0,0|2,0,0]=4 8541 B8R0.29 C[N+](C)(C)CCC(O)=O Amb24117222 [0,2,0,0,0,0|1,0,0]=3 8542 B8R0.29 C[Si](C)(C)CCC(N)=O Amb25745193 [0,2,0,0,0,0|1,1,0]=4 8543 B8R0.29 C[Si](C)(C)CCC(O)=O Amb19894136 [0,2,0,0,0,0|0,1,0]=3 8544 B8R0.29 C[Si](C)(C)CCC(O)=O Amb22274047 [0,2,0,0,0,0|0,1,0]=3 8545 B8R0.29 C[Si](C)(C)CCC([O-])=O Amb24121542 [0,2,0,0,0,0|0,1,1]=4 8546 B8R0.29 C[Si](C)(O)CCC(O)=O Amb24680973 [0,2,0,0,0,0|0,1,0]=3 8547 B8R0.29 ClC(=O)OCC(C)(C)C Amb10844667 [0,2,0,0,0,0|2,0,0]=4 8548 B8R0.29 O=C(Br)CCC(F)(F)F Amb22360324 [0,2,0,0,0,0|2,0,0]=4 8549 B8R0.29 O=C(Cl)CCC(Cl)(Cl)Cl Amb25342106 [0,2,0,0,0,0|2,0,0]=4 8550 B8R0.29 O=C(Cl)CCC(F)(F)F Amb19737369 [0,2,0,0,0,0|2,0,0]=4 8551 B8R0.29 OC(=O)CCC(Br)(F)F Amb10838819 [0,2,0,0,0,0|1,0,0]=3 8552 B8R0.29 OC(=O)CCC(F)(Cl)Cl Amb25062982 [0,2,0,0,0,0|1,0,0]=3 8553 B8R0.29 OC(=O)CCC(N)(C)C Amb13951332 [0,2,0,0,0,0|0,0,0]=2 8554 B8R0.29 OC(=O)CCP(=O)(O)C Amb1792559 [0,2,0,0,0,0|1,0,0]=3 8555 B8R0.29 OC(=O)CCP(=O)(O)O Amb2228990 [0,2,0,0,0,0|2,0,0]=4 8556 B8R0.29 OC(=O)CCS(=O)(=O)Cl Amb24481869 [0,2,0,0,0,0|2,0,0]=4 8557 B8R0.29 OC(=O)CCS(=O)(=O)O Amb17399954 [0,2,0,0,0,0|2,0,0]=4 8558 B8R0.29 OC(=O)CCS(=O)(=O)S Amb24627680 [0,2,0,0,0,0|2,0,0]=4 8559 B8R0.29 OC(=O)CC[B-](F)(F)F Amb24351210 [0,2,0,0,0,0|2,0,0]=4 8560 B8R0.29 OC(=O)CC[Ge](Cl)(Cl)Cl Amb19930252 [0,2,0,0,0,0|1,1,0]=4 8561 B8R0.29 OC(=O)CC[P](O)(O)O Amb24543829 [0,2,0,0,0,0|2,0,0]=4 8562 B8R0.29 OC(=O)CNC(C)(C)C Amb10610332 [0,2,0,0,0,0|1,0,0]=3 8563 B8R0.29 OC(=O)CNC(O)(O)O Amb24671331 [0,2,0,0,0,0|2,0,0]=4 8564 B8R0.29 OC(=O)CNS(=O)(=O)C Amb1120433 [0,2,0,0,0,0|2,0,0]=4 8565 B8R0.29 OC(=O)CSS(=O)(=O)C Amb17610576 [0,2,0,0,0,0|2,0,0]=4 8566 B8R0.29 OS(=O)(=O)CCC(Cl)Cl Amb24546390 [0,2,0,0,0,0|2,0,0]=4 8567 B8R0.29 [O-]C(=O)CC[Si](C)(C)C Amb10563760 [0,2,0,0,0,0|0,1,1]=4 8568 B8R0.29 [O-]C(=O)CNC(C)(C)C Amb10576193 [0,2,0,0,0,0|1,0,1]=4 8569 B6R1.2 BrC1=CCCC1 Amb10067271 [1,0,0,1,0,0|2,0,0]=4 8570 B6R1.2 BrC1=CCCO1 Amb24322605 [1,0,0,1,0,0|1,0,1]=4 8571 B6R1.2 BrC1CCCO1 Amb24322808 [1,0,0,1,0,0|1,0,1]=4 8572 B6R1.2 C1C[NH2+]NC1=O Amb2408363 [1,0,0,1,0,0|2,0,0]=4 8573 B6R1.2 C=C1CCCC1 Amb22337671 [1,0,0,1,0,0|2,0,0]=4 8574 B6R1.2 C=C1OCCO1 Amb24477046 [1,0,0,1,0,0|2,0,0]=4 8575 B6R1.2 CC1=CCCO1 Amb20621083 [1,0,0,1,0,0|1,0,1]=4 8576 B6R1.2 ClC1CCCO1 Amb24093635 [1,0,0,1,0,0|1,0,1]=4 8577 B6R1.2 ClC=1CCCC1 Amb22351980 [1,0,0,1,0,0|2,0,0]=4 8578 B6R1.2 FC1=CCCO1 Amb24322815 [1,0,0,1,0,0|1,0,1]=4 8579 B6R1.2 IC1=CCCO1 Amb24322816 [1,0,0,1,0,0|1,0,1]=4 8580 B6R1.2 IC1CCCO1 Amb24692765 [1,0,0,1,0,0|1,0,1]=4 8581 B6R1.2 IC=1CCCC1 Amb24332192 [1,0,0,1,0,0|2,0,0]=4 8582 B6R1.2 N=C1CCCC1 Amb22274869 [1,0,0,1,0,0|2,0,0]=4 8583 B6R1.2 N=C1CCCN1 Amb2371632 [1,0,0,1,0,0|2,0,0]=4 8584 B6R1.2 N=C1CCCS1 Amb10072429 [1,0,0,1,0,0|1,1,0]=4 8585 B6R1.2 N=C1NCCO1 Amb20623979 [1,0,0,1,0,0|2,0,0]=4 8586 B6R1.2 NC1=NCCC1 Amb10976565 [1,0,0,1,0,0|2,0,0]=4 8587 B6R1.2 NC1=NCCO1 Amb24325166 [1,0,0,1,0,0|2,0,0]=4 8588 B6R1.2 NC1CCCO1 Amb16233703 [1,0,0,1,0,0|1,0,1]=4 8589 B6R1.2 NC=1CCCC1 Amb25699912 [1,0,0,1,0,0|2,0,0]=4 8590 B6R1.2 N[C@@H]1CCCO1 Amb25146442 [1,0,0,1,0,0|1,0,1]=4 8591 B6R1.2 O=C1BCCN1 Amb25267191 [1,0,0,1,0,0|2,0,0]=4 8592 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,1,0,0|1,0,1]=4 8593 B6R1.2 O=C1CCCN1 Amb20240633 [1,0,0,1,0,0|1,0,0]=3 8594 B6R1.2 O=C1CCCN1 Amb22338202 [1,0,0,1,0,0|1,0,0]=3 8595 B6R1.2 O=C1CCCN1 Amb22432663 [1,0,0,1,0,0|1,0,0]=3 8596 B6R1.2 O=C1CCCS1 Amb22338102 [1,0,0,1,0,0|0,1,0]=3 8597 B6R1.2 O=C1CCNN1 Amb22730624 [1,0,0,1,0,0|2,0,0]=4 8598 B6R1.2 O=C1CCON1 Amb22235009 [1,0,0,1,0,0|2,0,0]=4 8599 B6R1.2 O=C1CN=CO1 Amb24333834 [1,0,0,1,0,0|1,0,1]=4 8600 B6R1.2 O=C1CNCN1 Amb19957368 [1,0,0,1,0,0|2,0,0]=4 8601 B6R1.2 O=C1CNCO1 Amb24661408 [1,0,0,1,0,0|1,0,0]=3 8602 B6R1.2 O=C1CS[Ca]O1 Amb22369695 [1,0,0,1,0,0|2,0,0]=4 8603 B6R1.2 O=C1N=CCO1 Amb25024901 [1,0,0,1,0,0|1,0,1]=4 8604 B6R1.2 O=C1SCCS1 Amb24630172 [1,0,0,1,0,0|1,1,0]=4 8605 B6R1.2 O=P1OCCO1 Amb22346149 [1,0,0,1,0,0|2,0,0]=4 8606 B6R1.2 O=[13C]1CCCC1 Amb22353487 [1,0,0,1,0,0|1,0,0]=3 8607 B6R1.2 O=[13C]1OCCO1 Amb22338878 [1,0,0,1,0,0|1,0,0]=3 8608 B6R1.2 O=[13C]1O[13CH2][13CH2]O1 Amb22351705 [1,0,0,1,0,0|1,0,0]=3 8609 B6R1.2 OC1=NNCC1 Amb2111955 [1,0,0,1,0,0|2,0,0]=4 8610 B6R1.2 OC1CCCO1 Amb17615892 [1,0,0,1,0,0|0,0,2]=4 8611 B6R1.2 O[13CH]1CCCC1 Amb22367208 [1,0,0,1,0,0|1,0,1]=4 8612 B6R1.2 O[C@@H]1CCCN1 Amb25662794 [1,0,0,1,0,0|1,0,1]=4 8613 B6R1.2 O[C@@H]1CCCO1 Amb25146365 [1,0,0,1,0,0|0,0,2]=4 8614 B6R1.2 O[C@H]1CCCN1 Amb25662512 [1,0,0,1,0,0|1,0,1]=4 8615 B6R1.2 S=C1NCCO1 Amb2371644 [1,0,0,1,0,0|1,1,0]=4 8616 B6R1.3 CCCC1CO1 Amb17771535 [1,0,0,1,0,0|1,0,1]=4 8617 B6R1.3 CCC[C@@H]1CO1 Amb25348803 [1,0,0,1,0,0|1,0,1]=4 8618 B6R1.3 CCC[C@H]1CO1 Amb10982593 [1,0,0,1,0,0|1,0,1]=4 8619 B6R1.5 CC1CC(=O)C1 Amb22284831 [1,0,0,1,0,0|1,0,0]=3 8620 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|0,0,0]=2 8621 B6R1.5 CC1CC(C)O1 Amb22737240 [1,0,0,1,0,0|1,0,1]=4 8622 B6R1.5 CC1CC(O)C1 Amb22235436 [1,0,0,1,0,0|1,0,1]=4 8623 B6R1.5 CN1CC(=O)C1 Amb22292462 [1,0,0,1,0,0|2,0,0]=4 8624 B6R1.5 C[C@@H]1CC(=O)O1 Amb10603200 [1,0,0,1,0,0|0,0,0]=2 8625 B6R1.5 C[C@@H]1C[C@@H](C)O1 Amb24332806 [1,0,0,1,0,0|1,0,1]=4 8626 B6R1.5 C[C@@H]1C[C@H](C)O1 Amb24333814 [1,0,0,1,0,0|1,0,1]=4 8627 B6R1.5 C[C@H]1CC(=O)N1 Amb25755939 [1,0,0,1,0,0|1,0,0]=3 8628 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|0,0,0]=2 8629 B6R1.5 NC1CC(=O)C1 Amb20241928 [1,0,0,1,0,0|2,0,0]=4 8630 B6R1.5 NC1CC(=O)C1 Amb23439093 [1,0,0,1,0,0|2,0,0]=4 8631 B6R1.5 O=C1CC(Br)C1 Amb22388498 [1,0,0,1,0,0|2,0,0]=4 8632 B6R1.5 O=C1CC(Br)N1 Amb24332152 [1,0,0,1,0,0|2,0,0]=4 8633 B6R1.5 O=C1CC(Cl)C1 Amb25087791 [1,0,0,1,0,0|2,0,0]=4 8634 B6R1.5 O=C1CC(Cl)N1 Amb24531401 [1,0,0,1,0,0|2,0,0]=4 8635 B6R1.5 O=C1CC(F)N1 Amb24588463 [1,0,0,1,0,0|2,0,0]=4 8636 B6R1.5 OC1CC(=O)C1 Amb22235480 [1,0,0,1,0,0|2,0,0]=4 8637 B6R1.5 O[C@H]1CC(=O)O1 Amb25106737 [1,0,0,1,0,0|1,0,0]=3 8638 B6R1.8 CCC1CC1=O Amb24686409 [1,0,0,1,0,0|1,0,0]=3 8639 B6R1.8 CCC1OC1=O Amb24426509 [1,0,0,1,0,0|0,0,0]=2 8640 B6R1.8 CCC1OC1C Amb1141391 [1,0,0,1,0,0|1,0,1]=4 8641 B6R1.8 CCC1OC1Cl Amb24571837 [1,0,0,1,0,0|1,0,1]=4 8642 B6R1.8 CC[C@@H]1C[C@@H]1O Amb25026310 [1,0,0,1,0,0|1,0,1]=4 8643 B6R1.8 CC[C@@H]1O[C@@H]1Cl Amb25179251 [1,0,0,1,0,0|1,0,1]=4 8644 B6R1.9 CC1CC1(C)O Amb22157187 [1,0,0,1,0,0|1,0,1]=4 8645 B6R1.10 CC1(O)CCC1 Amb17940165 [1,0,0,1,0,0|1,0,1]=4 8646 B6R1.10 O=S1(=O)CCC1 Amb13883572 [1,0,0,1,0,0|1,0,1]=4 8647 B6R1.11 C=C(Br)C1CC1 Amb22583737 [1,0,0,1,0,0|2,0,0]=4 8648 B6R1.11 CC(=C)C1CC1 Amb25147701 [1,0,0,1,0,0|2,0,0]=4 8649 B6R1.11 CC(=O)C1CS1 Amb25373120 [1,0,0,1,0,0|2,0,0]=4 8650 B6R1.11 CC(=O)N1CC1 Amb17607538 [1,0,0,1,0,0|2,0,0]=4 8651 B6R1.11 CC(=O)[C@H]1CO1 Amb24628197 [1,0,0,1,0,0|2,0,0]=4 8652 B6R1.11 C[C@@H](C1CC1)O Amb13952945 [1,0,0,1,0,0|1,0,1]=4 8653 B6R1.11 C[C@H](C1CC1)O Amb13952943 [1,0,0,1,0,0|1,0,1]=4 8654 B6R1.11 FC(=O)C1CC1 Amb17673783 [1,0,0,1,0,0|1,0,0]=3 8655 B6R1.11 NC(=O)C1CC1 Amb1789460 [1,0,0,1,0,0|1,0,0]=3 8656 B6R1.11 NC(O)C1CC1 Amb22492754 [1,0,0,1,0,0|1,0,1]=4 8657 B6R1.11 N[13C](=O)[13CH]1[13CH2]O1 Amb17614804 [1,0,0,1,0,0|2,0,0]=4 8658 B6R1.11 O=S(Cl)C1CC1 Amb25662827 [1,0,0,1,0,0|2,0,0]=4 8659 B6R1.11 OB(C1CC1)O Amb2455832 [1,0,0,1,0,0|1,0,1]=4 8660 B6R1.11 OC(=O)C1CN1 Amb21864773 [1,0,0,1,0,0|1,0,0]=3 8661 B6R1.11 OC(=O)C1CS1 Amb24641854 [1,0,0,1,0,0|1,0,0]=3 8662 B6R1.11 OC(=O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|1,0,0]=3 8663 B6R1.11 OS(=O)C1CC1 Amb24334290 [1,0,0,1,0,0|1,0,0]=3 8664 B6R1.11 [O-]C(=O)C1CO1 Amb22492453 [1,0,0,1,0,0|1,0,1]=4 8665 B6R1.11 [O-]C(=O)[C@@H]1CO1 Amb22503671 [1,0,0,1,0,0|1,0,1]=4 8666 B6R1.11 [O-]C(=O)[C@H]1CO1 Amb22503672 [1,0,0,1,0,0|1,0,1]=4 8667 B6R1.11 [O-][N+](=O)C1CC1 Amb25768805 [1,0,0,1,0,0|1,0,1]=4 8668 B6R1.1 C1C=COCN1 Amb24550978 [1,0,0,1,0,0|1,0,1]=4 8669 B6R1.1 C1C=COCO1 Amb25368331 [1,0,0,1,0,0|1,0,1]=4 8670 B6R1.1 C1CCCC=C1 Amb22732445 [1,0,0,1,0,0|1,0,0]=3 8671 B6R1.1 C1CCCCN1 Amb22337970 [1,0,0,1,0,0|1,0,1]=4 8672 B6R1.1 C1CCCCN1 Amb22734066 [1,0,0,1,0,0|1,0,1]=4 8673 B6R1.1 C1CCCC[NH2+]1 Amb19957935 [1,0,0,1,0,0|1,0,1]=4 8674 B6R1.1 C1CCCC[NH2+]1 Amb21856129 [1,0,0,1,0,0|1,0,1]=4 8675 B6R1.1 C1CCCN=N1 Amb24350499 [1,0,0,1,0,0|2,0,0]=4 8676 B6R1.1 C1CCCNC1 Amb10560825 [1,0,0,1,0,0|1,0,1]=4 8677 B6R1.1 C1CCCNN1 Amb18559485 [1,0,0,1,0,0|2,0,0]=4 8678 B6R1.1 C1CCCNN1 Amb22263856 [1,0,0,1,0,0|2,0,0]=4 8679 B6R1.1 C1CCCON1 Amb22586922 [1,0,0,1,0,0|1,0,0]=3 8680 B6R1.1 C1CCCOO1 Amb22734700 [1,0,0,1,0,0|1,0,0]=3 8681 B6R1.1 C1CCC[NH2+]C1 Amb10552522 [1,0,0,1,0,0|1,0,1]=4 8682 B6R1.1 C1CCC[SiH2]O1 Amb24621895 [1,0,0,1,0,0|0,1,0]=3 8683 B6R1.1 C1CCN=CN1 Amb17620508 [1,0,0,1,0,0|2,0,0]=4 8684 B6R1.1 C1CCNC=C1 Amb22898834 [1,0,0,1,0,0|1,0,1]=4 8685 B6R1.1 C1CCNC=C1 Amb24389577 [1,0,0,1,0,0|1,0,1]=4 8686 B6R1.1 C1CCNNC1 Amb10975991 [1,0,0,1,0,0|2,0,0]=4 8687 B6R1.1 C1CCOCN1 Amb17506190 [1,0,0,1,0,0|1,0,1]=4 8688 B6R1.1 C1CCSCC1 Amb17666898 [1,0,0,1,0,0|0,1,1]=4 8689 B6R1.1 C1COC=CO1 Amb22043779 [1,0,0,1,0,0|1,0,1]=4 8690 B6R1.1 C1COCCN1 Amb22359453 [1,0,0,1,0,0|1,0,1]=4 8691 B6R1.1 C1COCCO1 Amb19930266 [1,0,0,1,0,0|1,0,1]=4 8692 B6R1.1 C1COCCO1 Amb22052510 [1,0,0,1,0,0|1,0,1]=4 8693 B6R1.1 C1COCC[NH2+]1 Amb25066950 [1,0,0,1,0,0|1,0,1]=4 8694 B6R1.1 C1NCOC=N1 Amb24688472 [1,0,0,1,0,0|2,0,0]=4 8695 B6R1.1 O1CCC=CC1 Amb16234261 [1,0,0,1,0,0|2,0,0]=4 8696 B6R1.1 [13CH2]1[13CH2]N[13CH2][13CH2]O1 Amb17618124 [1,0,0,1,0,0|1,0,1]=4 8697 B6R1.4 C=C1CCC1=O Amb25747444 [1,0,0,1,0,0|0,0,2]=4 8698 B6R1.4 C=C1CCC1Br Amb25826187 [1,0,0,1,0,0|2,0,0]=4 8699 B6R1.4 C=C1CCC1I Amb24502672 [1,0,0,1,0,0|2,0,0]=4 8700 B6R1.4 CC1CCC1Cl Amb24711317 [1,0,0,1,0,0|1,0,1]=4 8701 B6R1.4 CC1CCC1N Amb24117460 [1,0,0,1,0,0|1,0,1]=4 8702 B6R1.4 CC1CCN1C Amb24428417 [1,0,0,1,0,0|2,0,0]=4 8703 B6R1.4 CC1CCN1N Amb25767050 [1,0,0,1,0,0|2,0,0]=4 8704 B6R1.4 CC1CNC1=O Amb24444140 [1,0,0,1,0,0|1,0,0]=3 8705 B6R1.4 CC1COC1=O Amb25794274 [1,0,0,1,0,0|1,0,0]=3 8706 B6R1.4 CC1CSC1O Amb24353121 [1,0,0,1,0,0|1,0,1]=4 8707 B6R1.4 CC1NCC1O Amb22754478 [1,0,0,1,0,0|1,0,1]=4 8708 B6R1.4 CC1OCC1=O Amb23456088 [1,0,0,1,0,0|1,0,0]=3 8709 B6R1.4 CC1SCC1O Amb25687738 [1,0,0,1,0,0|1,0,1]=4 8710 B6R1.4 CC=1CCC1Br Amb25189799 [1,0,0,1,0,0|1,0,1]=4 8711 B6R1.4 C[C@@H]1CCC1=O Amb24334317 [1,0,0,1,0,0|0,0,0]=2 8712 B6R1.4 C[C@@H]1CC[C@@H]1O Amb25317495 [1,0,0,1,0,0|0,0,1]=3 8713 B6R1.4 C[C@@H]1CC[C@H]1Cl Amb25363292 [1,0,0,1,0,0|1,0,1]=4 8714 B6R1.4 C[C@@H]1CNC1=O Amb24568896 [1,0,0,1,0,0|1,0,0]=3 8715 B6R1.4 C[C@@H]1NCC1O Amb24120609 [1,0,0,1,0,0|1,0,1]=4 8716 B6R1.4 C[C@@H]1NC[C@@H]1O Amb25252257 [1,0,0,1,0,0|1,0,1]=4 8717 B6R1.4 C[C@H]1CCC1=O Amb24333446 [1,0,0,1,0,0|0,0,0]=2 8718 B6R1.4 C[C@H]1CC[C@H]1Cl Amb24565733 [1,0,0,1,0,0|1,0,1]=4 8719 B6R1.4 C[C@H]1CC[C@H]1O Amb24556459 [1,0,0,1,0,0|0,0,1]=3 8720 B6R1.4 NC1CCC1=O Amb22896568 [1,0,0,1,0,0|1,0,0]=3 8721 B6R1.4 NC1CCC1O Amb19148610 [1,0,0,1,0,0|1,0,1]=4 8722 B6R1.4 NC1CNC1=O Amb18832512 [1,0,0,1,0,0|2,0,0]=4 8723 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22757952 [1,0,0,1,0,0|1,0,1]=4 8724 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22823228 [1,0,0,1,0,0|1,0,1]=4 8725 B6R1.4 N[C@@H]1CC[C@H]1O Amb22757953 [1,0,0,1,0,0|1,0,1]=4 8726 B6R1.4 N[C@@H]1CC[C@H]1O Amb22823232 [1,0,0,1,0,0|1,0,1]=4 8727 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [1,0,0,1,0,0|2,0,0]=4 8728 B6R1.4 N[C@@H]1COC1=O Amb22748014 [1,0,0,1,0,0|2,0,0]=4 8729 B6R1.4 N[C@@H]1COC1=O Amb22757168 [1,0,0,1,0,0|2,0,0]=4 8730 B6R1.4 N[C@H]1CC[C@@H]1O Amb24579886 [1,0,0,1,0,0|1,0,1]=4 8731 B6R1.4 N[C@H]1CC[C@H]1O Amb24580190 [1,0,0,1,0,0|1,0,1]=4 8732 B6R1.4 N[C@H]1CNC1=O Amb25811302 [1,0,0,1,0,0|2,0,0]=4 8733 B6R1.4 O=C1CCC1Br Amb21964157 [1,0,0,1,0,0|1,0,0]=3 8734 B6R1.4 O=C1CCC1C Amb17593022 [1,0,0,1,0,0|0,0,0]=2 8735 B6R1.4 O=C1CCC1Cl Amb19892275 [1,0,0,1,0,0|1,0,0]=3 8736 B6R1.4 O=C1CCC1O Amb17593027 [1,0,0,1,0,0|1,0,0]=3 8737 B6R1.4 O=C1SCC1Cl Amb24502718 [1,0,0,1,0,0|2,0,0]=4 8738 B6R1.4 OC1CCC1Br Amb24473973 [1,0,0,1,0,0|1,0,1]=4 8739 B6R1.4 OC1CCC1S Amb25854751 [1,0,0,1,0,0|1,0,1]=4 8740 B6R1.4 OC1CNC1=O Amb24689689 [1,0,0,1,0,0|2,0,0]=4 8741 B6R1.4 O[C@@H]1CC[C@@H]1O Amb24505810 [1,0,0,1,0,0|1,0,1]=4 8742 B6R1.4 O[C@H]1CC[C@@H]1O Amb25746176 [1,0,0,1,0,0|1,0,1]=4 8743 B6R1.4 [NH3+][C@H]1COC1=O Amb22349488 [1,0,0,1,0,0|2,0,0]=4 8744 B6R1.6 BrC=C1CCC1 Amb25189864 [1,0,0,1,0,0|1,0,1]=4 8745 B6R1.6 BrCC1CCO1 Amb2383525 [1,0,0,1,0,0|1,0,1]=4 8746 B6R1.6 C#CC1CCC1 Amb25184959 [1,0,0,1,0,0|1,0,1]=4 8747 B6R1.6 C=CC1CCN1 Amb24618150 [1,0,0,1,0,0|2,0,0]=4 8748 B6R1.6 CCC1CCC1 Amb24394555 [1,0,0,1,0,0|1,0,1]=4 8749 B6R1.6 CCC1CCN1 Amb24117042 [1,0,0,1,0,0|1,0,1]=4 8750 B6R1.6 CCC1CNC1 Amb25836819 [1,0,0,1,0,0|2,0,0]=4 8751 B6R1.6 CNC1CCC1 Amb18946245 [1,0,0,1,0,0|2,0,0]=4 8752 B6R1.6 CNC1CCC1 Amb19303706 [1,0,0,1,0,0|2,0,0]=4 8753 B6R1.6 ClCC1CCO1 Amb22495451 [1,0,0,1,0,0|1,0,1]=4 8754 B6R1.6 Cl[Mg]C1CCC1 Amb22897278 [1,0,0,1,0,0|2,0,0]=4 8755 B6R1.6 IC=C1CCC1 Amb24334135 [1,0,0,1,0,0|1,0,1]=4 8756 B6R1.6 ICC1CCO1 Amb13883581 [1,0,0,1,0,0|1,0,1]=4 8757 B6R1.6 N#CC1CCC1 Amb16232994 [1,0,0,1,0,0|1,0,1]=4 8758 B6R1.6 NCC1CCO1 Amb19895255 [1,0,0,1,0,0|1,0,1]=4 8759 B6R1.6 NNC1CCC1 Amb10604136 [1,0,0,1,0,0|2,0,0]=4 8760 B6R1.6 NNC1CCC1 Amb21936692 [1,0,0,1,0,0|2,0,0]=4 8761 B6R1.6 NOC1CCC1 Amb10975959 [1,0,0,1,0,0|2,0,0]=4 8762 B6R1.6 NOC1CCC1 Amb25118834 [1,0,0,1,0,0|2,0,0]=4 8763 B6R1.6 O=C=C1CCC1 Amb25332371 [1,0,0,1,0,0|0,0,2]=4 8764 B6R1.6 O=CC1CCN1 Amb25757222 [1,0,0,1,0,0|1,0,0]=3 8765 B6R1.6 O=CC1CCO1 Amb24565587 [1,0,0,1,0,0|1,0,0]=3 8766 B6R1.6 O=CC1COC1 Amb21857829 [1,0,0,1,0,0|1,0,0]=3 8767 B6R1.6 O=CC1CSC1 Amb25145476 [1,0,0,1,0,0|1,0,0]=3 8768 B6R1.6 O=CN1CCC1 Amb24431842 [1,0,0,1,0,0|1,0,0]=3 8769 B6R1.6 O=NN1CCC1 Amb24407378 [1,0,0,1,0,0|2,0,0]=4 8770 B6R1.6 OCC1CCN1 Amb21963462 [1,0,0,1,0,0|1,0,1]=4 8771 B6R1.6 OCC1CCO1 Amb21960943 [1,0,0,1,0,0|1,0,1]=4 8772 B6R1.6 OCC1CCS1 Amb24651415 [1,0,0,1,0,0|1,0,1]=4 8773 B6R1.6 OCC1CNC1 Amb17943116 [1,0,0,1,0,0|1,0,1]=4 8774 B6R1.6 OCC1COC1 Amb19958096 [1,0,0,1,0,0|1,0,1]=4 8775 B6R1.6 OCC1CSC1 Amb23438800 [1,0,0,1,0,0|1,0,1]=4 8776 B6R1.6 OC[C@@H]1CCN1 Amb22406086 [1,0,0,1,0,0|1,0,1]=4 8777 B6R1.6 OC[C@H]1CCN1 Amb22233159 [1,0,0,1,0,0|1,0,1]=4 8778 B6R1.6 OC[C@H]1CCO1 Amb24559274 [1,0,0,1,0,0|1,0,1]=4 8779 B6R1.6 ONC1CNC1 Amb25318853 [1,0,0,1,0,0|2,0,0]=4 8780 B6R1.6 [C-]#[N+]C1CCC1 Amb19892422 [1,0,0,1,0,0|2,0,0]=4 8781 B8R1.1 C#CC1CCC(=O)N1 Amb24505237 [0,1,0,1,0,0|1,0,1]=4 8782 B8R1.1 C#CC1COC(=O)O1 Amb25056381 [0,1,0,1,0,0|0,0,2]=4 8783 B8R1.1 C#C[C@@H]1CCC(=O)N1 Amb25840299 [0,1,0,1,0,0|1,0,1]=4 8784 B8R1.1 C#C[C@H]1CC(=O)CC1 Amb24721679 [0,1,0,1,0,0|1,0,1]=4 8785 B8R1.1 C#C[C@H]1CCC(=O)N1 Amb25062993 [0,1,0,1,0,0|1,0,1]=4 8786 B8R1.1 C=C1COC(CCl)O1 Amb25798065 [0,1,0,1,0,0|2,0,0]=4 8787 B8R1.1 C=C1COC(CO)C1 Amb25662542 [0,1,0,1,0,0|2,0,0]=4 8788 B8R1.1 C=CC1CCC(=O)N1 Amb20622087 [0,1,0,1,0,0|1,0,1]=4 8789 B8R1.1 C=CC1CNC(=O)O1 Amb25064259 [0,1,0,1,0,0|0,0,2]=4 8790 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,1,0,1,0,0|0,0,2]=4 8791 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,1,0,1,0,0|0,0,2]=4 8792 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,1,0,1,0,0|0,0,2]=4 8793 B8R1.1 C=C[C@H]1CC(=O)CC1 Amb24524536 [0,1,0,1,0,0|1,0,1]=4 8794 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,1,0,1,0,0|0,0,2]=4 8795 B8R1.1 CC1=CCC(CO)O1 Amb24386881 [0,1,0,1,0,0|1,0,1]=4 8796 B8R1.1 CC1=NCC(CBr)O1 Amb25783980 [0,1,0,1,0,0|2,0,0]=4 8797 B8R1.1 CC1=NCC(CCl)O1 Amb25706232 [0,1,0,1,0,0|2,0,0]=4 8798 B8R1.1 CC1=NCC(CF)O1 Amb25322610 [0,1,0,1,0,0|2,0,0]=4 8799 B8R1.1 CC1=NCC(CI)O1 Amb24622214 [0,1,0,1,0,0|2,0,0]=4 8800 B8R1.1 CC1C=C(CO)CO1 Amb25346209 [0,1,0,1,0,0|2,0,0]=4 8801 B8R1.1 CC1CC(CC1)=NO Amb24394648 [0,1,0,1,0,0|1,0,0]=3 8802 B8R1.1 CC1CC(CC1)C=O Amb24483120 [0,1,0,1,0,0|1,0,1]=4 8803 B8R1.1 CC1CC(CC1)CO Amb22886865 [0,1,0,1,0,0|1,0,1]=4 8804 B8R1.1 CC1CCC(C=O)=C1 Amb18641617 [0,1,0,1,0,0|1,0,0]=3 8805 B8R1.1 CC1CCC(CBr)=C1 Amb24483109 [0,1,0,1,0,0|2,0,0]=4 8806 B8R1.1 CC1CCC(CO)=C1 Amb24733187 [0,1,0,1,0,0|1,0,0]=3 8807 B8R1.1 CC1CCC(CO)=N1 Amb25721614 [0,1,0,1,0,0|1,0,0]=3 8808 B8R1.1 CC1CCC(CO)S1 Amb24687787 [0,1,0,1,0,0|0,1,1]=4 8809 B8R1.1 CC1CCC(CS)O1 Amb24524291 [0,1,0,1,0,0|0,1,1]=4 8810 B8R1.1 CC1CCC(O1)C=O Amb17593184 [0,1,0,1,0,0|0,0,1]=3 8811 B8R1.1 CC1CC[C@@H](CO)N1 Amb25068509 [0,1,0,1,0,0|1,0,1]=4 8812 B8R1.1 CC1CN(CC1)C=O Amb24406673 [0,1,0,1,0,0|2,0,0]=4 8813 B8R1.1 CC1COC(CC)O1 Amb19892405 [0,1,0,1,0,0|1,0,1]=4 8814 B8R1.1 CC=1CC(CBr)ON1 Amb23571392 [0,1,0,1,0,0|2,0,0]=4 8815 B8R1.1 CC=1CC(CCl)ON1 Amb23571110 [0,1,0,1,0,0|2,0,0]=4 8816 B8R1.1 CC=1CC(CN)ON1 Amb21955831 [0,1,0,1,0,0|2,0,0]=4 8817 B8R1.1 CC=1CCC(CO)N1 Amb24734855 [0,1,0,1,0,0|2,0,0]=4 8818 B8R1.1 CCC1=COC(=O)N1 Amb25276478 [0,1,0,1,0,0|1,0,1]=4 8819 B8R1.1 CCC1=NCC(=O)O1 Amb25238829 [0,1,0,1,0,0|0,0,1]=3 8820 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,1,0,1,0,0|0,0,1]=3 8821 B8R1.1 CCC1C=CC(=O)S1 Amb24638103 [0,1,0,1,0,0|0,1,1]=4 8822 B8R1.1 CCC1CC(=O)C=C1 Amb25713811 [0,1,0,1,0,0|1,0,0]=3 8823 B8R1.1 CCC1CC(=O)CC1 Amb19267107 [0,1,0,1,0,0|1,0,0]=3 8824 B8R1.1 CCC1CC(=O)CS1 Amb25273070 [0,1,0,1,0,0|0,1,0]=3 8825 B8R1.1 CCC1CC(O)C=C1 Amb25262905 [0,1,0,1,0,0|1,0,1]=4 8826 B8R1.1 CCC1CC(O)CO1 Amb24340231 [0,1,0,1,0,0|0,0,2]=4 8827 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,1,0,1,0,0|1,0,0]=3 8828 B8R1.1 CCC1CCC(O)C1 Amb24471617 [0,1,0,1,0,0|1,0,1]=4 8829 B8R1.1 CCC1CN=C(C)N1 Amb25732193 [0,1,0,1,0,0|2,0,0]=4 8830 B8R1.1 CCC1CN=C(C)S1 Amb25197984 [0,1,0,1,0,0|1,1,0]=4 8831 B8R1.1 CCC1CN=C(Cl)O1 Amb24519084 [0,1,0,1,0,0|1,0,0]=3 8832 B8R1.1 CCC1CN=C(N)N1 Amb24483143 [0,1,0,1,0,0|2,0,0]=4 8833 B8R1.1 CCC1CN=C(N)O1 Amb25728217 [0,1,0,1,0,0|1,0,0]=3 8834 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,1,0,1,0,0|1,0,0]=3 8835 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,1,0,1,0,0|1,0,0]=3 8836 B8R1.1 CCC1CNC(S)=N1 Amb25072509 [0,1,0,1,0,0|1,1,0]=4 8837 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,1,0,1,0,0|1,0,0]=3 8838 B8R1.1 CCC1COC(N)=N1 Amb24436270 [0,1,0,1,0,0|2,0,0]=4 8839 B8R1.1 CCC1CSC(=S)N1 Amb25078191 [0,1,0,1,0,0|1,1,0]=4 8840 B8R1.1 CCC1CSC(Br)=N1 Amb25749236 [0,1,0,1,0,0|2,0,0]=4 8841 B8R1.1 CCC1CSC(C)=N1 Amb24325349 [0,1,0,1,0,0|2,0,0]=4 8842 B8R1.1 CCC1N=C(C)CS1 Amb24664975 [0,1,0,1,0,0|2,0,0]=4 8843 B8R1.1 CCC1NC(C)=NO1 Amb25757916 [0,1,0,1,0,0|2,0,0]=4 8844 B8R1.1 CCC1NCC(O1)C Amb17506185 [0,1,0,1,0,0|1,0,1]=4 8845 B8R1.1 CCC=1CC(=O)OC1 Amb24759211 [0,1,0,1,0,0|0,0,1]=3 8846 B8R1.1 CCC=1CCC(C)C1 Amb25810526 [0,1,0,1,0,0|2,0,0]=4 8847 B8R1.1 CCC=1COC(=O)C1 Amb24686984 [0,1,0,1,0,0|0,0,2]=4 8848 B8R1.1 CCC=1NC(=O)CN1 Amb25162785 [0,1,0,1,0,0|1,0,1]=4 8849 B8R1.1 CCN1CCC(=O)N1 Amb24716029 [0,1,0,1,0,0|1,0,0]=3 8850 B8R1.1 CCN1C[C@H](O)CC1 Amb24735301 [0,1,0,1,0,0|1,0,1]=4 8851 B8R1.1 CC[C@@H]1CC(=O)CC1 Amb25142670 [0,1,0,1,0,0|1,0,0]=3 8852 B8R1.1 CC[C@@H]1CCC(=S)N1 Amb25712485 [0,1,0,1,0,0|1,1,0]=4 8853 B8R1.1 CC[C@@H]1CC[C@@H](O)C1 Amb24587422 [0,1,0,1,0,0|1,0,1]=4 8854 B8R1.1 CC[C@@H]1CNC(=O)C1 Amb25367322 [0,1,0,1,0,0|1,0,0]=3 8855 B8R1.1 CC[C@@H]1CNC(=O)O1 Amb24507830 [0,1,0,1,0,0|0,0,0]=2 8856 B8R1.1 CC[C@@H]1CSC(=S)N1 Amb24409541 [0,1,0,1,0,0|1,1,0]=4 8857 B8R1.1 CC[C@H]1CC(=O)CC1 Amb24614252 [0,1,0,1,0,0|1,0,0]=3 8858 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,1,0,1,0,0|0,0,0]=2 8859 B8R1.1 CC[C@H]1CNC(=O)C1 Amb24632784 [0,1,0,1,0,0|1,0,0]=3 8860 B8R1.1 CC[C@H]1C[C@H](O)C=C1 Amb25206636 [0,1,0,1,0,0|1,0,1]=4 8861 B8R1.1 CN1CCC(C=O)=N1 Amb24483066 [0,1,0,1,0,0|2,0,0]=4 8862 B8R1.1 CN1CCC(C=O)O1 Amb24333644 [0,1,0,1,0,0|1,0,1]=4 8863 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,1,0,1,0,0|2,0,0]=4 8864 B8R1.1 CNC=1CC(=O)OC1 Amb25779165 [0,1,0,1,0,0|1,0,1]=4 8865 B8R1.1 CNC=1CCC(=O)C1 Amb24377588 [0,1,0,1,0,0|1,0,1]=4 8866 B8R1.1 COC1=CCC(=O)O1 Amb24695758 [0,1,0,1,0,0|0,0,2]=4 8867 B8R1.1 COC1=CCC(C)N1 Amb24481331 [0,1,0,1,0,0|1,0,1]=4 8868 B8R1.1 COC1C=CC(=O)O1 Amb22490509 [0,1,0,1,0,0|0,0,2]=4 8869 B8R1.1 COC1CC(=O)C=C1 Amb24425404 [0,1,0,1,0,0|2,0,0]=4 8870 B8R1.1 COC1CC(=O)CC1 Amb24483163 [0,1,0,1,0,0|1,0,0]=3 8871 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,1,0,1,0,0|1,0,0]=3 8872 B8R1.1 COC1CNC(=O)C1 Amb24683870 [0,1,0,1,0,0|2,0,0]=4 8873 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,1,0,1,0,0|2,0,0]=4 8874 B8R1.1 COC=1CCC(=O)C1 Amb21864758 [0,1,0,1,0,0|1,0,1]=4 8875 B8R1.1 CO[C@@H]1C=CC(=O)O1 Amb25144040 [0,1,0,1,0,0|0,0,2]=4 8876 B8R1.1 CO[C@@H]1CC[C@@H](O)C1 Amb25283262 [0,1,0,1,0,0|1,0,1]=4 8877 B8R1.1 CO[C@H]1CC(=O)C=C1 Amb25689601 [0,1,0,1,0,0|2,0,0]=4 8878 B8R1.1 CSC=1CCC(=O)C1 Amb24626948 [0,1,0,1,0,0|1,0,1]=4 8879 B8R1.1 C[C@@H]1CCC(C=O)=C1 Amb25839230 [0,1,0,1,0,0|1,0,0]=3 8880 B8R1.1 C[C@@H]1CCC(CO)O1 Amb24524279 [0,1,0,1,0,0|0,0,2]=4 8881 B8R1.1 C[C@@H]1CC[C@@H](CCl)O1 Amb24579524 [0,1,0,1,0,0|1,0,1]=4 8882 B8R1.1 C[C@@H]1CC[C@@H](CO)N1 Amb24516993 [0,1,0,1,0,0|1,0,1]=4 8883 B8R1.1 C[C@@H]1CC[C@@H](CO)O1 Amb24712524 [0,1,0,1,0,0|0,0,2]=4 8884 B8R1.1 C[C@@H]1CC[C@H](CO)N1 Amb24679369 [0,1,0,1,0,0|1,0,1]=4 8885 B8R1.1 C[C@@H]1CC[C@H](CO)O1 Amb22886849 [0,1,0,1,0,0|0,0,2]=4 8886 B8R1.1 C[C@H]1CC(CC1)C=O Amb24483030 [0,1,0,1,0,0|1,0,1]=4 8887 B8R1.1 C[C@H]1CC(CC1)CO Amb25676567 [0,1,0,1,0,0|1,0,1]=4 8888 B8R1.1 C[C@H]1CCC(C=O)=C1 Amb25760068 [0,1,0,1,0,0|1,0,0]=3 8889 B8R1.1 C[C@H]1CCC(CO)O1 Amb25119985 [0,1,0,1,0,0|0,0,2]=4 8890 B8R1.1 C[C@H]1CC[C@@H](CO)N1 Amb22886262 [0,1,0,1,0,0|1,0,1]=4 8891 B8R1.1 C[C@H]1CC[C@@H](CO)N1 Amb24745399 [0,1,0,1,0,0|1,0,1]=4 8892 B8R1.1 C\C=C\1/CCC(=O)O1 Amb24751500 [0,1,0,1,0,0|0,0,1]=3 8893 B8R1.1 ClC1CCC(CBr)O1 Amb25363330 [0,1,0,1,0,0|1,0,1]=4 8894 B8R1.1 ClCC1CC(Br)=NO1 Amb23449511 [0,1,0,1,0,0|2,0,0]=4 8895 B8R1.1 ClCC1CCC(=O)O1 Amb10608418 [0,1,0,1,0,0|0,0,0]=2 8896 B8R1.1 ClCC1CNC(=O)O1 Amb1152954 [0,1,0,1,0,0|1,0,0]=3 8897 B8R1.1 N#CC1CC(=O)CC1 Amb22886979 [0,1,0,1,0,0|1,0,1]=4 8898 B8R1.1 N#C[C@@H]1CCC(=O)N1 Amb25662472 [0,1,0,1,0,0|1,0,1]=4 8899 B8R1.1 N=C1CCC(CO)N1 Amb24630540 [0,1,0,1,0,0|2,0,0]=4 8900 B8R1.1 N=C1CC[C@@H](CO)N1 Amb24580264 [0,1,0,1,0,0|2,0,0]=4 8901 B8R1.1 NC1=NCC(CBr)O1 Amb21953933 [0,1,0,1,0,0|2,0,0]=4 8902 B8R1.1 NCC1CC(=O)CC1 Amb24644946 [0,1,0,1,0,0|1,0,0]=3 8903 B8R1.1 NCC1CC(Br)=NO1 Amb22169739 [0,1,0,1,0,0|2,0,0]=4 8904 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,1,0,1,0,0|1,0,0]=3 8905 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,1,0,1,0,0|1,0,0]=3 8906 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,1,0,1,0,0|0,0,0]=2 8907 B8R1.1 NCC1CCC(O)C1 Amb18641846 [0,1,0,1,0,0|1,0,1]=4 8908 B8R1.1 NCC1CCC(O)C1 Amb22886211 [0,1,0,1,0,0|1,0,1]=4 8909 B8R1.1 NCC1CN=C(N)O1 Amb24674197 [0,1,0,1,0,0|2,0,0]=4 8910 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,1,0,1,0,0|2,0,0]=4 8911 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,1,0,1,0,0|1,0,0]=3 8912 B8R1.1 NCC1CNC(=O)O1 Amb23439310 [0,1,0,1,0,0|1,0,0]=3 8913 B8R1.1 NCC1COC(=O)C1 Amb22642236 [0,1,0,1,0,0|1,0,0]=3 8914 B8R1.1 NCC1CSC(=O)O1 Amb25843341 [0,1,0,1,0,0|1,0,0]=3 8915 B8R1.1 NCC=1CC(=O)ON1 Amb18833041 [0,1,0,1,0,0|1,0,1]=4 8916 B8R1.1 NC[C@@H]1CC(Cl)=NO1 Amb25104783 [0,1,0,1,0,0|2,0,0]=4 8917 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,1,0,1,0,0|1,0,0]=3 8918 B8R1.1 NC[C@@H]1CCC(=O)O1 Amb24656037 [0,1,0,1,0,0|0,0,0]=2 8919 B8R1.1 NC[C@@H]1CC[C@@H](C1)O Amb10066982 [0,1,0,1,0,0|1,0,1]=4 8920 B8R1.1 NC[C@@H]1CC[C@H](C1)O Amb10066974 [0,1,0,1,0,0|1,0,1]=4 8921 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,1,0,1,0,0|2,0,0]=4 8922 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,1,0,1,0,0|2,0,0]=4 8923 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,1,0,1,0,0|1,0,0]=3 8924 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,1,0,1,0,0|1,0,0]=3 8925 B8R1.1 NC[C@H]1CC(Br)=NO1 Amb25839874 [0,1,0,1,0,0|2,0,0]=4 8926 B8R1.1 NC[C@H]1CC(Cl)=NO1 Amb25076795 [0,1,0,1,0,0|2,0,0]=4 8927 B8R1.1 NC[C@H]1CC(O)=NO1 Amb25334789 [0,1,0,1,0,0|1,0,1]=4 8928 B8R1.1 NC[C@H]1CCC(=O)O1 Amb24376645 [0,1,0,1,0,0|0,0,0]=2 8929 B8R1.1 NC[C@H]1CC[C@@H](C1)O Amb10066981 [0,1,0,1,0,0|1,0,1]=4 8930 B8R1.1 NC[C@H]1CC[C@H](C1)O Amb10066975 [0,1,0,1,0,0|1,0,1]=4 8931 B8R1.1 O=C1C=CC(CBr)O1 Amb24423424 [0,1,0,1,0,0|0,0,2]=4 8932 B8R1.1 O=C1CC(CBr)CC1 Amb24483273 [0,1,0,1,0,0|1,0,0]=3 8933 B8R1.1 O=C1CC(CBr)CN1 Amb23597459 [0,1,0,1,0,0|2,0,0]=4 8934 B8R1.1 O=C1CC(CCl)CO1 Amb25367200 [0,1,0,1,0,0|1,0,0]=3 8935 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,1,0,1,0,0|1,0,0]=3 8936 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,1,0,1,0,0|2,0,0]=4 8937 B8R1.1 O=C1CC=C(CBr)O1 Amb24469203 [0,1,0,1,0,0|0,0,2]=4 8938 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,1,0,1,0,0|1,0,0]=3 8939 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,1,0,1,0,0|0,0,0]=2 8940 B8R1.1 O=C1CCC(CCl)=C1 Amb24645790 [0,1,0,1,0,0|1,0,1]=4 8941 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,1,0,1,0,0|1,0,0]=3 8942 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,1,0,1,0,0|0,0,0]=2 8943 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,1,0,1,0,0|0,0,0]=2 8944 B8R1.1 O=C1CC[C@@H](CF)N1 Amb19148412 [0,1,0,1,0,0|1,0,0]=3 8945 B8R1.1 O=C1CC\C(=C\Br)\O1 Amb24605306 [0,1,0,1,0,0|0,0,2]=4 8946 B8R1.1 O=C1CC\C(=C\Cl)\O1 Amb25024821 [0,1,0,1,0,0|0,0,2]=4 8947 B8R1.1 O=C1C[C@@H](CF)CO1 Amb22746494 [0,1,0,1,0,0|1,0,0]=3 8948 B8R1.1 O=C1C[C@H](CBr)CO1 Amb24429041 [0,1,0,1,0,0|1,0,0]=3 8949 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,1,0,1,0,0|1,0,0]=3 8950 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,1,0,1,0,0|1,0,0]=3 8951 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,1,0,1,0,0|1,0,0]=3 8952 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,1,0,1,0,0|1,0,0]=3 8953 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,1,0,1,0,0|1,0,0]=3 8954 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,1,0,1,0,0|2,0,0]=4 8955 B8R1.1 O=C1OC[C@H](CCl)O1 Amb25234049 [0,1,0,1,0,0|1,0,0]=3 8956 B8R1.1 O=C1SCC(CBr)S1 Amb24376514 [0,1,0,1,0,0|1,1,0]=4 8957 B8R1.1 O=CC1CC(=O)CC1 Amb18124240 [0,1,0,1,0,0|1,0,1]=4 8958 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [0,1,0,1,0,0|1,0,1]=4 8959 B8R1.1 O=CC1CCC(=O)O1 Amb18641761 [0,1,0,1,0,0|0,0,1]=3 8960 B8R1.1 O=CC1CCC(=O)S1 Amb25094339 [0,1,0,1,0,0|0,1,1]=4 8961 B8R1.1 O=C[C@@H]1CC(=O)CC1 Amb24481518 [0,1,0,1,0,0|1,0,1]=4 8962 B8R1.1 O=C[C@@H]1CCC(=O)O1 Amb24527426 [0,1,0,1,0,0|0,0,1]=3 8963 B8R1.1 O=C[C@@H]1CCC(=O)S1 Amb24483031 [0,1,0,1,0,0|0,1,1]=4 8964 B8R1.1 O=C[C@H]1CC(=O)CC1 Amb25759704 [0,1,0,1,0,0|1,0,1]=4 8965 B8R1.1 O=C[C@H]1CCC(=O)N1 Amb24482383 [0,1,0,1,0,0|1,0,1]=4 8966 B8R1.1 O=S1CO[C@@H](CCl)C1 Amb24393149 [0,1,0,1,0,0|2,0,0]=4 8967 B8R1.1 O=S1OCC(CCl)O1 Amb24624110 [0,1,0,1,0,0|2,0,0]=4 8968 B8R1.1 O=S1OCC(CF)O1 Amb21951909 [0,1,0,1,0,0|2,0,0]=4 8969 B8R1.1 O=S1OC[C@@H](CBr)O1 Amb25834609 [0,1,0,1,0,0|2,0,0]=4 8970 B8R1.1 O=S1OC[C@H](CBr)O1 Amb24654743 [0,1,0,1,0,0|2,0,0]=4 8971 B8R1.1 O=S1OC[C@H](CCl)O1 Amb24353584 [0,1,0,1,0,0|2,0,0]=4 8972 B8R1.1 OC1CC(CC1)CS Amb25853014 [0,1,0,1,0,0|1,0,1]=4 8973 B8R1.1 OC1CCC(C1)CO Amb22168730 [0,1,0,1,0,0|1,0,1]=4 8974 B8R1.1 OC1CCC(CCl)O1 Amb24428834 [0,1,0,1,0,0|0,0,2]=4 8975 B8R1.1 OC1CCC(CO)O1 Amb22492783 [0,1,0,1,0,0|0,0,2]=4 8976 B8R1.1 OC1CCC(CO)S1 Amb25346247 [0,1,0,1,0,0|0,1,1]=4 8977 B8R1.1 OC1CC[C@@H](CCl)O1 Amb24446577 [0,1,0,1,0,0|0,0,2]=4 8978 B8R1.1 OC1CC[C@H](CBr)O1 Amb24390382 [0,1,0,1,0,0|0,0,2]=4 8979 B8R1.1 OC=1OC(CCl)CP1 Amb24481387 [0,1,0,1,0,0|1,0,1]=4 8980 B8R1.1 OCC1CC(=O)CC1 Amb22168734 [0,1,0,1,0,0|1,0,0]=3 8981 B8R1.1 OCC1CC(=O)CO1 Amb24117838 [0,1,0,1,0,0|1,0,0]=3 8982 B8R1.1 OCC1CC(Br)=NO1 Amb23449512 [0,1,0,1,0,0|2,0,0]=4 8983 B8R1.1 OCC1CCC(=O)N1 Amb1162732 [0,1,0,1,0,0|1,0,0]=3 8984 B8R1.1 OCC1CCC(=O)O1 Amb20240701 [0,1,0,1,0,0|0,0,0]=2 8985 B8R1.1 OCC1CN=C(S)O1 Amb25092005 [0,1,0,1,0,0|1,1,0]=4 8986 B8R1.1 OCC1CNC(=O)S1 Amb25349662 [0,1,0,1,0,0|1,1,0]=4 8987 B8R1.1 OCC1CNC(O)=N1 Amb24602100 [0,1,0,1,0,0|2,0,0]=4 8988 B8R1.1 OCC1COC(=O)C1 Amb22886806 [0,1,0,1,0,0|1,0,0]=3 8989 B8R1.1 OCC1COC(=O)N1 Amb22410779 [0,1,0,1,0,0|2,0,0]=4 8990 B8R1.1 OCC1COC(=S)O1 Amb24353008 [0,1,0,1,0,0|1,1,0]=4 8991 B8R1.1 OCC1COP(=O)O1 Amb24475979 [0,1,0,1,0,0|2,0,0]=4 8992 B8R1.1 OCC1COS(=O)O1 Amb25802802 [0,1,0,1,0,0|2,0,0]=4 8993 B8R1.1 OCC1OCC(=O)O1 Amb24643063 [0,1,0,1,0,0|1,0,0]=3 8994 B8R1.1 OC[C@@H]1CC(=O)C=C1 Amb25373368 [0,1,0,1,0,0|2,0,0]=4 8995 B8R1.1 OC[C@@H]1CC(=O)CC1 Amb22748084 [0,1,0,1,0,0|1,0,0]=3 8996 B8R1.1 OC[C@@H]1CC(Br)=NO1 Amb24504219 [0,1,0,1,0,0|2,0,0]=4 8997 B8R1.1 OC[C@@H]1CCC(=O)N1 Amb2371840 [0,1,0,1,0,0|1,0,0]=3 8998 B8R1.1 OC[C@@H]1CCC(=O)S1 Amb24372061 [0,1,0,1,0,0|0,1,0]=3 8999 B8R1.1 OC[C@@H]1CNC(=O)C1 Amb25745471 [0,1,0,1,0,0|2,0,0]=4 9000 B8R1.1 OC[C@@H]1CNC(=O)O1 Amb24183552 [0,1,0,1,0,0|1,0,0]=3 9001 B8R1.1 OC[C@@H]1COC(=O)C1 Amb24414055 [0,1,0,1,0,0|1,0,0]=3 9002 B8R1.1 OC[C@@H]1COS(=O)O1 Amb24748538 [0,1,0,1,0,0|2,0,0]=4 9003 B8R1.1 OC[C@H]1CC(=O)C=C1 Amb25093663 [0,1,0,1,0,0|2,0,0]=4 9004 B8R1.1 OC[C@H]1CC(=O)CC1 Amb24532129 [0,1,0,1,0,0|1,0,0]=3 9005 B8R1.1 OC[C@H]1CCC(=O)S1 Amb25823343 [0,1,0,1,0,0|0,1,0]=3 9006 B8R1.1 OC[C@H]1CNC(=O)C1 Amb24515579 [0,1,0,1,0,0|2,0,0]=4 9007 B8R1.1 OC[C@H]1CNC(=O)O1 Amb22737250 [0,1,0,1,0,0|1,0,0]=3 9008 B8R1.1 OC[C@H]1CSC(=O)N1 Amb24697600 [0,1,0,1,0,0|2,0,0]=4 9009 B8R1.1 O[C@@H]1CC[C@H](C1)CO Amb22748539 [0,1,0,1,0,0|1,0,1]=4 9010 B8R1.1 O[C@H]1CC[C@@H](C1)CO Amb24544575 [0,1,0,1,0,0|1,0,1]=4 9011 B8R1.1 O[C@H]1CC[C@H](C1)CO Amb24619136 [0,1,0,1,0,0|1,0,1]=4 9012 B8R1.1 S=C1OC(CBr)CS1 Amb24667928 [0,1,0,1,0,0|1,1,0]=4 9013 B8R1.4 C=C1CC(O)CCC1 Amb25296194 [0,1,0,1,0,0|2,0,0]=4 9014 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,1,0,1,0,0|1,0,0]=3 9015 B8R1.4 CC1=CC(=O)CCO1 Amb25053054 [0,1,0,1,0,0|1,0,1]=4 9016 B8R1.4 CC1=CC(=O)CCS1 Amb25092957 [0,1,0,1,0,0|1,0,1]=4 9017 B8R1.4 CC1=CC(CCC1)O Amb10844732 [0,1,0,1,0,0|1,0,1]=4 9018 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,1,0,1,0,0|0,0,1]=3 9019 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,1,0,1,0,0|0,0,2]=4 9020 B8R1.4 CC1C=C(C)CCN1 Amb24694144 [0,1,0,1,0,0|2,0,0]=4 9021 B8R1.4 CC1C=CCC(=O)N1 Amb24392943 [0,1,0,1,0,0|1,0,1]=4 9022 B8R1.4 CC1CC(=C)CCC1 Amb25237522 [0,1,0,1,0,0|2,0,0]=4 9023 B8R1.4 CC1CC(=C)CCO1 Amb25235098 [0,1,0,1,0,0|2,0,0]=4 9024 B8R1.4 CC1CC(=N)NCC1 Amb19930463 [0,1,0,1,0,0|2,0,0]=4 9025 B8R1.4 CC1CC(=O)CC=C1 Amb25713549 [0,1,0,1,0,0|1,0,1]=4 9026 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,1,0,1,0,0|1,0,0]=3 9027 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,1,0,1,0,0|1,0,0]=3 9028 B8R1.4 CC1CC(=O)NCC1 Amb20668125 [0,1,0,1,0,0|1,0,0]=3 9029 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [0,1,0,1,0,0|1,0,1]=4 9030 B8R1.4 CC1CC(Br)OCC1 Amb24433110 [0,1,0,1,0,0|1,0,1]=4 9031 B8R1.4 CC1CC(Cl)OCC1 Amb24693934 [0,1,0,1,0,0|1,0,1]=4 9032 B8R1.4 CC1CC(N)=NCC1 Amb22496716 [0,1,0,1,0,0|2,0,0]=4 9033 B8R1.4 CC1CC(N)CCO1 Amb22059408 [0,1,0,1,0,0|1,0,1]=4 9034 B8R1.4 CC1CC(O)CCO1 Amb22757197 [0,1,0,1,0,0|1,0,1]=4 9035 B8R1.4 CC1CC(O)CNC1 Amb24507417 [0,1,0,1,0,0|1,0,1]=4 9036 B8R1.4 CC1CC(O)CSC1 Amb23568717 [0,1,0,1,0,0|1,0,1]=4 9037 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,1,0,1,0,0|0,0,1]=3 9038 B8R1.4 CC1CC=NC(=O)N1 Amb24580624 [0,1,0,1,0,0|1,0,1]=4 9039 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,1,0,1,0,0|1,0,0]=3 9040 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,1,0,1,0,0|1,0,0]=3 9041 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,1,0,1,0,0|0,0,0]=2 9042 B8R1.4 CC1CCCC(Cl)O1 Amb25258362 [0,1,0,1,0,0|1,0,1]=4 9043 B8R1.4 CC1CCCC(N)=N1 Amb24674080 [0,1,0,1,0,0|2,0,0]=4 9044 B8R1.4 CC1CCN=C(N)S1 Amb22228568 [0,1,0,1,0,0|1,1,0]=4 9045 B8R1.4 CC1CCNC(=N)C1 Amb17616048 [0,1,0,1,0,0|2,0,0]=4 9046 B8R1.4 CC1CCNC(=S)O1 Amb25836339 [0,1,0,1,0,0|0,1,0]=3 9047 B8R1.4 CC1CCNC(C)=N1 Amb25837033 [0,1,0,1,0,0|2,0,0]=4 9048 B8R1.4 CC1CCOB(O)O1 Amb24079673 [0,1,0,1,0,0|1,0,1]=4 9049 B8R1.4 CC1CCOC(=O)C1 Amb15693478 [0,1,0,1,0,0|0,0,0]=2 9050 B8R1.4 CC1CCOC(=S)N1 Amb24548582 [0,1,0,1,0,0|1,1,0]=4 9051 B8R1.4 CC1CCSC(=S)N1 Amb25368051 [0,1,0,1,0,0|1,1,0]=4 9052 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,1,0,1,0,0|1,0,0]=3 9053 B8R1.4 CC1CNCC(C)=C1 Amb25757457 [0,1,0,1,0,0|2,0,0]=4 9054 B8R1.4 CC1CNCC(C)O1 Amb22754920 [0,1,0,1,0,0|1,0,1]=4 9055 B8R1.4 CC1COCC(=O)C1 Amb24431094 [0,1,0,1,0,0|1,0,0]=3 9056 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,1,0,1,0,0|1,0,0]=3 9057 B8R1.4 CC1CS(=O)CCN1 Amb18124392 [0,1,0,1,0,0|2,0,0]=4 9058 B8R1.4 CC1CSCC(=O)C1 Amb23568711 [0,1,0,1,0,0|1,0,0]=3 9059 B8R1.4 CC1CSCC(=O)N1 Amb25131602 [0,1,0,1,0,0|1,0,0]=3 9060 B8R1.4 CC1NCCC(=O)C1 Amb1087926 [0,1,0,1,0,0|1,0,0]=3 9061 B8R1.4 CC1OCCC(C)=C1 Amb17689157 [0,1,0,1,0,0|2,0,0]=4 9062 B8R1.4 CC=1CC(=O)OCC1 Amb24751502 [0,1,0,1,0,0|0,0,2]=4 9063 B8R1.4 CC=1CC(O)CCC1 Amb25245575 [0,1,0,1,0,0|2,0,0]=4 9064 B8R1.4 CC=1CCCC(Br)C1 Amb25108623 [0,1,0,1,0,0|2,0,0]=4 9065 B8R1.4 CC=1CCCC(N)C1 Amb18641662 [0,1,0,1,0,0|2,0,0]=4 9066 B8R1.4 CC=1CCC[C@@H](O)C1 Amb25734264 [0,1,0,1,0,0|1,0,1]=4 9067 B8R1.4 CC=1COCC(=O)C1 Amb25065804 [0,1,0,1,0,0|1,0,1]=4 9068 B8R1.4 CC=1C[C@@H](O)CCC1 Amb24619172 [0,1,0,1,0,0|2,0,0]=4 9069 B8R1.4 CC=1NCCC(=O)N1 Amb24382048 [0,1,0,1,0,0|1,0,1]=4 9070 B8R1.4 CN1CC(=O)CCC1 Amb22304741 [0,1,0,1,0,0|1,0,0]=3 9071 B8R1.4 CN1CC(=O)CCC1 Amb22490632 [0,1,0,1,0,0|1,0,0]=3 9072 B8R1.4 CN1CC(=O)NCC1 Amb19958159 [0,1,0,1,0,0|2,0,0]=4 9073 B8R1.4 CN1CC(=O)OCC1 Amb21963307 [0,1,0,1,0,0|1,0,0]=3 9074 B8R1.4 CN1CC(=O)OCC1 Amb22491652 [0,1,0,1,0,0|1,0,0]=3 9075 B8R1.4 CN1CC(O)CCC1 Amb24064756 [0,1,0,1,0,0|1,0,1]=4 9076 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,1,0,1,0,0|1,0,0]=3 9077 B8R1.4 CN1CCNC(=O)N1 Amb24426756 [0,1,0,1,0,0|2,0,0]=4 9078 B8R1.4 CN1C[C@@H](O)CCC1 Amb22225471 [0,1,0,1,0,0|1,0,1]=4 9079 B8R1.4 CN1C[C@H](O)CCC1 Amb22225150 [0,1,0,1,0,0|1,0,1]=4 9080 B8R1.4 CS=1CCCC(=O)C1 Amb25318868 [0,1,0,1,0,0|1,0,0]=3 9081 B8R1.4 C[C@@H]1CC(=O)CCC1 Amb22799724 [0,1,0,1,0,0|1,0,0]=3 9082 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,1,0,1,0,0|1,0,0]=3 9083 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,1,0,1,0,0|1,0,0]=3 9084 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,1,0,1,0,0|1,0,0]=3 9085 B8R1.4 C[C@@H]1CC(=O)NCC1 Amb25739591 [0,1,0,1,0,0|1,0,0]=3 9086 B8R1.4 C[C@@H]1CC=CC(=O)N1 Amb25062539 [0,1,0,1,0,0|1,0,1]=4 9087 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,1,0,1,0,0|1,0,0]=3 9088 B8R1.4 C[C@@H]1CCCC(O)O1 Amb25680618 [0,1,0,1,0,0|0,0,2]=4 9089 B8R1.4 C[C@@H]1CCC[C@@H](O)O1 Amb25345132 [0,1,0,1,0,0|0,0,2]=4 9090 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,1,0,1,0,0|1,0,0]=3 9091 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,1,0,1,0,0|1,0,0]=3 9092 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22745550 [0,1,0,1,0,0|1,0,1]=4 9093 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22748718 [0,1,0,1,0,0|1,0,1]=4 9094 B8R1.4 C[C@@H]1COCC(=O)C1 Amb25746655 [0,1,0,1,0,0|1,0,0]=3 9095 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,1,0,1,0,0|1,0,0]=3 9096 B8R1.4 C[C@@H]1CS(=O)CCN1 Amb24695988 [0,1,0,1,0,0|2,0,0]=4 9097 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [0,1,0,1,0,0|1,0,1]=4 9098 B8R1.4 C[C@@H]1C[C@@H](O)CCO1 Amb22753040 [0,1,0,1,0,0|1,0,1]=4 9099 B8R1.4 C[C@@H]1C[C@@H](O)CCS1 Amb24515322 [0,1,0,1,0,0|1,0,1]=4 9100 B8R1.4 C[C@@H]1C[C@H](Cl)OCC1 Amb24513485 [0,1,0,1,0,0|1,0,1]=4 9101 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [0,1,0,1,0,0|1,0,1]=4 9102 B8R1.4 C[C@@H]1C[C@H](O)CCC1 Amb22800307 [0,1,0,1,0,0|1,0,1]=4 9103 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb22406182 [0,1,0,1,0,0|1,0,1]=4 9104 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb23440188 [0,1,0,1,0,0|1,0,1]=4 9105 B8R1.4 C[C@@H]1C[C@H](O)CCO1 Amb22746391 [0,1,0,1,0,0|1,0,1]=4 9106 B8R1.4 C[C@H]1CC(=O)CCC1 Amb21618704 [0,1,0,1,0,0|1,0,0]=3 9107 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,1,0,1,0,0|1,0,0]=3 9108 B8R1.4 C[C@H]1CC(O)OCC1 Amb25810643 [0,1,0,1,0,0|0,0,2]=4 9109 B8R1.4 C[C@H]1CC=CC(=O)C1 Amb25723295 [0,1,0,1,0,0|1,0,1]=4 9110 B8R1.4 C[C@H]1CC=CC(=O)N1 Amb25326479 [0,1,0,1,0,0|1,0,1]=4 9111 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,1,0,1,0,0|0,0,1]=3 9112 B8R1.4 C[C@H]1CCCC(=O)N1 Amb25327957 [0,1,0,1,0,0|1,0,0]=3 9113 B8R1.4 C[C@H]1CCC[C@@H](O)O1 Amb25175369 [0,1,0,1,0,0|0,0,2]=4 9114 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,1,0,1,0,0|1,0,0]=3 9115 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,1,0,1,0,0|1,0,0]=3 9116 B8R1.4 C[C@H]1CNC[C@H](C)O1 Amb22406103 [0,1,0,1,0,0|1,0,1]=4 9117 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,1,0,1,0,0|1,0,0]=3 9118 B8R1.4 C[C@H]1C[C@@H](O)CCC1 Amb24713971 [0,1,0,1,0,0|1,0,1]=4 9119 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Amb22406181 [0,1,0,1,0,0|1,0,1]=4 9120 B8R1.4 C[C@H]1C[C@@H](O)CCS1 Amb24515349 [0,1,0,1,0,0|1,0,1]=4 9121 B8R1.4 C[C@H]1C[C@H](O)CCC1 Amb24383351 [0,1,0,1,0,0|1,0,1]=4 9122 B8R1.4 C[C@H]1C[C@H](O)CCS1 Amb24515394 [0,1,0,1,0,0|1,0,1]=4 9123 B8R1.4 C[C@H]1C[C@H](O)CNC1 Amb25206204 [0,1,0,1,0,0|1,0,1]=4 9124 B8R1.4 ClC=1CCCC(Br)C1 Amb25189957 [0,1,0,1,0,0|2,0,0]=4 9125 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,1,0,1,0,0|1,0,1]=4 9126 B8R1.4 NC1CC(=O)CCC1 Amb23440459 [0,1,0,1,0,0|1,0,0]=3 9127 B8R1.4 NC1CC(=O)NCC1 Amb19957631 [0,1,0,1,0,0|1,0,0]=3 9128 B8R1.4 NC1CC(=O)NCC1 Amb21960626 [0,1,0,1,0,0|1,0,0]=3 9129 B8R1.4 NC1CC(=O)OCC1 Amb18641823 [0,1,0,1,0,0|0,0,0]=2 9130 B8R1.4 NC1CC(N)=NCC1 Amb25225367 [0,1,0,1,0,0|2,0,0]=4 9131 B8R1.4 NC1CC(O)CCC1 Amb22491291 [0,1,0,1,0,0|1,0,1]=4 9132 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,1,0,1,0,0|1,0,0]=3 9133 B8R1.4 NC1CS(=O)CCC1 Amb18124391 [0,1,0,1,0,0|2,0,0]=4 9134 B8R1.4 NC=1CCCC(=O)N1 Amb24525241 [0,1,0,1,0,0|1,0,1]=4 9135 B8R1.4 N[C@@H]1CC(=O)NCC1 Amb25168718 [0,1,0,1,0,0|1,0,0]=3 9136 B8R1.4 N[C@@H]1C[C@@H](O)CCC1 Amb22828171 [0,1,0,1,0,0|1,0,1]=4 9137 B8R1.4 N[C@@H]1C[C@@H](O)CCC1 Amb22886176 [0,1,0,1,0,0|1,0,1]=4 9138 B8R1.4 N[C@@H]1C[C@H](O)CCC1 Amb22746547 [0,1,0,1,0,0|1,0,1]=4 9139 B8R1.4 N[C@@H]1C[C@H](O)CCC1 Amb22752827 [0,1,0,1,0,0|1,0,1]=4 9140 B8R1.4 N[C@H]1CC(=O)OCC1 Amb24550653 [0,1,0,1,0,0|0,0,0]=2 9141 B8R1.4 N[C@H]1CS(=O)CCC1 Amb25168909 [0,1,0,1,0,0|2,0,0]=4 9142 B8R1.4 N[C@H]1C[C@@H](O)CCC1 Amb22270007 [0,1,0,1,0,0|1,0,1]=4 9143 B8R1.4 N[C@H]1C[C@H](O)CCC1 Amb24074365 [0,1,0,1,0,0|1,0,1]=4 9144 B8R1.4 N[C@H]1C[C@H](O)CCC1 Amb24671187 [0,1,0,1,0,0|1,0,1]=4 9145 B8R1.4 O=C1C=C(Br)CCO1 Amb23400648 [0,1,0,1,0,0|0,0,2]=4 9146 B8R1.4 O=C1CC(Cl)CNN1 Amb22728306 [0,1,0,1,0,0|2,0,0]=4 9147 B8R1.4 O=C1CC(F)CCC1 Amb24578309 [0,1,0,1,0,0|1,0,0]=3 9148 B8R1.4 O=C1CC(F)OCC1 Amb21927920 [0,1,0,1,0,0|2,0,0]=4 9149 B8R1.4 O=C1CC(I)CCC1 Amb24436778 [0,1,0,1,0,0|1,0,0]=3 9150 B8R1.4 O=C1CC(I)CCN1 Amb24387789 [0,1,0,1,0,0|1,0,0]=3 9151 B8R1.4 O=C1CC(I)CNN1 Amb25250615 [0,1,0,1,0,0|2,0,0]=4 9152 B8R1.4 O=C1CC(S)CCC1 Amb25205406 [0,1,0,1,0,0|1,0,0]=3 9153 B8R1.4 O=C1CCCC(=S)N1 Amb25807347 [0,1,0,1,0,0|1,0,1]=4 9154 B8R1.4 O=C1CCCC(I)=C1 Amb25706767 [0,1,0,1,0,0|1,0,1]=4 9155 B8R1.4 O=C1CCCC(S)=C1 Amb25128260 [0,1,0,1,0,0|1,0,1]=4 9156 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,1,0,1,0,0|1,0,1]=4 9157 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,1,0,1,0,0|1,0,1]=4 9158 B8R1.4 O=C1CCOC(=O)N1 Amb25055705 [0,1,0,1,0,0|1,0,1]=4 9159 B8R1.4 O=C1CNCC(=O)O1 Amb25834762 [0,1,0,1,0,0|1,0,1]=4 9160 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,1,0,1,0,0|1,0,1]=4 9161 B8R1.4 O=S1C[C@@H](Cl)CCC1 Amb24533964 [0,1,0,1,0,0|2,0,0]=4 9162 B8R1.4 O=S1C[C@H](Cl)CCC1 Amb25779923 [0,1,0,1,0,0|2,0,0]=4 9163 B8R1.4 O=[13C]1CCC[13C](=O)O1 Amb17614796 [0,1,0,1,0,0|0,0,1]=3 9164 B8R1.4 O=[13C]1CCC[13C](=O)[13CH2]1 Amb17611454 [0,1,0,1,0,0|1,0,1]=4 9165 B8R1.4 O=[13C]1[13CH2][13CH2][13CH2][13C](=O)[13CH2]1 Amb17611455 [0,1,0,1,0,0|1,0,1]=4 9166 B8R1.4 OC1=CC(=O)CCC1 Amb17844413 [0,1,0,1,0,0|1,0,1]=4 9167 B8R1.4 OC1CC(=O)CCC1 Amb22754759 [0,1,0,1,0,0|1,0,0]=3 9168 B8R1.4 OC1CC(=O)CCN1 Amb24746013 [0,1,0,1,0,0|2,0,0]=4 9169 B8R1.4 OC1CC(=O)OCC1 Amb24475154 [0,1,0,1,0,0|0,0,0]=2 9170 B8R1.4 OC1CC(Br)CCC1 Amb24483115 [0,1,0,1,0,0|1,0,1]=4 9171 B8R1.4 OC1CC(O)OCC1 Amb25808083 [0,1,0,1,0,0|0,0,2]=4 9172 B8R1.4 OC1CCCC(Br)=C1 Amb24606865 [0,1,0,1,0,0|2,0,0]=4 9173 B8R1.4 OC1CCCC(O)O1 Amb25048422 [0,1,0,1,0,0|0,0,2]=4 9174 B8R1.4 OC1CCNC(=O)C1 Amb10602744 [0,1,0,1,0,0|1,0,0]=3 9175 B8R1.4 OC1CCNC(C1)C Amb1051141 [0,1,0,1,0,0|1,0,1]=4 9176 B8R1.4 OC1CNCC(=O)N1 Amb24446977 [0,1,0,1,0,0|2,0,0]=4 9177 B8R1.4 O[C@@H]1CC(=O)NCC1 Amb22744924 [0,1,0,1,0,0|1,0,0]=3 9178 B8R1.4 O[C@@H]1CCNC(=O)C1 Amb17845212 [0,1,0,1,0,0|1,0,0]=3 9179 B8R1.4 O[C@@H]1C[C@@H](O)CCC1 Amb22801014 [0,1,0,1,0,0|1,0,1]=4 9180 B8R1.4 O[C@@H]1C[C@H](Br)CCC1 Amb24739845 [0,1,0,1,0,0|1,0,1]=4 9181 B8R1.4 O[C@@H]1C[C@H](Cl)CCC1 Amb24512124 [0,1,0,1,0,0|1,0,1]=4 9182 B8R1.4 O[C@@H]1C[C@H](O)CCC1 Amb22801622 [0,1,0,1,0,0|1,0,1]=4 9183 B8R1.4 O[C@H]1CC(=O)CCC1 Amb25320136 [0,1,0,1,0,0|1,0,0]=3 9184 B8R1.4 O[C@H]1CC(=O)OCC1 Amb25320391 [0,1,0,1,0,0|0,0,0]=2 9185 B8R1.4 O[C@H]1CCCC(Br)=C1 Amb25296540 [0,1,0,1,0,0|2,0,0]=4 9186 B8R1.4 O[C@H]1C[C@H](Br)CCC1 Amb24558410 [0,1,0,1,0,0|1,0,1]=4 9187 B8R1.4 O[C@H]1C[C@H](Cl)CCC1 Amb24739695 [0,1,0,1,0,0|1,0,1]=4 9188 B8R1.4 [O-]C1COCC(=O)C1 Amb22739834 [0,1,0,1,0,0|2,0,0]=4 9189 B8R1.18 CC1=CC(=O)CC1Br Amb24552421 [0,1,0,1,0,0|1,0,1]=4 9190 B8R1.18 CC1=CC(=O)CC1Cl Amb24711398 [0,1,0,1,0,0|1,0,1]=4 9191 B8R1.18 CC1=CC(=O)CC1O Amb24633748 [0,1,0,1,0,0|1,0,1]=4 9192 B8R1.18 CC1=CC(=O)C[C@@H]1O Amb25093715 [0,1,0,1,0,0|1,0,1]=4 9193 B8R1.18 CC1=CC(=O)C[C@H]1O Amb24612700 [0,1,0,1,0,0|1,0,1]=4 9194 B8R1.18 CC1=CC(Cl)C(=O)O1 Amb24349720 [0,1,0,1,0,0|0,0,2]=4 9195 B8R1.18 CC1C=C(O)C(=O)O1 Amb24332982 [0,1,0,1,0,0|0,0,2]=4 9196 B8R1.18 CC1CC(=O)C(=O)O1 Amb24524552 [0,1,0,1,0,0|0,0,1]=3 9197 B8R1.18 CC1CC(=O)C(O)=C1 Amb25370657 [0,1,0,1,0,0|1,0,1]=4 9198 B8R1.18 CC1CC(=O)CN1C Amb20669273 [0,1,0,1,0,0|2,0,0]=4 9199 B8R1.18 CC1CC(=O)N(C1)C Amb10068268 [0,1,0,1,0,0|2,0,0]=4 9200 B8R1.18 CC1CC(C)C(O)C1 Amb17674171 [0,1,0,1,0,0|1,0,1]=4 9201 B8R1.18 CC1CC(C)NC1=O Amb24698782 [0,1,0,1,0,0|1,0,0]=3 9202 B8R1.18 CC1CC(C)OC1O Amb25226270 [0,1,0,1,0,0|0,0,2]=4 9203 B8R1.18 CC1CC(Cl)C(O)O1 Amb25124830 [0,1,0,1,0,0|0,0,2]=4 9204 B8R1.18 CC1CC(O)C(=O)C1 Amb25143497 [0,1,0,1,0,0|1,0,0]=3 9205 B8R1.18 CC1CC(O)C(N)C1 Amb24677532 [0,1,0,1,0,0|1,0,1]=4 9206 B8R1.18 CC1CC(O)CC1=O Amb24752493 [0,1,0,1,0,0|2,0,0]=4 9207 B8R1.18 CC1CC(O)CC1N Amb25169593 [0,1,0,1,0,0|1,0,1]=4 9208 B8R1.18 CC1CC(O)CC1O Amb25055810 [0,1,0,1,0,0|1,0,1]=4 9209 B8R1.18 CC1CC(O)NC1=O Amb24377025 [0,1,0,1,0,0|2,0,0]=4 9210 B8R1.18 CC1CC(O)OC1=O Amb25283481 [0,1,0,1,0,0|1,0,0]=3 9211 B8R1.18 CC1CN(C)CC1=O Amb20622328 [0,1,0,1,0,0|2,0,0]=4 9212 B8R1.18 CC1C[C@@H](N)C(=O)O1 Amb24622840 [0,1,0,1,0,0|0,0,0]=2 9213 B8R1.18 CC1NC(=O)CC1=O Amb23598276 [0,1,0,1,0,0|1,0,1]=4 9214 B8R1.18 CC1NC(=O)CC1C Amb20623595 [0,1,0,1,0,0|1,0,0]=3 9215 B8R1.18 CC1NC(=O)CC1S Amb24441528 [0,1,0,1,0,0|1,0,0]=3 9216 B8R1.18 CC1NC(=S)CC1C Amb24532333 [0,1,0,1,0,0|1,1,0]=4 9217 B8R1.18 CC1NC(C)C(=O)N1 Amb24481399 [0,1,0,1,0,0|2,0,0]=4 9218 B8R1.18 CC1OC(=O)CC1Cl Amb24483262 [0,1,0,1,0,0|0,0,0]=2 9219 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,1,0,1,0,0|1,0,1]=4 9220 B8R1.18 CC1OC(=O)NC1C Amb25747248 [0,1,0,1,0,0|1,0,0]=3 9221 B8R1.18 CC1OC(=O)NC1N Amb24568318 [0,1,0,1,0,0|1,0,0]=3 9222 B8R1.18 CC1OC(C)CC1Cl Amb24699077 [0,1,0,1,0,0|1,0,1]=4 9223 B8R1.18 CC1OC(C)CC1N Amb24619349 [0,1,0,1,0,0|1,0,1]=4 9224 B8R1.18 CC1OC(C)CC1O Amb25238640 [0,1,0,1,0,0|1,0,1]=4 9225 B8R1.18 CC1OC(C)CC1S Amb22234723 [0,1,0,1,0,0|1,0,1]=4 9226 B8R1.18 CC1OC(N)=NC1C Amb24452888 [0,1,0,1,0,0|2,0,0]=4 9227 B8R1.18 CC1OC(O)CC1O Amb25696669 [0,1,0,1,0,0|0,0,2]=4 9228 B8R1.18 CC1SC(C)CC1=O Amb25735260 [0,1,0,1,0,0|2,0,0]=4 9229 B8R1.18 CC=1CC(C)C(=O)C1 Amb24647798 [0,1,0,1,0,0|1,0,1]=4 9230 B8R1.18 CC=1C[C@@H](C)C(=O)C1 Amb24686437 [0,1,0,1,0,0|1,0,1]=4 9231 B8R1.18 CC=1OC(=O)CC1Br Amb25101107 [0,1,0,1,0,0|0,0,2]=4 9232 B8R1.18 C[C@@H]1CC(=O)C[C@@H]1C Amb22230244 [0,1,0,1,0,0|1,0,0]=3 9233 B8R1.18 C[C@@H]1CC(=O)C[C@H]1C Amb24470272 [0,1,0,1,0,0|1,0,0]=3 9234 B8R1.18 C[C@@H]1CC(=O)N(C)C1 Amb24182041 [0,1,0,1,0,0|2,0,0]=4 9235 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,1,0,1,0,0|1,0,1]=4 9236 B8R1.18 C[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25288126 [0,1,0,1,0,0|0,0,0]=2 9237 B8R1.18 C[C@@H]1C[C@@H](O)C(=C)O1 Amb25284313 [0,1,0,1,0,0|1,0,0]=3 9238 B8R1.18 C[C@@H]1C[C@@H](O)C(=O)O1 Amb24615353 [0,1,0,1,0,0|0,0,0]=2 9239 B8R1.18 C[C@@H]1C[C@@H](O)C[C@H]1O Amb25261754 [0,1,0,1,0,0|1,0,1]=4 9240 B8R1.18 C[C@@H]1C[C@H](Cl)C(=O)O1 Amb24596085 [0,1,0,1,0,0|0,0,0]=2 9241 B8R1.18 C[C@@H]1C[C@H](Cl)[C@@H](O)O1 Amb24739817 [0,1,0,1,0,0|0,0,2]=4 9242 B8R1.18 C[C@@H]1C[C@H](N)C(=O)O1 Amb24760900 [0,1,0,1,0,0|0,0,0]=2 9243 B8R1.18 C[C@@H]1C[C@H](O)C(=O)O1 Amb24519690 [0,1,0,1,0,0|0,0,0]=2 9244 B8R1.18 C[C@@H]1C[C@H](O)CC1=O Amb25236934 [0,1,0,1,0,0|2,0,0]=4 9245 B8R1.18 C[C@@H]1NC(=O)CC1=O Amb18833079 [0,1,0,1,0,0|1,0,1]=4 9246 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O Amb24760967 [0,1,0,1,0,0|1,0,0]=3 9247 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1S Amb24586770 [0,1,0,1,0,0|1,0,0]=3 9248 B8R1.18 C[C@@H]1NC(=O)C[C@H]1C Amb24550340 [0,1,0,1,0,0|1,0,0]=3 9249 B8R1.18 C[C@@H]1NC(=O)C[C@H]1O Amb25203404 [0,1,0,1,0,0|1,0,0]=3 9250 B8R1.18 C[C@@H]1NC(=O)C[C@H]1S Amb24685136 [0,1,0,1,0,0|1,0,0]=3 9251 B8R1.18 C[C@@H]1NC(=O)N[C@@H]1C Amb25791194 [0,1,0,1,0,0|2,0,0]=4 9252 B8R1.18 C[C@@H]1OC(=N)N[C@@H]1C Amb24523145 [0,1,0,1,0,0|2,0,0]=4 9253 B8R1.18 C[C@@H]1OC(=O)C=C1O Amb25087875 [0,1,0,1,0,0|0,0,2]=4 9254 B8R1.18 C[C@@H]1OC(=O)CC1O Amb25332464 [0,1,0,1,0,0|0,0,0]=2 9255 B8R1.18 C[C@@H]1OC(=O)C[C@H]1C Amb24583426 [0,1,0,1,0,0|0,0,0]=2 9256 B8R1.18 C[C@@H]1OC(=O)C[C@H]1O Amb25328533 [0,1,0,1,0,0|0,0,0]=2 9257 B8R1.18 C[C@@H]1OC(=O)N[C@@H]1C Amb24601098 [0,1,0,1,0,0|1,0,0]=3 9258 B8R1.18 C[C@@H]1OC(=O)N[C@H]1C Amb24516825 [0,1,0,1,0,0|1,0,0]=3 9259 B8R1.18 C[C@@H]1OC(=S)N[C@H]1C Amb24746694 [0,1,0,1,0,0|1,1,0]=4 9260 B8R1.18 C[C@@H]1OC(C)C[C@H]1O Amb25176118 [0,1,0,1,0,0|1,0,1]=4 9261 B8R1.18 C[C@@H]1OC(O)C[C@H]1O Amb25177050 [0,1,0,1,0,0|0,0,2]=4 9262 B8R1.18 C[C@@H]1O[C@@H](O)C[C@H]1C Amb24597062 [0,1,0,1,0,0|0,0,2]=4 9263 B8R1.18 C[C@@H]1SC(=O)N[C@@H]1C Amb24606920 [0,1,0,1,0,0|1,1,0]=4 9264 B8R1.18 C[C@H]1C[C@@H](C)C(=O)C1 Amb24643266 [0,1,0,1,0,0|1,0,0]=3 9265 B8R1.18 C[C@H]1C[C@@H](O)C(=S)N1 Amb25259817 [0,1,0,1,0,0|1,1,0]=4 9266 B8R1.18 C[C@H]1C[C@H](Br)C(=O)O1 Amb25322131 [0,1,0,1,0,0|0,0,0]=2 9267 B8R1.18 C[C@H]1C[C@H](C)NC1=O Amb25174475 [0,1,0,1,0,0|1,0,0]=3 9268 B8R1.18 C[C@H]1C[C@H](N)C(=O)O1 Amb24538781 [0,1,0,1,0,0|0,0,0]=2 9269 B8R1.18 C[C@H]1OC(=O)C[C@@H]1C Amb25245321 [0,1,0,1,0,0|0,0,0]=2 9270 B8R1.18 C[C@H]1OC(=O)C[C@@H]1O Amb24577403 [0,1,0,1,0,0|0,0,0]=2 9271 B8R1.18 C[C@H]1OC(=O)C[C@H]1N Amb24619491 [0,1,0,1,0,0|0,0,0]=2 9272 B8R1.18 C[C@H]1OC(C)C[C@H]1O Amb24588218 [0,1,0,1,0,0|1,0,1]=4 9273 B8R1.18 C[C@H]1OC(O)C[C@@H]1C Amb24616560 [0,1,0,1,0,0|0,0,2]=4 9274 B8R1.18 C[C@H]1O[C@H](C)CC1=O Amb25744762 [0,1,0,1,0,0|2,0,0]=4 9275 B8R1.18 NC1CC(=O)OC1=O Amb19929452 [0,1,0,1,0,0|1,0,1]=4 9276 B8R1.18 NC1CC(=O)OC1O Amb24745298 [0,1,0,1,0,0|1,0,0]=3 9277 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,1,0,1,0,0|1,0,1]=4 9278 B8R1.18 O=C1C=C(C(C1)C)C Amb16191977 [0,1,0,1,0,0|1,0,1]=4 9279 B8R1.18 O=C1C[C@@H](Cl)[C@H](Cl)C1 Amb25139007 [0,1,0,1,0,0|2,0,0]=4 9280 B8R1.18 O=C1C[C@H](Cl)[C@@H](Cl)C1 Amb24515104 [0,1,0,1,0,0|2,0,0]=4 9281 B8R1.18 O=C1OC(=O)CC1Cl Amb24677749 [0,1,0,1,0,0|1,0,1]=4 9282 B8R1.18 O=C1OC(=O)C[C@@H]1Br Amb24558394 [0,1,0,1,0,0|1,0,1]=4 9283 B8R1.18 O=C1OC(=O)C[C@@H]1Cl Amb25837364 [0,1,0,1,0,0|1,0,1]=4 9284 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,1,0,1,0,0|2,0,0]=4 9285 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,1,0,1,0,0|2,0,0]=4 9286 B8R1.18 OC1CC(=O)CC1O Amb25834386 [0,1,0,1,0,0|2,0,0]=4 9287 B8R1.18 O[C@@H]1CC(=O)OC1=O Amb25142904 [0,1,0,1,0,0|1,0,1]=4 9288 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,1,0,1,0,0|1,0,1]=4 9289 B8R1.20 C=C1C[C@@H]1CC(O)=O Amb25331268 [0,1,0,1,0,0|0,0,1]=3 9290 B8R1.20 C=C1C[C@H]1CC(O)=O Amb24686141 [0,1,0,1,0,0|0,0,1]=3 9291 B8R1.20 CC1CC1=CC(O)=O Amb25256441 [0,1,0,1,0,0|0,0,1]=3 9292 B8R1.20 CC1CC1CB(O)O Amb24641424 [0,1,0,1,0,0|1,0,1]=4 9293 B8R1.20 CC1CC1CC(N)=O Amb25772500 [0,1,0,1,0,0|1,0,0]=3 9294 B8R1.20 CC1CC1CC(O)=O Amb25316515 [0,1,0,1,0,0|0,0,0]=2 9295 B8R1.20 CC1CC1NC(N)=O Amb25074259 [0,1,0,1,0,0|1,0,0]=3 9296 B8R1.20 CC1CC1NC(N)=S Amb25361754 [0,1,0,1,0,0|1,1,0]=4 9297 B8R1.20 CC1OC1CC(O)=O Amb24710388 [0,1,0,1,0,0|0,0,0]=2 9298 B8R1.20 CC1OC1C[N+]([O-])=O Amb25205724 [0,1,0,1,0,0|1,0,1]=4 9299 B8R1.20 C[C@@H]1C[C@H]1CC(C)=O Amb24373459 [0,1,0,1,0,0|1,0,0]=3 9300 B8R1.20 C[C@@H]1C[C@H]1NC(C)=O Amb24619123 [0,1,0,1,0,0|1,0,0]=3 9301 B8R1.20 C[C@@H]1O[C@H]1CC(N)=O Amb24629162 [0,1,0,1,0,0|1,0,0]=3 9302 B8R1.20 C[C@H]1C[C@H]1CC(C)=O Amb25257655 [0,1,0,1,0,0|1,0,0]=3 9303 B8R1.20 C[C@H]1C[C@H]1CC(O)=O Amb25174744 [0,1,0,1,0,0|0,0,0]=2 9304 B8R1.20 C[C@H]1C[C@H]1NC(N)=O Amb24532410 [0,1,0,1,0,0|1,0,0]=3 9305 B8R1.20 C[C@H]1O[C@@H]1CC(C)O Amb25176687 [0,1,0,1,0,0|1,0,1]=4 9306 B8R1.20 C[C@H]1O[C@H]1CC(O)=O Amb25747306 [0,1,0,1,0,0|0,0,0]=2 9307 B8R1.20 N[C@H]1C[C@H]1CC(O)=O Amb24585123 [0,1,0,1,0,0|0,0,0]=2 9308 B8R1.31 CC(=C)[C@@H]1CC[C@H]1O Amb24625276 [0,1,0,1,0,0|2,0,0]=4 9309 B8R1.31 CC(=O)C1CCN1C Amb25196048 [0,1,0,1,0,0|1,0,0]=3 9310 B8R1.31 CC1CCC1C(=O)Cl Amb25123268 [0,1,0,1,0,0|1,0,0]=3 9311 B8R1.31 CC1CCC1C(C)=O Amb25101506 [0,1,0,1,0,0|1,0,0]=3 9312 B8R1.31 CC1CCC1C(C)O Amb25270791 [0,1,0,1,0,0|1,0,1]=4 9313 B8R1.31 CC1CCC1C(N)=O Amb24481452 [0,1,0,1,0,0|1,0,0]=3 9314 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,1,0,1,0,0|0,0,0]=2 9315 B8R1.31 CC1CCN1C(N)=O Amb24748909 [0,1,0,1,0,0|1,0,0]=3 9316 B8R1.31 CN1CCC1C(N)=O Amb22227962 [0,1,0,1,0,0|1,0,0]=3 9317 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,1,0,1,0,0|0,0,0]=2 9318 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,1,0,1,0,0|0,0,0]=2 9319 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,1,0,1,0,0|0,0,0]=2 9320 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,1,0,1,0,0|0,0,0]=2 9321 B8R1.31 C[C@@H]1CN[C@@H]1C(O)=O Amb24597629 [0,1,0,1,0,0|0,0,0]=2 9322 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,1,0,1,0,0|0,0,0]=2 9323 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,1,0,1,0,0|0,0,0]=2 9324 B8R1.31 C[C@H]1CN[C@@H]1C(O)=O Amb24629618 [0,1,0,1,0,0|0,0,0]=2 9325 B8R1.31 NC(=O)C1CCC1Cl Amb24482516 [0,1,0,1,0,0|1,0,0]=3 9326 B8R1.31 NC(=O)[C@@H]1CC[C@@H]1Cl Amb25174435 [0,1,0,1,0,0|1,0,0]=3 9327 B8R1.31 NC(=O)[C@@H]1CC[C@H]1Cl Amb25024326 [0,1,0,1,0,0|1,0,0]=3 9328 B8R1.31 NC1CCC1C(N)=O Amb20248288 [0,1,0,1,0,0|1,0,0]=3 9329 B8R1.31 NC1COC1C(N)=O Amb25309396 [0,1,0,1,0,0|2,0,0]=4 9330 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,1,0,1,0,0|1,0,0]=3 9331 B8R1.31 N[C@@H]1CC[C@@H]1C(N)=O Amb24670123 [0,1,0,1,0,0|1,0,0]=3 9332 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,1,0,1,0,0|0,0,0]=2 9333 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,1,0,1,0,0|0,0,0]=2 9334 B8R1.31 N[C@@H]1CO[C@@H]1C(O)=O Amb24568133 [0,1,0,1,0,0|1,0,0]=3 9335 B8R1.31 N[C@@H]1CO[C@H]1C(O)=O Amb24681491 [0,1,0,1,0,0|1,0,0]=3 9336 B8R1.31 N[C@H]1CC[C@H]1C(N)=O Amb25326921 [0,1,0,1,0,0|1,0,0]=3 9337 B8R1.31 N[C@H]1CO[C@@H]1C(O)=O Amb25324265 [0,1,0,1,0,0|1,0,0]=3 9338 B8R1.31 O=C(Cl)C1CCC1Cl Amb25718688 [0,1,0,1,0,0|1,0,0]=3 9339 B8R1.31 O=C(Cl)[C@@H]1CC[C@@H]1Cl Amb25361006 [0,1,0,1,0,0|1,0,0]=3 9340 B8R1.31 OC(=O)C1C=CC1Cl Amb24482989 [0,1,0,1,0,0|0,0,2]=4 9341 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,1,0,1,0,0|0,0,0]=2 9342 B8R1.31 OC(=O)C1CNC1=O Amb24524290 [0,1,0,1,0,0|1,0,1]=4 9343 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,1,0,1,0,0|0,0,0]=2 9344 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,1,0,1,0,0|0,0,0]=2 9345 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,1,0,1,0,0|0,0,0]=2 9346 B8R1.31 OC=1CCC1C(O)=O Amb25119748 [0,1,0,1,0,0|0,0,2]=4 9347 B8R1.34 C=C(Br)CN1CCC1 Amb22896555 [0,1,0,1,0,0|2,0,0]=4 9348 B8R1.34 C=C(Br)CN1CCC1 Amb25136715 [0,1,0,1,0,0|2,0,0]=4 9349 B8R1.34 CC(=C)CC1CCC1 Amb25141378 [0,1,0,1,0,0|2,0,0]=4 9350 B8R1.34 CC(=C)CC1CNC1 Amb24576858 [0,1,0,1,0,0|2,0,0]=4 9351 B8R1.34 CC(=O)C=C1CCC1 Amb21858878 [0,1,0,1,0,0|1,0,1]=4 9352 B8R1.34 CC(=O)CC1CCC1 Amb20668826 [0,1,0,1,0,0|1,0,0]=3 9353 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,1,0,1,0,0|1,0,0]=3 9354 B8R1.34 CC(=O)CN1CCC1 Amb25266769 [0,1,0,1,0,0|1,0,0]=3 9355 B8R1.34 CC(=O)NC1CNC1 Amb21960869 [0,1,0,1,0,0|2,0,0]=4 9356 B8R1.34 CC(=O)OC1CCC1 Amb25215621 [0,1,0,1,0,0|1,0,0]=3 9357 B8R1.34 CC(=O)OC1CNC1 Amb21956164 [0,1,0,1,0,0|2,0,0]=4 9358 B8R1.34 CC(=O)OC1CNC1 Amb21959342 [0,1,0,1,0,0|2,0,0]=4 9359 B8R1.34 CC(=O)OC1COC1 Amb25257353 [0,1,0,1,0,0|2,0,0]=4 9360 B8R1.34 CC(O)CC1CCC1 Amb24590967 [0,1,0,1,0,0|1,0,1]=4 9361 B8R1.34 CC(O)CC1CSC1 Amb25746467 [0,1,0,1,0,0|1,0,1]=4 9362 B8R1.34 C[C@@H](O)CC1CCC1 Amb24673338 [0,1,0,1,0,0|1,0,1]=4 9363 B8R1.34 C[C@@H](O)CN1CCC1 Amb25787395 [0,1,0,1,0,0|1,0,1]=4 9364 B8R1.34 C[C@H](O)CC1CCC1 Amb24719399 [0,1,0,1,0,0|1,0,1]=4 9365 B8R1.34 C[C@H](O)CN1CCC1 Amb24735102 [0,1,0,1,0,0|1,0,1]=4 9366 B8R1.34 NC(=N)CC1CCC1 Amb25693457 [0,1,0,1,0,0|2,0,0]=4 9367 B8R1.34 NC(=N)NC1CCC1 Amb24433597 [0,1,0,1,0,0|2,0,0]=4 9368 B8R1.34 NC(=O)CC1CCN1 Amb24561003 [0,1,0,1,0,0|1,0,0]=3 9369 B8R1.34 NC(=O)CC1COC1 Amb25080580 [0,1,0,1,0,0|1,0,0]=3 9370 B8R1.34 NC(=O)CN1CCC1 Amb25167404 [0,1,0,1,0,0|1,0,0]=3 9371 B8R1.34 NC(=O)NC1CCC1 Amb24692278 [0,1,0,1,0,0|1,0,0]=3 9372 B8R1.34 NC(=O)OC1CNC1 Amb23598269 [0,1,0,1,0,0|2,0,0]=4 9373 B8R1.34 NC(=O)OC1CSC1 Amb22364584 [0,1,0,1,0,0|2,0,0]=4 9374 B8R1.34 NC(=S)NC1CCC1 Amb24619949 [0,1,0,1,0,0|1,1,0]=4 9375 B8R1.34 O=C(Cl)CC1CCC1 Amb22491179 [0,1,0,1,0,0|1,0,0]=3 9376 B8R1.34 OB(O)CN1CCC1 Amb24526709 [0,1,0,1,0,0|1,0,1]=4 9377 B8R1.34 OC(=O)C=C1CCC1 Amb20667794 [0,1,0,1,0,0|0,0,1]=3 9378 B8R1.34 OC(=O)C=C1CSC1 Amb24379733 [0,1,0,1,0,0|0,0,2]=4 9379 B8R1.34 OC(=O)CC1CCN1 Amb25068427 [0,1,0,1,0,0|0,0,0]=2 9380 B8R1.34 OC(=O)CC1CNC1 Amb21856240 [0,1,0,1,0,0|0,0,0]=2 9381 B8R1.34 OC(=O)CC1CNC1 Amb22057370 [0,1,0,1,0,0|0,0,0]=2 9382 B8R1.34 OC(=O)CC1CNC1 Amb22739043 [0,1,0,1,0,0|0,0,0]=2 9383 B8R1.34 OC(=O)CC1COC1 Amb18199145 [0,1,0,1,0,0|0,0,0]=2 9384 B8R1.34 OC(=O)CC=1CCC1 Amb24397299 [0,1,0,1,0,0|0,0,1]=3 9385 B8R1.34 OC(=O)CN1CCC1 Amb22059611 [0,1,0,1,0,0|0,0,0]=2 9386 B8R1.34 [O-][N+](=O)CC1COC1 Amb21961002 [0,1,0,1,0,0|1,0,1]=4 9387 B8R1.40 BrCC(=O)NC1CC1 Amb17331226 [0,1,0,1,0,0|2,0,0]=4 9388 B8R1.40 C#CC(=O)NC1CC1 Amb23556886 [0,1,0,1,0,0|2,0,0]=4 9389 B8R1.40 C=CC(O)CC1CC1 Amb24469416 [0,1,0,1,0,0|1,0,1]=4 9390 B8R1.40 CC(CC1CC1)=NN Amb24619029 [0,1,0,1,0,0|2,0,0]=4 9391 B8R1.40 CC(CC1CC1)C=O Amb25100922 [0,1,0,1,0,0|1,0,1]=4 9392 B8R1.40 CC(CC1CC1)CO Amb24433846 [0,1,0,1,0,0|1,0,1]=4 9393 B8R1.40 CC(CC1CC1)NO Amb24388093 [0,1,0,1,0,0|1,0,1]=4 9394 B8R1.40 CCC(O)CC1CC1 Amb24481406 [0,1,0,1,0,0|1,0,1]=4 9395 B8R1.40 CC[C@H](O)CC1CC1 Amb25693970 [0,1,0,1,0,0|1,0,1]=4 9396 B8R1.40 CN(CC1CC1)C=O Amb24117127 [0,1,0,1,0,0|2,0,0]=4 9397 B8R1.40 CNC(=O)NC1CC1 Amb2132760 [0,1,0,1,0,0|2,0,0]=4 9398 B8R1.40 COC(=N)CC1CC1 Amb24377021 [0,1,0,1,0,0|1,0,0]=3 9399 B8R1.40 COC(=O)CC1CC1 Amb20622313 [0,1,0,1,0,0|0,0,0]=2 9400 B8R1.40 COC(=O)NC1CC1 Amb17869115 [0,1,0,1,0,0|1,0,0]=3 9401 B8R1.40 COC(C)=NC1CC1 Amb25349452 [0,1,0,1,0,0|2,0,0]=4 9402 B8R1.40 CON(C)CC1CC1 Amb25077342 [0,1,0,1,0,0|2,0,0]=4 9403 B8R1.40 CO\C(\C)=N\C1CC1 Amb22356785 [0,1,0,1,0,0|2,0,0]=4 9404 B8R1.40 C\C(\C=O)=C/C1CC1 Amb25086591 [0,1,0,1,0,0|1,0,1]=4 9405 B8R1.40 NC(CC1CC1)CO Amb18203350 [0,1,0,1,0,0|1,0,1]=4 9406 B8R1.40 NCC(=O)CC1CC1 Amb18203369 [0,1,0,1,0,0|1,0,0]=3 9407 B8R1.40 NCC(=O)NC1CC1 Amb2371201 [0,1,0,1,0,0|2,0,0]=4 9408 B8R1.40 NCC(=O)OC1CC1 Amb17942928 [0,1,0,1,0,0|2,0,0]=4 9409 B8R1.40 NCC(O)CC1CC1 Amb18833011 [0,1,0,1,0,0|1,0,1]=4 9410 B8R1.40 O=C(CBr)CC1CC1 Amb24364944 [0,1,0,1,0,0|1,0,0]=3 9411 B8R1.40 O=C(CCl)CC1CC1 Amb22395343 [0,1,0,1,0,0|1,0,0]=3 9412 B8R1.40 O=C(CF)NC1CC1 Amb25108089 [0,1,0,1,0,0|2,0,0]=4 9413 B8R1.40 O=C(CI)NC1CC1 Amb23512747 [0,1,0,1,0,0|2,0,0]=4 9414 B8R1.40 O=C(CS)NC1CC1 Amb24183332 [0,1,0,1,0,0|1,1,0]=4 9415 B8R1.40 OCC(=O)OC1CC1 Amb25317031 [0,1,0,1,0,0|1,0,0]=3 9416 B8R1.40 ONC(=O)CC1CC1 Amb25704077 [0,1,0,1,0,0|0,0,0]=2 9417 B8R1.40 O\N=C(\NC1CC1)/N Amb10066962 [0,1,0,1,0,0|2,0,0]=4 9418 B8R1.42 CC(=O)CC1(C)CC1 Amb10607353 [0,1,0,1,0,0|1,0,0]=3 9419 B8R1.42 CC(=O)CC1(C)CO1 Amb25232199 [0,1,0,1,0,0|2,0,0]=4 9420 B8R1.42 CC(=O)CC1(F)CC1 Amb24748494 [0,1,0,1,0,0|1,0,0]=3 9421 B8R1.42 CC(=O)NC1(C)CC1 Amb24372211 [0,1,0,1,0,0|2,0,0]=4 9422 B8R1.42 CC(=O)OC1(C)CC1 Amb10069988 [0,1,0,1,0,0|2,0,0]=4 9423 B8R1.42 CC(O)CC1(N)CC1 Amb18833015 [0,1,0,1,0,0|1,0,1]=4 9424 B8R1.42 CC(O)CC1(O)CC1 Amb25336996 [0,1,0,1,0,0|1,0,1]=4 9425 B8R1.42 CC1(CC(N)=O)CC1 Amb24393728 [0,1,0,1,0,0|1,0,0]=3 9426 B8R1.42 CC1(CC(O)=O)CC1 Amb18833039 [0,1,0,1,0,0|0,0,0]=2 9427 B8R1.42 CC1(CC1)NC(N)=O Amb24579273 [0,1,0,1,0,0|2,0,0]=4 9428 B8R1.42 NC1(CC(O)=O)CC1 Amb18833024 [0,1,0,1,0,0|0,0,0]=2 9429 B8R1.42 NC1(CC(O)=O)CC1 Amb21964520 [0,1,0,1,0,0|0,0,0]=2 9430 B8R1.42 OC(=O)CC1(O)CC1 Amb24117238 [0,1,0,1,0,0|0,0,0]=2 9431 B8R1.43 C#C[C@@H]1C[C@H]1C(O)=O Amb25294666 [0,1,0,1,0,0|0,0,1]=3 9432 B8R1.43 C#C[C@H]1C[C@@H]1C(O)=O Amb24076488 [0,1,0,1,0,0|0,0,1]=3 9433 B8R1.43 C=CC1CC1C(N)=O Amb24530246 [0,1,0,1,0,0|1,0,1]=4 9434 B8R1.43 C=C[C@H]1C[C@@H]1C(O)=O Amb24562586 [0,1,0,1,0,0|0,0,1]=3 9435 B8R1.43 C=C[C@H]1C[C@H]1C(O)=O Amb25173924 [0,1,0,1,0,0|0,0,1]=3 9436 B8R1.43 CC(=O)C1CC1CO Amb25762004 [0,1,0,1,0,0|1,0,0]=3 9437 B8R1.43 CC(=O)[C@@H]1C[C@@H]1C=C Amb25784181 [0,1,0,1,0,0|1,0,1]=4 9438 B8R1.43 CC(=O)[C@H]1C[C@@H]1C=C Amb24570441 [0,1,0,1,0,0|1,0,1]=4 9439 B8R1.43 CC(O)[C@@H]1C[C@H]1CC Amb24733487 [0,1,0,1,0,0|1,0,1]=4 9440 B8R1.43 CC(O)[C@H]1C[C@H]1CO Amb25260054 [0,1,0,1,0,0|1,0,1]=4 9441 B8R1.43 CCC1CC1C(N)=O Amb24482378 [0,1,0,1,0,0|1,0,0]=3 9442 B8R1.43 CCC1CC1C(O)=O Amb18961272 [0,1,0,1,0,0|0,0,0]=2 9443 B8R1.43 CCC1OC1C(O)=O Amb24640795 [0,1,0,1,0,0|0,0,0]=2 9444 B8R1.43 CC[C@@H]1C[C@@H]1C(C)=O Amb25779618 [0,1,0,1,0,0|1,0,0]=3 9445 B8R1.43 CC[C@@H]1C[C@H]1C(=O)Cl Amb24606720 [0,1,0,1,0,0|1,0,0]=3 9446 B8R1.43 CC[C@@H]1C[C@H]1C(C)=O Amb25809901 [0,1,0,1,0,0|1,0,0]=3 9447 B8R1.43 CC[C@@H]1C[C@H]1C(N)=O Amb24532446 [0,1,0,1,0,0|1,0,0]=3 9448 B8R1.43 CC[C@@H]1C[C@H]1C(O)=O Amb24112910 [0,1,0,1,0,0|0,0,0]=2 9449 B8R1.43 CC[C@@H]1O[C@H]1C(O)=O Amb24587605 [0,1,0,1,0,0|0,0,0]=2 9450 B8R1.43 CC[C@H]1C[C@H]1C(C)=O Amb24635581 [0,1,0,1,0,0|1,0,0]=3 9451 B8R1.43 COC1CC1C(C)=O Amb25252874 [0,1,0,1,0,0|1,0,0]=3 9452 B8R1.43 COC1CC1C(O)=O Amb25081919 [0,1,0,1,0,0|0,0,0]=2 9453 B8R1.43 CO[C@@H]1C[C@H]1C(O)=O Amb24514838 [0,1,0,1,0,0|0,0,0]=2 9454 B8R1.43 C[C@@H](O)[C@@H]1C[C@@H]1CC Amb25358065 [0,1,0,1,0,0|1,0,1]=4 9455 B8R1.43 C[C@@H](O)[C@@H]1C[C@@H]1CO Amb25206739 [0,1,0,1,0,0|1,0,1]=4 9456 B8R1.43 C[C@H](O)[C@@H]1C[C@@H]1CO Amb25175328 [0,1,0,1,0,0|1,0,1]=4 9457 B8R1.43 C[C@H](O)[C@@H]1C[C@H]1CO Amb24588289 [0,1,0,1,0,0|1,0,1]=4 9458 B8R1.43 C[C@H](O)[C@H]1C[C@H]1CO Amb24732834 [0,1,0,1,0,0|1,0,1]=4 9459 B8R1.43 C\C=C/1\CC1C(O)=O Amb24386730 [0,1,0,1,0,0|0,0,1]=3 9460 B8R1.43 C\C=C/1\C[C@H]1C(O)=O Amb25359125 [0,1,0,1,0,0|0,0,1]=3 9461 B8R1.43 N#CC1CC1C(O)=O Amb24183452 [0,1,0,1,0,0|0,0,1]=3 9462 B8R1.43 N#C[C@@H]1C[C@@H]1C(O)=O Amb24183522 [0,1,0,1,0,0|0,0,1]=3 9463 B8R1.43 N#C[C@@H]1C[C@H]1C(O)=O Amb24183456 [0,1,0,1,0,0|0,0,1]=3 9464 B8R1.43 N#C[C@H]1C[C@H]1C(O)=O Amb25168974 [0,1,0,1,0,0|0,0,1]=3 9465 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,1,0,1,0,0|1,0,0]=3 9466 B8R1.43 NC(=O)C1OC1CBr Amb25702387 [0,1,0,1,0,0|2,0,0]=4 9467 B8R1.43 NC(=O)C1OC1CO Amb25351466 [0,1,0,1,0,0|2,0,0]=4 9468 B8R1.43 NC(=O)[C@@H]1O[C@H]1CO Amb25229010 [0,1,0,1,0,0|2,0,0]=4 9469 B8R1.43 NCC1CC1C(N)=O Amb24604918 [0,1,0,1,0,0|1,0,0]=3 9470 B8R1.43 NC[C@@H]1C[C@@H]1C(O)=O Amb24680970 [0,1,0,1,0,0|0,0,0]=2 9471 B8R1.43 NNC1CC1C(=O)O Amb10576221 [0,1,0,1,0,0|1,0,0]=3 9472 B8R1.43 OB(O)[C@H]1C[C@@H]1CCl Amb24551898 [0,1,0,1,0,0|1,0,1]=4 9473 B8R1.43 OC(=O)[C@@H]1C[C@H]1C=O Amb25174216 [0,1,0,1,0,0|0,0,1]=3 9474 B8R1.43 OC(=O)[C@@H]1C[C@H]1CCl Amb24698643 [0,1,0,1,0,0|0,0,0]=2 9475 B8R1.43 OC(=O)[C@H]1C[C@@H]1C=O Amb25188101 [0,1,0,1,0,0|0,0,1]=3 9476 B8R1.43 OC(=O)[C@H]1C[C@@H]1CBr Amb24515045 [0,1,0,1,0,0|0,0,0]=2 9477 B8R1.43 OC(=O)[C@H]1O[C@@H]1CBr Amb24603042 [0,1,0,1,0,0|1,0,0]=3 9478 B8R1.43 OCC1CC1C(O)=O Amb25173469 [0,1,0,1,0,0|0,0,0]=2 9479 B8R1.43 OC[C@@H]1C[C@H]1C(O)=O Amb25231147 [0,1,0,1,0,0|0,0,0]=2 9480 B8R1.43 OC[C@H]1C[C@@H]1C(O)=O Amb25319844 [0,1,0,1,0,0|0,0,0]=2 9481 B8R1.43 [O-]C(=O)C1OC1CO Amb24557010 [0,1,0,1,0,0|1,0,1]=4 9482 B8R1.43 [O-]C(=O)[C@@H]1O[C@H]1CO Amb25215740 [0,1,0,1,0,0|1,0,1]=4 9483 B8R1.43 [O-]C(=O)[C@H]1O[C@@H]1CO Amb24541614 [0,1,0,1,0,0|1,0,1]=4 9484 B8R1.43 [O-][N+](=O)C1CC1CO Amb23571861 [0,1,0,1,0,0|1,0,1]=4 9485 B8R1.51 BrC1CCS(=O)(=O)C1 Amb2548437 [0,1,0,1,0,0|1,0,1]=4 9486 B8R1.51 CC1(C)C=CC(=O)O1 Amb24099124 [0,1,0,1,0,0|0,0,2]=4 9487 B8R1.51 CC1(C)CC(=O)CC1 Amb19516867 [0,1,0,1,0,0|1,0,0]=3 9488 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,1,0,1,0,0|2,0,0]=4 9489 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,1,0,1,0,0|2,0,0]=4 9490 B8R1.51 CC1(C)CC(=O)CS1 Amb21964095 [0,1,0,1,0,0|2,0,0]=4 9491 B8R1.51 CC1(C)CC(O)CC1 Amb22549345 [0,1,0,1,0,0|1,0,1]=4 9492 B8R1.51 CC1(C)CCC(=N)N1 Amb25733497 [0,1,0,1,0,0|2,0,0]=4 9493 B8R1.51 CC1(C)CCC(=S)N1 Amb25827545 [0,1,0,1,0,0|1,1,0]=4 9494 B8R1.51 CC1(C)CN=C(N)O1 Amb25720624 [0,1,0,1,0,0|2,0,0]=4 9495 B8R1.51 CC1(C)COC(=O)C1 Amb22284870 [0,1,0,1,0,0|2,0,0]=4 9496 B8R1.51 CC1(C)COC(=O)N1 Amb19516997 [0,1,0,1,0,0|2,0,0]=4 9497 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,1,0,1,0,0|1,0,0]=3 9498 B8R1.51 CC1(C)CSC(=O)O1 Amb24357776 [0,1,0,1,0,0|1,0,0]=3 9499 B8R1.51 CC1(C)NC(=O)CO1 Amb25254094 [0,1,0,1,0,0|2,0,0]=4 9500 B8R1.51 CC1(F)CNC(=O)C1 Amb24454478 [0,1,0,1,0,0|2,0,0]=4 9501 B8R1.51 CC1(N)COC(=O)C1 Amb25288591 [0,1,0,1,0,0|2,0,0]=4 9502 B8R1.51 CC1(O)CC(=O)CC1 Amb25129578 [0,1,0,1,0,0|1,0,0]=3 9503 B8R1.51 CC1(O)CC(N)CC1 Amb24483255 [0,1,0,1,0,0|1,0,1]=4 9504 B8R1.51 CC1(O)CCC(=O)N1 Amb24483013 [0,1,0,1,0,0|1,0,0]=3 9505 B8R1.51 CC1(O)CCC(=O)O1 Amb22338334 [0,1,0,1,0,0|0,0,0]=2 9506 B8R1.51 CC1CCS(=O)(=O)C1 Amb2548451 [0,1,0,1,0,0|1,0,1]=4 9507 B8R1.51 CC1CCS(=O)(=O)N1 Amb24556783 [0,1,0,1,0,0|1,0,1]=4 9508 B8R1.51 CC1COS(=O)(=O)O1 Amb17772236 [0,1,0,1,0,0|2,0,0]=4 9509 B8R1.51 CP1(=O)CC(=O)CC1 Amb25231314 [0,1,0,1,0,0|2,0,0]=4 9510 B8R1.51 CP1(=O)CCC(=O)O1 Amb22228817 [0,1,0,1,0,0|1,0,0]=3 9511 B8R1.51 CP1(=S)CC(=O)CC1 Amb24388618 [0,1,0,1,0,0|2,0,0]=4 9512 B8R1.51 C[C@@H]1COS(=O)(=O)O1 Amb22736783 [0,1,0,1,0,0|2,0,0]=4 9513 B8R1.51 C[C@@]1(O)CNC(=O)C1 Amb24672065 [0,1,0,1,0,0|2,0,0]=4 9514 B8R1.51 C[N+]1(C)CC(=O)CC1 Amb25735729 [0,1,0,1,0,0|2,0,0]=4 9515 B8R1.51 ClC1CCS(=O)(=O)C1 Amb2505054 [0,1,0,1,0,0|1,0,1]=4 9516 B8R1.51 NC1CCS(=O)(=O)C1 Amb1080886 [0,1,0,1,0,0|1,0,1]=4 9517 B8R1.51 NC1CCS(=O)(=O)C1 Amb1152771 [0,1,0,1,0,0|1,0,1]=4 9518 B8R1.51 NC1CC[S+]([O-])(=O)C1 Amb17726901 [0,1,0,1,0,0|1,0,1]=4 9519 B8R1.51 NC1CP(O)(=O)CC1 Amb25231215 [0,1,0,1,0,0|1,0,0]=3 9520 B8R1.51 NC1CS(=O)(=O)CC1 Amb22345691 [0,1,0,1,0,0|1,0,1]=4 9521 B8R1.51 N[C@@H]1CS(=O)(=O)CC1 Amb24563288 [0,1,0,1,0,0|1,0,1]=4 9522 B8R1.51 O=C1CC(F)(F)CC1 Amb21963547 [0,1,0,1,0,0|2,0,0]=4 9523 B8R1.51 O=C1CCC(O1)([2H])[2H] Amb17610398 [0,1,0,1,0,0|1,0,0]=3 9524 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,1,0,1,0,0|2,0,0]=4 9525 B8R1.51 O=C1COC(O1)(C)C Amb10601611 [0,1,0,1,0,0|1,0,0]=3 9526 B8R1.51 O=C1NCC(O1)(C)C Amb16202554 [0,1,0,1,0,0|1,0,0]=3 9527 B8R1.51 O=C1OCC(F)(F)O1 Amb24332045 [0,1,0,1,0,0|2,0,0]=4 9528 B8R1.51 O=S1(=O)CC(I)CC1 Amb19517046 [0,1,0,1,0,0|1,0,1]=4 9529 B8R1.51 O=S1(=O)CC([S-])CC1 Amb18526895 [0,1,0,1,0,0|1,0,1]=4 9530 B8R1.51 OC1=N[N+](CC1)(C)C Amb10777461 [0,1,0,1,0,0|2,0,0]=4 9531 B8R1.51 OC1CCS(=O)(=O)C1 Amb1068281 [0,1,0,1,0,0|1,0,1]=4 9532 B8R1.51 OC1CC[S+](=O)(C1)[O-] Amb10236942 [0,1,0,1,0,0|1,0,1]=4 9533 B8R1.51 O[C@@H]1CS(=O)(=O)CC1 Amb25837922 [0,1,0,1,0,0|1,0,1]=4 9534 B8R1.51 [18OH]C1CCS(=O)(=O)C1 Amb2548438 [0,1,0,1,0,0|1,0,1]=4 9535 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb2459236 [0,1,0,1,0,0|1,0,1]=4 9536 B8R1.62 CC1(CCl)CC(=O)O1 Amb25784185 [0,1,0,1,0,0|1,0,0]=3 9537 B8R1.62 CC1(CO)CC(=O)C1 Amb22406263 [0,1,0,1,0,0|2,0,0]=4 9538 B8R1.62 CC1(CS)CC(=O)N1 Amb25771053 [0,1,0,1,0,0|2,0,0]=4 9539 B8R1.62 CCC1(C)CC(=O)N1 Amb24443895 [0,1,0,1,0,0|1,0,0]=3 9540 B8R1.62 CC[C@@]1(C)CC(=O)N1 Amb25766440 [0,1,0,1,0,0|1,0,0]=3 9541 B8R1.62 COC1(C)CC(=O)C1 Amb24686485 [0,1,0,1,0,0|2,0,0]=4 9542 B8R1.67 CC(=O)C1C(C)C1C Amb24722893 [0,1,0,1,0,0|1,0,0]=3 9543 B8R1.67 CC(=O)[C@@H]1[C@@H](C)C1=C Amb24634605 [0,1,0,1,0,0|1,0,1]=4 9544 B8R1.67 CC(=O)[C@H]1[C@H](C)C1=C Amb25336490 [0,1,0,1,0,0|1,0,1]=4 9545 B8R1.67 CC(O)C1C(C)C1C Amb25199981 [0,1,0,1,0,0|1,0,1]=4 9546 B8R1.67 CC1C(C1C)C(N)=O Amb24627878 [0,1,0,1,0,0|1,0,0]=3 9547 B8R1.67 CC1C(C1C)C(O)=O Amb25314641 [0,1,0,1,0,0|0,0,0]=2 9548 B8R1.67 CC1C(Cl)C1C(C)=O Amb25122776 [0,1,0,1,0,0|1,0,0]=3 9549 B8R1.67 CC1C(N)C1C(O)=O Amb25764435 [0,1,0,1,0,0|0,0,0]=2 9550 B8R1.67 CC=1C(C(O)=O)C1C Amb25737086 [0,1,0,1,0,0|0,0,2]=4 9551 B8R1.67 CC=1C(C)C1C(O)=O Amb24586301 [0,1,0,1,0,0|0,0,2]=4 9552 B8R1.67 CC=1[C@H](C)C1C(O)=O Amb24445514 [0,1,0,1,0,0|0,0,2]=4 9553 B8R1.67 C[C@@H]1[C@@H](Br)[C@H]1C(C)=O Amb24654990 [0,1,0,1,0,0|1,0,0]=3 9554 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(N)=O Amb24332855 [0,1,0,1,0,0|1,0,0]=3 9555 B8R1.67 C[C@@H]1[C@H]([C@@H]1C)C(O)=O Amb25378219 [0,1,0,1,0,0|0,0,0]=2 9556 B8R1.67 C[C@H]1C([C@@H]1C)C(O)=O Amb25811791 [0,1,0,1,0,0|0,0,0]=2 9557 B8R1.67 C[C@H]1[C@@H](Br)[C@@H]1C(C)=O Amb25216918 [0,1,0,1,0,0|1,0,0]=3 9558 B8R1.67 C[C@H]1[C@@H](Cl)[C@@H]1C(C)=O Amb25179034 [0,1,0,1,0,0|1,0,0]=3 9559 B8R1.67 C[C@H]1[C@H](Br)[C@@H]1C(C)=O Amb25300342 [0,1,0,1,0,0|1,0,0]=3 9560 B8R1.67 C[C@H]1[C@H](N)[C@@H]1C(O)=O Amb24698691 [0,1,0,1,0,0|0,0,0]=2 9561 B8R1.83 CC(NO)C1CC1C Amb24383458 [0,1,0,1,0,0|1,0,1]=4 9562 B8R1.83 CC1CC1C(=N)NC Amb25831689 [0,1,0,1,0,0|2,0,0]=4 9563 B8R1.83 CC1CC1C(=N)OC Amb24705967 [0,1,0,1,0,0|1,0,0]=3 9564 B8R1.83 CC1CC1C(=O)C=C Amb25173576 [0,1,0,1,0,0|1,0,0]=3 9565 B8R1.83 CC1CC1C(=O)CBr Amb24526945 [0,1,0,1,0,0|1,0,0]=3 9566 B8R1.83 CC1CC1C(=O)CCl Amb24104125 [0,1,0,1,0,0|1,0,0]=3 9567 B8R1.83 CC1CC1C(=O)CN Amb24524253 [0,1,0,1,0,0|1,0,0]=3 9568 B8R1.83 CC1CC1C(=O)NN Amb1130542 [0,1,0,1,0,0|1,0,0]=3 9569 B8R1.83 CC1CC1C(C)=NN Amb25701135 [0,1,0,1,0,0|2,0,0]=4 9570 B8R1.83 CC1CC1C(C)=NO Amb25697279 [0,1,0,1,0,0|1,0,0]=3 9571 B8R1.83 CC1CC1C(N)=NN Amb24672641 [0,1,0,1,0,0|2,0,0]=4 9572 B8R1.83 CC1CC1C(N)=NO Amb25186813 [0,1,0,1,0,0|1,0,0]=3 9573 B8R1.83 CC1CC1C(O)C#C Amb25084872 [0,1,0,1,0,0|1,0,1]=4 9574 B8R1.83 CC1CC1C(O)C#N Amb25087929 [0,1,0,1,0,0|1,0,1]=4 9575 B8R1.83 CC1OC1C(=O)NC Amb25204387 [0,1,0,1,0,0|2,0,0]=4 9576 B8R1.83 CC1OC1C(=O)OC Amb22055865 [0,1,0,1,0,0|1,0,0]=3 9577 B8R1.83 CC1OC1C(O)CC Amb25296412 [0,1,0,1,0,0|1,0,1]=4 9578 B8R1.83 CCC(=O)[C@@H]1C[C@@H]1Cl Amb24602103 [0,1,0,1,0,0|2,0,0]=4 9579 B8R1.83 COC(=O)C1CC1F Amb25373911 [0,1,0,1,0,0|1,0,0]=3 9580 B8R1.83 COC(=O)C1CC1O Amb25328067 [0,1,0,1,0,0|1,0,0]=3 9581 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Br Amb25242493 [0,1,0,1,0,0|1,0,0]=3 9582 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Cl Amb24519340 [0,1,0,1,0,0|1,0,0]=3 9583 B8R1.83 COC(=O)[C@@H]1C[C@H]1Cl Amb24610039 [0,1,0,1,0,0|1,0,0]=3 9584 B8R1.83 COC(=O)[C@H]1C[C@@H]1Cl Amb24519701 [0,1,0,1,0,0|1,0,0]=3 9585 B8R1.83 COC(=O)[C@H]1C[C@@H]1N Amb24629188 [0,1,0,1,0,0|1,0,0]=3 9586 B8R1.83 C[C@@H]1C[C@H]1C(=C)CO Amb24515469 [0,1,0,1,0,0|1,0,0]=3 9587 B8R1.83 C[C@@H]1C[C@H]1C(O)C#N Amb25307554 [0,1,0,1,0,0|1,0,1]=4 9588 B8R1.83 C[C@@H]1N[C@H]1C(=O)OC Amb24120620 [0,1,0,1,0,0|1,0,0]=3 9589 B8R1.83 C[C@H]1C[C@@H]1C(=O)CC Amb25272348 [0,1,0,1,0,0|1,0,0]=3 9590 B8R1.83 C[C@H]1C[C@@H]1C(=O)NO Amb25358413 [0,1,0,1,0,0|0,0,0]=2 9591 B8R1.83 C[C@H]1C[C@H]1C(=C)CO Amb25266793 [0,1,0,1,0,0|1,0,0]=3 9592 B8R1.83 C[C@H]1C[C@H]1[C@@H](O)CC Amb25285604 [0,1,0,1,0,0|1,0,1]=4 9593 B8R1.2 BrC=C1CCCCC1 Amb22337534 [0,1,0,1,0,0|2,0,0]=4 9594 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,1,0,1,0,0|1,0,1]=4 9595 B8R1.2 BrCC=1CCCCC1 Amb23439167 [0,1,0,1,0,0|2,0,0]=4 9596 B8R1.2 C#CC1=CCCCC1 Amb1102053 [0,1,0,1,0,0|2,0,0]=4 9597 B8R1.2 C#CC1CCCCO1 Amb17673286 [0,1,0,1,0,0|1,0,1]=4 9598 B8R1.2 C1CCOC=C1C=O Amb2433566 [0,1,0,1,0,0|2,0,0]=4 9599 B8R1.2 C1OCCC=C1C=O Amb1102766 [0,1,0,1,0,0|2,0,0]=4 9600 B8R1.2 C=CC=1CCCCC1 Amb24387238 [0,1,0,1,0,0|2,0,0]=4 9601 B8R1.2 CCC=1CCCCC1 Amb25337001 [0,1,0,1,0,0|2,0,0]=4 9602 B8R1.2 CCC=1CCCCN1 Amb24481485 [0,1,0,1,0,0|2,0,0]=4 9603 B8R1.2 CNC=1CCCCN1 Amb23570622 [0,1,0,1,0,0|2,0,0]=4 9604 B8R1.2 CN[C@@H]1CCCCO1 Amb24606835 [0,1,0,1,0,0|1,0,1]=4 9605 B8R1.2 CN[C@H]1CCCCO1 Amb24634478 [0,1,0,1,0,0|1,0,1]=4 9606 B8R1.2 COC1=CCCCC1 Amb10601667 [0,1,0,1,0,0|1,0,0]=3 9607 B8R1.2 COC1CCCCN1 Amb24384593 [0,1,0,1,0,0|1,0,1]=4 9608 B8R1.2 COC1CCCCO1 Amb21955138 [0,1,0,1,0,0|0,0,2]=4 9609 B8R1.2 COC=1CCOCC1 Amb21927983 [0,1,0,1,0,0|2,0,0]=4 9610 B8R1.2 COC=1COCCN1 Amb25304653 [0,1,0,1,0,0|2,0,0]=4 9611 B8R1.2 CSC1CCCCO1 Amb24649762 [0,1,0,1,0,0|0,1,1]=4 9612 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,1,0,1,0,0|1,0,1]=4 9613 B8R1.2 ClCC=1CCCCC1 Amb25173836 [0,1,0,1,0,0|2,0,0]=4 9614 B8R1.2 ClC[C@@H]1CCCCO1 Amb24596063 [0,1,0,1,0,0|1,0,1]=4 9615 B8R1.2 ClN=C1CCCCC1 Amb25069376 [0,1,0,1,0,0|2,0,0]=4 9616 B8R1.2 ICC1CCCCO1 Amb24060887 [0,1,0,1,0,0|1,0,1]=4 9617 B8R1.2 NCC1=CCCCC1 Amb10607847 [0,1,0,1,0,0|2,0,0]=4 9618 B8R1.2 NCC1CCCCO1 Amb19372867 [0,1,0,1,0,0|1,0,1]=4 9619 B8R1.2 NCC=1CCCCC1 Amb22587029 [0,1,0,1,0,0|2,0,0]=4 9620 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,1,0,1,0,0|1,0,1]=4 9621 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,1,0,1,0,0|1,0,1]=4 9622 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,1,0,1,0,0|1,0,1]=4 9623 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,1,0,1,0,0|1,0,1]=4 9624 B8R1.2 NNC1CCCCO1 Amb25322400 [0,1,0,1,0,0|1,0,1]=4 9625 B8R1.2 NNC=1CCCCN1 Amb24119302 [0,1,0,1,0,0|2,0,0]=4 9626 B8R1.2 NOC1CCCCC1 Amb18641839 [0,1,0,1,0,0|1,0,1]=4 9627 B8R1.2 NOC1CCCCO1 Amb10975936 [0,1,0,1,0,0|0,0,2]=4 9628 B8R1.2 O=C=C1CCCCC1 Amb24745297 [0,1,0,1,0,0|1,0,0]=3 9629 B8R1.2 O=CC1=CCCCO1 Amb18641688 [0,1,0,1,0,0|0,0,1]=3 9630 B8R1.2 O=CC1CCCCN1 Amb20242687 [0,1,0,1,0,0|1,0,1]=4 9631 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,1,0,1,0,0|0,1,1]=4 9632 B8R1.2 O=CC1CSCCO1 Amb25328255 [0,1,0,1,0,0|1,0,1]=4 9633 B8R1.2 O=CC1OCCCO1 Amb25756192 [0,1,0,1,0,0|1,0,1]=4 9634 B8R1.2 O=CC=1CCCNC1 Amb25326735 [0,1,0,1,0,0|2,0,0]=4 9635 B8R1.2 O=CC=1CCNCC1 Amb24630224 [0,1,0,1,0,0|2,0,0]=4 9636 B8R1.2 O=CC=1CCOCC1 Amb18641683 [0,1,0,1,0,0|2,0,0]=4 9637 B8R1.2 O=CC=1CSCCC1 Amb18642670 [0,1,0,1,0,0|2,0,0]=4 9638 B8R1.2 O=CN1CCCCO1 Amb24332705 [0,1,0,1,0,0|1,0,0]=3 9639 B8R1.2 O=C[C@@H]1CCCCO1 Amb25731797 [0,1,0,1,0,0|0,0,1]=3 9640 B8R1.2 O=C[C@@H]1CCOCO1 Amb25839349 [0,1,0,1,0,0|1,0,1]=4 9641 B8R1.2 O=C[C@H]1CCCCO1 Amb25811086 [0,1,0,1,0,0|0,0,1]=3 9642 B8R1.2 O=NN1CCCCC1 Amb10604043 [0,1,0,1,0,0|2,0,0]=4 9643 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,1,0,1,0,0|0,0,2]=4 9644 B8R1.2 OCC1CCCCN1 Amb1803268 [0,1,0,1,0,0|1,0,1]=4 9645 B8R1.2 OCC1CCCCS1 Amb20669084 [0,1,0,1,0,0|0,1,1]=4 9646 B8R1.2 OCC=1CCCCC1 Amb24122911 [0,1,0,1,0,0|1,0,0]=3 9647 B8R1.2 OCC=1CCCOC1 Amb24426430 [0,1,0,1,0,0|2,0,0]=4 9648 B8R1.2 OCC=1CCCON1 Amb25675358 [0,1,0,1,0,0|2,0,0]=4 9649 B8R1.2 OCC=1CCNCC1 Amb24105368 [0,1,0,1,0,0|2,0,0]=4 9650 B8R1.2 OCC=1CNCCC1 Amb25189014 [0,1,0,1,0,0|2,0,0]=4 9651 B8R1.2 OCC=1COCCC1 Amb24329074 [0,1,0,1,0,0|2,0,0]=4 9652 B8R1.2 OC[C@@H]1CCCCN1 Amb13886314 [0,1,0,1,0,0|1,0,1]=4 9653 B8R1.2 OC[C@@H]1CCCCN1 Amb22504549 [0,1,0,1,0,0|1,0,1]=4 9654 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,1,0,1,0,0|0,0,2]=4 9655 B8R1.2 OC[C@H]1CCCCN1 Amb13886286 [0,1,0,1,0,0|1,0,1]=4 9656 B8R1.2 OC[C@H]1CCCCN1 Amb22504550 [0,1,0,1,0,0|1,0,1]=4 9657 B8R1.2 ON=C1CCNCC1 Amb16226328 [0,1,0,1,0,0|2,0,0]=4 9658 B8R1.2 ON=C1CCSCC1 Amb2445012 [0,1,0,1,0,0|2,0,0]=4 9659 B8R1.2 ON=C1CNCCC1 Amb24612155 [0,1,0,1,0,0|2,0,0]=4 9660 B8R1.2 ON=C1CNCCS1 Amb25229322 [0,1,0,1,0,0|1,1,0]=4 9661 B8R1.2 ON=C1COCCC1 Amb24745113 [0,1,0,1,0,0|2,0,0]=4 9662 B8R1.2 ON=C1CSCCC1 Amb25132339 [0,1,0,1,0,0|2,0,0]=4 9663 B8R1.2 ONC1CCCCC1 Amb22233686 [0,1,0,1,0,0|1,0,1]=4 9664 B8R1.2 O\N=C\1/CNCCC1 Amb25209821 [0,1,0,1,0,0|2,0,0]=4 9665 B8R1.2 SCC1CCCCO1 Amb23585661 [0,1,0,1,0,0|0,1,1]=4 9666 B8R1.2 [2H]OC1CCCCC1 Amb22354031 [0,1,0,1,0,0|1,0,1]=4 9667 B8R1.2 [C-]#[N+]C1=CCCCC1 Amb10603087 [0,1,0,1,0,0|2,0,0]=4 9668 B8R1.2 [C-]#[N+]C1CCCCO1 Amb25252978 [0,1,0,1,0,0|1,0,1]=4 9669 B8R1.2 [N-]=[N+]=C1CCCCC1 Amb25785673 [0,1,0,1,0,0|2,0,0]=4 9670 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,1,0,1,0,0|1,0,1]=4 9671 B8R1.3 C=C1CCC(Br)CC1 Amb25320915 [0,1,0,1,0,0|2,0,0]=4 9672 B8R1.3 C=C1CCC(N)CC1 Amb23599023 [0,1,0,1,0,0|2,0,0]=4 9673 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,1,0,1,0,0|1,0,1]=4 9674 B8R1.3 CC1CCC(=C)CC1 Amb24058250 [0,1,0,1,0,0|2,0,0]=4 9675 B8R1.3 CC1CCC(=O)C=C1 Amb24556470 [0,1,0,1,0,0|1,0,0]=3 9676 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,1,0,1,0,0|0,0,0]=2 9677 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,1,0,1,0,0|0,1,0]=3 9678 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,1,0,1,0,0|1,0,0]=3 9679 B8R1.3 CC1CCC(Br)CO1 Amb25808117 [0,1,0,1,0,0|1,0,1]=4 9680 B8R1.3 CC1CCC(Cl)CO1 Amb25774457 [0,1,0,1,0,0|1,0,1]=4 9681 B8R1.3 CC1CCC(O)CN1 Amb18641838 [0,1,0,1,0,0|1,0,1]=4 9682 B8R1.3 CC1CCC(O)CS1 Amb23568601 [0,1,0,1,0,0|0,1,1]=4 9683 B8R1.3 CC1CCN(O)CC1 Amb25188076 [0,1,0,1,0,0|2,0,0]=4 9684 B8R1.3 CC1CNC(=N)CC1 Amb25680063 [0,1,0,1,0,0|2,0,0]=4 9685 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,1,0,1,0,0|2,0,0]=4 9686 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,1,0,1,0,0|1,0,0]=3 9687 B8R1.3 CC1CNC(O)=NC1 Amb25268854 [0,1,0,1,0,0|2,0,0]=4 9688 B8R1.3 CC1COC(=O)OC1 Amb21856480 [0,1,0,1,0,0|1,0,0]=3 9689 B8R1.3 CC1SCC(=O)CS1 Amb25086708 [0,1,0,1,0,0|1,1,0]=4 9690 B8R1.3 CC=1CCC(=O)NC1 Amb25078192 [0,1,0,1,0,0|1,0,1]=4 9691 B8R1.3 CC=1CCC(O)CN1 Amb25700893 [0,1,0,1,0,0|2,0,0]=4 9692 B8R1.3 CC=1CC[C@@H](O)CC1 Amb25796430 [0,1,0,1,0,0|2,0,0]=4 9693 B8R1.3 CN1CCC(=O)C=C1 Amb17593148 [0,1,0,1,0,0|2,0,0]=4 9694 B8R1.3 CP1CCC(=O)CC1 Amb25767035 [0,1,0,1,0,0|2,0,0]=4 9695 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,1,0,1,0,0|1,0,0]=3 9696 B8R1.3 C[C@@H]1CCC(O)C=C1 Amb24362861 [0,1,0,1,0,0|1,0,1]=4 9697 B8R1.3 C[C@@H]1CC[C@@H](CC1)O Amb10844735 [0,1,0,1,0,0|1,0,1]=4 9698 B8R1.3 C[C@@H]1CC[C@@H](O)C=C1 Amb25225606 [0,1,0,1,0,0|1,0,1]=4 9699 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb22886214 [0,1,0,1,0,0|1,0,1]=4 9700 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb25175824 [0,1,0,1,0,0|1,0,1]=4 9701 B8R1.3 C[C@@H]1CC[C@@H](O)CO1 Amb25176515 [0,1,0,1,0,0|0,0,2]=4 9702 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb22886213 [0,1,0,1,0,0|1,0,1]=4 9703 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,1,0,1,0,0|2,0,0]=4 9704 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,1,0,1,0,0|2,0,0]=4 9705 B8R1.3 C[C@H]1CCC(=O)CO1 Amb25262664 [0,1,0,1,0,0|0,0,0]=2 9706 B8R1.3 C[C@H]1CC[C@H](O)C=C1 Amb25317220 [0,1,0,1,0,0|1,0,1]=4 9707 B8R1.3 C[C@H]1CC[C@H](O)CN1 Amb24575263 [0,1,0,1,0,0|1,0,1]=4 9708 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,1,0,1,0,0|2,0,0]=4 9709 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,1,0,1,0,0|2,0,0]=4 9710 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,1,0,1,0,0|1,0,0]=3 9711 B8R1.3 C[NH+]1CCC(=O)CC1 Amb10552693 [0,1,0,1,0,0|2,0,0]=4 9712 B8R1.3 ClC1CC=C(Cl)CC1 Amb25210464 [0,1,0,1,0,0|2,0,0]=4 9713 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,1,0,1,0,0|1,0,0]=3 9714 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,1,0,1,0,0|1,0,0]=3 9715 B8R1.3 NC1CCC(=O)CC1 Amb22831860 [0,1,0,1,0,0|1,0,0]=3 9716 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,1,0,1,0,0|1,0,0]=3 9717 B8R1.3 NC1CCC(=O)NN1 Amb24456868 [0,1,0,1,0,0|2,0,0]=4 9718 B8R1.3 NC1CCN(O)CC1 Amb24546360 [0,1,0,1,0,0|2,0,0]=4 9719 B8R1.3 NC1CCS(=O)CC1 Amb18943776 [0,1,0,1,0,0|2,0,0]=4 9720 B8R1.3 NC1CCS(=O)CC1 Amb21988665 [0,1,0,1,0,0|2,0,0]=4 9721 B8R1.3 NC1CNC(=O)CC1 Amb18833034 [0,1,0,1,0,0|1,0,0]=3 9722 B8R1.3 NC1CNC(O)=NC1 Amb25232194 [0,1,0,1,0,0|2,0,0]=4 9723 B8R1.3 NC1COS(=O)OC1 Amb24564500 [0,1,0,1,0,0|2,0,0]=4 9724 B8R1.3 N[C@@H]1CC[C@@H](CC1)O Amb10071293 [0,1,0,1,0,0|1,0,1]=4 9725 B8R1.3 N[C@@H]1CNC(=O)CC1 Amb22748949 [0,1,0,1,0,0|1,0,0]=3 9726 B8R1.3 O=C1CCC(=O)CN1 Amb15692796 [0,1,0,1,0,0|1,0,1]=4 9727 B8R1.3 O=C1CCC(Br)C=C1 Amb24483190 [0,1,0,1,0,0|1,0,1]=4 9728 B8R1.3 O=C1CCC(Cl)NN1 Amb24749762 [0,1,0,1,0,0|2,0,0]=4 9729 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,1,0,1,0,0|1,0,0]=3 9730 B8R1.3 O=C1CCC(I)CN1 Amb25341317 [0,1,0,1,0,0|1,0,0]=3 9731 B8R1.3 O=C1CNC(=O)CC1 Amb22491034 [0,1,0,1,0,0|1,0,1]=4 9732 B8R1.3 O=C1CNC(=O)OC1 Amb24481365 [0,1,0,1,0,0|1,0,1]=4 9733 B8R1.3 O=C1NCC(Br)CN1 Amb24749834 [0,1,0,1,0,0|2,0,0]=4 9734 B8R1.3 O=S1CCC(Cl)CC1 Amb21988466 [0,1,0,1,0,0|2,0,0]=4 9735 B8R1.3 OC1CC=C(Br)CC1 Amb24353589 [0,1,0,1,0,0|2,0,0]=4 9736 B8R1.3 OC1CCC(=O)NC1 Amb10066907 [0,1,0,1,0,0|1,0,0]=3 9737 B8R1.3 OC1CCC(Br)CC1 Amb24117124 [0,1,0,1,0,0|1,0,1]=4 9738 B8R1.3 OC1CCC(F)CC1 Amb25698698 [0,1,0,1,0,0|1,0,1]=4 9739 B8R1.3 OC1CCN(O)CC1 Amb25092093 [0,1,0,1,0,0|2,0,0]=4 9740 B8R1.3 OC1CCS(=O)CC1 Amb21988465 [0,1,0,1,0,0|2,0,0]=4 9741 B8R1.3 OC1CNC(=O)NC1 Amb19516674 [0,1,0,1,0,0|2,0,0]=4 9742 B8R1.3 OC1CNC(O)=NC1 Amb20001781 [0,1,0,1,0,0|2,0,0]=4 9743 B8R1.3 O[C@@H]1CC[C@@H](O)CC1 Amb22750651 [0,1,0,1,0,0|1,0,1]=4 9744 B8R1.3 O[C@@H]1CC[C@@H](S)CC1 Amb23400868 [0,1,0,1,0,0|1,0,1]=4 9745 B8R1.3 O[C@@H]1CC[C@H](Br)CC1 Amb24448359 [0,1,0,1,0,0|1,0,1]=4 9746 B8R1.3 O[C@@H]1CC[C@H](Cl)CC1 Amb25708530 [0,1,0,1,0,0|1,0,1]=4 9747 B8R1.3 O[C@@H]1CC[C@H](F)CC1 Amb25341995 [0,1,0,1,0,0|1,0,1]=4 9748 B8R1.3 O[C@@H]1CO[C@@H](O)CC1 Amb25219273 [0,1,0,1,0,0|0,0,2]=4 9749 B8R1.3 O[C@@H]1CS[C@@H](O)CC1 Amb24576460 [0,1,0,1,0,0|0,1,1]=4 9750 B8R1.3 O[C@@H]1CS[C@H](O)CC1 Amb25747081 [0,1,0,1,0,0|0,1,1]=4 9751 B8R1.3 O[C@H]1CCC(=O)C=C1 Amb25707492 [0,1,0,1,0,0|1,0,1]=4 9752 B8R1.5 BrC1=CCCCC1O Amb17594500 [0,1,0,1,0,0|1,0,1]=4 9753 B8R1.5 BrC1CCCC=C1Br Amb25255682 [0,1,0,1,0,0|2,0,0]=4 9754 B8R1.5 BrC1CCCOC1Br Amb17940346 [0,1,0,1,0,0|1,0,1]=4 9755 B8R1.5 Br[C@@H]1CCCCC1=O Amb16234120 [0,1,0,1,0,0|1,0,0]=3 9756 B8R1.5 C=C1CCCCC1=O Amb18561347 [0,1,0,1,0,0|1,0,0]=3 9757 B8R1.5 C=C1CCCCC1Br Amb24483250 [0,1,0,1,0,0|2,0,0]=4 9758 B8R1.5 C=C1CCCC[C@@H]1Br Amb24552422 [0,1,0,1,0,0|2,0,0]=4 9759 B8R1.5 C=C1CCCC[C@@H]1O Amb25220251 [0,1,0,1,0,0|1,0,0]=3 9760 B8R1.5 C=C1CCOCC1O Amb24363585 [0,1,0,1,0,0|2,0,0]=4 9761 B8R1.5 C=C1COCCC1=O Amb18063600 [0,1,0,1,0,0|2,0,0]=4 9762 B8R1.5 CC1=CCCCC1N Amb18641661 [0,1,0,1,0,0|2,0,0]=4 9763 B8R1.5 CC1=CCCCC1O Amb22365276 [0,1,0,1,0,0|1,0,1]=4 9764 B8R1.5 CC1=CCCC[C@H]1Br Amb24470173 [0,1,0,1,0,0|2,0,0]=4 9765 B8R1.5 CC1=CCCC[C@H]1N Amb25339311 [0,1,0,1,0,0|2,0,0]=4 9766 B8R1.5 CC1=CCCC[C@H]1O Amb25699989 [0,1,0,1,0,0|1,0,1]=4 9767 B8R1.5 CC1=[N+](C)CCCC1 Amb10552885 [0,1,0,1,0,0|2,0,0]=4 9768 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,1,0,1,0,0|1,0,1]=4 9769 B8R1.5 CC1CCCC=C1C Amb22489910 [0,1,0,1,0,0|2,0,0]=4 9770 B8R1.5 CC1CCCC=C1N Amb24647647 [0,1,0,1,0,0|2,0,0]=4 9771 B8R1.5 CC1CCCCC1=C Amb25203919 [0,1,0,1,0,0|2,0,0]=4 9772 B8R1.5 CC1CCCCC1O Amb24061297 [0,1,0,1,0,0|1,0,1]=4 9773 B8R1.5 CC1CCCNC1=S Amb25104722 [0,1,0,1,0,0|1,1,0]=4 9774 B8R1.5 CC1CCNNC1=O Amb25169591 [0,1,0,1,0,0|2,0,0]=4 9775 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,1,0,0|2,0,0]=4 9776 B8R1.5 CC1CNCCC1=O Amb19888361 [0,1,0,1,0,0|2,0,0]=4 9777 B8R1.5 CC1CNCCC1=O Amb22490481 [0,1,0,1,0,0|2,0,0]=4 9778 B8R1.5 CC1COCCC1=O Amb21856147 [0,1,0,1,0,0|2,0,0]=4 9779 B8R1.5 CC1NCCNC1=O Amb2189174 [0,1,0,1,0,0|2,0,0]=4 9780 B8R1.5 CC1OCCCC1Br Amb22500038 [0,1,0,1,0,0|1,0,1]=4 9781 B8R1.5 CC1OCCCC1Cl Amb25772379 [0,1,0,1,0,0|1,0,1]=4 9782 B8R1.5 CC1OCCCC1N Amb18833013 [0,1,0,1,0,0|1,0,1]=4 9783 B8R1.5 CC1OCCNC1=O Amb19517095 [0,1,0,1,0,0|2,0,0]=4 9784 B8R1.5 CC1SCCOC1=O Amb25255546 [0,1,0,1,0,0|1,0,0]=3 9785 B8R1.5 CC=1CCCC[N+]1[O-] Amb25340684 [0,1,0,1,0,0|1,0,1]=4 9786 B8R1.5 CN1CCCCC1=O Amb10573526 [0,1,0,1,0,0|1,0,0]=3 9787 B8R1.5 CN1CCCCC1=S Amb24712596 [0,1,0,1,0,0|1,1,0]=4 9788 B8R1.5 CN1CCNCC1=O Amb21955857 [0,1,0,1,0,0|2,0,0]=4 9789 B8R1.5 CN1CCOCC1=O Amb22301593 [0,1,0,1,0,0|2,0,0]=4 9790 B8R1.5 CN1NCCCC1=O Amb18559232 [0,1,0,1,0,0|2,0,0]=4 9791 B8R1.5 C[C@@H]1CCCCC1=O Amb25693013 [0,1,0,1,0,0|1,0,0]=3 9792 B8R1.5 C[C@@H]1CCCCC1O Amb25135464 [0,1,0,1,0,0|1,0,1]=4 9793 B8R1.5 C[C@@H]1CCCC[C@@H]1O Amb22801473 [0,1,0,1,0,0|1,0,1]=4 9794 B8R1.5 C[C@@H]1CCCNC1=O Amb25694356 [0,1,0,1,0,0|1,0,0]=3 9795 B8R1.5 C[C@@H]1NCCNC1=O Amb18203363 [0,1,0,1,0,0|2,0,0]=4 9796 B8R1.5 C[C@@H]1OCCC[C@@H]1Br Amb25336533 [0,1,0,1,0,0|1,0,1]=4 9797 B8R1.5 C[C@@H]1OCCC[C@@H]1Cl Amb24625287 [0,1,0,1,0,0|1,0,1]=4 9798 B8R1.5 C[C@@H]1OCCC[C@@H]1O Amb24618653 [0,1,0,1,0,0|1,0,1]=4 9799 B8R1.5 C[C@@H]1OCCC[C@H]1O Amb25176726 [0,1,0,1,0,0|1,0,1]=4 9800 B8R1.5 C[C@@H]1OCCNC1=O Amb24465112 [0,1,0,1,0,0|2,0,0]=4 9801 B8R1.5 C[C@H]1CCCC[C@@H]1O Amb10842239 [0,1,0,1,0,0|1,0,1]=4 9802 B8R1.5 C[C@H]1NCCNC1=O Amb22336965 [0,1,0,1,0,0|2,0,0]=4 9803 B8R1.5 ClC1CCCC=C1Cl Amb24650431 [0,1,0,1,0,0|2,0,0]=4 9804 B8R1.5 ClC1CCCCC1=O Amb1154371 [0,1,0,1,0,0|1,0,0]=3 9805 B8R1.5 ClC1CCCOC1Cl Amb25101518 [0,1,0,1,0,0|1,0,1]=4 9806 B8R1.5 Cl[C@H]1CCCO[C@H]1Cl Amb24595340 [0,1,0,1,0,0|1,0,1]=4 9807 B8R1.5 FC1CCCCC1=O Amb10605769 [0,1,0,1,0,0|1,0,0]=3 9808 B8R1.5 FC1OCCCC1Br Amb25103571 [0,1,0,1,0,0|1,0,1]=4 9809 B8R1.5 FC1OCCCC1Cl Amb25376565 [0,1,0,1,0,0|1,0,1]=4 9810 B8R1.5 F[C@@H]1OCCC[C@H]1Cl Amb24654960 [0,1,0,1,0,0|1,0,1]=4 9811 B8R1.5 N=C1CCCCN1O Amb24524093 [0,1,0,1,0,0|1,0,0]=3 9812 B8R1.5 NC1=NCCCC1Br Amb24710039 [0,1,0,1,0,0|2,0,0]=4 9813 B8R1.5 NC1CCCC=C1Cl Amb18124341 [0,1,0,1,0,0|2,0,0]=4 9814 B8R1.5 NC1CCCCC1=O Amb17939051 [0,1,0,1,0,0|1,0,0]=3 9815 B8R1.5 NC1CCCCC1=O Amb22001819 [0,1,0,1,0,0|1,0,0]=3 9816 B8R1.5 NC1CCCCC1O Amb22228578 [0,1,0,1,0,0|1,0,1]=4 9817 B8R1.5 NC1CCCOB1O Amb24681060 [0,1,0,1,0,0|1,0,1]=4 9818 B8R1.5 NC1CCONC1=O Amb22295935 [0,1,0,1,0,0|2,0,0]=4 9819 B8R1.5 NC1COCCC1=O Amb18833021 [0,1,0,1,0,0|2,0,0]=4 9820 B8R1.5 NC=1CCCCC1N Amb24673835 [0,1,0,1,0,0|2,0,0]=4 9821 B8R1.5 NN1CCCCC1=O Amb13952152 [0,1,0,1,0,0|1,0,0]=3 9822 B8R1.5 NN1CCCCC1=O Amb22275946 [0,1,0,1,0,0|1,0,0]=3 9823 B8R1.5 NN1CCCNC1=O Amb25343173 [0,1,0,1,0,0|2,0,0]=4 9824 B8R1.5 N[C@@H]1CCCCC1=O Amb25727179 [0,1,0,1,0,0|1,0,0]=3 9825 B8R1.5 N[C@@H]1CCCCC1O Amb24401932 [0,1,0,1,0,0|1,0,1]=4 9826 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993806 [0,1,0,1,0,0|1,0,1]=4 9827 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993917 [0,1,0,1,0,0|1,0,1]=4 9828 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993805 [0,1,0,1,0,0|1,0,1]=4 9829 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993916 [0,1,0,1,0,0|1,0,1]=4 9830 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,1,0,1,0,0|1,0,0]=3 9831 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,1,0,1,0,0|1,0,0]=3 9832 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb19515805 [0,1,0,1,0,0|1,0,1]=4 9833 B8R1.5 N[C@H]1CCCC[C@H]1O Amb19516016 [0,1,0,1,0,0|1,0,1]=4 9834 B8R1.5 N[C@H]1CCCC[C@H]1O Amb20622436 [0,1,0,1,0,0|1,0,1]=4 9835 B8R1.5 O=C1C=CCCC1Cl Amb25700953 [0,1,0,1,0,0|1,0,1]=4 9836 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,1,0,1,0,0|1,0,1]=4 9837 B8R1.5 O=C1CCCC=C1C Amb15693479 [0,1,0,1,0,0|1,0,1]=4 9838 B8R1.5 O=C1CCCC=C1Cl Amb24524498 [0,1,0,1,0,0|1,0,1]=4 9839 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,1,0,1,0,0|1,0,1]=4 9840 B8R1.5 O=C1CCCCC1=O Amb1154131 [0,1,0,1,0,0|0,0,1]=3 9841 B8R1.5 O=C1CCCCC1S Amb25839265 [0,1,0,1,0,0|0,1,0]=3 9842 B8R1.5 O=C1CCCC[C@@H]1Br Amb24524273 [0,1,0,1,0,0|1,0,0]=3 9843 B8R1.5 O=C1CCCC[C@@H]1Cl Amb24483264 [0,1,0,1,0,0|1,0,0]=3 9844 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,1,0,1,0,0|1,0,0]=3 9845 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,1,0,1,0,0|0,0,1]=3 9846 B8R1.5 O=C1CCNCC1Br Amb20242103 [0,1,0,1,0,0|2,0,0]=4 9847 B8R1.5 O=C1CCNCC1Br Amb21520330 [0,1,0,1,0,0|2,0,0]=4 9848 B8R1.5 O=C1CCNCC1F Amb13885958 [0,1,0,1,0,0|2,0,0]=4 9849 B8R1.5 O=C1CCNCC1F Amb22002662 [0,1,0,1,0,0|2,0,0]=4 9850 B8R1.5 O=C1CCNC[C@@H]1F Amb24670514 [0,1,0,1,0,0|2,0,0]=4 9851 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,1,0,1,0,0|2,0,0]=4 9852 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,1,0,1,0,0|2,0,0]=4 9853 B8R1.5 O=C1CCOCC1F Amb19958536 [0,1,0,1,0,0|2,0,0]=4 9854 B8R1.5 O=C1CCOC[C@@H]1Cl Amb24723222 [0,1,0,1,0,0|2,0,0]=4 9855 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,1,0,1,0,0|2,0,0]=4 9856 B8R1.5 O=C1CCSCC1Br Amb22493812 [0,1,0,1,0,0|2,0,0]=4 9857 B8R1.5 O=C1CNCCN1C Amb1834069 [0,1,0,1,0,0|2,0,0]=4 9858 B8R1.5 O=C1COCCC1=O Amb25712943 [0,1,0,1,0,0|1,0,1]=4 9859 B8R1.5 O=C1COCCC1Br Amb24416092 [0,1,0,1,0,0|2,0,0]=4 9860 B8R1.5 O=C1NCCCC1=O Amb2445649 [0,1,0,1,0,0|1,0,1]=4 9861 B8R1.5 O=C1NCCCC1Br Amb20669047 [0,1,0,1,0,0|1,0,0]=3 9862 B8R1.5 O=C1NCCCC1Cl Amb24472253 [0,1,0,1,0,0|1,0,0]=3 9863 B8R1.5 O=C1NCCCC1F Amb13888988 [0,1,0,1,0,0|1,0,0]=3 9864 B8R1.5 O=C1NCCCC1I Amb24355271 [0,1,0,1,0,0|1,0,0]=3 9865 B8R1.5 O=C1NCCCC1N Amb1088746 [0,1,0,1,0,0|1,0,0]=3 9866 B8R1.5 O=C1NCCCC1O Amb10602315 [0,1,0,1,0,0|1,0,0]=3 9867 B8R1.5 O=C1NCCCN1C Amb10608416 [0,1,0,1,0,0|2,0,0]=4 9868 B8R1.5 O=C1NCCC[C@@H]1N Amb10603272 [0,1,0,1,0,0|1,0,0]=3 9869 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,1,0,1,0,0|0,0,0]=2 9870 B8R1.5 O=C1OCCCN1N Amb17608306 [0,1,0,1,0,0|1,0,0]=3 9871 B8R1.5 O=C1OCCNC1=O Amb24120265 [0,1,0,1,0,0|1,0,1]=4 9872 B8R1.5 O=C1SCCSC1Cl Amb25026142 [0,1,0,1,0,0|1,1,0]=4 9873 B8R1.5 O=S1CCCC[C@@H]1Cl Amb24415441 [0,1,0,1,0,0|1,0,1]=4 9874 B8R1.5 O=S1CCCC[C@H]1Br Amb25756741 [0,1,0,1,0,0|1,0,1]=4 9875 B8R1.5 OC1C=CCCC1=O Amb25346850 [0,1,0,1,0,0|0,0,2]=4 9876 B8R1.5 OC1CCCCC1Br Amb17594580 [0,1,0,1,0,0|1,0,1]=4 9877 B8R1.5 OC1CCCCC1I Amb10601565 [0,1,0,1,0,0|1,0,1]=4 9878 B8R1.5 OC1CCCCC1P Amb24524365 [0,1,0,1,0,0|1,0,1]=4 9879 B8R1.5 OC1CCCCN1O Amb24675112 [0,1,0,1,0,0|0,0,2]=4 9880 B8R1.5 OC1CCCOC1=O Amb19959000 [0,1,0,1,0,0|0,0,0]=2 9881 B8R1.5 OC1CNCCC1=O Amb24075970 [0,1,0,1,0,0|1,0,0]=3 9882 B8R1.5 OC1CNCNC1=O Amb25300748 [0,1,0,1,0,0|2,0,0]=4 9883 B8R1.5 OC1OCCCC1=O Amb24645841 [0,1,0,1,0,0|1,0,0]=3 9884 B8R1.5 OC1OCCCC1Br Amb24634011 [0,1,0,1,0,0|0,0,2]=4 9885 B8R1.5 OC1OCCC[C@H]1Br Amb24710193 [0,1,0,1,0,0|0,0,2]=4 9886 B8R1.5 ON1CNCCC1=O Amb24120639 [0,1,0,1,0,0|1,0,0]=3 9887 B8R1.5 O[C@@H]1CCCC=C1Br Amb25687871 [0,1,0,1,0,0|1,0,1]=4 9888 B8R1.5 O[C@@H]1CCCCC1O Amb25687852 [0,1,0,1,0,0|0,0,2]=4 9889 B8R1.5 O[C@@H]1CCCC[C@@H]1Br Amb24546000 [0,1,0,1,0,0|1,0,1]=4 9890 B8R1.5 O[C@@H]1CCCC[C@H]1Br Amb17940195 [0,1,0,1,0,0|1,0,1]=4 9891 B8R1.5 O[C@@H]1CCCC[C@H]1Cl Amb17844352 [0,1,0,1,0,0|1,0,1]=4 9892 B8R1.5 O[C@@H]1CCCC[C@H]1F Amb10606383 [0,1,0,1,0,0|1,0,1]=4 9893 B8R1.5 O[C@@H]1CCCNC1=O Amb22225342 [0,1,0,1,0,0|1,0,0]=3 9894 B8R1.5 O[C@@H]1CCCOC1O Amb24704773 [0,1,0,1,0,0|0,0,2]=4 9895 B8R1.5 O[C@@H]1COCCC1=O Amb25086646 [0,1,0,1,0,0|1,0,0]=3 9896 B8R1.5 O[C@@H]1OCCC[C@H]1Cl Amb25360183 [0,1,0,1,0,0|0,0,2]=4 9897 B8R1.5 O[C@H]1CCC=CC1=O Amb25263127 [0,1,0,1,0,0|0,0,2]=4 9898 B8R1.5 O[C@H]1CCCC=C1Br Amb24505024 [0,1,0,1,0,0|1,0,1]=4 9899 B8R1.5 O[C@H]1CCCC[C@@H]1Br Amb24629284 [0,1,0,1,0,0|1,0,1]=4 9900 B8R1.5 O[C@H]1CCCC[C@@H]1I Amb10601566 [0,1,0,1,0,0|1,0,1]=4 9901 B8R1.5 O[C@H]1CCCNC1=O Amb22226682 [0,1,0,1,0,0|1,0,0]=3 9902 B8R1.5 O[C@H]1OCCC[C@@H]1Cl Amb24558218 [0,1,0,1,0,0|0,0,2]=4 9903 B8R1.5 [NH3+][C@@H]1CCCC[C@@H]1O Amb24112952 [0,1,0,1,0,0|1,0,1]=4 9904 B8R1.9 C=C1CC1CCCBr Amb24552849 [0,1,0,1,0,0|2,0,0]=4 9905 B8R1.9 C=C1CC1CCCCl Amb24460116 [0,1,0,1,0,0|2,0,0]=4 9906 B8R1.9 CC1OC1CCCCl Amb24524265 [0,1,0,1,0,0|1,0,1]=4 9907 B8R1.9 CCCCC1=CC1=O Amb24332715 [0,1,0,1,0,0|1,0,0]=3 9908 B8R1.9 CCCCC1OC1Cl Amb25266992 [0,1,0,1,0,0|1,0,1]=4 9909 B8R1.9 CCCC[C@@H]1C[C@H]1O Amb24598213 [0,1,0,1,0,0|1,0,1]=4 9910 B8R1.9 CCCC[C@@H]1O[C@@H]1Cl Amb25339622 [0,1,0,1,0,0|1,0,1]=4 9911 B8R1.9 C[C@@H]1O[C@@H]1CCCBr Amb25173062 [0,1,0,1,0,0|1,0,1]=4 9912 B8R1.9 C[C@@H]1O[C@@H]1CCCCl Amb24515089 [0,1,0,1,0,0|1,0,1]=4 9913 B8R1.9 C[C@@H]1O[C@@H]1CCCO Amb25176894 [0,1,0,1,0,0|1,0,1]=4 9914 B8R1.9 C[C@H]1O[C@H]1CCCO Amb25332332 [0,1,0,1,0,0|1,0,1]=4 9915 B8R1.9 OCCCC1=CC1=O Amb25142657 [0,1,0,1,0,0|1,0,1]=4 9916 B8R1.9 O[C@H]1CC1CCCCl Amb25283482 [0,1,0,1,0,0|1,0,1]=4 9917 B8R1.13 CCCC1CCC1O Amb24359183 [0,1,0,1,0,0|1,0,1]=4 9918 B8R1.13 CCC[C@@H]1SC[C@H]1O Amb25271389 [0,1,0,1,0,0|0,1,1]=4 9919 B8R1.13 CCOC1CCC1=O Amb22896768 [0,1,0,1,0,0|2,0,0]=4 9920 B8R1.17 CCCC1OC1CCl Amb25779218 [0,1,0,1,0,0|1,0,1]=4 9921 B8R1.17 CCCC1OC1CO Amb25772063 [0,1,0,1,0,0|0,0,2]=4 9922 B8R1.17 CCCC1O[C@H]1CO Amb25107872 [0,1,0,1,0,0|0,0,2]=4 9923 B8R1.17 CCC[C@@H]1C[C@@H]1CO Amb24520124 [0,1,0,1,0,0|1,0,1]=4 9924 B8R1.17 CCC[C@@H]1C[C@H]1CO Amb24533879 [0,1,0,1,0,0|1,0,1]=4 9925 B8R1.17 CCC[C@@H]1O[C@@H]1CBr Amb25173138 [0,1,0,1,0,0|1,0,1]=4 9926 B8R1.17 CCC[C@@H]1O[C@H]1CO Amb24655946 [0,1,0,1,0,0|0,0,2]=4 9927 B8R1.17 CCC[C@@H]1S[C@@H]1CO Amb25317475 [0,1,0,1,0,0|0,1,1]=4 9928 B8R1.17 CCC[C@@H]1S[C@H]1CO Amb24611192 [0,1,0,1,0,0|0,1,1]=4 9929 B8R1.17 CCC[C@H]1C[C@@H]1CO Amb24580060 [0,1,0,1,0,0|1,0,1]=4 9930 B8R1.17 CCC[C@H]1O[C@@H]1C=O Amb24566218 [0,1,0,1,0,0|0,0,1]=3 9931 B8R1.17 CCC[C@H]1O[C@@H]1CBr Amb25238290 [0,1,0,1,0,0|1,0,1]=4 9932 B8R1.17 CCC[C@H]1O[C@@H]1CCl Amb25026210 [0,1,0,1,0,0|1,0,1]=4 9933 B8R1.17 O=C[C@@H]1O[C@H]1CCBr Amb25172900 [0,1,0,1,0,0|1,0,1]=4 9934 B8R1.22 BrC1=CCCCCC1 Amb10071167 [0,1,0,1,0,0|2,0,0]=4 9935 B8R1.22 C=C1CCCCCC1 Amb25325282 [0,1,0,1,0,0|2,0,0]=4 9936 B8R1.22 C=C1CNCCCC1 Amb24624045 [0,1,0,1,0,0|2,0,0]=4 9937 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,1,0,1,0,0|1,0,0]=3 9938 B8R1.22 CC1=CCCCCN1 Amb24443923 [0,1,0,1,0,0|2,0,0]=4 9939 B8R1.22 CC1CCCCCO1 Amb22364798 [0,1,0,1,0,0|1,0,1]=4 9940 B8R1.22 CC1CNCCCO1 Amb22886427 [0,1,0,1,0,0|1,0,1]=4 9941 B8R1.22 CC1OCCCCO1 Amb22731719 [0,1,0,1,0,0|1,0,1]=4 9942 B8R1.22 CC=1CCCCCC1 Amb22227978 [0,1,0,1,0,0|2,0,0]=4 9943 B8R1.22 CC=1CCNCCN1 Amb25784814 [0,1,0,1,0,0|2,0,0]=4 9944 B8R1.22 CC=1NCCCCN1 Amb22345658 [0,1,0,1,0,0|2,0,0]=4 9945 B8R1.22 N=C1CCCCCN1 Amb22488763 [0,1,0,1,0,0|2,0,0]=4 9946 B8R1.22 N=C1CCNCCN1 Amb24481332 [0,1,0,1,0,0|2,0,0]=4 9947 B8R1.22 N=C1COCCCN1 Amb25223773 [0,1,0,1,0,0|2,0,0]=4 9948 B8R1.22 NC=1CCCCCC1 Amb24739386 [0,1,0,1,0,0|2,0,0]=4 9949 B8R1.22 NC=1CCCCCN1 Amb19514661 [0,1,0,1,0,0|2,0,0]=4 9950 B8R1.22 NC=1CSCCCN1 Amb25688170 [0,1,0,1,0,0|2,0,0]=4 9951 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,1,0,1,0,0|1,0,1]=4 9952 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,1,0,1,0,0|1,0,1]=4 9953 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,1,0,1,0,0|1,0,1]=4 9954 B8R1.22 O=C1CCCCC=C1 Amb10601704 [0,1,0,1,0,0|1,0,0]=3 9955 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,1,0,1,0,0|0,1,0]=3 9956 B8R1.22 O=C1CCCCC[N-]1 Amb22053646 [0,1,0,1,0,0|1,0,0]=3 9957 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,1,0,1,0,0|1,0,0]=3 9958 B8R1.22 O=C1CCCCSC1 Amb10071767 [0,1,0,1,0,0|0,1,0]=3 9959 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,1,0,1,0,0|1,0,0]=3 9960 B8R1.22 O=C1CCOCCO1 Amb24060726 [0,1,0,1,0,0|0,0,0]=2 9961 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,1,0,1,0,0|1,0,0]=3 9962 B8R1.22 O=C1CNCCCC1 Amb22000936 [0,1,0,1,0,0|1,0,0]=3 9963 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,1,0,1,0,0|1,0,0]=3 9964 B8R1.22 O=C1CNCCNC1 Amb25259581 [0,1,0,1,0,0|2,0,0]=4 9965 B8R1.22 O=C1COCCC=C1 Amb25295282 [0,1,0,1,0,0|0,0,2]=4 9966 B8R1.22 O=C1COCCCC1 Amb25143067 [0,1,0,1,0,0|0,0,0]=2 9967 B8R1.22 O=C1COCCCN1 Amb22371065 [0,1,0,1,0,0|1,0,0]=3 9968 B8R1.22 O=C1COCCCO1 Amb24558825 [0,1,0,1,0,0|0,0,0]=2 9969 B8R1.22 O=C1COCCOC1 Amb22284314 [0,1,0,1,0,0|1,0,0]=3 9970 B8R1.22 O=C1CSCCCN1 Amb25378108 [0,1,0,1,0,0|1,0,0]=3 9971 B8R1.22 O=C1NCCNCC1 Amb10069937 [0,1,0,1,0,0|1,0,0]=3 9972 B8R1.22 O=C1NCCNCC1 Amb1107713 [0,1,0,1,0,0|1,0,0]=3 9973 B8R1.22 O=C1NCCOCC1 Amb13951193 [0,1,0,1,0,0|1,0,0]=3 9974 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,1,0,1,0,0|0,0,0]=2 9975 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,1,0,1,0,0|2,0,0]=4 9976 B8R1.22 OC1CCCCCS1 Amb17615898 [0,1,0,1,0,0|0,1,1]=4 9977 B8R1.22 OC1CCCNCC1 Amb19958701 [0,1,0,1,0,0|1,0,1]=4 9978 B8R1.22 OC1CCCOCC1 Amb18202762 [0,1,0,1,0,0|1,0,1]=4 9979 B8R1.22 OC1CCCSCC1 Amb18202861 [0,1,0,1,0,0|1,0,1]=4 9980 B8R1.22 OC1CCOCCO1 Amb25687903 [0,1,0,1,0,0|0,0,2]=4 9981 B8R1.22 OC1CNCCCC1 Amb22371121 [0,1,0,1,0,0|1,0,1]=4 9982 B8R1.22 OC1CNCCCC1 Amb22886250 [0,1,0,1,0,0|1,0,1]=4 9983 B8R1.22 O[C@@H]1CCCCC=C1 Amb24720019 [0,1,0,1,0,0|1,0,1]=4 9984 B8R1.22 O[C@H]1CNCCCC1 Amb24630787 [0,1,0,1,0,0|1,0,1]=4 9985 B8R1.22 S=C1CCCCCN1 Amb1935077 [0,1,0,1,0,0|1,1,0]=4 9986 B8R1.22 S=C1CCOCCN1 Amb25836331 [0,1,0,1,0,0|1,1,0]=4 9987 B8R1.22 S=C1COCCCN1 Amb25808992 [0,1,0,1,0,0|1,1,0]=4 9988 B8R1.22 S=C1CSCCCN1 Amb25367071 [0,1,0,1,0,0|1,1,0]=4 9989 B8R1.38 C#CC(=O)C1CNC1 Amb25062877 [0,1,0,1,0,0|2,0,0]=4 9990 B8R1.38 C#C[C@H](O)C1CCC1 Amb24575679 [0,1,0,1,0,0|1,0,1]=4 9991 B8R1.38 C=CC(=O)C1CNC1 Amb25173599 [0,1,0,1,0,0|2,0,0]=4 9992 B8R1.38 CC(CO)C1CCC1 Amb23590277 [0,1,0,1,0,0|1,0,1]=4 9993 B8R1.38 CC(NO)C1CCC1 Amb24619544 [0,1,0,1,0,0|1,0,1]=4 9994 B8R1.38 CCC(=C)C1CCC1 Amb24406839 [0,1,0,1,0,0|2,0,0]=4 9995 B8R1.38 CCC(=O)C1CCC1 Amb17593163 [0,1,0,1,0,0|1,0,0]=3 9996 B8R1.38 CCC(=O)C1CCS1 Amb24679074 [0,1,0,1,0,0|2,0,0]=4 9997 B8R1.38 CCC(=O)C1CNC1 Amb24366850 [0,1,0,1,0,0|2,0,0]=4 9998 B8R1.38 CCC(=O)N1CCC1 Amb25846211 [0,1,0,1,0,0|2,0,0]=4 9999 B8R1.38 CC[C@H](O)C1CCC1 Amb24690264 [0,1,0,1,0,0|1,0,1]=4 10000 B8R1.38 CNC(=N)C1CCC1 Amb24735570 [0,1,0,1,0,0|2,0,0]=4 10001 B8R1.38 CNC(=O)C1CCC1 Amb22231329 [0,1,0,1,0,0|1,0,0]=3 10002 B8R1.38 CNC(=O)C1CCN1 Amb24452000 [0,1,0,1,0,0|2,0,0]=4 10003 B8R1.38 CNC(=O)C1CNC1 Amb20061385 [0,1,0,1,0,0|2,0,0]=4 10004 B8R1.38 CNC(=O)C1CNC1 Amb21960262 [0,1,0,1,0,0|2,0,0]=4 10005 B8R1.38 CNC(=O)C1COC1 Amb25189024 [0,1,0,1,0,0|2,0,0]=4 10006 B8R1.38 CNC(=O)[C@@H]1CCN1 Amb25745110 [0,1,0,1,0,0|2,0,0]=4 10007 B8R1.38 COC(=N)C1CCC1 Amb25098857 [0,1,0,1,0,0|1,0,0]=3 10008 B8R1.38 COC(=N)C1CSC1 Amb24742847 [0,1,0,1,0,0|2,0,0]=4 10009 B8R1.38 COC(=O)C1CCN1 Amb20243415 [0,1,0,1,0,0|1,0,0]=3 10010 B8R1.38 COC(=O)C1CCN1 Amb22757529 [0,1,0,1,0,0|1,0,0]=3 10011 B8R1.38 COC(=O)C1CCO1 Amb22736125 [0,1,0,1,0,0|1,0,0]=3 10012 B8R1.38 COC(=O)C1CNC1 Amb10604008 [0,1,0,1,0,0|1,0,0]=3 10013 B8R1.38 COC(=O)C1CNC1 Amb13883580 [0,1,0,1,0,0|1,0,0]=3 10014 B8R1.38 COC(=O)C1COC1 Amb21927994 [0,1,0,1,0,0|1,0,0]=3 10015 B8R1.38 COC(=O)C1COC1 Amb21961760 [0,1,0,1,0,0|1,0,0]=3 10016 B8R1.38 COC(=O)C=1CCC1 Amb24689222 [0,1,0,1,0,0|0,0,2]=4 10017 B8R1.38 COC(=O)N1CCC1 Amb24354373 [0,1,0,1,0,0|1,0,0]=3 10018 B8R1.38 COC(=O)[C@@H]1CCN1 Amb19888362 [0,1,0,1,0,0|1,0,0]=3 10019 B8R1.38 COC(=O)[C@@H]1CCN1 Amb22405994 [0,1,0,1,0,0|1,0,0]=3 10020 B8R1.38 COC(=O)[C@H]1CCN1 Amb22737543 [0,1,0,1,0,0|1,0,0]=3 10021 B8R1.38 COC(=O)[C@H]1CCN1 Amb24694404 [0,1,0,1,0,0|1,0,0]=3 10022 B8R1.38 N#CC(=O)C1CCC1 Amb25718424 [0,1,0,1,0,0|1,0,0]=3 10023 B8R1.38 N#CC(O)C1CCC1 Amb24747346 [0,1,0,1,0,0|1,0,1]=4 10024 B8R1.38 N#C[C@@H](O)C1CCC1 Amb25144989 [0,1,0,1,0,0|1,0,1]=4 10025 B8R1.38 N=C(NO)C1CCC1 Amb22265719 [0,1,0,1,0,0|1,0,0]=3 10026 B8R1.38 N=C(NO)C1COC1 Amb17933805 [0,1,0,1,0,0|2,0,0]=4 10027 B8R1.38 NC(CO)C1CCC1 Amb24077492 [0,1,0,1,0,0|1,0,1]=4 10028 B8R1.38 NCC(=O)C1CCC1 Amb24524254 [0,1,0,1,0,0|1,0,0]=3 10029 B8R1.38 NCC(=O)N1CCC1 Amb22896591 [0,1,0,1,0,0|2,0,0]=4 10030 B8R1.38 NCC(=O)N1CCC1 Amb25167399 [0,1,0,1,0,0|2,0,0]=4 10031 B8R1.38 NNC(=O)C1CCO1 Amb25180076 [0,1,0,1,0,0|2,0,0]=4 10032 B8R1.38 NNC(=O)C1CNC1 Amb24577532 [0,1,0,1,0,0|2,0,0]=4 10033 B8R1.38 N[C@@H](CO)C1CCC1 Amb24077485 [0,1,0,1,0,0|1,0,1]=4 10034 B8R1.38 N[C@H](CO)C1CCC1 Amb24077520 [0,1,0,1,0,0|1,0,1]=4 10035 B8R1.38 O=C(CBr)C1CCC1 Amb20622821 [0,1,0,1,0,0|1,0,0]=3 10036 B8R1.38 O=C(CF)C1CCC1 Amb23571927 [0,1,0,1,0,0|1,0,0]=3 10037 B8R1.38 O=CC(=O)N1CCC1 Amb24409005 [0,1,0,1,0,0|1,0,1]=4 10038 B8R1.38 O=CC(F)C1CCC1 Amb22011677 [0,1,0,1,0,0|1,0,1]=4 10039 B8R1.38 OC(C=O)C1CCC1 Amb24409082 [0,1,0,1,0,0|0,0,1]=3 10040 B8R1.38 OCC(Br)=C1CCC1 Amb25769222 [0,1,0,1,0,0|1,0,1]=4 10041 B8R1.38 ON=C(Cl)C1CCC1 Amb25805125 [0,1,0,1,0,0|1,0,0]=3 10042 B8R1.38 ONC(=O)C1CCO1 Amb25295628 [0,1,0,1,0,0|1,0,0]=3 10043 B8R1.38 ONC(=O)C1CNC1 Amb25684724 [0,1,0,1,0,0|1,0,0]=3 10044 B8R1.38 ONC(=O)C1COC1 Amb24557050 [0,1,0,1,0,0|1,0,0]=3 10045 B8R1.41 CCCC[C@]1(C)CO1 Amb25791165 [0,1,0,1,0,0|1,0,1]=4 10046 B8R1.44 CCC1(O)CC1CC Amb24483076 [0,1,0,1,0,0|1,0,1]=4 10047 B8R1.44 CCC1CC1(N)CO Amb25662784 [0,1,0,1,0,0|1,0,1]=4 10048 B8R1.46 CCC1=CC(=O)C1O Amb25107847 [0,1,0,1,0,0|0,0,2]=4 10049 B8R1.46 CCC1NC(=O)C1=C Amb24713912 [0,1,0,1,0,0|1,0,1]=4 10050 B8R1.46 C[C@@H]1[C@H](CBr)OC1=O Amb24612442 [0,1,0,1,0,0|1,0,0]=3 10051 B8R1.46 C[C@@H]1[C@H](CC)NC1=O Amb24580120 [0,1,0,1,0,0|1,0,0]=3 10052 B8R1.46 C[C@H]1[C@H](CBr)OC1=O Amb24626650 [0,1,0,1,0,0|1,0,0]=3 10053 B8R1.46 NC1C(CF)NC1=O Amb25810377 [0,1,0,1,0,0|2,0,0]=4 10054 B8R1.46 N[C@@H]1[C@H](CF)NC1=O Amb25231101 [0,1,0,1,0,0|2,0,0]=4 10055 B8R1.46 OC1C(CO)OC1=O Amb25359586 [0,1,0,1,0,0|1,0,0]=3 10056 B8R1.46 OCC1CC(=O)N1O Amb25143826 [0,1,0,1,0,0|1,0,0]=3 10057 B8R1.46 OC[C@H]1CC(=O)[C@H]1F Amb24602944 [0,1,0,1,0,0|2,0,0]=4 10058 B8R1.46 ON1C(CBr)CC1=O Amb25137528 [0,1,0,1,0,0|1,0,0]=3 10059 B8R1.47 CCC1CC(CO)C1 Amb23537746 [0,1,0,1,0,0|1,0,1]=4 10060 B8R1.47 CC[C@@H]1C[C@H](CO)C1 Amb25226269 [0,1,0,1,0,0|1,0,1]=4 10061 B8R1.47 OCC1CC(C1)=NO Amb23570500 [0,1,0,1,0,0|2,0,0]=4 10062 B8R1.50 BrC1=C(C)CCC1=O Amb10067495 [0,1,0,1,0,0|1,0,1]=4 10063 B8R1.50 CC1C(=O)CCN1C Amb24453852 [0,1,0,1,0,0|2,0,0]=4 10064 B8R1.50 CC1C(C)CNC1=O Amb24334186 [0,1,0,1,0,0|2,0,0]=4 10065 B8R1.50 CC1C(C)SCC1=O Amb24687046 [0,1,0,1,0,0|2,0,0]=4 10066 B8R1.50 CC1CC=C(C)C1=O Amb17778666 [0,1,0,1,0,0|1,0,1]=4 10067 B8R1.50 CC1CCC(=O)C1=O Amb22233560 [0,1,0,1,0,0|0,0,1]=3 10068 B8R1.50 CC1CCC(=O)C1Br Amb24356701 [0,1,0,1,0,0|1,0,0]=3 10069 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,1,0,1,0,0|1,0,0]=3 10070 B8R1.50 CC1CCC(=O)C1O Amb25773264 [0,1,0,1,0,0|0,0,0]=2 10071 B8R1.50 CC1CCC(=O)N1C Amb15693449 [0,1,0,1,0,0|1,0,0]=3 10072 B8R1.50 CC1CCC(C)C1O Amb24447767 [0,1,0,1,0,0|1,0,1]=4 10073 B8R1.50 CC1CCC(O)C1C Amb24406635 [0,1,0,1,0,0|1,0,1]=4 10074 B8R1.50 CC1CCC(O)[C@H]1O Amb24642421 [0,1,0,1,0,0|0,0,2]=4 10075 B8R1.50 CC1CNC(=O)C1Cl Amb24610736 [0,1,0,1,0,0|2,0,0]=4 10076 B8R1.50 CC1CNC(=S)C1O Amb24482492 [0,1,0,1,0,0|1,1,0]=4 10077 B8R1.50 CC1COC(=O)C1Cl Amb25240615 [0,1,0,1,0,0|2,0,0]=4 10078 B8R1.50 CC1COC(=O)C1N Amb24482307 [0,1,0,1,0,0|2,0,0]=4 10079 B8R1.50 CC1CSC(=O)C1N Amb25169595 [0,1,0,1,0,0|2,0,0]=4 10080 B8R1.50 CC1NCC(=O)N1C Amb24742108 [0,1,0,1,0,0|2,0,0]=4 10081 B8R1.50 CC1NNC(=O)C1O Amb25739720 [0,1,0,1,0,0|2,0,0]=4 10082 B8R1.50 CC1OC=C(O)C1=O Amb25128250 [0,1,0,1,0,0|1,0,1]=4 10083 B8R1.50 CC1OCC(=C)C1O Amb24527630 [0,1,0,1,0,0|2,0,0]=4 10084 B8R1.50 CC1OCC(=O)C1N Amb24601568 [0,1,0,1,0,0|2,0,0]=4 10085 B8R1.50 CC=1CCC(=O)C1C Amb22351730 [0,1,0,1,0,0|1,0,1]=4 10086 B8R1.50 CC=1CCC(C)C1C Amb25725570 [0,1,0,1,0,0|2,0,0]=4 10087 B8R1.50 CC=1COC(=O)C1O Amb23571854 [0,1,0,1,0,0|1,0,1]=4 10088 B8R1.50 CC=1CSC(=O)C1O Amb24638526 [0,1,0,1,0,0|1,0,1]=4 10089 B8R1.50 CN1C(Cl)CCC1=O Amb25697191 [0,1,0,1,0,0|2,0,0]=4 10090 B8R1.50 CN1CCC(=C)C1=O Amb24457267 [0,1,0,1,0,0|2,0,0]=4 10091 B8R1.50 CN1CCC(=O)C1=O Amb24183817 [0,1,0,1,0,0|1,0,1]=4 10092 B8R1.50 CN1CCC(O)C1=O Amb20622738 [0,1,0,1,0,0|1,0,1]=4 10093 B8R1.50 CN1CC[C@H](O)C1=O Amb24400512 [0,1,0,1,0,0|1,0,1]=4 10094 B8R1.50 CN1[C@H](O)CCC1=O Amb24684724 [0,1,0,1,0,0|2,0,0]=4 10095 B8R1.50 C[C@@H]1C(=O)CCN1C Amb18833064 [0,1,0,1,0,0|2,0,0]=4 10096 B8R1.50 C[C@@H]1CCC(=O)C1=O Amb24357250 [0,1,0,1,0,0|0,0,1]=3 10097 B8R1.50 C[C@@H]1CCC(=O)C1C Amb25834175 [0,1,0,1,0,0|1,0,0]=3 10098 B8R1.50 C[C@@H]1CCC(=O)[C@H]1Br Amb24706631 [0,1,0,1,0,0|1,0,0]=3 10099 B8R1.50 C[C@@H]1CC[C@@H](C)C1=O Amb25293431 [0,1,0,1,0,0|1,0,1]=4 10100 B8R1.50 C[C@@H]1CC[C@@H](C)C1O Amb25216158 [0,1,0,1,0,0|1,0,1]=4 10101 B8R1.50 C[C@@H]1CC[C@@H](O)[C@@H]1O Amb25218831 [0,1,0,1,0,0|0,0,2]=4 10102 B8R1.50 C[C@@H]1CC[C@@H](O)[C@H]1C Amb24619635 [0,1,0,1,0,0|1,0,1]=4 10103 B8R1.50 C[C@@H]1CC[C@@H](O)[C@H]1N Amb25366548 [0,1,0,1,0,0|1,0,1]=4 10104 B8R1.50 C[C@@H]1COC(=O)[C@H]1N Amb25216668 [0,1,0,1,0,0|2,0,0]=4 10105 B8R1.50 C[C@@H]1NNC(=O)[C@@H]1O Amb24599440 [0,1,0,1,0,0|2,0,0]=4 10106 B8R1.50 C[C@H]1C(=O)CCN1C Amb25762428 [0,1,0,1,0,0|2,0,0]=4 10107 B8R1.50 C[C@H]1C=CC(=O)[C@@H]1O Amb25024971 [0,1,0,1,0,0|0,0,2]=4 10108 B8R1.50 C[C@H]1CCC(=O)C1=C Amb24737469 [0,1,0,1,0,0|1,0,0]=3 10109 B8R1.50 C[C@H]1CCC(=O)[C@H]1Br Amb25286608 [0,1,0,1,0,0|1,0,0]=3 10110 B8R1.50 C[C@H]1CCC(=O)[C@H]1C Amb24557180 [0,1,0,1,0,0|1,0,0]=3 10111 B8R1.50 C[C@H]1CCC(=O)[C@H]1Cl Amb24544320 [0,1,0,1,0,0|1,0,0]=3 10112 B8R1.50 C[C@H]1CCC(O)[C@@H]1C Amb25357992 [0,1,0,1,0,0|1,0,1]=4 10113 B8R1.50 C[C@H]1CNC(=S)[C@H]1O Amb24581277 [0,1,0,1,0,0|1,1,0]=4 10114 B8R1.50 C[C@H]1COC(=O)[C@@H]1N Amb25339475 [0,1,0,1,0,0|2,0,0]=4 10115 B8R1.50 C[C@H]1COC(=O)[C@@H]1O Amb25320667 [0,1,0,1,0,0|1,0,0]=3 10116 B8R1.50 C[C@H]1OCC(=O)[C@@H]1O Amb25026255 [0,1,0,1,0,0|1,0,0]=3 10117 B8R1.50 C[C@H]1[C@@H](C)CNC1=O Amb24761480 [0,1,0,1,0,0|2,0,0]=4 10118 B8R1.50 C[C@H]1[C@H](O)CCC1=O Amb24631662 [0,1,0,1,0,0|2,0,0]=4 10119 B8R1.50 NC1CNC(=O)C1O Amb24481564 [0,1,0,1,0,0|2,0,0]=4 10120 B8R1.50 NC1COC(=O)C1O Amb24724728 [0,1,0,1,0,0|2,0,0]=4 10121 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,1,0,1,0,0|2,0,0]=4 10122 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,1,0,1,0,0|2,0,0]=4 10123 B8R1.50 N[C@H]1CNC(=O)[C@@H]1O Amb24612411 [0,1,0,1,0,0|2,0,0]=4 10124 B8R1.50 O=C1C(C)CCN1C Amb10068267 [0,1,0,1,0,0|2,0,0]=4 10125 B8R1.50 OC1=C(O)CCC1=O Amb17593179 [0,1,0,1,0,0|1,0,1]=4 10126 B8R1.50 OC1C(=O)CCC1=O Amb24443990 [0,1,0,1,0,0|1,0,1]=4 10127 B8R1.50 OC1C(F)COC1=O Amb25831080 [0,1,0,1,0,0|2,0,0]=4 10128 B8R1.50 OC1C(O)COC1=O Amb22730078 [0,1,0,1,0,0|2,0,0]=4 10129 B8R1.50 OC1CCC(=O)C1=O Amb24432188 [0,1,0,1,0,0|1,0,1]=4 10130 B8R1.50 OC1CCC(=O)C1O Amb24627902 [0,1,0,1,0,0|1,0,0]=3 10131 B8R1.50 OC1CCC(=O)N1C Amb17615583 [0,1,0,1,0,0|2,0,0]=4 10132 B8R1.50 OC=1C(=O)CCC1Br Amb24677469 [0,1,0,1,0,0|1,0,1]=4 10133 B8R1.50 OC=1CCC(O)C1O Amb25745324 [0,1,0,1,0,0|1,0,1]=4 10134 B8R1.50 ON1C(=O)CCC1=O Amb1152089 [0,1,0,1,0,0|1,0,1]=4 10135 B8R1.50 O[C@@H]1[C@@H](O)COC1=O Amb15692412 [0,1,0,1,0,0|2,0,0]=4 10136 B8R1.50 O[C@H]1[C@H](F)COC1=O Amb25356232 [0,1,0,1,0,0|2,0,0]=4 10137 B8R1.50 O[C@H]1[C@H](O)COC1=O Amb24609731 [0,1,0,1,0,0|2,0,0]=4 10138 B8R1.52 C#CC1(O)CCCC1 Amb1058765 [0,1,0,1,0,0|1,0,1]=4 10139 B8R1.52 C=CC1(O)CCCC1 Amb24483275 [0,1,0,1,0,0|1,0,1]=4 10140 B8R1.52 CC1(CCCC1)C=O Amb18641706 [0,1,0,1,0,0|1,0,1]=4 10141 B8R1.52 CC1(CO)CCCC1 Amb22059633 [0,1,0,1,0,0|1,0,1]=4 10142 B8R1.52 NC1(CO)CCCC1 Amb20248305 [0,1,0,1,0,0|1,0,1]=4 10143 B8R1.52 NCC1(O)CCCC1 Amb1108087 [0,1,0,1,0,0|1,0,1]=4 10144 B8R1.52 NCC1(O)CCCC1 Amb22504268 [0,1,0,1,0,0|1,0,1]=4 10145 B8R1.52 O=CC1(Br)CCCC1 Amb25758600 [0,1,0,1,0,0|1,0,1]=4 10146 B8R1.52 OC1(CCCC1)C=O Amb18124253 [0,1,0,1,0,0|0,0,1]=3 10147 B8R1.52 OCC1(Cl)CCCC1 Amb25676138 [0,1,0,1,0,0|1,0,1]=4 10148 B8R1.52 OCC1(N)CCCC1 Amb2236186 [0,1,0,1,0,0|1,0,1]=4 10149 B8R1.52 OCC1(O)CCCC1 Amb20668271 [0,1,0,1,0,0|0,0,2]=4 10150 B8R1.58 CC1CCC1(Cl)CO Amb24474117 [0,1,0,1,0,0|1,0,1]=4 10151 B8R1.58 CC1CCC1(N)CO Amb24419205 [0,1,0,1,0,0|1,0,1]=4 10152 B8R1.58 CCC1(O)CCC1C Amb24388094 [0,1,0,1,0,0|1,0,1]=4 10153 B8R1.6 C#CCC1CC(=O)N1 Amb24642215 [0,1,0,1,0,0|1,0,1]=4 10154 B8R1.6 C=CCC1CC(=O)N1 Amb24453069 [0,1,0,1,0,0|1,0,1]=4 10155 B8R1.6 C=CC[C@@H]1CC(=O)N1 Amb25107896 [0,1,0,1,0,0|1,0,1]=4 10156 B8R1.6 CCCC1CC(=C)C1 Amb25237339 [0,1,0,1,0,0|2,0,0]=4 10157 B8R1.6 CCCN1CC(O)C1 Amb25747214 [0,1,0,1,0,0|1,0,1]=4 10158 B8R1.6 CCC[C@@H]1CC(=O)N1 Amb25842837 [0,1,0,1,0,0|1,0,0]=3 10159 B8R1.6 CCNC1CC(O)C1 Amb24391346 [0,1,0,1,0,0|1,0,1]=4 10160 B8R1.6 CCOC1CC(=C)C1 Amb24654384 [0,1,0,1,0,0|2,0,0]=4 10161 B8R1.6 CCOC1CC(=O)C1 Amb22059813 [0,1,0,1,0,0|1,0,0]=3 10162 B8R1.6 CCOC1CC(=O)N1 Amb24393354 [0,1,0,1,0,0|1,0,0]=3 10163 B8R1.6 CCOC1CC(O)C1 Amb25079645 [0,1,0,1,0,0|1,0,1]=4 10164 B8R1.6 CCOC=1CC(=O)C1 Amb24689572 [0,1,0,1,0,0|1,0,1]=4 10165 B8R1.6 CCO[C@@H]1C[C@@H](O)C1 Amb24482985 [0,1,0,1,0,0|1,0,1]=4 10166 B8R1.6 CCSC1CC(=O)N1 Amb24604270 [0,1,0,1,0,0|1,0,0]=3 10167 B8R1.6 CNCC1CC(O)C1 Amb25732572 [0,1,0,1,0,0|1,0,1]=4 10168 B8R1.6 CNC[C@@H]1C[C@H](O)C1 Amb22831752 [0,1,0,1,0,0|1,0,1]=4 10169 B8R1.6 COCC1CC(=O)C1 Amb25771052 [0,1,0,1,0,0|1,0,0]=3 10170 B8R1.6 C\C=C\C1CC(=O)N1 Amb24573008 [0,1,0,1,0,0|1,0,1]=4 10171 B8R1.6 NCCC1CC(=O)N1 Amb25127066 [0,1,0,1,0,0|1,0,0]=3 10172 B8R1.6 NCCC1CC(O)C1 Amb24715768 [0,1,0,1,0,0|1,0,1]=4 10173 B8R1.6 NCCN1CC(=O)C1 Amb25268925 [0,1,0,1,0,0|2,0,0]=4 10174 B8R1.6 NCC[C@H]1C[C@@H](O)C1 Amb25062403 [0,1,0,1,0,0|1,0,1]=4 10175 B8R1.6 O=CCC1CC(=O)N1 Amb24376079 [0,1,0,1,0,0|1,0,1]=4 10176 B8R1.7 C=C(F)C1CCCN1 Amb24526874 [0,1,0,1,0,0|2,0,0]=4 10177 B8R1.7 C=C(F)[C@@H]1CCCN1 Amb25232471 [0,1,0,1,0,0|2,0,0]=4 10178 B8R1.7 CC(=C)C1CCCN1 Amb23536664 [0,1,0,1,0,0|2,0,0]=4 10179 B8R1.7 CC(=C)C1COCC1 Amb25305384 [0,1,0,1,0,0|2,0,0]=4 10180 B8R1.7 CC(=C)N1CCCC1 Amb25245391 [0,1,0,1,0,0|2,0,0]=4 10181 B8R1.7 CC(=O)C1CCC=C1 Amb25373909 [0,1,0,1,0,0|1,0,1]=4 10182 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [0,1,0,1,0,0|1,0,1]=4 10183 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,1,0,1,0,0|1,0,0]=3 10184 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [0,1,0,1,0,0|1,0,0]=3 10185 B8R1.7 CC(=O)C1CCN=N1 Amb24086404 [0,1,0,1,0,0|2,0,0]=4 10186 B8R1.7 CC(=O)C1CCSS1 Amb24584425 [0,1,0,1,0,0|2,0,0]=4 10187 B8R1.7 CC(=O)C1CNCC1 Amb18833067 [0,1,0,1,0,0|1,0,0]=3 10188 B8R1.7 CC(=O)C1CNCC1 Amb22899078 [0,1,0,1,0,0|1,0,0]=3 10189 B8R1.7 CC(=O)C1COCC1 Amb18833038 [0,1,0,1,0,0|1,0,0]=3 10190 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [0,1,0,1,0,0|2,0,0]=4 10191 B8R1.7 CC(=O)C1NCCS1 Amb25127993 [0,1,0,1,0,0|2,0,0]=4 10192 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [0,1,0,1,0,0|2,0,0]=4 10193 B8R1.7 CC(=O)C1SCCS1 Amb25173435 [0,1,0,1,0,0|2,0,0]=4 10194 B8R1.7 CC(=O)C=1CCCC1 Amb22338190 [0,1,0,1,0,0|1,0,1]=4 10195 B8R1.7 CC(=O)C=1CCCN1 Amb21962890 [0,1,0,1,0,0|1,0,1]=4 10196 B8R1.7 CC(=O)N1CCCN1 Amb25213247 [0,1,0,1,0,0|2,0,0]=4 10197 B8R1.7 CC(=O)N1CCCO1 Amb24354493 [0,1,0,1,0,0|2,0,0]=4 10198 B8R1.7 CC(=O)N1CSCC1 Amb24354533 [0,1,0,1,0,0|2,0,0]=4 10199 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [0,1,0,1,0,0|1,0,0]=3 10200 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [0,1,0,1,0,0|1,0,0]=3 10201 B8R1.7 CC(C1CCCN1)O Amb17231822 [0,1,0,1,0,0|1,0,1]=4 10202 B8R1.7 CC(O)C1CCCS1 Amb25694920 [0,1,0,1,0,0|1,0,1]=4 10203 B8R1.7 CC(O)C1CCNC1 Amb22886901 [0,1,0,1,0,0|1,0,1]=4 10204 B8R1.7 CC(O)C1CCOC1 Amb20623722 [0,1,0,1,0,0|1,0,1]=4 10205 B8R1.7 CC(O)C1CCSC1 Amb24411877 [0,1,0,1,0,0|1,0,1]=4 10206 B8R1.7 CC(O)[C@@H]1CCCN1 Amb24685154 [0,1,0,1,0,0|1,0,1]=4 10207 B8R1.7 CS(=O)C1CNCC1 Amb25185409 [0,1,0,1,0,0|2,0,0]=4 10208 B8R1.7 C[C@@H](O)C1CCCC1 Amb19515558 [0,1,0,1,0,0|1,0,1]=4 10209 B8R1.7 C[C@@H](O)C1CCOC1 Amb25724373 [0,1,0,1,0,0|1,0,1]=4 10210 B8R1.7 C[C@@H](O)[C@@H]1CCNC1 Amb25174882 [0,1,0,1,0,0|1,0,1]=4 10211 B8R1.7 C[C@@H](O)[C@H]1CCCO1 Amb24592408 [0,1,0,1,0,0|1,0,1]=4 10212 B8R1.7 C[C@H](O)C1CCCC1 Amb25842291 [0,1,0,1,0,0|1,0,1]=4 10213 B8R1.7 C[C@H](O)C1CCOC1 Amb24365203 [0,1,0,1,0,0|1,0,1]=4 10214 B8R1.7 ClC(=O)C1CSCN1 Amb17142875 [0,1,0,1,0,0|2,0,0]=4 10215 B8R1.7 NC(=N)C1CCCN1 Amb24549144 [0,1,0,1,0,0|2,0,0]=4 10216 B8R1.7 NC(=N)C1CCCO1 Amb22059430 [0,1,0,1,0,0|2,0,0]=4 10217 B8R1.7 NC(=N)C1CCCS1 Amb24470321 [0,1,0,1,0,0|2,0,0]=4 10218 B8R1.7 NC(=N)C1CNCC1 Amb17934233 [0,1,0,1,0,0|2,0,0]=4 10219 B8R1.7 NC(=N)C1CNCC1 Amb24502578 [0,1,0,1,0,0|2,0,0]=4 10220 B8R1.7 NC(=N)N1CCCC1 Amb10070761 [0,1,0,1,0,0|2,0,0]=4 10221 B8R1.7 NC(=N)N1CCCC1 Amb2079636 [0,1,0,1,0,0|2,0,0]=4 10222 B8R1.7 NC(=N)N1CCCC1 Amb22736590 [0,1,0,1,0,0|2,0,0]=4 10223 B8R1.7 NC(=O)C1CC=CC1 Amb10068010 [0,1,0,1,0,0|1,0,1]=4 10224 B8R1.7 NC(=O)C1CCC=C1 Amb25063981 [0,1,0,1,0,0|1,0,1]=4 10225 B8R1.7 NC(=O)C1CCCN1 Amb1152272 [0,1,0,1,0,0|1,0,0]=3 10226 B8R1.7 NC(=O)C1CCCS1 Amb24461593 [0,1,0,1,0,0|1,0,0]=3 10227 B8R1.7 NC(=O)C1CCSS1 Amb24060539 [0,1,0,1,0,0|2,0,0]=4 10228 B8R1.7 NC(=O)C1CNCC1 Amb19373271 [0,1,0,1,0,0|1,0,0]=3 10229 B8R1.7 NC(=O)C1CNCO1 Amb25276465 [0,1,0,1,0,0|2,0,0]=4 10230 B8R1.7 NC(=O)C1CNCS1 Amb24481531 [0,1,0,1,0,0|2,0,0]=4 10231 B8R1.7 NC(=O)C1COCN1 Amb24740220 [0,1,0,1,0,0|2,0,0]=4 10232 B8R1.7 NC(=O)C1SCCS1 Amb25097480 [0,1,0,1,0,0|2,0,0]=4 10233 B8R1.7 NC(=O)C=1CCCC1 Amb20622488 [0,1,0,1,0,0|1,0,1]=4 10234 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [0,1,0,1,0,0|1,0,0]=3 10235 B8R1.7 NC(=O)N1CCCN1 Amb24563074 [0,1,0,1,0,0|2,0,0]=4 10236 B8R1.7 NC(=O)N1CCCO1 Amb24465577 [0,1,0,1,0,0|2,0,0]=4 10237 B8R1.7 NC(=O)N1COCC1 Amb24603319 [0,1,0,1,0,0|2,0,0]=4 10238 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,1,0,1,0,0|1,0,0]=3 10239 B8R1.7 NC(=O)[C@@H]1CCON1 Amb24542870 [0,1,0,1,0,0|2,0,0]=4 10240 B8R1.7 NC(=O)[C@@H]1CNCC1 Amb20671395 [0,1,0,1,0,0|1,0,0]=3 10241 B8R1.7 NC(=O)[C@@H]1CNCC1 Amb22405893 [0,1,0,1,0,0|1,0,0]=3 10242 B8R1.7 NC(=O)[C@@H]1CSCN1 Amb25111427 [0,1,0,1,0,0|2,0,0]=4 10243 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,1,0,1,0,0|1,0,0]=3 10244 B8R1.7 NC(=O)[C@H]1CNCC1 Amb20671394 [0,1,0,1,0,0|1,0,0]=3 10245 B8R1.7 NC(=O)[C@H]1CNCC1 Amb22405894 [0,1,0,1,0,0|1,0,0]=3 10246 B8R1.7 NC(=S)C1CCCN1 Amb19148043 [0,1,0,1,0,0|1,1,0]=4 10247 B8R1.7 NC(=S)C1CCCO1 Amb18108094 [0,1,0,1,0,0|1,1,0]=4 10248 B8R1.7 NC(=S)C1COCC1 Amb1114015 [0,1,0,1,0,0|1,1,0]=4 10249 B8R1.7 NC(=S)[C@@H]1CCCN1 Amb24588473 [0,1,0,1,0,0|1,1,0]=4 10250 B8R1.7 NC(=S)[C@H]1CCCN1 Amb24469314 [0,1,0,1,0,0|1,1,0]=4 10251 B8R1.7 NC(=[NH2+])N1CCCC1 Amb22269903 [0,1,0,1,0,0|2,0,0]=4 10252 B8R1.7 NC(O)C1CCCC1 Amb24351467 [0,1,0,1,0,0|1,0,1]=4 10253 B8R1.7 O=C(Cl)C1CC=CC1 Amb24371090 [0,1,0,1,0,0|1,0,1]=4 10254 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [0,1,0,1,0,0|1,0,0]=3 10255 B8R1.7 O=C(Cl)[C@H]1CCCN1 Amb24655823 [0,1,0,1,0,0|1,0,0]=3 10256 B8R1.7 O=C(S)N1CCCC1 Amb25827611 [0,1,0,1,0,0|0,1,0]=3 10257 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [0,1,0,1,0,0|0,1,0]=3 10258 B8R1.7 OB(C1CCCC1)O Amb2447144 [0,1,0,1,0,0|1,0,1]=4 10259 B8R1.7 OB(O)C1CCCN1 Amb25333023 [0,1,0,1,0,0|1,0,1]=4 10260 B8R1.7 OB(O)C1CCCO1 Amb24317356 [0,1,0,1,0,0|1,0,1]=4 10261 B8R1.7 OB(O)C1CNCC1 Amb22490638 [0,1,0,1,0,0|1,0,1]=4 10262 B8R1.7 OB(O)C1COCC1 Amb21858260 [0,1,0,1,0,0|1,0,1]=4 10263 B8R1.7 OB(O)[C@@H]1CCCN1 Amb24333761 [0,1,0,1,0,0|1,0,1]=4 10264 B8R1.7 OC(=O)C1=CCCN1 Amb17593173 [0,1,0,1,0,0|0,0,2]=4 10265 B8R1.7 OC(=O)C1=CCCO1 Amb19148920 [0,1,0,1,0,0|0,0,2]=4 10266 B8R1.7 OC(=O)C1=CCCS1 Amb18642795 [0,1,0,1,0,0|0,0,2]=4 10267 B8R1.7 OC(=O)C1=NCCS1 Amb18642837 [0,1,0,1,0,0|1,0,1]=4 10268 B8R1.7 OC(=O)C1C=CCN1 Amb22899488 [0,1,0,1,0,0|0,0,2]=4 10269 B8R1.7 OC(=O)C1C=CCO1 Amb18641762 [0,1,0,1,0,0|0,0,2]=4 10270 B8R1.7 OC(=O)C1C=CCS1 Amb18642794 [0,1,0,1,0,0|0,0,2]=4 10271 B8R1.7 OC(=O)C1CC=NN1 Amb18641765 [0,1,0,1,0,0|1,0,1]=4 10272 B8R1.7 OC(=O)C1CCC=C1 Amb18641680 [0,1,0,1,0,0|0,0,1]=3 10273 B8R1.7 OC(=O)C1CCCN1 Amb22040086 [0,1,0,1,0,0|0,0,0]=2 10274 B8R1.7 OC(=O)C1CCCN1 Amb2542766 [0,1,0,1,0,0|0,0,0]=2 10275 B8R1.7 OC(=O)C1CCCS1 Amb18124363 [0,1,0,1,0,0|0,0,0]=2 10276 B8R1.7 OC(=O)C1CCNN1 Amb18641878 [0,1,0,1,0,0|1,0,0]=3 10277 B8R1.7 OC(=O)C1CCON1 Amb24351403 [0,1,0,1,0,0|1,0,0]=3 10278 B8R1.7 OC(=O)C1CN=CS1 Amb25829554 [0,1,0,1,0,0|1,0,1]=4 10279 B8R1.7 OC(=O)C1CNC=N1 Amb25247319 [0,1,0,1,0,0|1,0,1]=4 10280 B8R1.7 OC(=O)C1CNCC1 Amb16230724 [0,1,0,1,0,0|0,0,0]=2 10281 B8R1.7 OC(=O)C1CNCC1 Amb16233446 [0,1,0,1,0,0|0,0,0]=2 10282 B8R1.7 OC(=O)C1CNCO1 Amb24359881 [0,1,0,1,0,0|1,0,0]=3 10283 B8R1.7 OC(=O)C1CNOC1 Amb24560626 [0,1,0,1,0,0|1,0,0]=3 10284 B8R1.7 OC(=O)C1CSC=C1 Amb18642796 [0,1,0,1,0,0|0,0,2]=4 10285 B8R1.7 OC(=O)C1CSCC1 Amb18124360 [0,1,0,1,0,0|0,0,0]=2 10286 B8R1.7 OC(=O)C1CSCN1 Amb2549799 [0,1,0,1,0,0|1,0,0]=3 10287 B8R1.7 OC(=O)C1CSSC1 Amb17593735 [0,1,0,1,0,0|1,0,0]=3 10288 B8R1.7 OC(=O)C1C[13CH2]CN1 Amb22367338 [0,1,0,1,0,0|0,0,0]=2 10289 B8R1.7 OC(=O)C1NCCO1 Amb24760849 [0,1,0,1,0,0|1,0,0]=3 10290 B8R1.7 OC(=O)C1NCCS1 Amb2444644 [0,1,0,1,0,0|1,0,0]=3 10291 B8R1.7 OC(=O)C1OCCO1 Amb24349582 [0,1,0,1,0,0|1,0,0]=3 10292 B8R1.7 OC(=O)C1SCCS1 Amb20669087 [0,1,0,1,0,0|1,0,0]=3 10293 B8R1.7 OC(=O)C=1CCCN1 Amb18641721 [0,1,0,1,0,0|0,0,1]=3 10294 B8R1.7 OC(=O)C=1CCOC1 Amb18124248 [0,1,0,1,0,0|0,0,2]=4 10295 B8R1.7 OC(=O)C=1CCON1 Amb24353499 [0,1,0,1,0,0|1,0,1]=4 10296 B8R1.7 OC(=O)C=1COCC1 Amb24434391 [0,1,0,1,0,0|0,0,2]=4 10297 B8R1.7 OC(=O)C=1CSCC1 Amb18642797 [0,1,0,1,0,0|0,0,2]=4 10298 B8R1.7 OC(=O)[C@@H]1C=CCN1 Amb22750611 [0,1,0,1,0,0|0,0,2]=4 10299 B8R1.7 OC(=O)[C@@H]1CCC=N1 Amb25075457 [0,1,0,1,0,0|0,0,1]=3 10300 B8R1.7 OC(=O)[C@@H]1COCC1 Amb22226787 [0,1,0,1,0,0|0,0,0]=2 10301 B8R1.7 OC(=O)[C@@H]1COCN1 Amb19515958 [0,1,0,1,0,0|1,0,0]=3 10302 B8R1.7 OC(=O)[C@@H]1NCCS1 Amb24383041 [0,1,0,1,0,0|1,0,0]=3 10303 B8R1.7 OC(=O)[C@H]1C=CCN1 Amb19515991 [0,1,0,1,0,0|0,0,2]=4 10304 B8R1.7 OC(=O)[C@H]1CCC=C1 Amb25304679 [0,1,0,1,0,0|0,0,1]=3 10305 B8R1.7 OC(=O)[C@H]1CCCS1 Amb24481353 [0,1,0,1,0,0|0,0,0]=2 10306 B8R1.7 OC(=O)[C@H]1CCSS1 Amb24738509 [0,1,0,1,0,0|1,0,0]=3 10307 B8R1.7 OC(=O)[C@H]1COCC1 Amb10603235 [0,1,0,1,0,0|0,0,0]=2 10308 B8R1.7 OC(=O)[C@H]1COCN1 Amb25733088 [0,1,0,1,0,0|1,0,0]=3 10309 B8R1.7 OC(=O)[C@H]1NCC=C1 Amb16183937 [0,1,0,1,0,0|0,0,2]=4 10310 B8R1.7 OC(O)C1CCCN1 Amb24557296 [0,1,0,1,0,0|0,0,2]=4 10311 B8R1.7 OS(=O)C1COCC1 Amb25713371 [0,1,0,1,0,0|1,0,0]=3 10312 B8R1.7 O[13C](=O)C1CCCN1 Amb22367492 [0,1,0,1,0,0|0,0,0]=2 10313 B8R1.7 O[13C](=O)[13C@@H]1[13CH2][13CH2][13CH2][15NH]1 Amb19133705 [0,1,0,1,0,0|0,0,0]=2 10314 B8R1.7 O[13C](=O)[C@@H]1CCCN1 Amb22336891 [0,1,0,1,0,0|0,0,0]=2 10315 B8R1.7 SC(=S)C1CNCC1 Amb24435436 [0,1,0,1,0,0|0,2,0]=4 10316 B8R1.7 [13CH3][13C](=O)C1=NCCC1 Amb17607638 [0,1,0,1,0,0|1,0,1]=4 10317 B8R1.7 [O-]C(=O)C1CSCN1 Amb10072986 [0,1,0,1,0,0|1,0,1]=4 10318 B8R1.7 [S-]C(=S)N1CCCC1 Amb15741178 [0,1,0,1,0,0|0,2,0]=4 10319 B8R1.7 [S-]C(=S)N1CCCC1 Amb22757636 [0,1,0,1,0,0|0,2,0]=4 10320 B8R1.19 CC1(O)CCCC1Br Amb24652228 [0,1,0,1,0,0|1,0,1]=4 10321 B8R1.19 CC1(O)CCCC1Cl Amb24481532 [0,1,0,1,0,0|1,0,1]=4 10322 B8R1.19 CC1(O)CCCC1I Amb24664976 [0,1,0,1,0,0|1,0,1]=4 10323 B8R1.19 CC1(O)CCCC1N Amb22295747 [0,1,0,1,0,0|1,0,1]=4 10324 B8R1.19 CC1(O)CCCC1O Amb24407803 [0,1,0,1,0,0|1,0,1]=4 10325 B8R1.19 CC1CCOS1(=O)=O Amb15692754 [0,1,0,1,0,0|1,0,1]=4 10326 B8R1.19 CC1COCC1(C)O Amb25837241 [0,1,0,1,0,0|1,0,1]=4 10327 B8R1.19 CC1NCCC1(C)O Amb24518636 [0,1,0,1,0,0|1,0,1]=4 10328 B8R1.19 CC1OCCC1(C)O Amb24726892 [0,1,0,1,0,0|1,0,1]=4 10329 B8R1.19 CN1CCCS1(=O)=O Amb19959571 [0,1,0,1,0,0|1,0,1]=4 10330 B8R1.19 C[C@@H]1COC[C@]1(C)O Amb22886885 [0,1,0,1,0,0|1,0,1]=4 10331 B8R1.19 C[C@@]1(O)CCC[C@@H]1Cl Amb25300344 [0,1,0,1,0,0|1,0,1]=4 10332 B8R1.19 C[C@@]1(O)CCC[C@H]1Br Amb24540069 [0,1,0,1,0,0|1,0,1]=4 10333 B8R1.19 C[C@H]1COC[C@@]1(C)O Amb24588378 [0,1,0,1,0,0|1,0,1]=4 10334 B8R1.19 O=S1(=O)CCCC1Cl Amb25856670 [0,1,0,1,0,0|1,0,1]=4 10335 B8R1.19 OC1CCCS1(=O)=O Amb25201898 [0,1,0,1,0,0|1,0,1]=4 10336 B8R1.27 CCCC1CC1(C)O Amb25132122 [0,1,0,1,0,0|1,0,1]=4 10337 B8R1.35 C=C(Br)CNC1CC1 Amb18969560 [0,1,0,1,0,0|2,0,0]=4 10338 B8R1.35 C=C(Cl)CNC1CC1 Amb18969181 [0,1,0,1,0,0|2,0,0]=4 10339 B8R1.35 CC(=C)CNC1CC1 Amb17317871 [0,1,0,1,0,0|2,0,0]=4 10340 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,1,0,1,0,0|1,0,0]=3 10341 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,1,0,1,0,0|2,0,0]=4 10342 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,1,0,1,0,0|2,0,0]=4 10343 B8R1.35 CC(=O)OCC1CC1 Amb24502182 [0,1,0,1,0,0|1,0,0]=3 10344 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,1,0,1,0,0|2,0,0]=4 10345 B8R1.35 CC(=O)SCC1CC1 Amb24623413 [0,1,0,1,0,0|1,0,0]=3 10346 B8R1.35 CC(=O)\C=C\C1CC1 Amb25830492 [0,1,0,1,0,0|1,0,1]=4 10347 B8R1.35 CC(CNC1CC1)O Amb17138364 [0,1,0,1,0,0|1,0,1]=4 10348 B8R1.35 CC(O)CCC1CC1 Amb25733792 [0,1,0,1,0,0|1,0,1]=4 10349 B8R1.35 C[C@@H](O)CCC1CC1 Amb24693085 [0,1,0,1,0,0|1,0,1]=4 10350 B8R1.35 C[C@@H](O)CNC1CC1 Amb25083354 [0,1,0,1,0,0|1,0,1]=4 10351 B8R1.35 C[C@H](O)CCC1CC1 Amb25025020 [0,1,0,1,0,0|1,0,1]=4 10352 B8R1.35 C[C@H](O)CC[C@@H]1CO1 Amb25284230 [0,1,0,1,0,0|1,0,1]=4 10353 B8R1.35 C[C@H](O)CNC1CC1 Amb25694355 [0,1,0,1,0,0|1,0,1]=4 10354 B8R1.35 NC(=N)CNC1CC1 Amb24495903 [0,1,0,1,0,0|2,0,0]=4 10355 B8R1.35 NC(=N)NCC1CC1 Amb19748557 [0,1,0,1,0,0|2,0,0]=4 10356 B8R1.35 NC(=N)SCC1CC1 Amb24364813 [0,1,0,1,0,0|2,0,0]=4 10357 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,1,0,1,0,0|1,0,0]=3 10358 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,1,0,1,0,0|1,0,0]=3 10359 B8R1.35 NC(=O)\C=C\C1CC1 Amb25226133 [0,1,0,1,0,0|1,0,1]=4 10360 B8R1.35 NC(=S)CCC1CC1 Amb24483097 [0,1,0,1,0,0|1,1,0]=4 10361 B8R1.35 NC(=S)CNC1CC1 Amb17231870 [0,1,0,1,0,0|1,1,0]=4 10362 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,1,0,1,0,0|1,0,0]=3 10363 B8R1.35 O=C(Cl)OCC1CC1 Amb24370017 [0,1,0,1,0,0|1,0,0]=3 10364 B8R1.35 O=C(Cl)OCC1CO1 Amb25258534 [0,1,0,1,0,0|2,0,0]=4 10365 B8R1.35 OC(=O)C#CC1CC1 Amb1036650 [0,1,0,1,0,0|0,0,1]=3 10366 B8R1.35 OC(=O)CC=C1CC1 Amb25119812 [0,1,0,1,0,0|0,0,1]=3 10367 B8R1.35 OC(=O)\C=C\C1CC1 Amb18285135 [0,1,0,1,0,0|0,0,1]=3 10368 B8R1.35 OC(=O)\C=C\C1CO1 Amb24548089 [0,1,0,1,0,0|0,0,2]=4 10369 B8R1.35 [O-]S(=O)CCC1CC1 Amb25212503 [0,1,0,1,0,0|1,0,1]=4 10370 B8R1.36 BrCCCCC1CO1 Amb16234127 [0,1,0,1,0,0|1,0,1]=4 10371 B8R1.36 CCCCCC1CO1 Amb19892425 [0,1,0,1,0,0|1,0,1]=4 10372 B8R1.36 CCCCC[C@H]1CO1 Amb10982594 [0,1,0,1,0,0|1,0,1]=4 10373 B8R1.36 CCCSC[C@@H]1CO1 Amb24733152 [0,1,0,1,0,0|1,0,1]=4 10374 B8R1.36 CCCSC[C@H]1CO1 Amb24385827 [0,1,0,1,0,0|1,0,1]=4 10375 B8R1.36 CCOCCC1CO1 Amb25679046 [0,1,0,1,0,0|1,0,1]=4 10376 B8R1.36 COCCCC1CO1 Amb24676522 [0,1,0,1,0,0|1,0,1]=4 10377 B8R1.36 CSCCCC1CO1 Amb24687956 [0,1,0,1,0,0|1,0,1]=4 10378 B8R1.36 ClCCCCC1CO1 Amb25727648 [0,1,0,1,0,0|1,0,1]=4 10379 B8R1.36 NCCCCC1CO1 Amb25843740 [0,1,0,1,0,0|1,0,1]=4 10380 B8R1.36 OCCCCC=1CC1 Amb25344996 [0,1,0,1,0,0|2,0,0]=4 10381 B8R1.36 OCCCC[C@@H]1CO1 Amb25832754 [0,1,0,1,0,0|1,0,1]=4 10382 B8R1.48 OCC1CCS1(=O)=O Amb25178802 [0,1,0,1,0,0|1,0,1]=4 10383 B8R1.72 CC1(O)CCCNC1 Amb10607739 [0,1,0,1,0,0|1,0,1]=4 10384 B8R1.72 CC1(O)CCNCC1 Amb18943983 [0,1,0,1,0,0|1,0,1]=4 10385 B8R1.72 CC1(O)CCNCC1 Amb19515938 [0,1,0,1,0,0|1,0,1]=4 10386 B8R1.72 CC1(O)CCOCC1 Amb19957780 [0,1,0,1,0,0|1,0,1]=4 10387 B8R1.72 CC1(O)CCSCC1 Amb24672466 [0,1,0,1,0,0|1,0,1]=4 10388 B8R1.72 CC1(O)CNCCC1 Amb22491963 [0,1,0,1,0,0|1,0,1]=4 10389 B8R1.72 CC1(O)COCCC1 Amb20668932 [0,1,0,1,0,0|1,0,1]=4 10390 B8R1.72 CP1(=O)CCNCC1 Amb24715796 [0,1,0,1,0,0|2,0,0]=4 10391 B8R1.72 C[Si]1(C)CCCCO1 Amb19893844 [0,1,0,1,0,0|1,1,0]=4 10392 B8R1.72 N=S1(=O)CCCCC1 Amb25258608 [0,1,0,1,0,0|2,0,0]=4 10393 B8R1.72 N=S1(=O)CCOCC1 Amb22169429 [0,1,0,1,0,0|2,0,0]=4 10394 B8R1.72 NC1(N)CCCCO1 Amb24451527 [0,1,0,1,0,0|1,0,1]=4 10395 B8R1.72 NC1(O)CCCCC1 Amb24481433 [0,1,0,1,0,0|1,0,1]=4 10396 B8R1.72 O=S1(=O)CCCCN1 Amb10068561 [0,1,0,1,0,0|1,0,1]=4 10397 B8R1.72 O=S1(=O)CCNCC1 Amb1102302 [0,1,0,1,0,0|1,0,1]=4 10398 B8R1.72 O=S1(=O)OCCCO1 Amb22233116 [0,1,0,1,0,0|2,0,0]=4 10399 B8R1.72 OC1(O)CCNCC1 Amb10789293 [0,1,0,1,0,0|0,0,2]=4 10400 B8R1.72 OC1(O)CCNCC1 Amb17619443 [0,1,0,1,0,0|0,0,2]=4 10401 B8R1.23 C=C1CC(C1)C(N)=O Amb22896664 [0,1,0,1,0,0|1,0,1]=4 10402 B8R1.23 CC(=C)C1CC(=O)C1 Amb25373403 [0,1,0,1,0,0|1,0,1]=4 10403 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,1,0,1,0,0|1,0,0]=3 10404 B8R1.23 CC(=O)N1CC(F)C1 Amb25106122 [0,1,0,1,0,0|2,0,0]=4 10405 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,1,0,1,0,0|2,0,0]=4 10406 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,1,0,1,0,0|2,0,0]=4 10407 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,1,0,1,0,0|2,0,0]=4 10408 B8R1.23 CC(C)C1CC(=O)C1 Amb25806486 [0,1,0,1,0,0|1,0,0]=3 10409 B8R1.23 CC(N)C1CC(O)C1 Amb24413900 [0,1,0,1,0,0|1,0,1]=4 10410 B8R1.23 CC(N)[C@@H]1C[C@H](O)C1 Amb22899694 [0,1,0,1,0,0|1,0,1]=4 10411 B8R1.23 CC(O)C1CC(=O)O1 Amb25317296 [0,1,0,1,0,0|0,0,0]=2 10412 B8R1.23 CC1CC(C1)C(=O)Cl Amb24361916 [0,1,0,1,0,0|1,0,0]=3 10413 B8R1.23 CC1CC(C1)C(C)=O Amb23590280 [0,1,0,1,0,0|1,0,0]=3 10414 B8R1.23 CC1CC(C1)C(C)O Amb23590278 [0,1,0,1,0,0|1,0,1]=4 10415 B8R1.23 CC1CC(C1)C(O)=O Amb19515989 [0,1,0,1,0,0|0,0,0]=2 10416 B8R1.23 CC1CN(C1)C(C)=O Amb25044287 [0,1,0,1,0,0|2,0,0]=4 10417 B8R1.23 CC=1CC(C1)C(C)=O Amb24676939 [0,1,0,1,0,0|1,0,1]=4 10418 B8R1.23 CN1CC(C1)C(O)=O Amb19958116 [0,1,0,1,0,0|1,0,0]=3 10419 B8R1.23 C[C@@H]1C[C@@H](C1)C(O)=O Amb22746374 [0,1,0,1,0,0|0,0,0]=2 10420 B8R1.23 C[C@@H]1C[C@H](C1)C(O)=O Amb22746375 [0,1,0,1,0,0|0,0,0]=2 10421 B8R1.23 C[C@H](O)[C@@H]1CC(=O)O1 Amb24515159 [0,1,0,1,0,0|0,0,0]=2 10422 B8R1.23 C[C@H]1C[C@H](N1)C(O)=O Amb24514390 [0,1,0,1,0,0|0,0,0]=2 10423 B8R1.23 ClC(=O)C1CC(=C)C1 Amb10071441 [0,1,0,1,0,0|1,0,1]=4 10424 B8R1.23 ClC1CC(C1)C(=O)O Amb16233600 [0,1,0,1,0,0|0,0,0]=2 10425 B8R1.23 NC(=O)C1CC(=O)C1 Amb22896730 [0,1,0,1,0,0|1,0,1]=4 10426 B8R1.23 NC(=O)C1CC(O)C1 Amb23570502 [0,1,0,1,0,0|1,0,0]=3 10427 B8R1.23 NC(=O)N1CC(F)C1 Amb25739433 [0,1,0,1,0,0|2,0,0]=4 10428 B8R1.23 NC1CC(C1)C(=O)O Amb10610660 [0,1,0,1,0,0|0,0,0]=2 10429 B8R1.23 NC1CC(C1)C(N)=O Amb20622654 [0,1,0,1,0,0|1,0,0]=3 10430 B8R1.23 NC1CC(C1)C(O)=O Amb21963541 [0,1,0,1,0,0|0,0,0]=2 10431 B8R1.23 N[C@@H]1C[C@@H](C1)C(=O)O Amb10604131 [0,1,0,1,0,0|0,0,0]=2 10432 B8R1.23 N[C@@H]1C[C@@H](C1)C(N)=O Amb22896793 [0,1,0,1,0,0|1,0,0]=3 10433 B8R1.23 N[C@@H]1C[C@H](C1)C(=O)O Amb10604102 [0,1,0,1,0,0|0,0,0]=2 10434 B8R1.23 N[C@@H]1C[C@H](C1)C(N)=O Amb22896794 [0,1,0,1,0,0|1,0,0]=3 10435 B8R1.23 N[C@@H]1C[C@H](C1)C(O)=O Amb19514893 [0,1,0,1,0,0|0,0,0]=2 10436 B8R1.23 O=C(Cl)C1CC(Cl)C1 Amb24739809 [0,1,0,1,0,0|1,0,0]=3 10437 B8R1.23 O=C1CC(C1)C(=O)Cl Amb16230813 [0,1,0,1,0,0|1,0,1]=4 10438 B8R1.23 O=C1CC(C1)C(=O)O Amb1106387 [0,1,0,1,0,0|0,0,1]=3 10439 B8R1.23 O=C1CC(N1)C(=O)O Amb16232079 [0,1,0,1,0,0|1,0,1]=4 10440 B8R1.23 O=C1C[C@@H](O1)C(Cl)Cl Amb25108146 [0,1,0,1,0,0|1,0,0]=3 10441 B8R1.23 OC(=O)C1CC(F)C1 Amb20621267 [0,1,0,1,0,0|0,0,0]=2 10442 B8R1.23 OC(=O)[C@@H]1CC(=O)N1 Amb22367070 [0,1,0,1,0,0|1,0,1]=4 10443 B8R1.23 OC(=O)[C@@H]1C[C@@H](Br)C1 Amb24339433 [0,1,0,1,0,0|0,0,0]=2 10444 B8R1.23 OC(=O)[C@H]1CC(=O)O1 Amb25705638 [0,1,0,1,0,0|1,0,1]=4 10445 B8R1.23 OC1CC(C1)C(=O)Cl Amb24661280 [0,1,0,1,0,0|1,0,0]=3 10446 B8R1.23 O[C@@H]1C[C@H](C1)C(O)=O Amb19516178 [0,1,0,1,0,0|0,0,0]=2 10447 B8R1.23 O[C@H]1C[C@H](C1)C(O)=O Amb19516179 [0,1,0,1,0,0|0,0,0]=2 10448 B8R1.30 C=C1CC1(N)C(O)=O Amb22274582 [0,1,0,1,0,0|0,0,2]=4 10449 B8R1.30 CC(=O)C1(C)CC1Cl Amb24481567 [0,1,0,1,0,0|2,0,0]=4 10450 B8R1.30 CC(=O)C1(C)CC1F Amb25248317 [0,1,0,1,0,0|2,0,0]=4 10451 B8R1.30 CC(=O)[C@@]1(C)C[C@H]1Br Amb25176069 [0,1,0,1,0,0|2,0,0]=4 10452 B8R1.30 CC(=O)[C@]1(C)C[C@@H]1Br Amb25242518 [0,1,0,1,0,0|2,0,0]=4 10453 B8R1.30 CC(=O)[C@]1(C)C[C@H]1Br Amb24698158 [0,1,0,1,0,0|2,0,0]=4 10454 B8R1.30 CC1(CC1Br)C(N)=O Amb24687532 [0,1,0,1,0,0|2,0,0]=4 10455 B8R1.30 CC1(CC1Cl)C(=O)Cl Amb25700456 [0,1,0,1,0,0|2,0,0]=4 10456 B8R1.30 CC1(CC1F)C(N)=O Amb24630009 [0,1,0,1,0,0|2,0,0]=4 10457 B8R1.30 CC1(CC1F)C(O)=O Amb24445672 [0,1,0,1,0,0|1,0,0]=3 10458 B8R1.30 CC1(OC1C)C(=O)O Amb17593199 [0,1,0,1,0,0|1,0,0]=3 10459 B8R1.30 CC1CC1(C)C(C)=O Amb24570372 [0,1,0,1,0,0|1,0,0]=3 10460 B8R1.30 CC1CC1(C)C(C)O Amb24705805 [0,1,0,1,0,0|1,0,1]=4 10461 B8R1.30 CC1CC1(Cl)C(O)=O Amb25376529 [0,1,0,1,0,0|0,0,0]=2 10462 B8R1.30 CC1CC1(O)C(O)=O Amb24481340 [0,1,0,1,0,0|0,0,0]=2 10463 B8R1.30 CC1OC1(C)C(C)=O Amb25745803 [0,1,0,1,0,0|2,0,0]=4 10464 B8R1.30 CC1OC1(C)C(N)=O Amb24482460 [0,1,0,1,0,0|2,0,0]=4 10465 B8R1.30 CC1OC1(Cl)C(O)=O Amb24604328 [0,1,0,1,0,0|1,0,0]=3 10466 B8R1.30 C[C@@H]1C[C@@]1(C)C(O)=O Amb24680945 [0,1,0,1,0,0|0,0,0]=2 10467 B8R1.30 C[C@@H]1C[C@@]1(C)[C@@H](C)O Amb25285546 [0,1,0,1,0,0|1,0,1]=4 10468 B8R1.30 C[C@@H]1C[C@@]1(N)C(O)=O Amb23452877 [0,1,0,1,0,0|0,0,0]=2 10469 B8R1.30 C[C@@H]1C[C@]1(N)C(O)=O Amb23452872 [0,1,0,1,0,0|0,0,0]=2 10470 B8R1.30 C[C@@H]1C[C@]1(O)C(O)=O Amb24630291 [0,1,0,1,0,0|0,0,0]=2 10471 B8R1.30 C[C@@H]1O[C@@]1(C)C(N)=O Amb24760855 [0,1,0,1,0,0|2,0,0]=4 10472 B8R1.30 C[C@@H]1O[C@@]1(C)C(O)=O Amb25174091 [0,1,0,1,0,0|1,0,0]=3 10473 B8R1.30 C[C@@]1(C[C@H]1Cl)C(O)=O Amb25025974 [0,1,0,1,0,0|1,0,0]=3 10474 B8R1.30 C[C@H]1CC1(N)C(O)=O Amb25064269 [0,1,0,1,0,0|0,0,0]=2 10475 B8R1.30 C[C@H]1C[C@@]1(O)C(O)=O Amb25174792 [0,1,0,1,0,0|0,0,0]=2 10476 B8R1.30 C[C@H]1C[C@]1(C)C(C)=O Amb24550104 [0,1,0,1,0,0|1,0,0]=3 10477 B8R1.30 C[C@H]1O[C@@]1(C)C(C)=O Amb25207221 [0,1,0,1,0,0|2,0,0]=4 10478 B8R1.30 C[C@]1(C[C@@H]1F)C(O)=O Amb24053139 [0,1,0,1,0,0|1,0,0]=3 10479 B8R1.30 N[C@@]1(C[C@H]1Cl)C(O)=O Amb22748908 [0,1,0,1,0,0|1,0,0]=3 10480 B8R1.30 N[C@]1(C[C@@H]1Cl)C(O)=O Amb25245700 [0,1,0,1,0,0|1,0,0]=3 10481 B8R1.30 N[C@]1(C[C@H]1Br)C(O)=O Amb24567904 [0,1,0,1,0,0|1,0,0]=3 10482 B8R1.37 CCCC(Br)C1CO1 Amb25685425 [0,1,0,1,0,0|1,0,1]=4 10483 B8R1.37 CCCC(O)C1CO1 Amb24556410 [0,1,0,1,0,0|1,0,1]=4 10484 B8R1.37 CCC[C@H](Br)[C@@H]1CO1 Amb24601424 [0,1,0,1,0,0|1,0,1]=4 10485 B8R1.37 CCC[C@H](O)[C@H]1CO1 Amb24687701 [0,1,0,1,0,0|1,0,1]=4 10486 B8R1.54 C=C(C1CC1)C(O)=O Amb24481397 [0,1,0,1,0,0|0,0,1]=3 10487 B8R1.54 CC(=O)C(=O)C1CC1 Amb20241141 [0,1,0,1,0,0|1,0,1]=4 10488 B8R1.54 CC(C(=O)O)C1CC1 Amb17087493 [0,1,0,1,0,0|0,0,0]=2 10489 B8R1.54 CC(C(O)=O)=C1CC1 Amb24450586 [0,1,0,1,0,0|0,0,2]=4 10490 B8R1.54 CC(C1CC1)C(=O)Cl Amb25244618 [0,1,0,1,0,0|1,0,0]=3 10491 B8R1.54 CC(C1CC1)C(C)=O Amb25798488 [0,1,0,1,0,0|1,0,0]=3 10492 B8R1.54 CC(C1CC1)C(N)=N Amb23443623 [0,1,0,1,0,0|2,0,0]=4 10493 B8R1.54 CC(C1CC1)C(N)=O Amb23443624 [0,1,0,1,0,0|1,0,0]=3 10494 B8R1.54 CC(C1CC1)C(N)=S Amb23443616 [0,1,0,1,0,0|1,1,0]=4 10495 B8R1.54 C[C@@H](O)[C@H](N)C1CC1 Amb24604396 [0,1,0,1,0,0|1,0,1]=4 10496 B8R1.54 NC(=O)C(O)C1CC1 Amb20630809 [0,1,0,1,0,0|1,0,0]=3 10497 B8R1.54 NC(C1CC1)C(=O)Cl Amb25733572 [0,1,0,1,0,0|1,0,0]=3 10498 B8R1.54 NC(C1CC1)C(N)=O Amb18282442 [0,1,0,1,0,0|1,0,0]=3 10499 B8R1.54 NC(C1CC1)C(O)=O Amb19515010 [0,1,0,1,0,0|0,0,0]=2 10500 B8R1.54 N[C@@H](C1CC1)C(O)=O Amb19929447 [0,1,0,1,0,0|0,0,0]=2 10501 B8R1.54 O=C(C(=O)O)C1CC1 Amb16233327 [0,1,0,1,0,0|0,0,1]=3 10502 B8R1.54 OC(=O)C(Br)C1CC1 Amb24634830 [0,1,0,1,0,0|0,0,0]=2 10503 B8R1.54 OC(=O)C(Cl)=C1CC1 Amb24427356 [0,1,0,1,0,0|0,0,2]=4 10504 B8R1.54 OC(=O)C(Cl)C1CC1 Amb24333436 [0,1,0,1,0,0|0,0,0]=2 10505 B8R1.54 OC(C1CC1)C(O)=O Amb18282441 [0,1,0,1,0,0|0,0,0]=2 10506 B8R1.54 O[C@@H](C1CC1)C(O)=O Amb25312037 [0,1,0,1,0,0|0,0,0]=2 10507 B8R1.54 O[C@H](C1CC1)C(O)=O Amb25715899 [0,1,0,1,0,0|0,0,0]=2 10508 B8R1.54 [O-]C(=O)C(=O)C1CC1 Amb22641890 [0,1,0,1,0,0|0,0,2]=4 10509 B8R1.78 CC(=O)C1(C)CNC1 Amb24622325 [0,1,0,1,0,0|2,0,0]=4 10510 B8R1.78 CC(=O)C1(C)COC1 Amb22406104 [0,1,0,1,0,0|2,0,0]=4 10511 B8R1.78 CC1(CCC1)C(=O)Cl Amb24533834 [0,1,0,1,0,0|1,0,0]=3 10512 B8R1.78 CC1(CCN1)C(O)=O Amb24483061 [0,1,0,1,0,0|1,0,0]=3 10513 B8R1.78 CC1(CCO1)C(O)=O Amb22001906 [0,1,0,1,0,0|1,0,0]=3 10514 B8R1.78 CC1(CNC1)C(O)=O Amb24077476 [0,1,0,1,0,0|1,0,0]=3 10515 B8R1.78 CC1(CNC1)C(O)=O Amb24561978 [0,1,0,1,0,0|1,0,0]=3 10516 B8R1.78 CC1(CSC1)C(O)=O Amb21960451 [0,1,0,1,0,0|1,0,0]=3 10517 B8R1.78 C[C@]1(CCN1)C(O)=O Amb25726906 [0,1,0,1,0,0|1,0,0]=3 10518 B8R1.78 NC(=O)C1(Br)CCC1 Amb24481413 [0,1,0,1,0,0|1,0,0]=3 10519 B8R1.78 NC(=O)C1(N)CCC1 Amb18523727 [0,1,0,1,0,0|1,0,0]=3 10520 B8R1.78 NC(=O)C1(N)CCC1 Amb22137941 [0,1,0,1,0,0|1,0,0]=3 10521 B8R1.78 NC(=O)C1(N)COC1 Amb24483241 [0,1,0,1,0,0|2,0,0]=4 10522 B8R1.78 NC(=O)C1(O)CCC1 Amb24122570 [0,1,0,1,0,0|1,0,0]=3 10523 B8R1.78 NC(=O)C1(O)CNC1 Amb25246646 [0,1,0,1,0,0|2,0,0]=4 10524 B8R1.78 NC1(CCC1)C(=O)Cl Amb24567984 [0,1,0,1,0,0|1,0,0]=3 10525 B8R1.78 NC1(CNC1)C(O)=O Amb19895006 [0,1,0,1,0,0|1,0,0]=3 10526 B8R1.78 NC1(CNC1)C(O)=O Amb21960937 [0,1,0,1,0,0|1,0,0]=3 10527 B8R1.78 NC1(COC1)C(O)=O Amb18199133 [0,1,0,1,0,0|1,0,0]=3 10528 B8R1.78 NC1(CSC1)C(O)=O Amb21927718 [0,1,0,1,0,0|1,0,0]=3 10529 B8R1.78 OC(=O)C1(C)CCC1 Amb10843968 [0,1,0,1,0,0|0,0,0]=2 10530 B8R1.78 OC(=O)C1(C)COC1 Amb13883560 [0,1,0,1,0,0|1,0,0]=3 10531 B8R1.78 OC(=O)C1(Cl)CCC1 Amb24422884 [0,1,0,1,0,0|0,0,0]=2 10532 B8R1.78 OC(=O)C1(F)CCC1 Amb22886536 [0,1,0,1,0,0|0,0,0]=2 10533 B8R1.78 OC(=O)C1(F)CNC1 Amb23440120 [0,1,0,1,0,0|1,0,0]=3 10534 B8R1.78 OC(=O)C1(F)COC1 Amb24541298 [0,1,0,1,0,0|1,0,0]=3 10535 B8R1.78 OC(=O)C1(O)CNC1 Amb24122891 [0,1,0,1,0,0|1,0,0]=3 10536 B8R1.78 OC(=O)C1(O)COC1 Amb25714262 [0,1,0,1,0,0|1,0,0]=3 10537 B8R1.78 OC(=O)C1(O)CSC1 Amb25259612 [0,1,0,1,0,0|1,0,0]=3 10538 B8R1.78 [O-][N+](=O)C1(Br)CCC1 Amb25841397 [0,1,0,1,0,0|1,0,1]=4 10539 B8R1.69 CC1(C)CCC1(C)O Amb25052578 [0,1,0,1,0,0|1,0,1]=4 10540 B8R1.69 CC1(C)CCS1(=O)=O Amb22365064 [0,1,0,1,0,0|1,0,1]=4 10541 B8R1.69 CC1(O)CCC1(C)N Amb24117489 [0,1,0,1,0,0|1,0,1]=4 10542 B8R1.69 CC1(O)CCC1(C)N Amb25843376 [0,1,0,1,0,0|1,0,1]=4 10543 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,1,0,1,0,0|1,0,0]=3 10544 B8R1.77 CC(=O)C1CC1(F)F Amb25219948 [0,1,0,1,0,0|2,0,0]=4 10545 B8R1.77 CC(O)C1CC1(C)C Amb25859391 [0,1,0,1,0,0|1,0,1]=4 10546 B8R1.77 CC(O)[C@H]1CC1(C)C Amb25185137 [0,1,0,1,0,0|1,0,1]=4 10547 B8R1.77 CC1(C)C=C1C(O)=O Amb24746031 [0,1,0,1,0,0|0,0,2]=4 10548 B8R1.77 CC1(C)NC1C(O)=O Amb23401629 [0,1,0,1,0,0|1,0,0]=3 10549 B8R1.77 CC1(C)OC1C(N)=O Amb25324328 [0,1,0,1,0,0|2,0,0]=4 10550 B8R1.77 CC1(C)OC1C(O)=O Amb24481352 [0,1,0,1,0,0|1,0,0]=3 10551 B8R1.77 CC1(C)S[C@H]1C(O)=O Amb24445654 [0,1,0,1,0,0|1,0,0]=3 10552 B8R1.77 CC1(Cl)CC1C(O)=O Amb24629731 [0,1,0,1,0,0|0,0,0]=2 10553 B8R1.77 C[C@@H](O)C1CC1(C)C Amb25074915 [0,1,0,1,0,0|1,0,1]=4 10554 B8R1.77 ClC(=O)C1CC1(C)C Amb16230811 [0,1,0,1,0,0|1,0,0]=3 10555 B8R1.77 ClC(=O)C1CC1(Cl)Cl Amb16230810 [0,1,0,1,0,0|2,0,0]=4 10556 B8R1.77 NC(=O)C1CC1(Br)Br Amb22460226 [0,1,0,1,0,0|2,0,0]=4 10557 B8R1.77 NC(=O)C1CC1(F)F Amb24715693 [0,1,0,1,0,0|2,0,0]=4 10558 B8R1.77 NC(=O)[C@@H]1CC1(C)C Amb10072071 [0,1,0,1,0,0|1,0,0]=3 10559 B8R1.77 OC(=O)C1CC1(Br)Br Amb24651946 [0,1,0,1,0,0|1,0,0]=3 10560 B8R1.77 OC(=O)C1CC1(Cl)Cl Amb1106460 [0,1,0,1,0,0|1,0,0]=3 10561 B8R1.77 OC(=O)C1CC1(F)Cl Amb10841879 [0,1,0,1,0,0|1,0,0]=3 10562 B8R1.21 CC1OC1P(O)(O)=O Amb22730952 [0,1,0,1,0,0|2,0,0]=4 10563 B8R1.21 C[C@@H]1O[C@@H]1P(O)(=O)=O Amb22801578 [0,1,0,1,0,0|2,0,0]=4 10564 B8R1.21 C[C@@H]1O[C@@H]1P(O)(O)=O Amb22167220 [0,1,0,1,0,0|2,0,0]=4 10565 B8R1.21 C[C@@H]1O[C@@H]1P(O)(O)=O Amb25328384 [0,1,0,1,0,0|2,0,0]=4 10566 B8R1.21 [13CH3][13CH]1O[13CH]1P(=O)(O)O Amb17614611 [0,1,0,1,0,0|2,0,0]=4 10567 B8R1.55 CC(C)(O)C1CCC1 Amb24733544 [0,1,0,1,0,0|1,0,1]=4 10568 B8R1.55 NS(=O)(=O)C1CCC1 Amb22896754 [0,1,0,1,0,0|1,0,1]=4 10569 B8R1.55 O=S(=O)(Cl)C1CCC1 Amb22001055 [0,1,0,1,0,0|1,0,1]=4 10570 B8R1.55 OP(O)(=O)C1CCN1 Amb24481363 [0,1,0,1,0,0|2,0,0]=4 10571 B8R1.55 OP(O)(=O)C1CNC1 Amb24693640 [0,1,0,1,0,0|2,0,0]=4 10572 B8R1.55 OS(=O)(=O)C1CNC1 Amb24693636 [0,1,0,1,0,0|2,0,0]=4 10573 B8R1.56 CC(C)(O)CC1CC1 Amb24689606 [0,1,0,1,0,0|1,0,1]=4 10574 B8R1.56 NS(=O)(=O)CC1CC1 Amb19338125 [0,1,0,1,0,0|1,0,1]=4 10575 B8R1.56 O=S(=O)(Cl)CC1CC1 Amb18176559 [0,1,0,1,0,0|1,0,1]=4 10576 B8R1.56 [O-]S(=O)(=O)CC1CC1 Amb25242906 [0,1,0,1,0,0|1,0,1]=4 10577 B8R2.4 O=C1CC2CC1C2 Amb24426322 [0,0,0,2,0,0|1,0,0]=3 10578 B8R2.4 O[C@@H]1C[C@H]2C[C@@H]1C2 Amb25272289 [0,0,0,2,0,0|1,0,1]=4 10579 B8R2.18 O=C1CC2CC2C1 Amb25750119 [0,0,0,2,0,0|1,0,0]=3 10580 B8R2.18 O=C1CC2OC2C1 Amb25050255 [0,0,0,2,0,0|2,0,0]=4 10581 B8R2.18 O=C1C[C@@H]2O[C@@H]2C1 Amb25768575 [0,0,0,2,0,0|2,0,0]=4 10582 B8R2.18 OC1CC2CC2C1 Amb21864713 [0,0,0,2,0,0|1,0,1]=4 10583 B8R2.18 O[C@@H]1C[C@@H]2C[C@@H]2C1 Amb22746717 [0,0,0,2,0,0|1,0,1]=4 10584 B8R2.18 O[C@@H]1C[C@H]2C[C@H]2C1 Amb24576455 [0,0,0,2,0,0|1,0,1]=4 10585 B8R2.34 C1C[C@H]2CC[C@@H]1O2 Amb24364652 [0,0,0,2,0,0|1,0,1]=4 10586 B8R2.38 O=C1CCC2CC12 Amb22736104 [0,0,0,2,0,0|1,0,0]=3 10587 B8R2.38 O=C1CC[C@@H]2C[C@H]12 Amb24623125 [0,0,0,2,0,0|1,0,0]=3 10588 B8R2.38 O=C1CC[C@@H]2O[C@H]12 Amb25025235 [0,0,0,2,0,0|2,0,0]=4 10589 B8R2.38 O=C1CNC2CC12 Amb25104969 [0,0,0,2,0,0|2,0,0]=4 10590 B8R2.38 O=C1NCC2CC12 Amb22546330 [0,0,0,2,0,0|1,0,0]=3 10591 B8R2.38 O=C1NC[C@H]2C[C@@H]12 Amb24654659 [0,0,0,2,0,0|1,0,0]=3 10592 B8R2.38 O=C1NC[C@H]2O[C@@H]12 Amb25261527 [0,0,0,2,0,0|2,0,0]=4 10593 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|0,0,0]=2 10594 B8R2.38 O=C1OCC2OC12 Amb24061718 [0,0,0,2,0,0|1,0,0]=3 10595 B8R2.38 OC1CCC2CC21 Amb25040476 [0,0,0,2,0,0|1,0,1]=4 10596 B8R2.38 OC1CC[C@@H]2C[C@@H]21 Amb25128724 [0,0,0,2,0,0|1,0,1]=4 10597 B8R2.38 OC1CC[C@H]2C[C@H]21 Amb25240579 [0,0,0,2,0,0|1,0,1]=4 10598 B8R2.38 OC1OC[C@H]2C[C@H]21 Amb25175311 [0,0,0,2,0,0|0,0,2]=4 10599 B8R2.38 O[C@H]1CC[C@@H]2C[C@@H]21 Amb25811014 [0,0,0,2,0,0|1,0,1]=4 10600 B8R2.2 CC12CCCC1O2 Amb22338783 [0,0,0,2,0,0|1,0,1]=4 10601 B8R2.5 O=C1CC2CCC12 Amb24614514 [0,0,0,2,0,0|1,0,0]=3 10602 B8R2.5 O=C1NC2CCC12 Amb25026050 [0,0,0,2,0,0|1,0,0]=3 10603 B8R2.5 O=C1OC2C=CC12 Amb24751511 [0,0,0,2,0,0|0,0,2]=4 10604 B8R2.5 O[C@@H]1C[C@H]2CC[C@H]21 Amb25176278 [0,0,0,2,0,0|1,0,1]=4 10605 B8R2.11 O=C1C=2CCCC21 Amb25273112 [0,0,0,2,0,0|1,0,1]=4 10606 B8R2.11 OC1[C@H]2CCC[C@H]21 Amb25283489 [0,0,0,2,0,0|1,0,1]=4 10607 B8R2.11 O[C@@H]1[C@@H]2CCC[C@@H]21 Amb25344987 [0,0,0,2,0,0|1,0,1]=4 10608 B8R2.25 C1CCC2C(C1)O2 Amb1106363 [0,0,0,2,0,0|1,0,1]=4 10609 B8R2.24 C(C1CO1)C2CC2 Amb25088515 [0,0,0,2,0,0|1,0,1]=4 10610 B8R2.55 C1OC12CCCC2 Amb19375048 [0,0,0,2,0,0|1,0,1]=4 10611 B8R2.53 O=C1CC2(C1)CC2 Amb24106341 [0,0,0,2,0,0|1,0,0]=3 10612 B8R2.66 CC(=O)C12CC1C2 Amb25723785 [0,0,0,2,0,0|1,0,0]=3 10613 B8R2.66 OC(=O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|0,0,0]=2