0 B10R0.2 CC#CC(=O)CC(=O)OCC Amb24766740 [0,0,0,0,0,0|1,0,1]=2 1 B10R0.2 CC(CC(=O)OCC)SCC Amb18804594 [0,0,0,0,0,0|1,1,1]=3 2 B10R0.2 CC(CCC)=CC(=O)OCC Amb22230723 [0,0,0,0,0,0|2,0,1]=3 3 B10R0.2 CC(NCC)=NC(=O)CCC Amb25386414 [0,0,0,0,0,0|4,0,0]=4 4 B10R0.2 CCCC(=O)NC(=N)CCC Amb25384376 [0,0,0,0,0,0|4,0,0]=4 5 B10R0.2 CCCC(=O)NC(=O)CCC Amb25385979 [0,0,0,0,0,0|3,0,0]=3 6 B10R0.2 CCCC(=O)NC(=O)OCC Amb25385791 [0,0,0,0,0,0|2,0,0]=2 7 B10R0.2 CCCC(=O)NC(=O)SCC Amb25384444 [0,0,0,0,0,0|2,1,0]=3 8 B10R0.2 CCCC(CC(=O)OCC)N Amb10607611 [0,0,0,0,0,0|2,0,1]=3 9 B10R0.2 CCCC(CC(=O)OCC)O Amb10807459 [0,0,0,0,0,0|1,0,2]=3 10 B10R0.2 CCCC(N)CC(=O)OCC Amb22586906 [0,0,0,0,0,0|2,0,1]=3 11 B10R0.2 CCNC(=O)CC(=O)NCC Amb2099640 [0,0,0,0,0,0|2,0,0]=2 12 B10R0.2 CCNC(=S)CC(=O)NCC Amb25385285 [0,0,0,0,0,0|2,1,0]=3 13 B10R0.2 CCNC(=S)NC(=O)CCC Amb24366627 [0,0,0,0,0,0|3,1,0]=4 14 B10R0.2 CCN\C(=C\C(=O)OCC)\C Amb10602305 [0,0,0,0,0,0|2,0,1]=3 15 B10R0.2 CCOC(=N)CC(=N)OCC Amb20655813 [0,0,0,0,0,0|2,0,0]=2 16 B10R0.2 CCOC(=N)CC(=N)OCC Amb21857173 [0,0,0,0,0,0|2,0,0]=2 17 B10R0.2 CCOC(=N)CC(=O)OCC Amb1102037 [0,0,0,0,0,0|1,0,0]=1 18 B10R0.2 CCOC(=O)CC(=O)CC#N Amb10070791 [0,0,0,0,0,0|2,0,1]=3 19 B10R0.2 CCOC(=O)C[C@@H](O)CCN Amb23401359 [0,0,0,0,0,0|2,0,2]=4 20 B10R0.2 CCOC(=O)NC(=N)OCC Amb24766330 [0,0,0,0,0,0|2,0,0]=2 21 B10R0.2 CCOC(=O)NC(=O)CC#N Amb2408782 [0,0,0,0,0,0|3,0,1]=4 22 B10R0.2 CCOC(=O)NC(=O)CCCl Amb24767127 [0,0,0,0,0,0|3,0,0]=3 23 B10R0.2 CCOC(=O)NC(=S)CCC Amb25385929 [0,0,0,0,0,0|2,1,0]=3 24 B10R0.2 CCOC(=O)NC(=S)NCC Amb25729862 [0,0,0,0,0,0|2,1,0]=3 25 B10R0.2 CCOC(=O)[13CH2]C(=O)OCC Amb22336357 [0,0,0,0,0,0|0,0,0]=0 26 B10R0.2 CCOC(=O)[CH-]C(=O)OCC Amb22346257 [0,0,0,0,0,0|0,0,1]=1 27 B10R0.2 CCOC(=S)NC(=N)OCC Amb24766542 [0,0,0,0,0,0|2,1,0]=3 28 B10R0.2 CCOC(=S)NC(=O)OCC Amb25384430 [0,0,0,0,0,0|1,1,0]=2 29 B10R0.2 CCOC(=S)NC(=S)OCC Amb25385734 [0,0,0,0,0,0|1,2,0]=3 30 B10R0.2 CCO[13C](=O)C[13C](=O)OCC Amb22336530 [0,0,0,0,0,0|0,0,0]=0 31 B10R0.2 CCO[13C](=O)[13CH2][13C](=O)OCC Amb22055091 [0,0,0,0,0,0|0,0,0]=0 32 B10R0.2 CCO\C(=C/C(=O)OCC)\C Amb10069570 [0,0,0,0,0,0|1,0,1]=2 33 B10R0.2 CCSC(=N)NC(=O)OCC Amb25384763 [0,0,0,0,0,0|2,1,0]=3 34 B10R0.2 CCSC(=O)NC(=O)SCC Amb25384734 [0,0,0,0,0,0|1,2,0]=3 35 B10R0.2 CCSC(=S)NC(=O)CCC Amb25384646 [0,0,0,0,0,0|2,2,0]=4 36 B10R0.2 CCSC(=S)NC(=O)OCC Amb25385703 [0,0,0,0,0,0|1,2,0]=3 37 B10R0.2 CNCC(=O)NC(=O)NCC Amb25163211 [0,0,0,0,0,0|4,0,0]=4 38 B10R0.2 CNNC(=O)CC(=O)NNC Amb25384269 [0,0,0,0,0,0|4,0,0]=4 39 B10R0.2 COCC(=O)NC(=O)OCC Amb25384736 [0,0,0,0,0,0|3,0,0]=3 40 B10R0.2 C\C(=C/C(=O)CCC)\NCC Amb24766941 [0,0,0,0,0,0|3,0,1]=4 41 B10R0.2 C\C(=C/CC)\NC(=O)OCC Amb24484585 [0,0,0,0,0,0|3,0,0]=3 42 B10R0.2 C\C(=C\C(=O)OCC)\NCC Amb20621200 [0,0,0,0,0,0|2,0,1]=3 43 B10R0.2 C\C(=N/C(=O)OCC)\OCC Amb23569348 [0,0,0,0,0,0|2,0,0]=2 44 B10R0.2 C\C(\CCC)=C\C(=O)OCC Amb22727870 [0,0,0,0,0,0|2,0,1]=3 45 B10R0.2 C\C=C\C(=O)CC(=O)\C=C\C Amb24766914 [0,0,0,0,0,0|2,0,2]=4 46 B9R0.5 CC=C=CCC(=O)CCC Amb24570875 [1,0,0,0,0,0|2,0,1]=4 47 B9R0.5 CC=C\C=C\C(=O)OCC Amb25115104 [1,0,0,0,0,0|1,0,2]=4 48 B9R0.5 CCCC(=O)CCNCC Amb24568186 [1,0,0,0,0,0|2,0,1]=4 49 B9R0.5 CCCC(=O)CCOCC Amb25203937 [1,0,0,0,0,0|1,0,1]=3 50 B9R0.5 CCCC(=O)C\C=C\OC Amb25282754 [1,0,0,0,0,0|3,0,0]=4 51 B9R0.5 CCCCCC(=O)OCCl Amb24568887 [1,0,0,0,0,0|2,0,1]=4 52 B9R0.5 CCCCNC(=O)OCC Amb10552892 [1,0,0,0,0,0|2,0,1]=4 53 B9R0.5 CCCNCC(=O)CCC Amb25041554 [1,0,0,0,0,0|3,0,0]=4 54 B9R0.5 CCCOCC(=O)CCC Amb25331735 [1,0,0,0,0,0|3,0,0]=4 55 B9R0.5 CCCOCC(=O)NCC Amb25336196 [1,0,0,0,0,0|3,0,0]=4 56 B9R0.5 CCCONC(=O)OCC Amb25046316 [1,0,0,0,0,0|3,0,0]=4 57 B9R0.5 CCCSCC(=O)CCC Amb18800477 [1,0,0,0,0,0|3,0,0]=4 58 B9R0.5 CCC\C=C\C(=O)CCC Amb17593554 [1,0,0,0,0,0|2,0,1]=4 59 B9R0.5 CCC\C=C\C(=O)NCC Amb24353919 [1,0,0,0,0,0|2,0,1]=4 60 B9R0.5 CCC\C=C\C(=O)OCC Amb22001054 [1,0,0,0,0,0|1,0,1]=3 61 B9R0.5 CCNC(=O)CCNCC Amb20171977 [1,0,0,0,0,0|2,0,1]=4 62 B9R0.5 CCOC(=O)C#COCC Amb25074989 [1,0,0,0,0,0|0,0,2]=3 63 B9R0.5 CCOC(=O)CC#CCC Amb25057125 [1,0,0,0,0,0|1,0,1]=3 64 B9R0.5 CCOC(=O)CCC#CC Amb17939773 [1,0,0,0,0,0|1,0,2]=4 65 B9R0.5 CCOC(=O)CCCCCl Amb24445064 [1,0,0,0,0,0|2,0,1]=4 66 B9R0.5 CCOC(=O)CCCCN Amb19957938 [1,0,0,0,0,0|2,0,1]=4 67 B9R0.5 CCOC(=O)CCCCS Amb25246862 [1,0,0,0,0,0|2,0,1]=4 68 B9R0.5 CCOC(=O)CCCSC Amb25058939 [1,0,0,0,0,0|2,0,1]=4 69 B9R0.5 CCOC(=O)CCOC=C Amb25136518 [1,0,0,0,0,0|0,0,3]=4 70 B9R0.5 CCOC(=O)CCSCCl Amb25109198 [1,0,0,0,0,0|1,1,1]=4 71 B9R0.5 CCOC(=O)CNCCN Amb24090356 [1,0,0,0,0,0|3,0,0]=4 72 B9R0.5 CCOC(=O)CNCCS Amb25032631 [1,0,0,0,0,0|3,0,0]=4 73 B9R0.5 CCOC(=O)COCCCl Amb19958740 [1,0,0,0,0,0|3,0,0]=4 74 B9R0.5 CCOC(=O)COCCN Amb25850783 [1,0,0,0,0,0|3,0,0]=4 75 B9R0.5 CCOC(=O)COCCO Amb24113532 [1,0,0,0,0,0|3,0,0]=4 76 B9R0.5 CCOC(=O)CSCCF Amb25220848 [1,0,0,0,0,0|3,0,0]=4 77 B9R0.5 CCOC(=O)C\C=C\CCl Amb25074462 [1,0,0,0,0,0|2,0,0]=3 78 B9R0.5 CCOC(=O)\C=C/OCC Amb24605673 [1,0,0,0,0,0|0,0,1]=2 79 B9R0.5 CCOC(=O)\C=C\CCBr Amb24653674 [1,0,0,0,0,0|2,0,1]=4 80 B9R0.5 CCOC(=O)\C=C\CCCl Amb24378086 [1,0,0,0,0,0|2,0,1]=4 81 B9R0.5 CCOC(=O)\C=C\CCN Amb24413568 [1,0,0,0,0,0|2,0,1]=4 82 B9R0.5 CCOC(=O)\C=C\CSC Amb25330386 [1,0,0,0,0,0|2,0,1]=4 83 B9R0.5 CCOC(=O)\C=C\NCC Amb22732261 [1,0,0,0,0,0|1,0,1]=3 84 B9R0.5 CCOC=NC(=O)OCC Amb25207372 [1,0,0,0,0,0|1,0,0]=2 85 B9R0.5 CCOCCC(=O)CSC Amb18798154 [1,0,0,0,0,0|2,0,1]=4 86 B9R0.5 CCOCNC(=O)OCC Amb25117140 [1,0,0,0,0,0|1,0,1]=3 87 B9R0.5 CCO\C=C\C(=O)CCC Amb24746824 [1,0,0,0,0,0|1,0,1]=3 88 B9R0.5 CCO\C=N\C(=O)OCC Amb23569349 [1,0,0,0,0,0|1,0,0]=2 89 B9R0.5 CCS\C=C\C(=O)CCC Amb25146559 [1,0,0,0,0,0|1,1,1]=4 90 B9R0.5 CC\C=C\CC(=O)OCC Amb10071538 [1,0,0,0,0,0|1,0,0]=2 91 B9R0.5 COCSCC(=O)OCC Amb24482667 [1,0,0,0,0,0|3,0,0]=4 92 B9R0.5 C\C=C\C(=O)CCOCC Amb24676741 [1,0,0,0,0,0|1,0,2]=4 93 B9R0.5 C\C=C\CCC(=O)OCC Amb25242775 [1,0,0,0,0,0|1,0,2]=4 94 B9R0.5 NCCCCC(=O)OCC Amb10807401 [1,0,0,0,0,0|2,0,1]=4 95 B9R0.5 OCCCCC(=O)OCC Amb17593658 [1,0,0,0,0,0|2,0,1]=4 96 B9R0.34 CC#CC(=O)CC(=O)OC Amb24706767 [1,0,0,0,0,0|1,0,1]=3 97 B9R0.34 CC(=NC(=O)NC)OCC Amb24349718 [1,0,0,0,0,0|3,0,0]=4 98 B9R0.34 CC(CC(=O)CC)=NNC Amb24612439 [1,0,0,0,0,0|3,0,0]=4 99 B9R0.34 CC(CC(=O)CC)NCC Amb24480804 [1,0,0,0,0,0|2,0,1]=4 100 B9R0.34 CC(CC(=O)CC)OCC Amb24631573 [1,0,0,0,0,0|1,0,1]=3 101 B9R0.34 CC(CC(=O)NCC)CC Amb24480695 [1,0,0,0,0,0|2,0,1]=4 102 B9R0.34 CC(CCC)=CC(=O)OC Amb25347310 [1,0,0,0,0,0|2,0,1]=4 103 B9R0.34 CCC(=C)CC(=O)CNC Amb25791370 [1,0,0,0,0,0|3,0,0]=4 104 B9R0.34 CCC(=O)C=C(Cl)CCC Amb24760119 [1,0,0,0,0,0|2,0,1]=4 105 B9R0.34 CCC(=O)CC(=O)OCF Amb24383775 [1,0,0,0,0,0|1,0,0]=2 106 B9R0.34 CCC(=O)CC(=S)OCC Amb25834381 [1,0,0,0,0,0|0,1,0]=2 107 B9R0.34 CCC(Br)CC(=O)OCC Amb24695293 [1,0,0,0,0,0|1,0,1]=3 108 B9R0.34 CCC(N)CC(=O)NCC Amb25798371 [1,0,0,0,0,0|2,0,1]=4 109 B9R0.34 CCC(N)CC(=O)OCC Amb18644203 [1,0,0,0,0,0|1,0,1]=3 110 B9R0.34 CCC(O)CC(=O)OCC Amb24476858 [1,0,0,0,0,0|0,0,2]=3 111 B9R0.34 CCCC(=N)NC(=O)OC Amb24409618 [1,0,0,0,0,0|3,0,0]=4 112 B9R0.34 CCCC(=O)CC(=O)C#N Amb25128286 [1,0,0,0,0,0|2,0,1]=4 113 B9R0.34 CCCC(=O)CC(=O)NN Amb25066431 [1,0,0,0,0,0|3,0,0]=4 114 B9R0.34 CCCC(=O)CC(C)CC Amb25806879 [1,0,0,0,0,0|2,0,1]=4 115 B9R0.34 CCCC(=O)CC(C)OC Amb25304496 [1,0,0,0,0,0|2,0,1]=4 116 B9R0.34 CCCC(=O)NC(=O)CCl Amb24660479 [1,0,0,0,0,0|3,0,0]=4 117 B9R0.34 CCCC(=O)OC(=O)CCl Amb25809476 [1,0,0,0,0,0|3,0,0]=4 118 B9R0.34 CCCC(Br)CC(=O)OC Amb25278221 [1,0,0,0,0,0|2,0,1]=4 119 B9R0.34 CCCC(C)CC(=O)CC Amb25363636 [1,0,0,0,0,0|2,0,1]=4 120 B9R0.34 CCCC(C)CC(=O)OC Amb25125122 [1,0,0,0,0,0|2,0,1]=4 121 B9R0.34 CCCC(N)CC(=O)CC Amb24504347 [1,0,0,0,0,0|2,0,1]=4 122 B9R0.34 CCCC(N)CC(=O)OC Amb22059489 [1,0,0,0,0,0|2,0,1]=4 123 B9R0.34 CCCC(O)CC(=O)OC Amb21928831 [1,0,0,0,0,0|1,0,2]=4 124 B9R0.34 CCCS(=O)CC(=O)OC Amb18788303 [1,0,0,0,0,0|2,0,0]=3 125 B9R0.34 CCC[C@H](N)CC(=O)OC Amb25147500 [1,0,0,0,0,0|2,0,1]=4 126 B9R0.34 CCNC(=O)CC(=N)SC Amb25290309 [1,0,0,0,0,0|2,1,0]=4 127 B9R0.34 CCNC(=O)CC(=O)NO Amb24529208 [1,0,0,0,0,0|3,0,0]=4 128 B9R0.34 CCNC(=O)CC(=O)OC Amb17399890 [1,0,0,0,0,0|1,0,0]=2 129 B9R0.34 CCNC(=O)NC(=O)CC Amb25332672 [1,0,0,0,0,0|2,0,0]=3 130 B9R0.34 CCNC(=O)NC(=O)CCl Amb1151523 [1,0,0,0,0,0|3,0,0]=4 131 B9R0.34 CCNC(=O)NC(=O)CN Amb24353757 [1,0,0,0,0,0|3,0,0]=4 132 B9R0.34 CCNC(=O)NC(=O)OC Amb24478919 [1,0,0,0,0,0|2,0,0]=3 133 B9R0.34 CCOC(=C)OC(=O)CCl Amb24691762 [1,0,0,0,0,0|3,0,0]=4 134 B9R0.34 CCOC(=N)NC(=O)CCl Amb24376026 [1,0,0,0,0,0|3,0,0]=4 135 B9R0.34 CCOC(=O)/C=C(/C)OC Amb17673670 [1,0,0,0,0,0|1,0,1]=3 136 B9R0.34 CCOC(=O)CC(=C)CO Amb25056938 [1,0,0,0,0,0|2,0,0]=3 137 B9R0.34 CCOC(=O)CC(=N)NN Amb22730047 [1,0,0,0,0,0|3,0,0]=4 138 B9R0.34 CCOC(=O)CC(=N)NO Amb22285079 [1,0,0,0,0,0|3,0,0]=4 139 B9R0.34 CCOC(=O)CC(=O)C#N Amb25294401 [1,0,0,0,0,0|1,0,1]=3 140 B9R0.34 CCOC(=O)CC(=O)CF Amb25140068 [1,0,0,0,0,0|1,0,0]=2 141 B9R0.34 CCOC(=O)CC(=O)CI Amb10070790 [1,0,0,0,0,0|1,0,0]=2 142 B9R0.34 CCOC(=O)CC(=O)CN Amb18636481 [1,0,0,0,0,0|1,0,0]=2 143 B9R0.34 CCOC(=O)CC(=O)CO Amb25759916 [1,0,0,0,0,0|1,0,0]=2 144 B9R0.34 CCOC(=O)CC(=O)CS Amb20623663 [1,0,0,0,0,0|1,0,0]=2 145 B9R0.34 CCOC(=O)CC(=O)C[Na] Amb24478276 [1,0,0,0,0,0|1,0,0]=2 146 B9R0.34 CCOC(=O)CC(=O)NN Amb1644489 [1,0,0,0,0,0|2,0,0]=3 147 B9R0.34 CCOC(=O)CC(C)CN Amb22059484 [1,0,0,0,0,0|2,0,1]=4 148 B9R0.34 CCOC(=O)CC(C)CO Amb25770626 [1,0,0,0,0,0|2,0,1]=4 149 B9R0.34 CCOC(=O)CC(C)SC Amb18798150 [1,0,0,0,0,0|1,1,1]=4 150 B9R0.34 CCOC(=O)CC(CC)C Amb10807395 [1,0,0,0,0,0|1,0,1]=3 151 B9R0.34 CCOC(=O)CC(CCl)O Amb17594152 [1,0,0,0,0,0|1,0,2]=4 152 B9R0.34 CCOC(=O)CC(Cl)CCl Amb25111029 [1,0,0,0,0,0|2,0,1]=4 153 B9R0.34 CCOC(=O)CC(Cl)CO Amb25241335 [1,0,0,0,0,0|2,0,1]=4 154 B9R0.34 CCOC(=O)CC(F)CI Amb22738582 [1,0,0,0,0,0|2,0,1]=4 155 B9R0.34 CCOC(=O)CC(N)=NC Amb25695263 [1,0,0,0,0,0|2,0,0]=3 156 B9R0.34 CCOC(=O)CC(N)CN Amb24681015 [1,0,0,0,0,0|2,0,1]=4 157 B9R0.34 CCOC(=O)CC(N)CO Amb24477090 [1,0,0,0,0,0|2,0,1]=4 158 B9R0.34 CCOC(=O)CC(O)CBr Amb22733258 [1,0,0,0,0,0|1,0,2]=4 159 B9R0.34 CCOC(=O)CC(O)CI Amb22736620 [1,0,0,0,0,0|1,0,2]=4 160 B9R0.34 CCOC(=O)CC(O)CN Amb25095715 [1,0,0,0,0,0|1,0,2]=4 161 B9R0.34 CCOC(=O)CC(O)CO Amb25199318 [1,0,0,0,0,0|1,0,2]=4 162 B9R0.34 CCOC(=O)C[C@@H](O)CN Amb25224575 [1,0,0,0,0,0|1,0,2]=4 163 B9R0.34 CCOC(=O)C[C@H](C)CBr Amb24477273 [1,0,0,0,0,0|2,0,1]=4 164 B9R0.34 CCOC(=O)C[C@H](N)CO Amb24334216 [1,0,0,0,0,0|2,0,1]=4 165 B9R0.34 CCOC(=O)N=C(N)SC Amb24565783 [1,0,0,0,0,0|2,1,0]=4 166 B9R0.34 CCOC(=O)NC(=O)CC Amb25804805 [1,0,0,0,0,0|1,0,0]=2 167 B9R0.34 CCOC(=O)NC(=O)CI Amb25730437 [1,0,0,0,0,0|2,0,0]=3 168 B9R0.34 CCOC(=O)NC(=O)NBr Amb25032166 [1,0,0,0,0,0|3,0,0]=4 169 B9R0.34 CCOC(=O)NC(=S)CC Amb17613877 [1,0,0,0,0,0|1,1,0]=3 170 B9R0.34 CCOC(=O)NC(=S)NC Amb16186621 [1,0,0,0,0,0|2,1,0]=4 171 B9R0.34 CCOC(=O)NC(C)CC Amb17858944 [1,0,0,0,0,0|2,0,1]=4 172 B9R0.34 CCOC(=O)SC(=N)NC Amb25075037 [1,0,0,0,0,0|3,0,0]=4 173 B9R0.34 CCOC(=O)\C=C(/CBr)\C Amb17613965 [1,0,0,0,0,0|2,0,1]=4 174 B9R0.34 CCOC(=O)\C=C(\CBr)/C Amb17613964 [1,0,0,0,0,0|2,0,1]=4 175 B9R0.34 CCOC(=O)\C=C(\Cl)/CCl Amb25123280 [1,0,0,0,0,0|2,0,1]=4 176 B9R0.34 CCOC(=O)\C=C(\Cl)/CO Amb25846963 [1,0,0,0,0,0|2,0,1]=4 177 B9R0.34 CCOC(=O)\C=C(\N)/CF Amb25315025 [1,0,0,0,0,0|2,0,1]=4 178 B9R0.34 CCO[13C](=O)[13CH2][13C](=O)[13CH2]Cl Amb17613990 [1,0,0,0,0,0|1,0,0]=2 179 B9R0.34 CCO[C@@H](O)CC(=O)CCl Amb25141554 [1,0,0,0,0,0|1,0,2]=4 180 B9R0.34 CCO[C@@H](O)CC(=O)CO Amb25129047 [1,0,0,0,0,0|1,0,2]=4 181 B9R0.34 CCO[C@H](O)CC(=O)CCl Amb24585158 [1,0,0,0,0,0|1,0,2]=4 182 B9R0.34 CCS(=O)CC(=O)OCC Amb18788301 [1,0,0,0,0,0|1,0,0]=2 183 B9R0.34 CCSC(=O)CC(=O)CC Amb24402033 [1,0,0,0,0,0|0,1,0]=2 184 B9R0.34 CCSC(=O)NC(=O)CC Amb24452152 [1,0,0,0,0,0|1,1,0]=3 185 B9R0.34 CC[C@@H](N)CC(=O)OCC Amb24351614 [1,0,0,0,0,0|1,0,1]=3 186 B9R0.34 CC[C@@H](O)CC(=O)OCC Amb20241603 [1,0,0,0,0,0|0,0,2]=3 187 B9R0.34 CC\C(\O)=C\C(=O)CCC Amb25146578 [1,0,0,0,0,0|1,0,2]=4 188 B9R0.34 CN(CC(=O)NCC)CC Amb25145226 [1,0,0,0,0,0|3,0,0]=4 189 B9R0.34 CNC(=O)CC(=O)NCC Amb24544279 [1,0,0,0,0,0|2,0,0]=3 190 B9R0.34 CNC(=O)CC(=O)NOC Amb25216049 [1,0,0,0,0,0|3,0,0]=4 191 B9R0.34 CNC(=O)NC(=O)OCC Amb25185123 [1,0,0,0,0,0|2,0,0]=3 192 B9R0.34 CNCC(=O)NC(=O)OC Amb24476733 [1,0,0,0,0,0|3,0,0]=4 193 B9R0.34 COC(=N)CC(=O)OCC Amb24643488 [1,0,0,0,0,0|1,0,0]=2 194 B9R0.34 COC(=O)CC(=O)CC#N Amb25146780 [1,0,0,0,0,0|2,0,1]=4 195 B9R0.34 COC(=O)CC(=O)CC=C Amb24456670 [1,0,0,0,0,0|1,0,2]=4 196 B9R0.34 COC(=O)CC(=O)CCO Amb25833665 [1,0,0,0,0,0|2,0,0]=3 197 B9R0.34 COC(=O)CC(=O)CSC Amb24441248 [1,0,0,0,0,0|2,0,0]=3 198 B9R0.34 COC(=O)CC(=O)\C=N\O Amb25206153 [1,0,0,0,0,0|3,0,0]=4 199 B9R0.34 COC(=O)CS(=O)CCCl Amb25277573 [1,0,0,0,0,0|3,0,0]=4 200 B9R0.34 COC(=O)NC(=N)NCC Amb24388984 [1,0,0,0,0,0|3,0,0]=4 201 B9R0.34 COC(=O)NC(=N)OCC Amb25288244 [1,0,0,0,0,0|2,0,0]=3 202 B9R0.34 COC(=O)NC(=O)CCBr Amb1019519 [1,0,0,0,0,0|3,0,0]=4 203 B9R0.34 COC(=O)NC(=O)CCCl Amb25332043 [1,0,0,0,0,0|3,0,0]=4 204 B9R0.34 COC(=O)NC(=O)NCCl Amb25809477 [1,0,0,0,0,0|3,0,0]=4 205 B9R0.34 COC(=O)NC(=S)OCC Amb24477305 [1,0,0,0,0,0|1,1,0]=3 206 B9R0.34 COC(=O)NC(C)OCC Amb25068640 [1,0,0,0,0,0|2,0,1]=4 207 B9R0.34 COC(=S)NC(=O)NCC Amb25202045 [1,0,0,0,0,0|2,1,0]=4 208 B9R0.34 COC(C)NC(=O)OCC Amb25327169 [1,0,0,0,0,0|2,0,1]=4 209 B9R0.34 CON(C)CC(=O)OCC Amb25134510 [1,0,0,0,0,0|2,0,0]=3 210 B9R0.34 C\C(=C/C(=O)CC)\OCC Amb25714458 [1,0,0,0,0,0|1,0,1]=3 211 B9R0.34 C\C(=C/C(=O)CCC)\OC Amb24691571 [1,0,0,0,0,0|2,0,1]=4 212 B9R0.34 C\C(\CC(=O)CC)=N/NC Amb25830559 [1,0,0,0,0,0|3,0,0]=4 213 B9R0.34 C\C(\CC)=C\C(=O)OCC Amb24479412 [1,0,0,0,0,0|1,0,1]=3 214 B9R0.34 C\C(\CCC)=C/C(=O)CC Amb25855257 [1,0,0,0,0,0|2,0,1]=4 215 B9R0.34 C\C(\CCl)=C\C(=O)OCC Amb24480481 [1,0,0,0,0,0|2,0,1]=4 216 B9R0.34 C\C(\CN)=C\C(=O)OCC Amb24394887 [1,0,0,0,0,0|2,0,1]=4 217 B9R0.34 C\C=C\C(=O)CC(=C)CC Amb24471211 [1,0,0,0,0,0|2,0,1]=4 218 B9R0.34 C\C=C\C(=O)CC(=O)CC Amb24645388 [1,0,0,0,0,0|1,0,1]=3 219 B9R0.34 C\C=C\C(=O)NC(=O)OC Amb25366241 [1,0,0,0,0,0|2,0,1]=4 220 B11R0.1 CC(=O)OC(C)CC(=O)OCC Amb22731089 [0,1,0,0,0,0|1,0,2]=4 221 B11R0.1 CC(C)CC(N)CC(=O)OCC Amb22586903 [0,1,0,0,0,0|2,0,1]=4 222 B11R0.1 CCOC(=O)CC(=O)CC(=O)C Amb16192546 [0,1,0,0,0,0|1,0,1]=3 223 B11R0.1 CCOC(=O)CC(=O)CC(C)C Amb10576271 [0,1,0,0,0,0|1,0,0]=2 224 B11R0.1 CCOC(=O)CC(CC(C)C)N Amb10607609 [0,1,0,0,0,0|2,0,1]=4 225 B11R0.1 CCOC(=O)NC(=O)CC(=O)C Amb2420586 [0,1,0,0,0,0|2,0,1]=4 226 B11R0.1 CCOC(=O)NC(=O)NC(C)C Amb25276346 [0,1,0,0,0,0|2,0,0]=3 227 B11R0.1 C\C=C\C(=O)NC(=O)OC(C)C Amb24468905 [0,1,0,0,0,0|2,0,1]=4 228 B11R0.5 CCCCC(=O)CC(=O)OCC Amb10604434 [0,1,0,0,0,0|1,0,0]=2 229 B11R0.5 CCCCC(CC(=O)OCC)N Amb10607610 [0,1,0,0,0,0|2,0,1]=4 230 B11R0.5 CCCCC(N)CC(=O)OCC Amb22586905 [0,1,0,0,0,0|2,0,1]=4 231 B11R0.5 CCCCC(O)CC(=O)OCC Amb18803977 [0,1,0,0,0,0|1,0,2]=4 232 B11R0.5 CCOCC(=O)CC(=O)OCC Amb19890255 [0,1,0,0,0,0|0,0,0]=1 233 B11R0.5 CCSCC(=O)CC(=O)OCC Amb20668828 [0,1,0,0,0,0|0,1,0]=2 234 B11R0.5 COCCC(=O)CC(=O)OCC Amb18803903 [0,1,0,0,0,0|1,0,0]=2 235 B11R0.5 COCCN(CC(=O)OCC)C Amb16187056 [0,1,0,0,0,0|3,0,0]=4 236 B11R0.5 C\C(\CC(=O)OCC)=N/CCO Amb19866691 [0,1,0,0,0,0|2,0,0]=3 237 B11R0.5 OCCN\C(=C/C(=O)OCC)\C Amb2227280 [0,1,0,0,0,0|2,0,1]=4 238 B11R0.177 CC(C(=O)OCC)C(=S)NCC Amb22264530 [0,1,0,0,0,0|1,1,0]=3 239 B11R0.177 CCCC(=O)C(C(=O)OCC)C Amb10604915 [0,1,0,0,0,0|1,0,0]=2 240 B11R0.177 CCOC(=N)C(C(=N)OCC)C Amb10575144 [0,1,0,0,0,0|2,0,0]=3 241 B11R0.177 CCOC(=O)C(=C)C(=O)OCC Amb15693458 [0,1,0,0,0,0|0,0,1]=2 242 B11R0.177 CCOC(=O)C(=O)C(=O)CCC Amb22755696 [0,1,0,0,0,0|1,0,1]=3 243 B11R0.177 CCOC(=O)C(=O)C(=O)OCC Amb22756416 [0,1,0,0,0,0|0,0,1]=2 244 B11R0.177 CCOC(=O)C(C(=O)COC)C Amb10604913 [0,1,0,0,0,0|2,0,0]=3 245 B11R0.177 CCOC(=O)C(C(=O)OCC)N Amb1158253 [0,1,0,0,0,0|0,0,0]=1 246 B11R0.177 CCOC(=O)C(C(=O)OCC)O Amb10068673 [0,1,0,0,0,0|0,0,0]=1 247 B11R0.177 CCOC(=O)C([NH3+])C(=O)OCC Amb24113828 [0,1,0,0,0,0|0,0,0]=1 248 B11R0.182 CCO\C(\CBr)=C\C(=O)OCC Amb22733445 [0,1,0,0,0,0|1,0,1]=3 249 B11R0.182 CCO\C(\CC)=N/C(=O)OCC Amb23589351 [0,1,0,0,0,0|2,0,0]=3 250 B11R0.187 CCOC(=O)CN(C)C(=O)CC Amb18794790 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.30 CCCC(=O)CC1CCCO1 Amb18791733 [0,0,0,1,0,0|2,0,1]=4 252 B11R1.30 CCCC(=O)CC1OCCO1 Amb22000781 [0,0,0,1,0,0|1,0,2]=4 253 B11R1.30 CCCC(=O)CC=1CCCC1 Amb24764303 [0,0,0,1,0,0|3,0,0]=4 254 B11R1.30 CCOC(=N)CC1CCCO1 Amb18179727 [0,0,0,1,0,0|2,0,1]=4 255 B11R1.30 CCOC(=O)C=C1CCCC1 Amb21858427 [0,0,0,1,0,0|2,0,1]=4 256 B11R1.30 CCOC(=O)C=C1CCCN1 Amb24066417 [0,0,0,1,0,0|2,0,1]=4 257 B11R1.30 CCOC(=O)CC1=NCCS1 Amb24751244 [0,0,0,1,0,0|1,1,0]=3 258 B11R1.30 CCOC(=O)CC1CCCN1 Amb19015189 [0,0,0,1,0,0|2,0,1]=4 259 B11R1.30 CCOC(=O)CC1CCCN1 Amb19514733 [0,0,0,1,0,0|2,0,1]=4 260 B11R1.30 CCOC(=O)CC1CCCO1 Amb17939087 [0,0,0,1,0,0|1,0,1]=3 261 B11R1.30 CCOC(=O)CC1OCCO1 Amb21961945 [0,0,0,1,0,0|0,0,2]=3 262 B11R1.30 CCOC(=O)CC=1CCOC1 Amb23538522 [0,0,0,1,0,0|3,0,0]=4 263 B11R1.30 CCOC(=O)CN1CCCO1 Amb25382515 [0,0,0,1,0,0|2,0,0]=3 264 B11R1.30 CCOC(=O)C[S+]1CCCC1 Amb24063983 [0,0,0,1,0,0|3,0,0]=4 265 B11R1.30 CCOC(=O)Cc1[n][n]co1 Amb22886585 [0,0,0,1,0,0|2,0,1]=4 266 B11R1.30 CCOC(=O)Cc1cc[n]o1 Amb25382988 [0,0,0,1,0,0|2,0,1]=4 267 B11R1.30 CCOC(=O)NC1=NCCS1 Amb17786341 [0,0,0,1,0,0|2,1,0]=4 268 B11R1.30 CCOC(=O)\C=C/1\CCCN1 Amb18200450 [0,0,0,1,0,0|2,0,1]=4 269 B11R1.30 CCOC(=O)\C=C/1\CCCO1 Amb24087754 [0,0,0,1,0,0|1,0,1]=3 270 B11R1.30 CCOC(=O)\C=C\1/CCCN1 Amb23570705 [0,0,0,1,0,0|2,0,1]=4 271 B11R1.107 C=C1CC(=O)CCCCCC1 Amb24646699 [0,0,0,1,0,0|3,0,0]=4 272 B11R1.107 O=C1CC(=O)NCCCCC1 Amb25207080 [0,0,0,1,0,0|2,0,0]=3 273 B11R1.107 O=C1CCCCCCC(=O)C1 Amb17593852 [0,0,0,1,0,0|2,0,0]=3 274 B11R1.110 CCOC1CC(=O)CCCC1 Amb25373377 [0,0,0,1,0,0|2,0,1]=4 275 B11R1.110 CCOC1CC(=O)NCCC1 Amb25276962 [0,0,0,1,0,0|2,0,1]=4 276 B11R1.110 CCOC=1CC(=O)CCCN1 Amb24582469 [0,0,0,1,0,0|2,0,0]=3 277 B11R1.110 CCOC=1CCCCC(=O)C1 Amb25151609 [0,0,0,1,0,0|2,0,1]=4 278 B11R1.127 CCOc1c[s]c(c1)OCC Amb25385364 [0,0,0,1,0,0|1,1,1]=4 279 B11R1.127 CCOc1cc([nH][n]1)OCC Amb25383180 [0,0,0,1,0,0|2,0,1]=4 280 B11R1.187 CCC1OC(=CC1=O)OCC Amb24486292 [0,0,0,1,0,0|1,0,2]=4 281 B11R1.187 CCCC=1CC(=O)N(CC)N1 Amb18179524 [0,0,0,1,0,0|3,0,0]=4 282 B11R1.199 C#CCC(=O)C1CCOC1=O Amb25737877 [0,0,0,1,0,0|1,0,2]=4 283 B11R1.199 C=CCC(=O)C1CCOC1=O Amb25780083 [0,0,0,1,0,0|1,0,2]=4 284 B11R1.199 CC1=CCCN1C(=O)OCC Amb25267812 [0,0,0,1,0,0|3,0,0]=4 285 B11R1.199 CC1=NNCC1C(=O)OCC Amb25172788 [0,0,0,1,0,0|3,0,0]=4 286 B11R1.199 CC1CCCC1C(=O)OCC Amb24390634 [0,0,0,1,0,0|2,0,1]=4 287 B11R1.199 CC1OCCC1C(=O)CCC Amb25151810 [0,0,0,1,0,0|2,0,1]=4 288 B11R1.199 CC1OCNC1C(=O)OCC Amb25704206 [0,0,0,1,0,0|2,0,1]=4 289 B11R1.199 CC=1CCCC1C(=O)OCC Amb25120486 [0,0,0,1,0,0|2,0,1]=4 290 B11R1.199 CC=1NCCC1C(=O)OCC Amb24366082 [0,0,0,1,0,0|2,0,1]=4 291 B11R1.199 CCCC(=O)C1CCCC1=O Amb17940809 [0,0,0,1,0,0|2,0,0]=3 292 B11R1.199 CCCC(=O)C1CCOC1=O Amb25282758 [0,0,0,1,0,0|1,0,0]=2 293 B11R1.199 CCNC(=O)N1CCOC1=N Amb24399235 [0,0,0,1,0,0|3,0,0]=4 294 B11R1.199 CCOC(=O)C1=C(N)CCC1 Amb1993725 [0,0,0,1,0,0|2,0,1]=4 295 B11R1.199 CCOC(=O)C1=CNOC1=O Amb24053122 [0,0,0,1,0,0|1,0,2]=4 296 B11R1.199 CCOC(=O)C1C=NNC1=O Amb19134414 [0,0,0,1,0,0|2,0,1]=4 297 B11R1.199 CCOC(=O)C1CC=CC1=O Amb25838672 [0,0,0,1,0,0|1,0,1]=3 298 B11R1.199 CCOC(=O)C1CCCC1=N Amb21857661 [0,0,0,1,0,0|2,0,0]=3 299 B11R1.199 CCOC(=O)C1CCCC1=O Amb1151493 [0,0,0,1,0,0|1,0,0]=2 300 B11R1.199 CCOC(=O)C1CCCC1N Amb18126058 [0,0,0,1,0,0|2,0,1]=4 301 B11R1.199 CCOC(=O)C1CCCC1O Amb21961794 [0,0,0,1,0,0|1,0,2]=4 302 B11R1.199 CCOC(=O)C1CCCN1C Amb18787687 [0,0,0,1,0,0|3,0,0]=4 303 B11R1.199 CCOC(=O)C1CCOC1=N Amb24595651 [0,0,0,1,0,0|1,0,0]=2 304 B11R1.199 CCOC(=O)C1CCOC1=O Amb22490517 [0,0,0,1,0,0|0,0,0]=1 305 B11R1.199 CCOC(=O)C1CNCC1=O Amb21857703 [0,0,0,1,0,0|2,0,0]=3 306 B11R1.199 CCOC(=O)C1CNCC1=O Amb21857705 [0,0,0,1,0,0|2,0,0]=3 307 B11R1.199 CCOC(=O)C1COCC1=O Amb21963949 [0,0,0,1,0,0|2,0,0]=3 308 B11R1.199 CCOC(=O)C1CSCC1=O Amb20075892 [0,0,0,1,0,0|2,0,0]=3 309 B11R1.199 CCOC(=O)C1OCCC1=O Amb25767113 [0,0,0,1,0,0|2,0,0]=3 310 B11R1.199 CCOC(=O)C1SCCC1=O Amb22289193 [0,0,0,1,0,0|2,0,0]=3 311 B11R1.199 CCOC(=O)C=1CCCC1F Amb25837558 [0,0,0,1,0,0|2,0,1]=4 312 B11R1.199 CCOC(=O)C=1CCOC1N Amb24066442 [0,0,0,1,0,0|1,0,1]=3 313 B11R1.199 CCOC(=O)N1CC=CC1=O Amb22494811 [0,0,0,1,0,0|2,0,1]=4 314 B11R1.199 CCOC(=O)N1CCNC1=O Amb2569655 [0,0,0,1,0,0|2,0,0]=3 315 B11R1.199 CCOC(=O)[C@@H]1CCC[C@@H]1N Amb1994024 [0,0,0,1,0,0|2,0,1]=4 316 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N Amb22224844 [0,0,0,1,0,0|2,0,1]=4 317 B11R1.199 CCOC(=O)[C@@H]1CCC[C@H]1N Amb22745813 [0,0,0,1,0,0|2,0,1]=4 318 B11R1.199 CCOC(=O)[C@H]1CCC[C@H]1N Amb24715829 [0,0,0,1,0,0|2,0,1]=4 319 B11R1.199 CCSC(=O)C1CCCC1=O Amb25282757 [0,0,0,1,0,0|1,1,0]=3 320 B11R1.199 CNCC(=O)N1CCOC1=O Amb24476297 [0,0,0,1,0,0|3,0,0]=4 321 B11R1.199 COCC(=O)C1CCCC1=O Amb25150163 [0,0,0,1,0,0|3,0,0]=4 322 B11R1.199 C\C=C\C(=O)C1CCOC1=O Amb24370114 [0,0,0,1,0,0|1,0,1]=3 323 B11R1.199 O=C1OCCN1C(=O)CCBr Amb25145175 [0,0,0,1,0,0|3,0,0]=4 324 B11R1.334 CCCC(=O)CC(=O)C1CC1 Amb18787509 [0,0,0,1,0,0|2,0,0]=3 325 B11R1.334 CCOC(=O)CC(C1CC1)C Amb11193847 [0,0,0,1,0,0|2,0,1]=4 326 B11R1.334 CCOC(=O)CC(O)C1CC1 Amb18182343 [0,0,0,1,0,0|1,0,2]=4 327 B11R1.334 CCOC(=O)NC(=O)C1CC1 Amb25313128 [0,0,0,1,0,0|2,0,0]=3 328 B11R1.334 CCOC(=O)\C=C(/N)\C1CC1 Amb25383042 [0,0,0,1,0,0|2,0,1]=4 329 B11R1.334 CCOC(=O)\C=C(\N)/C1CC1 Amb20248179 [0,0,0,1,0,0|2,0,1]=4 330 B11R1.425 CCC1=C(CC)C(=O)NC1=O Amb17672557 [0,0,0,1,0,0|3,0,0]=4 331 B11R1.425 CCC1=C(OC)C(=O)CC1=O Amb24434651 [0,0,0,1,0,0|3,0,0]=4 332 B11R1.425 CCC1C(CC)C(=O)NC1=O Amb25068720 [0,0,0,1,0,0|3,0,0]=4 333 B11R1.425 CCN1C(=O)CC(=O)N1CC Amb25144052 [0,0,0,1,0,0|2,0,0]=3 334 B11R1.425 CCN1C(=O)NC(=O)N1CC Amb24532977 [0,0,0,1,0,0|3,0,0]=4 335 B11R1.464 CC1=CC(=O)CC(=O)N1CC Amb25730192 [0,0,0,1,0,0|2,0,1]=4 336 B11R1.464 CCN1C(C)CC(=O)NC1=O Amb18179650 [0,0,0,1,0,0|3,0,0]=4 337 B11R1.825 CCOC(=O)C1C(CC)C1=C Amb25384046 [0,0,0,1,0,0|2,0,0]=3 338 B11R1.840 CCOC(=O)CC1(F)CCC1 Amb22886540 [0,0,0,1,0,0|2,0,1]=4 339 B11R1.840 CCOC(=O)CC1(N)CCC1 Amb24762064 [0,0,0,1,0,0|2,0,1]=4 340 B9R0.35 CC#CC(=O)C(=C)OCC Amb25704126 [0,0,0,0,1,0|2,0,1]=4 341 B9R0.35 CC#CC(=O)C(=O)OCC Amb24662556 [0,0,0,0,1,0|1,0,1]=3 342 B9R0.35 CC(=CCC)C(=O)CCC Amb24621710 [0,0,0,0,1,0|3,0,0]=4 343 B9R0.35 CC(=CCC)C(=O)OCC Amb25032127 [0,0,0,0,1,0|2,0,0]=3 344 B9R0.35 CC(=NNC)C(=O)OCC Amb24397209 [0,0,0,0,1,0|3,0,0]=4 345 B9R0.35 CC(OCC)C(=O)OCC Amb25277049 [0,0,0,0,1,0|1,0,1]=3 346 B9R0.35 CC(SCC)C(=O)OCC Amb18798151 [0,0,0,0,1,0|1,1,1]=4 347 B9R0.35 CCC=C(Cl)C(=O)CCC Amb25298410 [0,0,0,0,1,0|3,0,0]=4 348 B9R0.35 CCCC(=O)C(=C)CCC Amb24448277 [0,0,0,0,1,0|3,0,0]=4 349 B9R0.35 CCCC(=O)C(=O)CCC Amb22732205 [0,0,0,0,1,0|2,0,0]=3 350 B9R0.35 CCC[C@@H](C(=O)OCC)N Amb16233901 [0,0,0,0,1,0|2,0,1]=4 351 B9R0.35 CCN=C(N)C(=O)NCC Amb24581191 [0,0,0,0,1,0|3,0,0]=4 352 B9R0.35 CCNC(=O)C(=O)NCC Amb1791698 [0,0,0,0,1,0|2,0,0]=3 353 B9R0.35 CCNC(=S)C(=O)NCC Amb25270104 [0,0,0,0,1,0|2,1,0]=4 354 B9R0.35 CCOC(=O)C(=C)CCC Amb22360691 [0,0,0,0,1,0|2,0,0]=3 355 B9R0.35 CCOC(=O)C(=C)CCCl Amb25279492 [0,0,0,0,1,0|3,0,0]=4 356 B9R0.35 CCOC(=O)C(=C)CCO Amb24379905 [0,0,0,0,1,0|3,0,0]=4 357 B9R0.35 CCOC(=O)C(=C)CNC Amb24478979 [0,0,0,0,1,0|3,0,0]=4 358 B9R0.35 CCOC(=O)C(=C)CSC Amb25328652 [0,0,0,0,1,0|3,0,0]=4 359 B9R0.35 CCOC(=O)C(=C)OCC Amb22230635 [0,0,0,0,1,0|1,0,0]=2 360 B9R0.35 CCOC(=O)C(=N)NCC Amb24628273 [0,0,0,0,1,0|2,0,0]=3 361 B9R0.35 CCOC(=O)C(=N)OCC Amb20670112 [0,0,0,0,1,0|1,0,0]=2 362 B9R0.35 CCOC(=O)C(=N)OCC Amb20670977 [0,0,0,0,1,0|1,0,0]=2 363 B9R0.35 CCOC(=O)C(=O)C#CCl Amb19664288 [0,0,0,0,1,0|2,0,1]=4 364 B9R0.35 CCOC(=O)C(=O)C=[N+]=[N-] Amb22490592 [0,0,0,0,1,0|3,0,0]=4 365 B9R0.35 CCOC(=O)C(=O)CC#C Amb24599260 [0,0,0,0,1,0|1,0,2]=4 366 B9R0.35 CCOC(=O)C(=O)CC#N Amb22235867 [0,0,0,0,1,0|2,0,1]=4 367 B9R0.35 CCOC(=O)C(=O)CC=C Amb25315928 [0,0,0,0,1,0|1,0,2]=4 368 B9R0.35 CCOC(=O)C(=O)CCCl Amb24705549 [0,0,0,0,1,0|2,0,0]=3 369 B9R0.35 CCOC(=O)C(=O)N=C=O Amb25211777 [0,0,0,0,1,0|2,0,1]=4 370 B9R0.35 CCOC(=O)C(=O)N=CO Amb25281356 [0,0,0,0,1,0|2,0,1]=4 371 B9R0.35 CCOC(=O)C(=O)N=[N+]=[N-] Amb25249195 [0,0,0,0,1,0|3,0,0]=4 372 B9R0.35 CCOC(=O)C(=O)NC#N Amb15691904 [0,0,0,0,1,0|2,0,1]=4 373 B9R0.35 CCOC(=O)C(=O)SC#N Amb22370860 [0,0,0,0,1,0|1,1,1]=4 374 B9R0.35 CCOC(=O)C(=O)[CH-]C#N Amb22727987 [0,0,0,0,1,0|2,0,1]=4 375 B9R0.35 CCOC(=O)C(=O)[CH-]C#N Amb22748929 [0,0,0,0,1,0|2,0,1]=4 376 B9R0.35 CCOC(=O)C(=O)\C=N/N Amb25341974 [0,0,0,0,1,0|3,0,0]=4 377 B9R0.35 CCOC(=O)C(=S)NCC Amb24461710 [0,0,0,0,1,0|1,1,0]=3 378 B9R0.35 CCOC(=O)C(Cl)=CCN Amb25095841 [0,0,0,0,1,0|3,0,0]=4 379 B9R0.35 CCOC(=O)C(Cl)=CNC Amb25254115 [0,0,0,0,1,0|3,0,0]=4 380 B9R0.35 CCOC(=O)C(Cl)CCC Amb18800860 [0,0,0,0,1,0|2,0,1]=4 381 B9R0.35 CCOC(=O)C(N)=CCC Amb25294674 [0,0,0,0,1,0|2,0,0]=3 382 B9R0.35 CCOC(=O)C(N)=NNC Amb24476759 [0,0,0,0,1,0|3,0,0]=4 383 B9R0.35 CCOC(=O)C(O)CCC Amb22350176 [0,0,0,0,1,0|1,0,2]=4 384 B9R0.35 CCOC(=O)C(OCC)O Amb17593682 [0,0,0,0,1,0|0,0,2]=3 385 B9R0.35 CCOC(=O)C(S)CCC Amb24613784 [0,0,0,0,1,0|1,1,1]=4 386 B9R0.35 CCOC(=O)N(N)CCC Amb18644276 [0,0,0,0,1,0|3,0,0]=4 387 B9R0.35 CCOC(=O)[C@@H](Br)CCC Amb25857084 [0,0,0,0,1,0|2,0,1]=4 388 B9R0.35 CCOC(=O)[C@@H](N)CCC Amb22747761 [0,0,0,0,1,0|2,0,1]=4 389 B9R0.35 CCOC(=O)[C@H](Br)CCC Amb25857397 [0,0,0,0,1,0|2,0,1]=4 390 B9R0.35 CCOC(=O)[C@H](O)CCC Amb22225395 [0,0,0,0,1,0|1,0,2]=4 391 B9R0.35 CCOC(F)C(=O)OCC Amb25739849 [0,0,0,0,1,0|1,0,1]=3 392 B9R0.35 CCOC(N)C(=O)OCC Amb24569391 [0,0,0,0,1,0|1,0,1]=3 393 B9R0.35 CCO[13C](=O)[13C](=O)OCC Amb22367388 [0,0,0,0,1,0|0,0,0]=1 394 B9R0.35 CCSC(=O)C(=O)SCC Amb24117225 [0,0,0,0,1,0|0,2,0]=3 395 B9R0.35 CCSC(Cl)C(=O)OCC Amb24434216 [0,0,0,0,1,0|1,1,1]=4 396 B9R0.35 CC\C=C(/Cl)\C(=O)CCC Amb25146826 [0,0,0,0,1,0|3,0,0]=4 397 B9R0.35 CN(OCC)C(=O)NCC Amb25345690 [0,0,0,0,1,0|3,0,0]=4 398 B9R0.35 CN(OCC)C(=O)OCC Amb24449383 [0,0,0,0,1,0|2,0,0]=3 399 B9R0.35 C\C(=C/CBr)\C(=O)OCC Amb24559830 [0,0,0,0,1,0|3,0,0]=4 400 B9R0.35 C\C(=C/CC)\C(=O)CCC Amb25184801 [0,0,0,0,1,0|3,0,0]=4 401 B9R0.35 C\C(=C\CCl)\C(=O)OCC Amb24122921 [0,0,0,0,1,0|3,0,0]=4 402 B11R0.62 CCCC(=O)CNC(=O)CCC Amb24072047 [0,0,0,0,0,1|2,0,0]=3 403 B11R0.62 CCCC(=O)NNC(=O)CCC Amb22261491 [0,0,0,0,0,1|3,0,0]=4 404 B11R0.62 CCNC(=O)NNC(=O)NCC Amb22369210 [0,0,0,0,0,1|3,0,0]=4 405 B11R0.62 CCOC(=O)CNC(=O)OCC Amb17868849 [0,0,0,0,0,1|0,0,0]=1 406 B11R0.62 CCOC(=O)N=NC(=O)OCC Amb10807487 [0,0,0,0,0,1|1,0,0]=2 407 B11R0.62 CCOC(=O)NNC(=O)NCC Amb22340243 [0,0,0,0,0,1|2,0,0]=3 408 B11R0.62 CCOC(=O)\N=C\C(=O)OCC Amb24103456 [0,0,0,0,0,1|0,0,1]=2 409 B11R0.62 CCOC(=S)SCC(=O)OCC Amb10808592 [0,0,0,0,0,1|0,1,0]=2 410 B8R0.1 CC=C=CC(=O)OCC Amb24428528 [2,0,0,0,0,0|1,0,1]=4 411 B8R0.1 CCCC(=O)CCOC Amb25163114 [2,0,0,0,0,0|1,0,1]=4 412 B8R0.1 CCCC(=O)CNCC Amb25142247 [2,0,0,0,0,0|2,0,0]=4 413 B8R0.1 CCCC(=O)COCC Amb25823475 [2,0,0,0,0,0|1,0,0]=3 414 B8R0.1 CCCC(=O)CSCC Amb25236661 [2,0,0,0,0,0|1,1,0]=4 415 B8R0.1 CCCC(=O)\C=C\OC Amb24513807 [2,0,0,0,0,0|1,0,1]=4 416 B8R0.1 CCCCC(=N)OCC Amb20673140 [2,0,0,0,0,0|1,0,1]=4 417 B8R0.1 CCCCC(=O)NCC Amb17787354 [2,0,0,0,0,0|1,0,1]=4 418 B8R0.1 CCCNC(=O)OCC Amb17787091 [2,0,0,0,0,0|1,0,1]=4 419 B8R0.1 CCNC(=O)CCOC Amb25027996 [2,0,0,0,0,0|1,0,1]=4 420 B8R0.1 CCNC(=O)CNOC Amb25714179 [2,0,0,0,0,0|2,0,0]=4 421 B8R0.1 CCOC(=N)\C=C\CC Amb24715849 [2,0,0,0,0,0|1,0,1]=4 422 B8R0.1 CCOC(=O)CCCF Amb24649863 [2,0,0,0,0,0|1,0,1]=4 423 B8R0.1 CCOC(=O)CCCI Amb21520420 [2,0,0,0,0,0|1,0,1]=4 424 B8R0.1 CCOC(=O)CCCO Amb22733346 [2,0,0,0,0,0|1,0,1]=4 425 B8R0.1 CCOC(=O)CCON Amb24481776 [2,0,0,0,0,0|1,0,1]=4 426 B8R0.1 CCOC(=O)CNCO Amb24693973 [2,0,0,0,0,0|2,0,0]=4 427 B8R0.1 CCOC(=O)CON=C Amb25208174 [2,0,0,0,0,0|1,0,1]=4 428 B8R0.1 CCOC(=O)C\C=C\Cl Amb24583058 [2,0,0,0,0,0|1,0,1]=4 429 B8R0.1 CCOC(=O)\C=C\CC Amb22008263 [2,0,0,0,0,0|0,0,1]=3 430 B8R0.1 CCOC(=O)\C=C\CF Amb24677225 [2,0,0,0,0,0|1,0,1]=4 431 B8R0.1 CCOC(=O)\C=C\CS Amb25065739 [2,0,0,0,0,0|1,0,1]=4 432 B8R0.1 CCOC(=O)\C=C\NC Amb25297465 [2,0,0,0,0,0|1,0,1]=4 433 B8R0.1 CCOCC(=N)NCC Amb24468516 [2,0,0,0,0,0|2,0,0]=4 434 B8R0.1 CCOCC(=N)OCC Amb25095949 [2,0,0,0,0,0|1,0,0]=3 435 B8R0.1 CCOCC(C)OCC Amb22227707 [2,0,0,0,0,0|1,0,1]=4 436 B8R0.1 CCONC(=O)CCC Amb25774745 [2,0,0,0,0,0|2,0,0]=4 437 B8R0.1 CCONC(=O)NCC Amb24699772 [2,0,0,0,0,0|2,0,0]=4 438 B8R0.1 CCO\C=C(\Cl)/OCC Amb24614569 [2,0,0,0,0,0|1,0,0]=3 439 B8R0.1 CCSCC(=N)OCC Amb25236645 [2,0,0,0,0,0|1,1,0]=4 440 B8R0.1 CCSCC(=O)NCC Amb25080742 [2,0,0,0,0,0|1,1,0]=4 441 B8R0.1 COCC(=O)COCC Amb24591446 [2,0,0,0,0,0|2,0,0]=4 442 B8R0.1 COCCC(=N)OCC Amb25300008 [2,0,0,0,0,0|1,0,1]=4 443 B8R0.1 CONCC(=O)OCC Amb25072690 [2,0,0,0,0,0|1,0,0]=3 444 B8R0.1 C\C=C\C(=O)COCC Amb25779716 [2,0,0,0,0,0|1,0,1]=4 445 B8R0.1 C\C=C\CC(=O)OCC Amb24621820 [2,0,0,0,0,0|0,0,1]=3 446 B8R0.1 ClCCCC(=O)OCC Amb1153203 [2,0,0,0,0,0|1,0,1]=4 447 B8R0.4 CCOCCCOCC Amb25833519 [2,0,0,0,0,0|0,0,2]=4 448 B8R0.6 CCC(=C)CNOCC Amb24688394 [2,0,0,0,0,0|2,0,0]=4 449 B8R0.6 CCC(=O)C\C=C\CC Amb25282725 [2,0,0,0,0,0|1,0,0]=3 450 B8R0.6 CCC(=O)\C=C/NCC Amb25838666 [2,0,0,0,0,0|1,0,1]=4 451 B8R0.6 CCC(=O)\C=C\OCC Amb22055193 [2,0,0,0,0,0|0,0,1]=3 452 B8R0.6 CCC(=O)\C=C\SCC Amb24424828 [2,0,0,0,0,0|0,1,1]=4 453 B8R0.6 CCCC=CC(=O)OC Amb24093828 [2,0,0,0,0,0|1,0,1]=4 454 B8R0.6 CCCNCC(=O)CC Amb24715612 [2,0,0,0,0,0|2,0,0]=4 455 B8R0.6 CCN\C=C\C(=O)OC Amb2386650 [2,0,0,0,0,0|1,0,1]=4 456 B8R0.6 CCOCCC(=O)CO Amb24478622 [2,0,0,0,0,0|1,0,1]=4 457 B8R0.6 CCOCCC(=O)NC Amb25302984 [2,0,0,0,0,0|1,0,1]=4 458 B8R0.6 CCO\C=C\C(=O)CCl Amb24389562 [2,0,0,0,0,0|1,0,1]=4 459 B8R0.6 CCS\C=C\C(=O)OC Amb24387094 [2,0,0,0,0,0|0,1,1]=4 460 B8R0.6 CC\C=C\CC(=O)CCl Amb24611212 [2,0,0,0,0,0|2,0,0]=4 461 B8R0.6 CC\C=C\CC(=O)NC Amb25328971 [2,0,0,0,0,0|2,0,0]=4 462 B8R0.6 CNC(=O)CNOCC Amb25723721 [2,0,0,0,0,0|2,0,0]=4 463 B8R0.6 COC(=O)CNOCC Amb24739353 [2,0,0,0,0,0|1,0,0]=3 464 B8R0.6 COC(=O)C\C=C\CCl Amb25084500 [2,0,0,0,0,0|2,0,0]=4 465 B8R0.6 COC(=O)C\C=C\CN Amb25146041 [2,0,0,0,0,0|2,0,0]=4 466 B8R0.6 COC(=O)C\C=C\CO Amb24404592 [2,0,0,0,0,0|2,0,0]=4 467 B8R0.6 COC(=O)NCOCC Amb24606808 [2,0,0,0,0,0|1,0,1]=4 468 B8R0.5 CC(=C)CC(=O)CCC Amb24377405 [2,0,0,0,0,0|2,0,0]=4 469 B8R0.5 CC(=C)NC(=O)OCC Amb25324994 [2,0,0,0,0,0|2,0,0]=4 470 B8R0.5 CC(=CC(O)=O)OCC Amb25770190 [2,0,0,0,0,0|1,0,1]=4 471 B8R0.5 CC(=O)C=C(N)OCC Amb24561013 [2,0,0,0,0,0|1,0,1]=4 472 B8R0.5 CC(=O)CC(=N)OCC Amb24103656 [2,0,0,0,0,0|1,0,0]=3 473 B8R0.5 CC(=O)CC(=O)CCC Amb22347230 [2,0,0,0,0,0|1,0,0]=3 474 B8R0.5 CC(=O)CC(=O)CCO Amb25685471 [2,0,0,0,0,0|2,0,0]=4 475 B8R0.5 CC(=O)CC(=O)NOC Amb24096697 [2,0,0,0,0,0|2,0,0]=4 476 B8R0.5 CC(=O)CC(=O)OCC Amb22360190 [2,0,0,0,0,0|0,0,0]=2 477 B8R0.5 CC(=O)CC(=O)OOC Amb24096083 [2,0,0,0,0,0|1,0,0]=3 478 B8R0.5 CC(=O)CC(=O)\C=C\C Amb25807638 [2,0,0,0,0,0|1,0,1]=4 479 B8R0.5 CC(=O)CC(=S)OCC Amb25282821 [2,0,0,0,0,0|0,1,0]=3 480 B8R0.5 CC(=O)C\C(\Cl)=C/CC Amb24334261 [2,0,0,0,0,0|2,0,0]=4 481 B8R0.5 CC(=O)C\C(\Cl)=C\CC Amb25370634 [2,0,0,0,0,0|2,0,0]=4 482 B8R0.5 CC(=O)NC(=O)CCC Amb25324995 [2,0,0,0,0,0|2,0,0]=4 483 B8R0.5 CC(=O)NC(=S)OCC Amb24356625 [2,0,0,0,0,0|1,1,0]=4 484 B8R0.5 CC(=O)\C=C(/N)\OCC Amb24451604 [2,0,0,0,0,0|1,0,1]=4 485 B8R0.5 CCCC(=C)CC(O)=O Amb18642622 [2,0,0,0,0,0|2,0,0]=4 486 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [2,0,0,0,0,0|2,0,0]=4 487 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [2,0,0,0,0,0|1,0,0]=3 488 B8R0.5 CCOC(=O)CB(O)O Amb25050326 [2,0,0,0,0,0|1,0,1]=4 489 B8R0.5 CCOC(=O)CC(=N)Cl Amb25847101 [2,0,0,0,0,0|2,0,0]=4 490 B8R0.5 CCOC(=O)CC(=S)N Amb1154429 [2,0,0,0,0,0|1,1,0]=4 491 B8R0.5 CCOC(=O)CC(C)=C Amb17940814 [2,0,0,0,0,0|1,0,0]=3 492 B8R0.5 CCOC(=O)CC(C)Br Amb17940889 [2,0,0,0,0,0|1,0,1]=4 493 B8R0.5 CCOC(=O)CC(C)S Amb19515282 [2,0,0,0,0,0|0,1,1]=4 494 B8R0.5 CCOC(=O)CC(O)=O Amb22360654 [2,0,0,0,0,0|0,0,0]=2 495 B8R0.5 CCOC(=O)CC([13CH3])=O Amb22366911 [2,0,0,0,0,0|0,0,0]=2 496 B8R0.5 CCOC(=O)CN(=O)=O Amb17781240 [2,0,0,0,0,0|1,0,1]=4 497 B8R0.5 CCOC(=O)CS(C)=O Amb18177141 [2,0,0,0,0,0|1,0,0]=3 498 B8R0.5 CCOC(=O)CS(C)C Amb22351352 [2,0,0,0,0,0|2,0,0]=4 499 B8R0.5 CCOC(=O)C[13C](C)=O Amb22336363 [2,0,0,0,0,0|0,0,0]=2 500 B8R0.5 CCOC(=O)C[13C]([13CH3])=O Amb22351420 [2,0,0,0,0,0|0,0,0]=2 501 B8R0.5 CCOC(=O)C[C@H](C)Cl Amb24479960 [2,0,0,0,0,0|1,0,1]=4 502 B8R0.5 CCOC(=O)NC(N)=O Amb19884044 [2,0,0,0,0,0|2,0,0]=4 503 B8R0.5 CCOC(=O)OC(N)=O Amb25809405 [2,0,0,0,0,0|2,0,0]=4 504 B8R0.5 CCOC(=O)[13CH2]C([13CH3])=O Amb22362626 [2,0,0,0,0,0|0,0,0]=2 505 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [2,0,0,0,0,0|1,0,1]=4 506 B8R0.5 CCO[13C](=O)[13CH2]C(C)=O Amb22353575 [2,0,0,0,0,0|0,0,0]=2 507 B8R0.5 CCO[13C](=O)[13CH2][13C](=O)O Amb17618079 [2,0,0,0,0,0|0,0,0]=2 508 B8R0.5 CCO[13C](=O)[13CH2][13C]([13CH3])=O Amb22351473 [2,0,0,0,0,0|0,0,0]=2 509 B8R0.5 CCO[C@@H](O)CC(C)=O Amb25051240 [2,0,0,0,0,0|0,0,2]=4 510 B8R0.5 CCO[C@H](C)CC(O)=O Amb24395833 [2,0,0,0,0,0|1,0,1]=4 511 B8R0.5 CC\C=C(/C)\CC(C)=O Amb24751417 [2,0,0,0,0,0|2,0,0]=4 512 B8R0.5 CC\C=C(\C)/CC(C)=O Amb25314826 [2,0,0,0,0,0|2,0,0]=4 513 B8R0.5 CC\N=C(\C)/CC(C)=O Amb25838829 [2,0,0,0,0,0|2,0,0]=4 514 B8R0.5 COCC(=O)CC(=O)C Amb15701314 [2,0,0,0,0,0|2,0,0]=4 515 B8R0.5 COCC(=O)CC(O)=O Amb24093174 [2,0,0,0,0,0|2,0,0]=4 516 B8R0.5 C[13C](=O)C[13C](=O)OCC Amb22336726 [2,0,0,0,0,0|0,0,0]=2 517 B8R0.5 C\C(=C/C(C)=O)\OCC Amb25373030 [2,0,0,0,0,0|1,0,1]=4 518 B8R0.5 C\C(=C\C(C)=O)\OCC Amb25147210 [2,0,0,0,0,0|1,0,1]=4 519 B8R0.5 C\C(=C\C(O)=O)\OCC Amb18642786 [2,0,0,0,0,0|1,0,1]=4 520 B8R0.5 C\C(\CC(O)=O)=C/CC Amb25087318 [2,0,0,0,0,0|2,0,0]=4 521 B8R0.5 C\C(\CC(O)=O)=C\CC Amb24562251 [2,0,0,0,0,0|2,0,0]=4 522 B8R0.5 C\C(\I)=C/C(=O)OCC Amb22503728 [2,0,0,0,0,0|1,0,1]=4 523 B8R0.5 C\C(\I)=C\C(=O)OCC Amb25790655 [2,0,0,0,0,0|1,0,1]=4 524 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22053734 [2,0,0,0,0,0|0,0,2]=4 525 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22456709 [2,0,0,0,0,0|0,0,2]=4 526 B8R0.5 C\C(\[O-])=C\C(=O)OCC Amb22733216 [2,0,0,0,0,0|0,0,2]=4 527 B8R0.5 [O-]C(=O)CC(=O)OCC Amb2221978 [2,0,0,0,0,0|0,0,1]=3 528 B8R0.19 CC(=CC(=O)OC)OC Amb24534136 [2,0,0,0,0,0|1,0,1]=4 529 B8R0.19 CC(CC(=O)OC)=CC Amb25215730 [2,0,0,0,0,0|1,0,1]=4 530 B8R0.19 CC(CC(=O)OC)=NC Amb25349555 [2,0,0,0,0,0|2,0,0]=4 531 B8R0.19 CC(CC)=CC(=O)CC Amb25683797 [2,0,0,0,0,0|1,0,1]=4 532 B8R0.19 CC(CC)=CC(=O)OC Amb25334129 [2,0,0,0,0,0|1,0,1]=4 533 B8R0.19 CCC(=C)CC(=O)CN Amb25329097 [2,0,0,0,0,0|2,0,0]=4 534 B8R0.19 CCC(=N)NC(=O)OC Amb24337400 [2,0,0,0,0,0|2,0,0]=4 535 B8R0.19 CCC(=O)C=C(F)CC Amb24550099 [2,0,0,0,0,0|1,0,1]=4 536 B8R0.19 CCC(=O)CC(=O)NO Amb24690699 [2,0,0,0,0,0|2,0,0]=4 537 B8R0.19 CCC(=O)CC(Cl)=CC Amb24617724 [2,0,0,0,0,0|1,0,1]=4 538 B8R0.19 CCC(=O)CC(N)CC Amb24481802 [2,0,0,0,0,0|1,0,1]=4 539 B8R0.19 CCC(=O)CC(O)OC Amb25065360 [2,0,0,0,0,0|0,0,2]=4 540 B8R0.19 CCC(=O)C[C@H](O)CC Amb25298397 [2,0,0,0,0,0|0,0,2]=4 541 B8R0.19 CCC(=O)NC(=O)CC Amb17940302 [2,0,0,0,0,0|1,0,0]=3 542 B8R0.19 CCC(=O)OC(=O)CCl Amb25261522 [2,0,0,0,0,0|2,0,0]=4 543 B8R0.19 CCC(=O)\C=C(/S)\CC Amb24646505 [2,0,0,0,0,0|0,1,1]=4 544 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [2,0,0,0,0,0|1,0,1]=4 545 B8R0.19 CCC(N)=CC(=O)CC Amb24540773 [2,0,0,0,0,0|1,0,1]=4 546 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [2,0,0,0,0,0|1,0,1]=4 547 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [2,0,0,0,0,0|1,0,1]=4 548 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [2,0,0,0,0,0|0,0,2]=4 549 B8R0.19 CCN(O)CC(=O)OC Amb25259900 [2,0,0,0,0,0|1,0,1]=4 550 B8R0.19 CCS(=O)CC(=O)CC Amb25361921 [2,0,0,0,0,0|1,0,0]=3 551 B8R0.19 CCS(=O)CC(=O)OC Amb18787291 [2,0,0,0,0,0|1,0,0]=3 552 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [2,0,0,0,0,0|1,0,1]=4 553 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [2,0,0,0,0,0|0,0,2]=4 554 B8R0.19 CC[C@H](Cl)CC(=O)OC Amb25074562 [2,0,0,0,0,0|1,0,1]=4 555 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [2,0,0,0,0,0|0,0,2]=4 556 B8R0.19 CC\C(\N)=C\C(=O)OC Amb25041460 [2,0,0,0,0,0|1,0,1]=4 557 B8R0.19 CN(CC(=O)OC)OC Amb25072271 [2,0,0,0,0,0|2,0,0]=4 558 B8R0.19 CNC(=O)CC(=O)CCl Amb25808925 [2,0,0,0,0,0|2,0,0]=4 559 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [2,0,0,0,0,0|1,0,0]=3 560 B8R0.19 CNC(=O)NC(=O)OC Amb24540421 [2,0,0,0,0,0|2,0,0]=4 561 B8R0.19 COC(=N)CC(=N)OC Amb21857807 [2,0,0,0,0,0|2,0,0]=4 562 B8R0.19 COC(=N)CC(=N)OC Amb24700148 [2,0,0,0,0,0|2,0,0]=4 563 B8R0.19 COC(=N)CC(=O)OC Amb24476600 [2,0,0,0,0,0|1,0,0]=3 564 B8R0.19 COC(=N)NC(=O)OC Amb24760898 [2,0,0,0,0,0|2,0,0]=4 565 B8R0.19 COC(=O)CC(=C)CCl Amb24053257 [2,0,0,0,0,0|2,0,0]=4 566 B8R0.19 COC(=O)CC(=O)C=C Amb17593339 [2,0,0,0,0,0|0,0,2]=4 567 B8R0.19 COC(=O)CC(=O)C=O Amb25827200 [2,0,0,0,0,0|1,0,1]=4 568 B8R0.19 COC(=O)CC(=O)CBr Amb24081949 [2,0,0,0,0,0|1,0,0]=3 569 B8R0.19 COC(=O)CC(=O)CN Amb18115867 [2,0,0,0,0,0|1,0,0]=3 570 B8R0.19 COC(=O)CC(=O)NN Amb22491081 [2,0,0,0,0,0|2,0,0]=4 571 B8R0.19 COC(=O)CS(=O)CCl Amb24582180 [2,0,0,0,0,0|2,0,0]=4 572 B8R0.19 COC(=O)NC(=O)CF Amb24609035 [2,0,0,0,0,0|2,0,0]=4 573 B8R0.19 COC(=O)NC(=O)CI Amb20668254 [2,0,0,0,0,0|2,0,0]=4 574 B8R0.19 COC(=O)NC(=O)OC Amb25103686 [2,0,0,0,0,0|1,0,0]=3 575 B8R0.19 COC(=O)OC(=O)OC Amb20240544 [2,0,0,0,0,0|1,0,0]=3 576 B8R0.19 C[C@@H](CC(=O)CC)CC Amb24448957 [2,0,0,0,0,0|1,0,1]=4 577 B8R0.19 C[C@H](CC(=O)CC)CC Amb24689490 [2,0,0,0,0,0|1,0,1]=4 578 B8R0.19 C\C(=C/C(=O)CC)\OC Amb24646507 [2,0,0,0,0,0|1,0,1]=4 579 B8R0.19 C\C(=C/C(=O)OC)\OC Amb21927982 [2,0,0,0,0,0|1,0,1]=4 580 B8R0.19 C\C(\CC(=O)CC)=C/C Amb25298433 [2,0,0,0,0,0|1,0,1]=4 581 B8R0.19 C\C(\CC(=O)OC)=C\C Amb24453303 [2,0,0,0,0,0|1,0,1]=4 582 B8R0.19 ClCC(=O)NC(=O)OC Amb1152897 [2,0,0,0,0,0|2,0,0]=4 583 B8R0.19 O=C(CC(=O)CCl)CCl Amb25738744 [2,0,0,0,0,0|2,0,0]=4 584 B8R0.19 O=C(CC(=O)O[K])O[K] Amb20246887 [2,0,0,0,0,0|2,0,0]=4 585 B8R0.19 OCC(=O)CC(=O)CO Amb24608175 [2,0,0,0,0,0|2,0,0]=4 586 B10R0.1 CCOC(=O)CCCOCC Amb22336385 [1,1,0,0,0,0|0,0,1]=3 587 B10R0.1 CCOC(=O)CCNCCN Amb18792258 [1,1,0,0,0,0|1,0,1]=4 588 B10R0.1 CCOC(=O)CCSCCN Amb18178450 [1,1,0,0,0,0|0,1,1]=4 589 B10R0.1 CCOC(=O)\C=C\CCCCl Amb19888384 [1,1,0,0,0,0|1,0,1]=4 590 B10R0.1 NCCCCCC(=O)OCC Amb10553125 [1,1,0,0,0,0|1,0,1]=4 591 B10R0.3 CCOC(=O)CCNC(C)C Amb19887847 [1,1,0,0,0,0|1,0,1]=4 592 B10R0.3 CCOC(=O)CNNC(C)C Amb24103460 [1,1,0,0,0,0|2,0,0]=4 593 B10R0.6 CCCCCC(=O)OC(C)C Amb22730708 [1,1,0,0,0,0|1,0,1]=4 594 B10R0.6 CCCOCC(=O)OC(C)C Amb15692603 [1,1,0,0,0,0|2,0,0]=4 595 B10R0.6 CCO\C=C\C(=O)NC(C)C Amb24766351 [1,1,0,0,0,0|1,0,1]=4 596 B10R0.19 CC=C=CC(O)C(=O)OCC Amb25386055 [1,1,0,0,0,0|1,0,1]=4 597 B10R0.19 C\C(=C/OCC)\C(=O)OCC Amb19895202 [1,1,0,0,0,0|0,0,1]=3 598 B10R0.91 CCCOCC(=O)OCCC Amb15692604 [1,1,0,0,0,0|2,0,0]=4 599 B10R0.91 CCOCCC(=O)OCCCl Amb24065564 [1,1,0,0,0,0|0,0,1]=3 600 B10R0.108 CCOC(=O)CNC(=O)CC Amb17775264 [1,1,0,0,0,0|2,0,0]=4 601 B10R0.7 CC(N)(CC(=O)OCC)CC Amb23443910 [1,1,0,0,0,0|1,0,1]=4 602 B10R0.7 CCOC(=O)CS(=O)(=O)CCl Amb22365044 [1,1,0,0,0,0|2,0,0]=4 603 B10R0.18 CCC(=O)NC(=O)OCCCl Amb25386348 [1,1,0,0,0,0|1,0,0]=3 604 B10R0.18 CCC(=O)NC(=O)SCCC Amb25384555 [1,1,0,0,0,0|1,1,0]=4 605 B10R0.18 CCCCC(=O)CC(=O)OC Amb15692765 [1,1,0,0,0,0|1,0,0]=3 606 B10R0.18 CCCOC(=O)NC(=O)CF Amb25384735 [1,1,0,0,0,0|2,0,0]=4 607 B10R0.18 CCON=C(N)CC(=O)NC Amb24762578 [1,1,0,0,0,0|2,0,0]=4 608 B10R0.18 CC\C=C\C(=O)NC(=O)OC Amb24610171 [1,1,0,0,0,0|2,0,0]=4 609 B10R0.18 COC(=N)NC(=O)OCCC Amb25384667 [1,1,0,0,0,0|2,0,0]=4 610 B10R0.18 COC(=O)CC(=O)COCC Amb22495523 [1,1,0,0,0,0|0,0,0]=2 611 B10R0.18 COC(=O)CC(=O)NCC#C Amb24766576 [1,1,0,0,0,0|1,0,1]=4 612 B10R0.18 COCCC(=O)CC(=O)OC Amb17739713 [1,1,0,0,0,0|1,0,0]=3 613 B10R0.26 CC(=C)C(=O)NC(=O)OCC Amb25289259 [1,1,0,0,0,0|1,0,1]=4 614 B10R0.26 CC(=CC(=O)OCC)C(C)F Amb24089412 [1,1,0,0,0,0|1,0,1]=4 615 B10R0.26 CC(C)C(O)CC(=O)OCC Amb18797786 [1,1,0,0,0,0|0,0,2]=4 616 B10R0.26 CC(C)[C@@H](O)CC(=O)OCC Amb20241550 [1,1,0,0,0,0|0,0,2]=4 617 B10R0.26 CCNC(=O)NC(=O)C(C)I Amb25151280 [1,1,0,0,0,0|2,0,0]=4 618 B10R0.26 CCOC(=O)CC(=O)C(Br)C Amb17621803 [1,1,0,0,0,0|0,0,0]=2 619 B10R0.26 CCOC(=O)CC(=O)C(F)F Amb1946008 [1,1,0,0,0,0|1,0,0]=3 620 B10R0.26 CCOC(=O)CC(C(C)C)N Amb13949090 [1,1,0,0,0,0|1,0,1]=4 621 B10R0.26 CCOC(=O)NC(=O)C(Cl)Cl Amb24694824 [1,1,0,0,0,0|2,0,0]=4 622 B10R0.26 CCOC(=O)\C=C(/C(F)C)\C Amb10841662 [1,1,0,0,0,0|1,0,1]=4 623 B10R0.26 CCOC(=O)\C=C(/N)\C(C)C Amb22498758 [1,1,0,0,0,0|1,0,1]=4 624 B10R0.26 CCOC(=O)\C=C(\N)/C(C)C Amb24754802 [1,1,0,0,0,0|1,0,1]=4 625 B10R0.26 CCOC(O)=CC(=O)C(C)F Amb24764990 [1,1,0,0,0,0|0,0,2]=4 626 B10R0.26 COCC(=O)CC(=O)C(C)C Amb22157286 [1,1,0,0,0,0|2,0,0]=4 627 B10R0.26 C\C(=C\C(=O)OCC)\C(C)O Amb25386080 [1,1,0,0,0,0|1,0,1]=4 628 B10R0.34 CCOC(=O)CC(OC)OC Amb22232477 [1,1,0,0,0,0|0,0,2]=4 629 B10R0.34 CCOC(=O)\C=C(/CC)\NC Amb25385261 [1,1,0,0,0,0|1,0,1]=4 630 B10R0.34 CO\C(\CBr)=C/C(=O)OCC Amb20241756 [1,1,0,0,0,0|1,0,1]=4 631 B10R0.35 CC(CC)=C(C)C(=O)OCC Amb24755466 [1,1,0,0,0,0|1,0,1]=4 632 B10R0.35 CC(CC)C(N)C(=O)OCC Amb19375483 [1,1,0,0,0,0|1,0,1]=4 633 B10R0.35 CCCC(=O)C(C)C(=O)NC Amb24766676 [1,1,0,0,0,0|2,0,0]=4 634 B10R0.35 CCCC(=O)C(C)C(=O)OC Amb18182338 [1,1,0,0,0,0|1,0,0]=3 635 B10R0.35 CCOC(=O)C(Br)C(=O)CBr Amb17689096 [1,1,0,0,0,0|1,0,0]=3 636 B10R0.35 CCOC(=O)C(C(=O)CC)C Amb10605323 [1,1,0,0,0,0|0,0,0]=2 637 B10R0.35 CCOC(=O)C(C)C(=O)NC Amb22347637 [1,1,0,0,0,0|1,0,0]=3 638 B10R0.35 CCOC(=O)C(C)C(=O)NN Amb25384104 [1,1,0,0,0,0|2,0,0]=4 639 B10R0.35 CCOC(=O)C(N)C(C)CC Amb17755590 [1,1,0,0,0,0|1,0,1]=4 640 B10R0.35 CCOC(=O)C(O)C(=O)NC Amb25385772 [1,1,0,0,0,0|1,0,0]=3 641 B10R0.35 CCOC(=O)N(C)C(=O)NC Amb25384561 [1,1,0,0,0,0|2,0,0]=4 642 B10R0.35 CCOC(=O)[C@H]([C@H](CC)C)N Amb16233813 [1,1,0,0,0,0|1,0,1]=4 643 B10R0.35 CCOC(=O)[C@H]([C@H](CC)C)N Amb16233939 [1,1,0,0,0,0|1,0,1]=4 644 B10R0.35 CCOC(=O)[C@H]([C@H](CC)C)N Amb16233940 [1,1,0,0,0,0|1,0,1]=4 645 B10R0.35 COCC(=O)C(Cl)C(=O)OC Amb22641849 [1,1,0,0,0,0|2,0,0]=4 646 B10R0.35 C\C=C\C(=O)C(C)C(=O)CC Amb24765430 [1,1,0,0,0,0|1,0,1]=4 647 B10R0.44 CC(=O)CC(=O)CC(=O)OC Amb18048464 [1,1,0,0,0,0|1,0,1]=4 648 B10R0.44 CC(=O)NC(=O)CC(=O)CC Amb25678567 [1,1,0,0,0,0|1,0,1]=4 649 B10R0.44 CC(C)=CC(=O)CC(=O)OC Amb24766927 [1,1,0,0,0,0|1,0,1]=4 650 B10R0.44 CC(C)OC(=O)NC(=O)CCl Amb24487868 [1,1,0,0,0,0|2,0,0]=4 651 B10R0.44 CCC(=O)NC(=O)CC(C)C Amb24653651 [1,1,0,0,0,0|2,0,0]=4 652 B10R0.44 CCC(=O)NC(=O)NC(C)C Amb25685908 [1,1,0,0,0,0|2,0,0]=4 653 B10R0.44 CNC(=O)CC(=O)OC(C)C Amb25384373 [1,1,0,0,0,0|1,0,0]=3 654 B10R0.44 COC(=O)CC(=O)CC(C)C Amb15693129 [1,1,0,0,0,0|1,0,0]=3 655 B10R0.44 COC(=O)CC(=O)NC(C)C Amb17400045 [1,1,0,0,0,0|1,0,0]=3 656 B10R0.44 COC(=O)NC(=N)OC(C)C Amb24378096 [1,1,0,0,0,0|2,0,0]=4 657 B10R0.44 COC(=O)NC(=O)CC(C)C Amb25125804 [1,1,0,0,0,0|2,0,0]=4 658 B10R0.44 C\C(=C\C(=O)CC)\OC(C)C Amb24765327 [1,1,0,0,0,0|1,0,1]=4 659 B10R0.44 C\C(\N)=C\C(=O)CC(=O)OC Amb24765219 [1,1,0,0,0,0|1,0,1]=4 660 B10R0.46 CCC(=O)CC(=O)C(=O)OC Amb24066601 [1,1,0,0,0,0|2,0,0]=4 661 B10R0.46 CCN(C)C(=O)CC(=O)NC Amb24762684 [1,1,0,0,0,0|2,0,0]=4 662 B10R0.46 COC(=O)C(=O)CC(=O)OC Amb22490417 [1,1,0,0,0,0|2,0,0]=4 663 B10R0.32 CC(=C[C@H](C)O)C(=O)OCC Amb25386077 [0,1,0,0,1,0|2,0,0]=4 664 B10R0.32 CC(=O)NC(=O)C(=O)OCC Amb24484965 [0,1,0,0,1,0|1,0,1]=4 665 B10R0.32 CCOC(=O)C(=O)CC(C)C Amb10605336 [0,1,0,0,1,0|1,0,0]=3 666 B10R0.32 CCOC(=O)C(N)=CC(C)C Amb25385253 [0,1,0,0,1,0|2,0,0]=4 667 B10R0.32 C\C(=C/[C@H](C)N)\C(=O)OCC Amb24764538 [0,1,0,0,1,0|2,0,0]=4 668 B10R0.32 C\C(=C\CC)\C(=O)OC(C)C Amb25379928 [0,1,0,0,1,0|2,0,0]=4 669 B10R0.32 C\C(\Cl)=C\C(=O)C(=O)OCC Amb24766986 [0,1,0,0,1,0|1,0,1]=4 670 B10R0.32 C\C(\N)=C/C(=O)C(=O)OCC Amb24764518 [0,1,0,0,1,0|1,0,1]=4 671 B10R0.33 CC=C(OCC)C(=O)NCC Amb25384816 [0,1,0,0,1,0|2,0,0]=4 672 B10R0.33 CCOC(=O)C(=CCC)C#N Amb25383236 [0,1,0,0,1,0|2,0,0]=4 673 B10R0.33 C\C=C(\OCC)/C(=O)NCC Amb25384140 [0,1,0,0,1,0|2,0,0]=4 674 B12R0.69 CCCC(=O)CC(=O)C(=O)OCC Amb1123761 [0,1,0,0,0,1|1,0,0]=3 675 B12R0.69 CCCC(=O)N(C)CC(=O)OCC Amb19059114 [0,1,0,0,0,1|1,0,0]=3 676 B12R0.69 CCOC(=O)C(S)CC(=O)OCC Amb22372038 [0,1,0,0,0,1|0,0,0]=2 677 B12R0.69 CCOC(=O)CC(=C)C(=O)OCC Amb15692707 [0,1,0,0,0,1|0,0,0]=2 678 B12R0.69 CCOC(=O)CC(=O)C(=O)OCC Amb10603616 [0,1,0,0,0,1|0,0,0]=2 679 B12R0.69 CCOC(=O)CC(=O)C(=O)OCC Amb22898981 [0,1,0,0,0,1|0,0,0]=2 680 B12R0.69 CCOC(=O)CC(C(=O)OCC)N Amb17594907 [0,1,0,0,0,1|0,0,0]=2 681 B12R0.69 CCOC(=O)[C@@H](N)CC(=O)OCC Amb22230805 [0,1,0,0,0,1|0,0,0]=2 682 B12R0.69 CCOC(=O)[C@H](N)CC(=O)OCC Amb22230510 [0,1,0,0,0,1|0,0,0]=2 683 B12R0.69 CCOC(=O)\C(\Cl)=C/C(=O)OCC Amb22055090 [0,1,0,0,0,1|0,0,1]=3 684 B12R0.69 CCOC(=O)\C=C(\C(=O)OCC)/O Amb16230916 [0,1,0,0,0,1|0,0,1]=3 685 B12R0.69 COCC(=O)N(C)CC(=O)OCC Amb18324262 [0,1,0,0,0,1|2,0,0]=4 686 B12R0.69 ClCCC(=O)NC(C(=O)OCC)C Amb17323364 [0,1,0,0,0,1|2,0,0]=4 687 B12R0.101 CCCCC(=S)NCC(=O)OCC Amb10563145 [0,1,0,0,0,1|1,1,0]=4 688 B12R0.101 CCCNC(=O)NNC(=O)OCC Amb2389251 [0,1,0,0,0,1|2,0,0]=4 689 B12R0.101 CCOC(=O)CNC(=O)NCC=C Amb2136470 [0,1,0,0,0,1|1,0,1]=4 690 B12R0.101 CCOC(=O)CNC(=O)NCCCl Amb24090360 [0,1,0,0,0,1|1,0,0]=3 691 B12R0.101 ClCCCC(=O)NCC(=O)OCC Amb17327118 [0,1,0,0,0,1|1,0,0]=3 692 B12R0.3 CC(CC(=O)CC(=O)CC(C)C)C Amb17594761 [0,2,0,0,0,0|2,0,0]=4 693 B12R0.78 CC(C)(C)OC(=O)NC(=S)OCC Amb25095194 [0,2,0,0,0,0|1,1,0]=4 694 B12R0.78 CCCC(=O)NC(=O)OC(C)(C)C Amb24531765 [0,2,0,0,0,0|2,0,0]=4 695 B12R0.78 CCOC(=O)CC(=O)CC(C)(C)C Amb20673087 [0,2,0,0,0,0|1,0,0]=3 696 B12R0.78 CCOC(=O)CC(=O)OC(C)(C)C Amb16230923 [0,2,0,0,0,0|0,0,0]=2 697 B12R0.78 CCOC(=O)CC(=O)O[Si](C)(C)C Amb22230697 [0,2,0,0,0,0|0,1,0]=3 698 B12R0.78 CCOC(=O)NC(=O)OC(C)(C)C Amb25858276 [0,2,0,0,0,0|1,0,0]=3 699 B12R0.191 CC(C)CC(=O)C(Cl)C(=O)OCC Amb20667603 [0,2,0,0,0,0|1,0,0]=3 700 B12R0.103 CCCNC(=O)CC(=O)NCCC Amb22485570 [0,2,0,0,0,0|2,0,0]=4 701 B12R0.103 NCCNC(=O)CC(=O)NCCN Amb21953121 [0,2,0,0,0,0|2,0,0]=4 702 B12R0.103 NCCNC(=O)CC(=O)NCCN Amb21953127 [0,2,0,0,0,0|2,0,0]=4 703 B12R0.103 NCC[N-]C(=O)CC(=O)[N-]CCN Amb21953122 [0,2,0,0,0,0|2,0,0]=4 704 B12R0.103 O=C(CC(=O)OCCCl)OCCCl Amb22345495 [0,2,0,0,0,0|0,0,0]=2 705 B12R0.103 OCCNC(=O)CC(=O)NCCO Amb1089430 [0,2,0,0,0,0|2,0,0]=4 706 B12R0.283 CCOC(=O)CC(=O)CCC(C)C Amb19070024 [0,2,0,0,0,0|1,0,0]=3 707 B12R0.353 C\C(=C/OCC)\C(=O)C(=O)OCC Amb19958553 [0,2,0,0,0,0|1,0,1]=4 708 B12R0.8 CCOC(=O)C(=CC)C(=O)OCC Amb10071214 [0,2,0,0,0,0|0,0,1]=3 709 B12R0.8 CCOC(=O)C(=NN)C(=O)OCC Amb22466504 [0,2,0,0,0,0|0,0,1]=3 710 B12R0.8 CCOC(=O)C(CBr)C(=O)OCC Amb24052989 [0,2,0,0,0,0|0,0,0]=2 711 B12R0.8 CNC(C(=O)OCC)C(=O)OCC Amb24184040 [0,2,0,0,0,0|0,0,0]=2 712 B12R0.8 C\C(\OCC)=C(\C#N)/C(=O)OCC Amb19748172 [0,2,0,0,0,0|1,0,1]=4 713 B12R0.731 CC(Br)(C(=O)OCC)C(=O)OCC Amb22756876 [0,2,0,0,0,0|0,0,0]=2 714 B12R0.731 CCOC(=O)C(Br)(Br)C(=O)OCC Amb19895075 [0,2,0,0,0,0|0,0,0]=2 715 B12R0.731 CCOC(=O)C(C(=O)OCC)(F)C Amb16230912 [0,2,0,0,0,0|0,0,0]=2 716 B12R0.731 CCOC(=O)C(C(=O)OCC)(F)F Amb10839610 [0,2,0,0,0,0|0,0,0]=2 717 B12R0.731 CCOC(=O)C(C(=O)OCC)(O)C Amb10604146 [0,2,0,0,0,0|0,0,0]=2 718 B12R0.731 CCOC(=O)C(O)(O)C(=O)OCC Amb24060915 [0,2,0,0,0,0|0,0,0]=2 719 B12R0.731 OCCC(=O)C(C(=O)OCC)(C)C Amb15701348 [0,2,0,0,0,0|2,0,0]=4 720 B12R0.731 [2H]C([2H])(C(=O)OCC)C(=O)OCC Amb22362011 [0,2,0,0,0,0|0,0,0]=2 721 B12R0.71 CCOC(=O)CC(=O)C(CC)CC Amb17529735 [0,2,0,0,0,0|1,0,0]=3 722 B12R0.313 CC(C)(CC)C(=O)CC(=O)OCC Amb19890422 [0,2,0,0,0,0|1,0,0]=3 723 B12R0.471 CCOP(=O)(CP(=O)(OCC)[O-])[O-] Amb10068627 [0,2,0,0,0,0|2,0,0]=4 724 B10R1.10 CCOC1=CC(=O)CCC1 Amb17750127 [1,0,0,1,0,0|1,0,1]=4 725 B10R1.10 CCOC=1CC(=O)CCC1 Amb25146714 [1,0,0,1,0,0|1,0,1]=4 726 B10R1.11 CCNC(=O)C1COCC1 Amb25188332 [1,0,0,1,0,0|1,0,1]=4 727 B10R1.11 CCNC(=O)C=1CCOC1 Amb25057393 [1,0,0,1,0,0|1,0,1]=4 728 B10R1.11 CCOC(=O)C1CCC=C1 Amb24356534 [1,0,0,1,0,0|1,0,0]=3 729 B10R1.11 CCOC(=O)C1CCC=N1 Amb24093469 [1,0,0,1,0,0|2,0,0]=4 730 B10R1.11 CCOC(=O)C1CCCC1 Amb21929348 [1,0,0,1,0,0|1,0,1]=4 731 B10R1.11 CCOC(=O)C1CCCS1 Amb24554669 [1,0,0,1,0,0|2,0,0]=4 732 B10R1.11 CCOC(=O)C1CCNC1 Amb17740007 [1,0,0,1,0,0|1,0,1]=4 733 B10R1.11 CCOC(=O)C1CCNO1 Amb23512822 [1,0,0,1,0,0|2,0,0]=4 734 B10R1.11 CCOC(=O)C1CCON1 Amb24062144 [1,0,0,1,0,0|1,0,0]=3 735 B10R1.11 CCOC(=O)C1CNCC1 Amb13887211 [1,0,0,1,0,0|1,0,1]=4 736 B10R1.11 CCOC(=O)C1COCC1 Amb10844811 [1,0,0,1,0,0|0,0,1]=3 737 B10R1.11 CCOC(=O)C1COCO1 Amb25376141 [1,0,0,1,0,0|1,0,1]=4 738 B10R1.11 CCOC(=O)C1CSCC1 Amb25761644 [1,0,0,1,0,0|0,1,1]=4 739 B10R1.11 CCOC(=O)N1CCC=C1 Amb25144136 [1,0,0,1,0,0|2,0,0]=4 740 B10R1.11 CCOC(=O)[C@@H]1C=CCN1 Amb24433183 [1,0,0,1,0,0|2,0,0]=4 741 B10R1.11 CCOC(=O)[C@@H]1CCC=C1 Amb25103016 [1,0,0,1,0,0|1,0,0]=3 742 B10R1.11 CCOC(=O)[C@@H]1CCCN1 Amb15692005 [1,0,0,1,0,0|2,0,0]=4 743 B10R1.11 CCOC(=O)[C@@H]1CCCN1 Amb22746877 [1,0,0,1,0,0|2,0,0]=4 744 B10R1.11 CCOC(=O)[C@@H]1CCON1 Amb24748594 [1,0,0,1,0,0|1,0,0]=3 745 B10R1.11 CCOC(=O)[C@@H]1CNCC1 Amb20670973 [1,0,0,1,0,0|1,0,1]=4 746 B10R1.11 CCOC(=O)[C@@H]1CNCC1 Amb22737483 [1,0,0,1,0,0|1,0,1]=4 747 B10R1.11 CCOC(=O)[C@H]1CCCN1 Amb22230604 [1,0,0,1,0,0|2,0,0]=4 748 B10R1.11 CCOC(=O)[C@H]1CCCN1 Amb24428260 [1,0,0,1,0,0|2,0,0]=4 749 B10R1.11 CCOC(=O)[C@H]1CNCC1 Amb20670974 [1,0,0,1,0,0|1,0,1]=4 750 B10R1.11 CCOC(=O)[C@H]1CNCC1 Amb22737482 [1,0,0,1,0,0|1,0,1]=4 751 B10R1.29 CCN\C=C\1/CCOC1=O Amb24479009 [1,0,0,1,0,0|1,0,1]=4 752 B10R1.29 CCOCC1CCCC1=O Amb24431926 [1,0,0,1,0,0|1,0,1]=4 753 B10R1.29 CCONC1CCNC1=O Amb25829895 [1,0,0,1,0,0|2,0,0]=4 754 B10R1.29 CCO\C=C/1\CCCC1=O Amb25146704 [1,0,0,1,0,0|1,0,1]=4 755 B10R1.29 CCO\C=C/1\CCOC1=O Amb24480991 [1,0,0,1,0,0|0,0,1]=3 756 B10R1.78 O=C1CC=CCCCCC1 Amb24571778 [1,0,0,1,0,0|2,0,0]=4 757 B10R1.79 CC1CCCC(=O)CC=C1 Amb25146784 [1,0,0,1,0,0|2,0,0]=4 758 B10R1.130 CCOC1=CC(=O)CC1C Amb25146685 [1,0,0,1,0,0|1,0,1]=4 759 B10R1.130 CCOC1=CC(=O)NC1C Amb25258901 [1,0,0,1,0,0|1,0,1]=4 760 B10R1.135 CCOC(=O)C1C=C1CBr Amb25314343 [1,0,0,1,0,0|2,0,0]=4 761 B10R1.135 CCOC(=O)C1C=C1CN Amb24453316 [1,0,0,1,0,0|2,0,0]=4 762 B10R1.135 CCOC(=O)C1C=C1CO Amb25169366 [1,0,0,1,0,0|2,0,0]=4 763 B10R1.135 CCOC(=O)C1CC1CC Amb24358493 [1,0,0,1,0,0|1,0,1]=4 764 B10R1.135 CCOC(=O)[C@H]1C=C1CBr Amb24713738 [1,0,0,1,0,0|2,0,0]=4 765 B10R1.136 CC1CC1CC(=O)OCC Amb24482665 [1,0,0,1,0,0|1,0,1]=4 766 B10R1.136 CCOC(=O)CN1CC1C Amb24078336 [1,0,0,1,0,0|2,0,0]=4 767 B10R1.137 CCOC(=O)C=C1CCC1 Amb16230894 [1,0,0,1,0,0|1,0,1]=4 768 B10R1.137 CCOC(=O)CC1CCC1 Amb21963823 [1,0,0,1,0,0|1,0,1]=4 769 B10R1.137 CCOC(=O)CC1CCO1 Amb22236098 [1,0,0,1,0,0|0,0,1]=3 770 B10R1.138 CCOC(=O)CSC1CC1 Amb25355964 [1,0,0,1,0,0|2,0,0]=4 771 B10R1.138 CCOC(=O)\C=C\C1CC1 Amb10067014 [1,0,0,1,0,0|1,0,1]=4 772 B10R1.186 CCO\C=C\C(=O)C1CC1 Amb24622573 [1,0,0,1,0,0|1,0,1]=4 773 B10R1.260 CCOC=1CC(=O)C1CC Amb24380854 [1,0,0,1,0,0|1,0,0]=3 774 B10R1.8 CCN1C[C@H](C)OC(=O)C1 Amb25350741 [1,0,0,1,0,0|2,0,0]=4 775 B10R1.22 CC1C(C)NC(=O)NC1=O Amb25727232 [1,0,0,1,0,0|2,0,0]=4 776 B10R1.22 CC1OC(=O)CC(=O)C1C Amb24467551 [1,0,0,1,0,0|0,0,0]=2 777 B10R1.22 C[C@@H]1OC(=O)CC(=O)[C@@H]1C Amb24602811 [1,0,0,1,0,0|0,0,0]=2 778 B10R1.22 C[C@@H]1[C@@H](C)NC(=O)NC1=O Amb24696322 [1,0,0,1,0,0|2,0,0]=4 779 B10R1.22 C[C@H]1[C@@H](C)NC(=O)NC1=O Amb24514993 [1,0,0,1,0,0|2,0,0]=4 780 B10R1.22 C[C@H]1[C@@H](O)CC(=O)O[C@@H]1C Amb25175300 [1,0,0,1,0,0|0,0,2]=4 781 B10R1.27 CCC(=O)CC1=CCCO1 Amb25725825 [1,0,0,1,0,0|1,0,0]=3 782 B10R1.27 CCC(=O)CC1CCCO1 Amb19375352 [1,0,0,1,0,0|1,0,1]=4 783 B10R1.27 CCC(=O)CC1OCCO1 Amb25146612 [1,0,0,1,0,0|0,0,2]=4 784 B10R1.27 CCC(=O)CC=1NCCN1 Amb24695922 [1,0,0,1,0,0|2,0,0]=4 785 B10R1.27 CCC(=O)\C=C/1\CCCO1 Amb24588983 [1,0,0,1,0,0|1,0,1]=4 786 B10R1.27 CCC(=O)\C=C\1/CCCO1 Amb25146747 [1,0,0,1,0,0|1,0,1]=4 787 B10R1.27 COC(=O)CC1CCCO1 Amb1094070 [1,0,0,1,0,0|1,0,1]=4 788 B10R1.27 COC(=O)CC1OCCO1 Amb21961887 [1,0,0,1,0,0|0,0,2]=4 789 B10R1.27 COC(=O)CC=1CCCC1 Amb24643741 [1,0,0,1,0,0|2,0,0]=4 790 B10R1.27 COC(=O)\C=C/1\CCCO1 Amb24406884 [1,0,0,1,0,0|1,0,1]=4 791 B10R1.35 CCN1N=C(CC1=O)CC Amb25823712 [1,0,0,1,0,0|2,0,0]=4 792 B10R1.49 CC=1C(C1CC)C(=O)OC Amb25373544 [1,0,0,1,0,0|2,0,0]=4 793 B10R1.99 CCCC1=N[C@@H]1C(=O)OC Amb24664352 [1,0,0,1,0,0|2,0,0]=4 794 B10R1.99 CCCC1=N[C@H]1C(=O)OC Amb25114613 [1,0,0,1,0,0|2,0,0]=4 795 B10R1.131 CCOC=1CC(=O)N(C)N1 Amb24482501 [1,0,0,1,0,0|2,0,0]=4 796 B10R1.134 CCC(=C)CC(=O)C1CC1 Amb24389573 [1,0,0,1,0,0|2,0,0]=4 797 B10R1.134 CCS(=O)CC(=O)C1CC1 Amb24696251 [1,0,0,1,0,0|2,0,0]=4 798 B10R1.149 CC1=CCCC1C(=O)CC Amb25839300 [1,0,0,1,0,0|2,0,0]=4 799 B10R1.149 CC1OCCC1C(=O)CC Amb24625957 [1,0,0,1,0,0|1,0,1]=4 800 B10R1.149 CC1OCCC1C(=O)OC Amb20622565 [1,0,0,1,0,0|1,0,1]=4 801 B10R1.149 CCC(=O)C1CCNC1=O Amb24511514 [1,0,0,1,0,0|1,0,0]=3 802 B10R1.149 CCN(C)C1CCOC1=O Amb24485060 [1,0,0,1,0,0|2,0,0]=4 803 B10R1.149 CNC(=O)C1CCCC1=O Amb25775852 [1,0,0,1,0,0|2,0,0]=4 804 B10R1.149 CNC(=O)N1CCOC1=O Amb25843710 [1,0,0,1,0,0|2,0,0]=4 805 B10R1.149 COC(=O)C1CC=CC1=O Amb24601779 [1,0,0,1,0,0|1,0,1]=4 806 B10R1.149 COC(=O)C1CCCS1=O Amb23448644 [1,0,0,1,0,0|2,0,0]=4 807 B10R1.149 COC(=O)C1CCNC1=O Amb13882864 [1,0,0,1,0,0|1,0,0]=3 808 B10R1.149 COC(=O)C1CCNC1=S Amb25335523 [1,0,0,1,0,0|1,1,0]=4 809 B10R1.149 COC(=O)C1CCOC1=O Amb21856449 [1,0,0,1,0,0|0,0,0]=2 810 B10R1.149 COC(=O)C1COCC1=O Amb21864714 [1,0,0,1,0,0|2,0,0]=4 811 B10R1.149 COC(=O)C1OCCC1=O Amb21963955 [1,0,0,1,0,0|2,0,0]=4 812 B10R1.149 COC(=O)C=1CCOC1Cl Amb22713485 [1,0,0,1,0,0|1,0,1]=4 813 B10R1.149 COC(=O)C=1CCOC1N Amb25147526 [1,0,0,1,0,0|1,0,1]=4 814 B10R1.149 COC(=O)N1CCNC1=O Amb25049699 [1,0,0,1,0,0|2,0,0]=4 815 B10R1.149 COC(=O)N1CCOC1=O Amb25794223 [1,0,0,1,0,0|1,0,0]=3 816 B10R1.149 COC(=O)[C@H]1CCCC1=O Amb24557403 [1,0,0,1,0,0|1,0,0]=3 817 B10R1.149 CON(C)C1CCOC1=O Amb25057341 [1,0,0,1,0,0|2,0,0]=4 818 B10R1.149 O=C1OCCN1C(=O)CI Amb20668212 [1,0,0,1,0,0|2,0,0]=4 819 B10R1.162 COC=1CC(=O)CCCN1 Amb25714255 [1,0,0,1,0,0|2,0,0]=4 820 B10R1.256 CC1C(CC)C(=O)NC1=O Amb24754038 [1,0,0,1,0,0|2,0,0]=4 821 B10R1.256 C[C@@H]1[C@H](CC)C(=O)NC1=O Amb24628983 [1,0,0,1,0,0|2,0,0]=4 822 B10R1.256 C[C@H]1[C@@H](CC)C(=O)NC1=O Amb24540840 [1,0,0,1,0,0|2,0,0]=4 823 B10R1.256 C[C@H]1[C@H](CC)C(=O)NC1=O Amb25264870 [1,0,0,1,0,0|2,0,0]=4 824 B10R1.330 CC=1CC(=O)CCC(C)C1 Amb24436317 [1,0,0,1,0,0|2,0,0]=4 825 B10R1.402 CC=1C(=O)C1C(=O)OCC Amb24432233 [1,0,0,1,0,0|0,0,2]=4 826 B10R1.418 CC1NC(=O)C1C(=O)OC Amb25046707 [1,0,0,1,0,0|1,0,0]=3 827 B10R1.2 CCC1CCCC(=O)C1=O Amb25372535 [0,0,0,1,1,0|2,0,0]=4 828 B10R1.118 CC1CC(=O)C(=O)CC1C Amb25145528 [0,0,0,1,1,0|2,0,0]=4 829 B10R1.212 CC(C(=O)OCC)=C1CC1 Amb24383704 [0,0,0,1,1,0|2,0,0]=4 830 B10R1.212 CCCC(=O)C(=O)C1CC1 Amb25059640 [0,0,0,1,1,0|2,0,0]=4 831 B10R1.212 CCOC(=O)C(=C)C1CC1 Amb24437752 [0,0,0,1,1,0|2,0,0]=4 832 B10R1.212 CCOC(=O)C(=O)C1CC1 Amb21912471 [0,0,0,1,1,0|1,0,0]=3 833 B10R1.403 CCOC(=O)C1(C)OC1C Amb25275719 [0,0,0,1,1,0|1,0,1]=4 834 B10R1.403 CCOC(=O)[C@@]1(C)O[C@@H]1C Amb24515013 [0,0,0,1,1,0|1,0,1]=4 835 B12R1.17 CCCC(=O)N1CC(=O)NCC1 Amb18806465 [0,0,0,1,0,1|2,0,0]=4 836 B12R1.17 CCNC(=O)N1CCNC(=O)C1 Amb18806866 [0,0,0,1,0,1|2,0,0]=4 837 B12R1.17 CCNC(=O)[C@H]1CCCC(=O)N1 Amb24393606 [0,0,0,1,0,1|2,0,0]=4 838 B12R1.17 CCOC(=C)C1CC(=O)CCC1 Amb24553540 [0,0,0,1,0,1|2,0,0]=4 839 B12R1.17 CCOC(=O)C1CC(=O)CCO1 Amb22001618 [0,0,0,1,0,1|2,0,0]=4 840 B12R1.17 CCOC(=O)C1CC(=O)NCC1 Amb24066473 [0,0,0,1,0,1|1,0,0]=3 841 B12R1.17 CCOC(=O)C1CCCC(=S)N1 Amb25378933 [0,0,0,1,0,1|1,1,0]=4 842 B12R1.17 CCOC(=O)C=1CC(=O)CCC1 Amb24378463 [0,0,0,1,0,1|1,0,1]=4 843 B12R1.17 CCOC(=O)N1CC(=O)CCC1 Amb22001757 [0,0,0,1,0,1|1,0,0]=3 844 B12R1.17 CCOC(=O)N1CC(=O)NCC1 Amb18807310 [0,0,0,1,0,1|1,0,0]=3 845 B12R1.17 CCOC(=O)N1CC(Br)=CCC1 Amb25345748 [0,0,0,1,0,1|2,0,0]=4 846 B12R1.17 CCOC(=O)N1CCN=C(N)C1 Amb24594124 [0,0,0,1,0,1|2,0,0]=4 847 B12R1.17 CCOC(=O)N1CCOC(=O)C1 Amb24101050 [0,0,0,1,0,1|0,0,0]=2 848 B12R1.17 CCOC(=O)[C@@H]1CC(=O)CCO1 Amb24532710 [0,0,0,1,0,1|2,0,0]=4 849 B12R1.17 CCOC(=O)[C@@H]1CCCC(=O)N1 Amb24532607 [0,0,0,1,0,1|1,0,0]=3 850 B12R1.17 CCOC(=O)[C@H]1CCCC(=S)N1 Amb24743302 [0,0,0,1,0,1|1,1,0]=4 851 B12R1.51 CCOC(=O)CCC1OCCO1 Amb24532765 [0,0,0,1,0,1|0,0,2]=4 852 B12R1.51 CCOC(=O)CN=C1NCCS1 Amb22469859 [0,0,0,1,0,1|1,1,0]=4 853 B12R1.51 CCOC(=O)CSC=1NCCN1 Amb22473620 [0,0,0,1,0,1|2,0,0]=4 854 B12R1.206 O=C1CCC(=O)CCCCCC1 Amb25294442 [0,0,0,1,0,1|2,0,0]=4 855 B12R1.206 O=C1CCCCCOC(=O)C=C1 Amb25768593 [0,0,0,1,0,1|1,0,1]=4 856 B12R1.313 CC1=C(CC(=O)N1)C(=O)OCC Amb2427802 [0,0,0,1,0,1|1,0,1]=4 857 B12R1.313 CC1=CC(=O)NC1C(=O)OCC Amb25784576 [0,0,0,1,0,1|1,0,1]=4 858 B12R1.313 CC1NC(=O)CC1C(=O)OCC Amb24356753 [0,0,0,1,0,1|1,0,0]=3 859 B12R1.313 CC1OC(=S)NC1C(=O)OCC Amb25683394 [0,0,0,1,0,1|0,1,0]=3 860 B12R1.313 CCOC(=O)N1CC(=O)CC1C Amb22755665 [0,0,0,1,0,1|1,0,0]=3 861 B12R1.313 C[C@@H]1CC(=O)N[C@@H]1C(=O)OCC Amb25296342 [0,0,0,1,0,1|1,0,0]=3 862 B12R1.313 C[C@@H]1OC(=O)N[C@@H]1C(=O)OCC Amb24759149 [0,0,0,1,0,1|0,0,0]=2 863 B12R1.313 C[C@H]1CC(=O)N[C@@H]1C(=O)OCC Amb24618705 [0,0,0,1,0,1|1,0,0]=3 864 B12R1.318 CCCC(=O)NC1CCOC1=O Amb22363052 [0,0,0,1,0,1|1,0,0]=3 865 B12R1.318 CCCC(=O)N[C@@H]1CCOC1=O Amb22744818 [0,0,0,1,0,1|1,0,0]=3 866 B12R1.318 CCNC(=O)CN1CCSC1=O Amb24719489 [0,0,0,1,0,1|1,1,0]=4 867 B12R1.318 CCNC(=O)N[C@H]1CCOC1=O Amb25190368 [0,0,0,1,0,1|1,0,0]=3 868 B12R1.318 CCNC(=S)NC1CCOC1=O Amb25817472 [0,0,0,1,0,1|1,1,0]=4 869 B12R1.318 CCNC(=S)N[C@H]1CCOC1=O Amb25226131 [0,0,0,1,0,1|1,1,0]=4 870 B12R1.318 CCOC(=O)NC1CCOC1=O Amb24574056 [0,0,0,1,0,1|0,0,0]=2 871 B12R1.318 CCOC(=O)NC1CONC1=O Amb24497303 [0,0,0,1,0,1|2,0,0]=4 872 B12R1.318 CCOC(=O)NC1CSCC1=O Amb25770523 [0,0,0,1,0,1|2,0,0]=4 873 B12R1.318 CCOC(=O)\C=C/1\CCCC1=O Amb24722973 [0,0,0,1,0,1|1,0,1]=4 874 B12R1.318 CCOC(=O)\C=C\1/CCCC1=O Amb25066318 [0,0,0,1,0,1|1,0,1]=4 875 B12R1.318 CCSC(=O)NC1CCSC1=O Amb22437618 [0,0,0,1,0,1|0,2,0]=4 876 B12R1.318 CNCC(=O)NC1CCOC1=O Amb25848134 [0,0,0,1,0,1|2,0,0]=4 877 B12R1.318 COCC(=O)N[C@H]1CCOC1=O Amb24749349 [0,0,0,1,0,1|2,0,0]=4 878 B12R1.318 C\C=C\C(=O)NC1CCOC1=O Amb25106486 [0,0,0,1,0,1|1,0,1]=4 879 B12R1.318 C\C=C\C(=O)N[C@H]1CCOC1=O Amb24525684 [0,0,0,1,0,1|1,0,1]=4 880 B12R1.318 NCCC(=O)N[C@H]1CCOC1=O Amb25682638 [0,0,0,1,0,1|2,0,0]=4 881 B12R1.318 O=C1OCCC1NC(=O)CCBr Amb25729680 [0,0,0,1,0,1|2,0,0]=4 882 B12R1.2586 CCOP1(=O)NCC(=O)NC1C Amb25733441 [0,0,0,1,0,1|2,0,0]=4 883 B12R1.31 CCOC(=O)Cc1nnc(o1)C Amb17592986 [0,1,0,1,0,0|1,0,1]=4 884 B12R1.31 CCOC(=O)NC=1CC(C)ON1 Amb25802557 [0,1,0,1,0,0|2,0,0]=4 885 B12R1.31 CCOC(=O)\C=C/1\CCC(C)O1 Amb25207383 [0,1,0,1,0,0|1,0,1]=4 886 B12R1.31 Cc1[n]c(CC(=O)OCC)o[n]1 Amb19373127 [0,1,0,1,0,0|1,0,1]=4 887 B12R1.31 Cc1cc(CC(=O)OCC)o[n]1 Amb22234620 [0,1,0,1,0,0|1,0,1]=4 888 B12R1.144 CC(C)=CC(=O)C1CCOC1=O Amb25859202 [0,1,0,1,0,0|1,0,1]=4 889 B12R1.144 CC(C)CC(=O)C1CCCC1=O Amb25751555 [0,1,0,1,0,0|2,0,0]=4 890 B12R1.144 CC(C)OC(=O)C1CCOC1C Amb24352549 [0,1,0,1,0,0|1,0,1]=4 891 B12R1.144 CC(C)OC(=O)N1CCNC1=O Amb24434965 [0,1,0,1,0,0|2,0,0]=4 892 B12R1.260 CC(C)OC(=O)CC1OCCO1 Amb25829693 [0,1,0,1,0,0|0,0,2]=4 893 B12R1.277 CCOC=1CC(=O)N(N1)C(C)C Amb24062002 [0,1,0,1,0,0|2,0,0]=4 894 B12R1.521 CCOC(=O)CC(=O)CC1CC1 Amb22000986 [0,1,0,1,0,0|1,0,0]=3 895 B12R1.32 CCOC(=O)CC1CCCCO1 Amb1094048 [0,1,0,1,0,0|1,0,1]=4 896 B12R1.32 CCOC(=O)CC1CNCCO1 Amb22011567 [0,1,0,1,0,0|1,0,1]=4 897 B12R1.32 CCOC(=O)CC1COCCN1 Amb22755683 [0,1,0,1,0,0|1,0,1]=4 898 B12R1.32 CCOC(=O)CC=1CCCOC1 Amb23538519 [0,1,0,1,0,0|1,0,0]=3 899 B12R1.32 CCOC(=O)\C=C\1/COCCN1 Amb22900976 [0,1,0,1,0,0|1,0,1]=4 900 B12R1.53 CCCOC(=O)CC1OCCO1 Amb22000696 [0,1,0,1,0,0|0,0,2]=4 901 B12R1.53 CCONC(=O)CC1OCCO1 Amb25036525 [0,1,0,1,0,0|0,0,2]=4 902 B12R1.141 O=C1CC(=O)NCCCCCN1 Amb24666785 [0,1,0,1,0,0|2,0,0]=4 903 B12R1.308 CCCC(=O)C1CCCCC1=O Amb17940808 [0,1,0,1,0,0|2,0,0]=4 904 B12R1.308 CCNC(=O)C1CCCCC1=O Amb24444368 [0,1,0,1,0,0|2,0,0]=4 905 B12R1.308 CCOC(=O)C1=CCCCC1=O Amb17594202 [0,1,0,1,0,0|1,0,1]=4 906 B12R1.308 CCOC(=O)C1CC=CCC1=O Amb24413617 [0,1,0,1,0,0|1,0,1]=4 907 B12R1.308 CCOC(=O)C1CCCOC1O Amb25157888 [0,1,0,1,0,0|0,0,2]=4 908 B12R1.308 CCOC(=O)C1CCNCC1=O Amb17935806 [0,1,0,1,0,0|1,0,0]=3 909 B12R1.308 CCOC(=O)C1CCNCC1=O Amb21857100 [0,1,0,1,0,0|1,0,0]=3 910 B12R1.308 CCOC(=O)C1CCOCC1=O Amb22737461 [0,1,0,1,0,0|0,0,0]=2 911 B12R1.308 CCOC(=O)C1CCOCC1N Amb25233625 [0,1,0,1,0,0|1,0,1]=4 912 B12R1.308 CCOC(=O)C1COCCC1=O Amb22001554 [0,1,0,1,0,0|1,0,0]=3 913 B12R1.308 CCOC(=O)C1C[NH2+]CCC1=O Amb22168430 [0,1,0,1,0,0|1,0,0]=3 914 B12R1.308 CCOC(=O)C1NCCCC1=O Amb25238463 [0,1,0,1,0,0|1,0,0]=3 915 B12R1.308 CCOC(=O)C1SCCCC1=O Amb22234465 [0,1,0,1,0,0|1,0,0]=3 916 B12R1.308 CCOC(=O)C1SCCNC1=O Amb22232476 [0,1,0,1,0,0|1,0,0]=3 917 B12R1.308 CCOC(=O)C1SCCNC1=S Amb25743413 [0,1,0,1,0,0|1,1,0]=4 918 B12R1.308 CCOC(=O)C=1CCOCC1O Amb22497612 [0,1,0,1,0,0|0,0,2]=4 919 B12R1.308 CCOC(=O)N1CCC=CC1=O Amb22500511 [0,1,0,1,0,0|2,0,0]=4 920 B12R1.308 CCOC(=O)[C@@H]1CCCCC1=O Amb25707491 [0,1,0,1,0,0|1,0,0]=3 921 B12R1.308 CCOC(=O)[C@@H]1CCOC[C@@H]1N Amb23401369 [0,1,0,1,0,0|1,0,1]=4 922 B12R1.308 CCOC(=O)[C@@H]1CCOC[C@@H]1N Amb24585320 [0,1,0,1,0,0|1,0,1]=4 923 B12R1.308 CCOC(=O)[C@@H]1CSCCC1=O Amb24182097 [0,1,0,1,0,0|1,0,0]=3 924 B12R1.308 C[C@@H]1OCCN[C@H]1C(=O)OCC Amb25299170 [0,1,0,1,0,0|1,0,1]=4 925 B12R1.308 C\C=C\C(=O)C1CCCOC1=O Amb25358847 [0,1,0,1,0,0|1,0,1]=4 926 B12R1.460 CC1OCCC1C(=O)NOCC Amb25333795 [0,1,0,1,0,0|1,0,1]=4 927 B12R1.1095 CC1=CC(=O)CC(=O)N1OCC Amb25773326 [0,1,0,1,0,0|1,0,1]=4 928 B12R1.1589 CC1CCC(=O)C1C(=O)OCC Amb20623644 [0,1,0,1,0,0|1,0,0]=3 929 B12R1.1589 CC1CNC(=S)C1C(=O)OCC Amb25102503 [0,1,0,1,0,0|1,1,0]=4 930 B12R1.1589 CC1OCC(=O)C1C(=O)OCC Amb22285057 [0,1,0,1,0,0|0,0,0]=2 931 B12R1.1589 CC1OCC(O)C1C(=O)OCC Amb25847787 [0,1,0,1,0,0|0,0,2]=4 932 B12R1.1589 CC=1NOC(=O)C1C(=O)OCC Amb23556295 [0,1,0,1,0,0|0,0,2]=4 933 B12R1.1589 CC=1OCC(O)C1C(=O)OCC Amb24448063 [0,1,0,1,0,0|1,0,1]=4 934 B12R1.1589 CCOC(=O)C1=C(O)COC1=O Amb17872635 [0,1,0,1,0,0|0,0,2]=4 935 B12R1.1589 CCOC(=O)C1C(=NOC1=O)C Amb10552814 [0,1,0,1,0,0|0,0,1]=3 936 B12R1.1589 CCOC(=O)C1C(=O)CCC1=O Amb24342030 [0,1,0,1,0,0|1,0,1]=4 937 B12R1.1589 CCOC(=O)C1C(=O)CCN1C Amb24662443 [0,1,0,1,0,0|1,0,0]=3 938 B12R1.1589 CCOC(=O)C1C(=O)CNC1=O Amb25700334 [0,1,0,1,0,0|1,0,1]=4 939 B12R1.1589 CCOC(=O)C1C(=O)COC1=N Amb25053154 [0,1,0,1,0,0|1,0,1]=4 940 B12R1.1589 C[C@@H]1CCC(=O)C1C(=O)OCC Amb25767752 [0,1,0,1,0,0|1,0,0]=3 941 B12R1.55 CC(C1OCCO1)C(=O)OCC Amb25148578 [0,1,0,1,0,0|0,0,2]=4 942 B12R1.796 CCN1C(=O)C(Cl)C(=O)N1CC Amb25034742 [0,1,0,1,0,0|2,0,0]=4 943 B12R1.1446 CCOC(=O)C(C(=O)C1CC1)C Amb10604914 [0,1,0,1,0,0|1,0,0]=3 944 B12R1.3393 CCOC(=O)C1(C)CCCC1=O Amb17594256 [0,1,0,1,0,0|1,0,0]=3 945 B12R1.3393 CCOC(=O)C1(N)CCOC1C Amb25156540 [0,1,0,1,0,0|1,0,1]=4 946 B12R1.3393 CCOC(=O)C1(O)CCCC1=O Amb24408349 [0,1,0,1,0,0|1,0,0]=3 947 B12R1.3393 CCOC(=O)C1(O)CCOC1C Amb25360680 [0,1,0,1,0,0|1,0,1]=4 948 B12R1.3393 CCOC(=O)[C@@]1(F)CCCC1=O Amb25128230 [0,1,0,1,0,0|1,0,0]=3 949 B12R1.3393 CCOC(=O)[C@]1(O)CCCC1=O Amb24535502 [0,1,0,1,0,0|1,0,0]=3 950 B12R1.3393 CCOC(O)C1(Cl)CCOC1=O Amb24748313 [0,1,0,1,0,0|0,0,2]=4 951 B12R1.468 COC(=O)C(=O)C1CCOC1=O Amb2569537 [0,1,0,1,0,0|2,0,0]=4 952 B12R1.1579 CC1=CCC(C1=O)C(=O)OCC Amb25723821 [0,1,0,1,0,0|1,0,1]=4 953 B12R1.1579 CCNC(=O)C1CCN(C)C1=O Amb24573828 [0,1,0,1,0,0|2,0,0]=4 954 B12R1.1579 CCOC(=O)C1CCC(=O)C1=O Amb24532512 [0,1,0,1,0,0|1,0,0]=3 955 B12R1.1579 CCOC(=O)C1CCC(Br)C1=O Amb21961793 [0,1,0,1,0,0|1,0,0]=3 956 B12R1.1579 CCOC(=O)C1CCC(C1=O)C Amb17594257 [0,1,0,1,0,0|1,0,0]=3 957 B12R1.1579 CCOC(=O)C1CCN(C)C1=O Amb19889855 [0,1,0,1,0,0|1,0,0]=3 958 B12R1.1579 CCOC(=O)C1CNC(=O)C1=O Amb25239419 [0,1,0,1,0,0|2,0,0]=4 959 B12R1.1579 CCOC(=O)C1COC(=O)C1=O Amb25799294 [0,1,0,1,0,0|2,0,0]=4 960 B12R1.1578 CCOC(=O)CS(=O)(=O)C1CC1 Amb19893355 [0,1,0,1,0,0|2,0,0]=4 961 B12R2.10 O=C1CCCC1C2=NCCO2 Amb24432209 [0,0,0,2,0,0|2,0,0]=4 962 B12R2.10 O=C1OCCC1N2CCCO2 Amb25781493 [0,0,0,2,0,0|2,0,0]=4 963 B12R2.246 O=C1CC(=O)NC2CCCC12 Amb18201123 [0,0,0,2,0,0|2,0,0]=4 964 B12R2.203 O=C1CCC2CCCC(=O)C12 Amb24486237 [0,0,0,2,0,0|2,0,0]=4 965 B12R2.524 O=C1CC2CCCCC(=O)C12 Amb24722722 [0,0,0,2,0,0|2,0,0]=4 966 B12R2.2028 O=C1CC(=O)C2CCCCN12 Amb18201124 [0,0,0,2,0,0|2,0,0]=4 967 B12R2.2028 O=C1CC(=O)C=2CCCCC12 Amb25148207 [0,0,0,2,0,0|2,0,0]=4 968 B12R2.2028 O=C1CC(=O)N2CCCCN21 Amb24757810 [0,0,0,2,0,0|2,0,0]=4 969 B12R2.2028 O=C1CC(=O)[C@@H]2CCCC[C@H]12 Amb24408398 [0,0,0,2,0,0|2,0,0]=4 970 B12R2.189 CCOC1=CC2CCC(=O)C12 Amb25792935 [0,0,0,2,0,0|2,0,0]=4 971 B12R2.189 CCOC1=C[C@@H]2CCC(=O)[C@H]12 Amb24737544 [0,0,0,2,0,0|2,0,0]=4 972 B12R2.459 O=C1CC2CC1C(=O)CCC2 Amb24706943 [0,0,0,2,0,0|2,0,0]=4 973 B12R2.96 O=C1CCCC12CCNC2=O Amb25270752 [0,0,0,2,0,0|2,0,0]=4 974 B12R2.96 O=C1CCCC12CCOC2=O Amb25834400 [0,0,0,2,0,0|1,0,0]=3 975 B12R2.96 O=C1CCC[C@]12CCOC2=O Amb24416697 [0,0,0,2,0,0|1,0,0]=3 976 B12R2.96 O=C1NCCC12CCNC2=O Amb25733039 [0,0,0,2,0,0|2,0,0]=4 977 B12R2.620 CC1CC(=O)C2C1COC2=O Amb25347498 [0,0,0,2,0,0|1,0,0]=3 978 B12R2.620 CC1OC(=O)C2C1CCC2=O Amb24736254 [0,0,0,2,0,0|1,0,0]=3 979 B12R2.620 CC1OC(=O)C2C1SCC2=O Amb24648015 [0,0,0,2,0,0|2,0,0]=4 980 B12R2.620 C[C@H]1OC(=O)[C@@H]2[C@H]1CON2C Amb24552827 [0,0,0,2,0,0|2,0,0]=4 981 B12R2.2372 O=C1CCCC1C(=O)C2CC2 Amb21949139 [0,0,0,2,0,0|2,0,0]=4 982 B12R2.2372 O=C1NCCC1C(=O)C2CC2 Amb25239555 [0,0,0,2,0,0|2,0,0]=4 983 B12R2.7420 O=C(CC(=O)C1CC1)C2CC2 Amb21960989 [0,0,0,2,0,0|2,0,0]=4 984 B12R2.5131 CC12CC(=O)C1C(=O)OCC2 Amb25086697 [0,0,0,2,0,0|1,0,0]=3 985 B12R2.5131 C[C@]12CC(=O)[C@H]1C(=O)OCC2 Amb25372815 [0,0,0,2,0,0|1,0,0]=3 986 B12R2.1313 O=C1CC(=O)C2CCC1CC2 Amb25767930 [0,0,0,2,0,0|2,0,0]=4 987 B8R0.3 CC#CC(=O)C(=O)OC Amb25031662 [1,0,0,0,1,0|1,0,1]=4 988 B8R0.3 CC(=CC)C(=O)OCC Amb24718920 [1,0,0,0,1,0|1,0,1]=4 989 B8R0.3 CCC(=C)C(=O)OCC Amb22353551 [1,0,0,0,1,0|1,0,0]=3 990 B8R0.3 CCC(=N)C(=O)OCC Amb24063521 [1,0,0,0,1,0|1,0,0]=3 991 B8R0.3 CCC(=O)\C(\F)=C/CC Amb24511455 [1,0,0,0,1,0|2,0,0]=4 992 B8R0.3 CCC(=O)\C(\F)=C\CC Amb25358941 [1,0,0,0,1,0|2,0,0]=4 993 B8R0.3 CCC(S)C(=O)OCC Amb20623543 [1,0,0,0,1,0|0,1,1]=4 994 B8R0.3 CCCC(=C)C(=O)CC Amb25706643 [1,0,0,0,1,0|2,0,0]=4 995 B8R0.3 CCCC(=C)C(=O)OC Amb25689366 [1,0,0,0,1,0|2,0,0]=4 996 B8R0.3 CCCC(=O)C(=O)CBr Amb24753971 [1,0,0,0,1,0|2,0,0]=4 997 B8R0.3 CCCC(=O)C(=O)OC Amb22755107 [1,0,0,0,1,0|1,0,0]=3 998 B8R0.3 CCNC(=O)C(=O)CBr Amb24650937 [1,0,0,0,1,0|2,0,0]=4 999 B8R0.3 CCNC(=O)C(=O)NC Amb1788377 [1,0,0,0,1,0|2,0,0]=4 1000 B8R0.3 CCOC(=C)C(=O)CC Amb25128975 [1,0,0,0,1,0|1,0,0]=3 1001 B8R0.3 CCOC(=C)C(=O)NC Amb24399066 [1,0,0,0,1,0|2,0,0]=4 1002 B8R0.3 CCOC(=O)C(=C)CCl Amb22489932 [1,0,0,0,1,0|2,0,0]=4 1003 B8R0.3 CCOC(=O)C(=C)CN Amb25791756 [1,0,0,0,1,0|2,0,0]=4 1004 B8R0.3 CCOC(=O)C(=C)CO Amb17614080 [1,0,0,0,1,0|2,0,0]=4 1005 B8R0.3 CCOC(=O)C(=N)SC Amb25795405 [1,0,0,0,1,0|1,1,0]=4 1006 B8R0.3 CCOC(=O)C(=O)C#C Amb25267112 [1,0,0,0,1,0|0,0,2]=4 1007 B8R0.3 CCOC(=O)C(=O)C#N Amb24544641 [1,0,0,0,1,0|1,0,1]=4 1008 B8R0.3 CCOC(=O)C(=O)CBr Amb2455861 [1,0,0,0,1,0|1,0,0]=3 1009 B8R0.3 CCOC(=O)C(=O)CC Amb15701231 [1,0,0,0,1,0|0,0,0]=2 1010 B8R0.3 CCOC(=O)C(=O)CF Amb22008246 [1,0,0,0,1,0|1,0,0]=3 1011 B8R0.3 CCOC(=O)C(=O)CO Amb25333851 [1,0,0,0,1,0|1,0,0]=3 1012 B8R0.3 CCOC(=O)C(=O)CP Amb25270367 [1,0,0,0,1,0|1,0,0]=3 1013 B8R0.3 CCOC(=O)C(=O)NN Amb19958923 [1,0,0,0,1,0|2,0,0]=4 1014 B8R0.3 CCOC(=O)C(=O)O[K] Amb22043915 [1,0,0,0,1,0|1,0,0]=3 1015 B8R0.3 CCOC(=O)C(=S)NC Amb24681047 [1,0,0,0,1,0|1,1,0]=4 1016 B8R0.3 CCOC(=O)C(Cl)=NC Amb24395155 [1,0,0,0,1,0|2,0,0]=4 1017 B8R0.3 CC[C@@H](Br)C(=O)OCC Amb25188936 [1,0,0,0,1,0|1,0,1]=4 1018 B8R0.3 CC[C@@H](N)C(=O)OCC Amb22745247 [1,0,0,0,1,0|1,0,1]=4 1019 B8R0.3 CC[C@H](Br)C(=O)OCC Amb24480229 [1,0,0,0,1,0|1,0,1]=4 1020 B8R0.3 CC\C=C(/N)\C(=O)OC Amb24447011 [1,0,0,0,1,0|2,0,0]=4 1021 B8R0.3 CN(CC)C(=O)OCC Amb25837294 [1,0,0,0,1,0|2,0,0]=4 1022 B8R0.3 COC(=O)C(=N)OCC Amb24657206 [1,0,0,0,1,0|1,0,0]=3 1023 B8R0.3 COC(=O)C(=O)OCC Amb25245154 [1,0,0,0,1,0|0,0,0]=2 1024 B8R0.3 COC(=O)[C@@H](C)OCC Amb25113653 [1,0,0,0,1,0|1,0,1]=4 1025 B8R0.3 COC(Br)C(=O)OCC Amb25745925 [1,0,0,0,1,0|1,0,1]=4 1026 B8R0.3 COC(C)C(=O)OCC Amb25692036 [1,0,0,0,1,0|1,0,1]=4 1027 B8R0.3 CON(C)C(=O)OCC Amb22338318 [1,0,0,0,1,0|2,0,0]=4 1028 B8R0.3 CO[C@H](C)C(=O)OCC Amb25146887 [1,0,0,0,1,0|1,0,1]=4 1029 B8R0.3 C\C(=C/CC)\C(=O)OC Amb22360680 [1,0,0,0,1,0|2,0,0]=4 1030 B8R0.3 C\C(=N/CC)\C(=O)CC Amb24340117 [1,0,0,0,1,0|2,0,0]=4 1031 B8R0.3 C\C=C\C(=O)C(=O)OC Amb24587426 [1,0,0,0,1,0|1,0,1]=4 1032 B12R0.285 CCCC(=O)NCCC(=O)OCC Amb19076451 [0,0,0,0,0,2|1,0,0]=3 1033 B12R0.285 CCOC(=O)C=CCC(=O)OCC Amb22230542 [0,0,0,0,0,2|0,0,0]=2 1034 B12R0.285 CCOC(=O)CSCC(=O)NCC Amb21618522 [0,0,0,0,0,2|1,0,0]=3 1035 B12R0.285 CCOC(=O)NCNC(=O)OCC Amb1144511 [0,0,0,0,0,2|0,0,0]=2 1036 B12R0.285 CCOC(=O)\C=C\CC(=O)OCC Amb22730501 [0,0,0,0,0,2|0,0,0]=2 1037 B12R0.285 CCO[13C](=O)[13CH2][13CH2][13CH2][13C](=O)OCC Amb22338935 [0,0,0,0,0,2|0,0,0]=2 1038 B12R0.285 COCC(=O)NCCC(=O)OCC Amb18330077 [0,0,0,0,0,2|2,0,0]=4