0 B7R1.3 BrC1=CCCCC1 Amb21856761 [0,0,0,0,0,0|1,0,1]=2 1 B7R1.3 BrC1=CCCCO1 Amb24322651 [0,0,0,0,0,0|2,0,1]=3 2 B7R1.3 BrC1=CCCNC1 Amb27173423 [0,0,0,0,0,0|2,0,1]=3 3 B7R1.3 BrC1=CCCNC1 Amb32651839 [0,0,0,0,0,0|2,0,1]=3 4 B7R1.3 BrC1=CCNCC1 Amb24317585 [0,0,0,0,0,0|2,0,1]=3 5 B7R1.3 BrC1=CCNCC1 Amb33189234 [0,0,0,0,0,0|2,0,1]=3 6 B7R1.3 BrC1=CCOCC1 Amb21964919 [0,0,0,0,0,0|2,0,1]=3 7 B7R1.3 BrC1=CCSCC1 Amb22229691 [0,0,0,0,0,0|2,0,1]=3 8 B7R1.3 BrC1=COCCC1 Amb24322600 [0,0,0,0,0,0|2,0,0]=2 9 B7R1.3 BrC1=COCCO1 Amb24322806 [0,0,0,0,0,0|3,0,0]=3 10 B7R1.3 BrC1C=CCCC1 Amb2720845 [0,0,0,0,0,0|1,0,1]=2 11 B7R1.3 BrC1C=NCCC1 Amb24322652 [0,0,0,0,0,0|2,0,1]=3 12 B7R1.3 BrC1CC=CCC1 Amb22229671 [0,0,0,0,0,0|1,0,3]=4 13 B7R1.3 BrC1CCCCC1 Amb3940351 [0,0,0,0,0,0|1,0,3]=4 14 B7R1.3 BrC1CCCCN1 Amb8629038 [0,0,0,0,0,0|2,0,2]=4 15 B7R1.3 BrC1CCCCO1 Amb24322575 [0,0,0,0,0,0|2,0,2]=4 16 B7R1.3 BrC1CCCNC1 Amb22497824 [0,0,0,0,0,0|2,0,2]=4 17 B7R1.3 BrC1CCCNC1 Amb8629039 [0,0,0,0,0,0|2,0,2]=4 18 B7R1.3 BrC1CCCOC1 Amb9173669 [0,0,0,0,0,0|2,0,2]=4 19 B7R1.3 BrC1CCCSC1 Amb26545490 [0,0,0,0,0,0|2,0,2]=4 20 B7R1.3 Br[C@H]1C=CCCC1 Amb27442441 [0,0,0,0,0,0|1,0,1]=2 21 B7R1.3 Brc1ccccc1 Amb2795756 [0,0,0,0,0,0|1,0,3]=4 22 B7R1.3 Brc1ccccn1 Amb535814 [0,0,0,0,0,0|2,0,2]=4 23 B7R1.3 Brc1cccnc1 Amb535815 [0,0,0,0,0,0|2,0,2]=4 24 B7R1.3 Brc1cccnn1 Amb10599679 [0,0,0,0,0,0|3,0,1]=4 25 B7R1.3 Brc1cccnn1 Amb30588506 [0,0,0,0,0,0|3,0,1]=4 26 B7R1.3 Brc1ccncc1 Amb21864762 [0,0,0,0,0,0|2,0,2]=4 27 B7R1.3 Brc1ccncc1 Amb2455980 [0,0,0,0,0,0|2,0,2]=4 28 B7R1.3 Brc1ccncc1 Amb33513273 [0,0,0,0,0,0|2,0,2]=4 29 B7R1.3 Brc1ccncc1 Amb534987 [0,0,0,0,0,0|2,0,2]=4 30 B7R1.3 Brc1ccncn1 Amb10599355 [0,0,0,0,0,0|3,0,1]=4 31 B7R1.3 Brc1ccncn1 Amb19887431 [0,0,0,0,0,0|3,0,1]=4 32 B7R1.3 Brc1ccncn1 Amb20670685 [0,0,0,0,0,0|3,0,1]=4 33 B7R1.3 Brc1ccnnc1 Amb10976038 [0,0,0,0,0,0|3,0,1]=4 34 B7R1.3 Brc1ccnnc1 Amb19929892 [0,0,0,0,0,0|3,0,1]=4 35 B7R1.3 Brc1ccnnc1 Amb20670983 [0,0,0,0,0,0|3,0,1]=4 36 B7R1.3 Brc1ccnnc1 Amb21963548 [0,0,0,0,0,0|3,0,1]=4 37 B7R1.3 C=C1CCCCC1 Amb8515603 [0,0,0,0,0,0|1,0,2]=3 38 B7R1.3 C=C1CCCCN1 Amb27801038 [0,0,0,0,0,0|2,0,1]=3 39 B7R1.3 C=C1CCCCO1 Amb28345156 [0,0,0,0,0,0|2,0,1]=3 40 B7R1.3 C=C1CCCNC1 Amb19514641 [0,0,0,0,0,0|2,0,1]=3 41 B7R1.3 C=C1CCCNC1 Amb22059305 [0,0,0,0,0,0|2,0,1]=3 42 B7R1.3 C=C1CCCOC1 Amb27594580 [0,0,0,0,0,0|2,0,1]=3 43 B7R1.3 C=C1CCCSC1 Amb22494848 [0,0,0,0,0,0|2,0,1]=3 44 B7R1.3 C=C1CCNCC1 Amb19514763 [0,0,0,0,0,0|2,0,2]=4 45 B7R1.3 C=C1CCNCC1 Amb24079604 [0,0,0,0,0,0|2,0,2]=4 46 B7R1.3 C=C1CCNCC1 Amb33715165 [0,0,0,0,0,0|2,0,2]=4 47 B7R1.3 C=C1CCOCC1 Amb22000865 [0,0,0,0,0,0|2,0,2]=4 48 B7R1.3 C=C1OCCCO1 Amb25734089 [0,0,0,0,0,0|3,0,1]=4 49 B7R1.3 CC1=CCCCC1 Amb8513524 [0,0,0,0,0,0|1,0,1]=2 50 B7R1.3 CC1=CCCCO1 Amb24480530 [0,0,0,0,0,0|2,0,1]=3 51 B7R1.3 CC1=CCCNC1 Amb23439963 [0,0,0,0,0,0|2,0,1]=3 52 B7R1.3 CC1=CCCNC1 Amb25063349 [0,0,0,0,0,0|2,0,1]=3 53 B7R1.3 CC1=CCNCC1 Amb18639053 [0,0,0,0,0,0|2,0,1]=3 54 B7R1.3 CC1=CCNCC1 Amb21961140 [0,0,0,0,0,0|2,0,1]=3 55 B7R1.3 CC1=CCOCC1 Amb24070517 [0,0,0,0,0,0|2,0,1]=3 56 B7R1.3 CC1=NCCCC1 Amb27459940 [0,0,0,0,0,0|2,0,1]=3 57 B7R1.3 CC1=NCCCN1 Amb3650246 [0,0,0,0,0,0|3,0,1]=4 58 B7R1.3 CC1=NCCCS1 Amb25808748 [0,0,0,0,0,0|3,0,1]=4 59 B7R1.3 CC1=NCCNC1 Amb22755966 [0,0,0,0,0,0|3,0,1]=4 60 B7R1.3 CC1C=CCCC1 Amb8515346 [0,0,0,0,0,0|1,0,1]=2 61 B7R1.3 CC1C=CCCN1 Amb27461298 [0,0,0,0,0,0|2,0,1]=3 62 B7R1.3 CC1C=CCCO1 Amb33715160 [0,0,0,0,0,0|2,0,1]=3 63 B7R1.3 CC1C=CCNC1 Amb27170704 [0,0,0,0,0,0|2,0,1]=3 64 B7R1.3 CC1C=COCC1 Amb27985265 [0,0,0,0,0,0|2,0,1]=3 65 B7R1.3 CC1CC=NCC1 Amb27453017 [0,0,0,0,0,0|2,0,2]=4 66 B7R1.3 CC1CCCCN1 Amb2792828 [0,0,0,0,0,0|2,0,2]=4 67 B7R1.3 CC1CCCCO1 Amb4035049 [0,0,0,0,0,0|2,0,2]=4 68 B7R1.3 CC1CCCCS1 Amb17666899 [0,0,0,0,0,0|2,0,2]=4 69 B7R1.3 CC1CCCNC1 Amb22491688 [0,0,0,0,0,0|2,0,2]=4 70 B7R1.3 CC1CCCNC1 Amb9703089 [0,0,0,0,0,0|2,0,2]=4 71 B7R1.3 CC1CCCOC1 Amb22347806 [0,0,0,0,0,0|2,0,2]=4 72 B7R1.3 CN1C=NCCC1 Amb30010877 [0,0,0,0,0,0|3,0,0]=3 73 B7R1.3 CN1CC=CCC1 Amb22734271 [0,0,0,0,0,0|2,0,2]=4 74 B7R1.3 CN1CCCCC1 Amb8387007 [0,0,0,0,0,0|2,0,2]=4 75 B7R1.3 CN1CCCNC1 Amb18121429 [0,0,0,0,0,0|3,0,1]=4 76 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [0,0,0,0,0,0|2,0,2]=4 77 B7R1.3 C[C@@H]1CCCCN1 Amb3939006 [0,0,0,0,0,0|2,0,2]=4 78 B7R1.3 C[C@@H]1CCCNC1 Amb24461444 [0,0,0,0,0,0|2,0,2]=4 79 B7R1.3 C[C@@H]1CCCNC1 Amb33801279 [0,0,0,0,0,0|2,0,2]=4 80 B7R1.3 C[C@H]1CCCCN1 Amb8387006 [0,0,0,0,0,0|2,0,2]=4 81 B7R1.3 C[C@H]1CCCNC1 Amb22745835 [0,0,0,0,0,0|2,0,2]=4 82 B7R1.3 C[C@H]1CCCNC1 Amb8387001 [0,0,0,0,0,0|2,0,2]=4 83 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [0,0,0,0,0,0|2,1,1]=4 84 B7R1.3 Cc1cc[o+]cc1 Amb27592946 [0,0,0,0,0,0|2,0,2]=4 85 B7R1.3 Cc1ccccn1 Amb2447016 [0,0,0,0,0,0|2,0,2]=4 86 B7R1.3 Cc1ccccn1 Amb33872315 [0,0,0,0,0,0|2,0,2]=4 87 B7R1.3 Cc1cccnc1 Amb2447038 [0,0,0,0,0,0|2,0,2]=4 88 B7R1.3 Cc1cccnn1 Amb2455766 [0,0,0,0,0,0|3,0,1]=4 89 B7R1.3 Cc1ccncc1 Amb2610072 [0,0,0,0,0,0|2,0,2]=4 90 B7R1.3 Cc1ccncn1 Amb2447543 [0,0,0,0,0,0|3,0,1]=4 91 B7R1.3 Cc1ccnnc1 Amb2724641 [0,0,0,0,0,0|3,0,1]=4 92 B7R1.3 ClC1=CCCCC1 Amb9785147 [0,0,0,0,0,0|1,0,1]=2 93 B7R1.3 ClC1=CCCCO1 Amb27449514 [0,0,0,0,0,0|2,0,1]=3 94 B7R1.3 ClC1=CCCNC1 Amb32664385 [0,0,0,0,0,0|2,0,1]=3 95 B7R1.3 ClC1=CCCNC1 Amb32664386 [0,0,0,0,0,0|2,0,1]=3 96 B7R1.3 ClC1=COCCO1 Amb27826498 [0,0,0,0,0,0|3,0,0]=3 97 B7R1.3 ClC1=NCCCN1 Amb27948666 [0,0,0,0,0,0|3,0,1]=4 98 B7R1.3 ClC1C=CCCC1 Amb22229267 [0,0,0,0,0,0|1,0,1]=2 99 B7R1.3 ClC1C=CCNC1 Amb32679264 [0,0,0,0,0,0|2,0,1]=3 100 B7R1.3 ClC1C=CCNC1 Amb32679265 [0,0,0,0,0,0|2,0,1]=3 101 B7R1.3 ClC1C=CCOC1 Amb27955246 [0,0,0,0,0,0|2,0,1]=3 102 B7R1.3 ClC1CC=CCC1 Amb22229749 [0,0,0,0,0,0|1,0,3]=4 103 B7R1.3 ClC1CCCCC1 Amb3940352 [0,0,0,0,0,0|1,0,3]=4 104 B7R1.3 ClC1CCCCN1 Amb20242688 [0,0,0,0,0,0|2,0,2]=4 105 B7R1.3 ClC1CCCCO1 Amb17673285 [0,0,0,0,0,0|2,0,2]=4 106 B7R1.3 ClC1CCCCS1 Amb28123985 [0,0,0,0,0,0|2,0,2]=4 107 B7R1.3 ClC1CCCOC1 Amb20622589 [0,0,0,0,0,0|2,0,2]=4 108 B7R1.3 ClN1CCCCC1 Amb25950915 [0,0,0,0,0,0|2,0,2]=4 109 B7R1.3 Clc1ccccc1 Amb2793069 [0,0,0,0,0,0|1,0,3]=4 110 B7R1.3 Clc1ccccn1 Amb3939993 [0,0,0,0,0,0|2,0,2]=4 111 B7R1.3 Clc1cccnc1 Amb8387117 [0,0,0,0,0,0|2,0,2]=4 112 B7R1.3 Clc1cccnn1 Amb19894724 [0,0,0,0,0,0|3,0,1]=4 113 B7R1.3 Clc1cccnn1 Amb3319392 [0,0,0,0,0,0|3,0,1]=4 114 B7R1.3 Clc1ccncc1 Amb22489495 [0,0,0,0,0,0|2,0,2]=4 115 B7R1.3 Clc1ccncc1 Amb4476999 [0,0,0,0,0,0|2,0,2]=4 116 B7R1.3 Clc1ccncc1 Amb6306685 [0,0,0,0,0,0|2,0,2]=4 117 B7R1.3 Clc1ccncn1 Amb19944555 [0,0,0,0,0,0|3,0,1]=4 118 B7R1.3 Clc1ccncn1 Amb22494628 [0,0,0,0,0,0|3,0,1]=4 119 B7R1.3 Clc1ccncn1 Amb5846632 [0,0,0,0,0,0|3,0,1]=4 120 B7R1.3 Clc1ccnnc1 Amb22235621 [0,0,0,0,0,0|3,0,1]=4 121 B7R1.3 FC1=CCCNC1 Amb27181097 [0,0,0,0,0,0|2,0,1]=3 122 B7R1.3 FC1=CCCNC1 Amb28314663 [0,0,0,0,0,0|2,0,1]=3 123 B7R1.3 FC1=CCNCC1 Amb27600797 [0,0,0,0,0,0|2,0,1]=3 124 B7R1.3 FC1=CCNCC1 Amb33484309 [0,0,0,0,0,0|2,0,1]=3 125 B7R1.3 FC1=COCCC1 Amb24322810 [0,0,0,0,0,0|2,0,0]=2 126 B7R1.3 FC1C=CCCC1 Amb27164038 [0,0,0,0,0,0|1,0,1]=2 127 B7R1.3 FC1CCCCC1 Amb2688084 [0,0,0,0,0,0|1,0,3]=4 128 B7R1.3 FC1CCCCO1 Amb24322826 [0,0,0,0,0,0|2,0,2]=4 129 B7R1.3 FC1CCCNC1 Amb13953137 [0,0,0,0,0,0|2,0,2]=4 130 B7R1.3 FC1CCCNC1 Amb2688404 [0,0,0,0,0,0|2,0,2]=4 131 B7R1.3 FC1CCCOC1 Amb24322825 [0,0,0,0,0,0|2,0,2]=4 132 B7R1.3 FC1CCC[NH2+]C1 Amb22042691 [0,0,0,0,0,0|2,0,2]=4 133 B7R1.3 F[C@@H]1CCCNC1 Amb20242276 [0,0,0,0,0,0|2,0,2]=4 134 B7R1.3 F[C@@H]1CCCNC1 Amb27619341 [0,0,0,0,0,0|2,0,2]=4 135 B7R1.3 F[C@H]1CCCNC1 Amb20242275 [0,0,0,0,0,0|2,0,2]=4 136 B7R1.3 Fc1ccccc1 Amb2688018 [0,0,0,0,0,0|1,0,3]=4 137 B7R1.3 Fc1ccccn1 Amb1159303 [0,0,0,0,0,0|2,0,2]=4 138 B7R1.3 Fc1cccnc1 Amb2688409 [0,0,0,0,0,0|2,0,2]=4 139 B7R1.3 Fc1cccnn1 Amb26052528 [0,0,0,0,0,0|3,0,1]=4 140 B7R1.3 Fc1ccncc1 Amb8393040 [0,0,0,0,0,0|2,0,2]=4 141 B7R1.3 Fc1ccncc1 Amb8396932 [0,0,0,0,0,0|2,0,2]=4 142 B7R1.3 Fc1ccncn1 Amb20242179 [0,0,0,0,0,0|3,0,1]=4 143 B7R1.3 IC1=CCCCC1 Amb27750996 [0,0,0,0,0,0|1,0,1]=2 144 B7R1.3 IC1=CCOCC1 Amb25364046 [0,0,0,0,0,0|2,0,1]=3 145 B7R1.3 IC1=COCCC1 Amb24322812 [0,0,0,0,0,0|2,0,0]=2 146 B7R1.3 IC1=COCCO1 Amb24322818 [0,0,0,0,0,0|3,0,0]=3 147 B7R1.3 IC1CC=CCC1 Amb27446684 [0,0,0,0,0,0|1,0,3]=4 148 B7R1.3 IC1CCCCC1 Amb6608670 [0,0,0,0,0,0|1,0,3]=4 149 B7R1.3 IC1CCCNC1 Amb22496356 [0,0,0,0,0,0|2,0,2]=4 150 B7R1.3 IC1CCCOC1 Amb22831295 [0,0,0,0,0,0|2,0,2]=4 151 B7R1.3 Ic1ccccc1 Amb22491511 [0,0,0,0,0,0|1,0,3]=4 152 B7R1.3 Ic1ccccc1 Amb2688833 [0,0,0,0,0,0|1,0,3]=4 153 B7R1.3 Ic1ccccn1 Amb4605859 [0,0,0,0,0,0|2,0,2]=4 154 B7R1.3 Ic1cccnc1 Amb2610015 [0,0,0,0,0,0|2,0,2]=4 155 B7R1.3 Ic1cccnn1 Amb22749745 [0,0,0,0,0,0|3,0,1]=4 156 B7R1.3 Ic1ccncc1 Amb534992 [0,0,0,0,0,0|2,0,2]=4 157 B7R1.3 Ic1ccncn1 Amb20671489 [0,0,0,0,0,0|3,0,1]=4 158 B7R1.3 Ic1ccnnc1 Amb26360619 [0,0,0,0,0,0|3,0,1]=4 159 B7R1.3 N=C1C=CNC=N1 Amb33719075 [0,0,0,0,0,0|3,0,1]=4 160 B7R1.3 N=C1CCCCC1 Amb26924126 [0,0,0,0,0,0|1,0,2]=3 161 B7R1.3 N=C1CCCCN1 Amb17616049 [0,0,0,0,0,0|2,0,1]=3 162 B7R1.3 N=C1CCCCN1 Amb2780013 [0,0,0,0,0,0|2,0,1]=3 163 B7R1.3 N=C1COCCN1 Amb24654396 [0,0,0,0,0,0|3,0,1]=4 164 B7R1.3 N=C1COCCN1 Amb28468104 [0,0,0,0,0,0|3,0,1]=4 165 B7R1.3 N=C1CSCCN1 Amb32679434 [0,0,0,0,0,0|3,0,1]=4 166 B7R1.3 N=C1NCCCN1 Amb22642014 [0,0,0,0,0,0|3,0,1]=4 167 B7R1.3 N=C1NCCCO1 Amb23597225 [0,0,0,0,0,0|3,0,1]=4 168 B7R1.3 N=C1NCCCO1 Amb28990985 [0,0,0,0,0,0|3,0,1]=4 169 B7R1.3 N=C1NCCCS1 Amb22524353 [0,0,0,0,0,0|3,0,1]=4 170 B7R1.3 NC1=CC=CCN1 Amb27391599 [0,0,0,0,0,0|2,0,1]=3 171 B7R1.3 NC1=CC=CCO1 Amb22167473 [0,0,0,0,0,0|2,0,1]=3 172 B7R1.3 NC1=CCCCC1 Amb28456773 [0,0,0,0,0,0|1,0,1]=2 173 B7R1.3 NC1=CNCC=C1 Amb25116751 [0,0,0,0,0,0|2,0,1]=3 174 B7R1.3 NC1=NCCCC1 Amb3997189 [0,0,0,0,0,0|2,0,1]=3 175 B7R1.3 NC1=NCCCN1 Amb17608307 [0,0,0,0,0,0|3,0,1]=4 176 B7R1.3 NC1=NCCCS1 Amb6817862 [0,0,0,0,0,0|3,0,1]=4 177 B7R1.3 NC1=NCCCS1 Amb8468160 [0,0,0,0,0,0|3,0,1]=4 178 B7R1.3 NC1=NCCOC1 Amb33743898 [0,0,0,0,0,0|3,0,1]=4 179 B7R1.3 NC1=NCCSC1 Amb844759 [0,0,0,0,0,0|3,0,1]=4 180 B7R1.3 NC1C=CCCC1 Amb20668839 [0,0,0,0,0,0|1,0,1]=2 181 B7R1.3 NC1C=CCCC1 Amb23385297 [0,0,0,0,0,0|1,0,1]=2 182 B7R1.3 NC1C=CCNO1 Amb25268953 [0,0,0,0,0,0|3,0,1]=4 183 B7R1.3 NC1CC=CCC1 Amb18639038 [0,0,0,0,0,0|1,0,3]=4 184 B7R1.3 NC1CC=CCC1 Amb19515491 [0,0,0,0,0,0|1,0,3]=4 185 B7R1.3 NC1CCCCC1 Amb2792843 [0,0,0,0,0,0|1,0,3]=4 186 B7R1.3 NC1CCCCC1 Amb4035820 [0,0,0,0,0,0|1,0,3]=4 187 B7R1.3 NC1CCCCC1 Amb6366094 [0,0,0,0,0,0|1,0,3]=4 188 B7R1.3 NC1CCCCN1 Amb16233706 [0,0,0,0,0,0|2,0,2]=4 189 B7R1.3 NC1CCCCS1 Amb28052869 [0,0,0,0,0,0|2,0,2]=4 190 B7R1.3 NC1CCCNC1 Amb2694718 [0,0,0,0,0,0|2,0,2]=4 191 B7R1.3 NC1CCCNC1 Amb2720311 [0,0,0,0,0,0|2,0,2]=4 192 B7R1.3 NC1CCCNC1 Amb8385620 [0,0,0,0,0,0|2,0,2]=4 193 B7R1.3 NC1CCCOC1 Amb1091859 [0,0,0,0,0,0|2,0,2]=4 194 B7R1.3 NC1CCCOC1 Amb19889218 [0,0,0,0,0,0|2,0,2]=4 195 B7R1.3 NC1CCCSC1 Amb13953228 [0,0,0,0,0,0|2,0,2]=4 196 B7R1.3 NC1CCCSC1 Amb32660970 [0,0,0,0,0,0|2,0,2]=4 197 B7R1.3 NN1CCCCC1 Amb535734 [0,0,0,0,0,0|2,0,2]=4 198 B7R1.3 NN1CCCCC1 Amb6892706 [0,0,0,0,0,0|2,0,2]=4 199 B7R1.3 N[C@@H]1C=CCCC1 Amb24640515 [0,0,0,0,0,0|1,0,1]=2 200 B7R1.3 N[C@@H]1CC=CCC1 Amb27975676 [0,0,0,0,0,0|1,0,3]=4 201 B7R1.3 N[C@@H]1CCCNC1 Amb16233705 [0,0,0,0,0,0|2,0,2]=4 202 B7R1.3 N[C@@H]1CCCNC1 Amb2695443 [0,0,0,0,0,0|2,0,2]=4 203 B7R1.3 N[C@@H]1CCCOC1 Amb19516292 [0,0,0,0,0,0|2,0,2]=4 204 B7R1.3 N[C@@H]1CCCOC1 Amb20241267 [0,0,0,0,0,0|2,0,2]=4 205 B7R1.3 N[C@H]1CC=CCC1 Amb26609127 [0,0,0,0,0,0|1,0,3]=4 206 B7R1.3 N[C@H]1CCCCO1 Amb27655590 [0,0,0,0,0,0|2,0,2]=4 207 B7R1.3 N[C@H]1CCCNC1 Amb17134809 [0,0,0,0,0,0|2,0,2]=4 208 B7R1.3 N[C@H]1CCCNC1 Amb2695444 [0,0,0,0,0,0|2,0,2]=4 209 B7R1.3 N[C@H]1CCCOC1 Amb19516313 [0,0,0,0,0,0|2,0,2]=4 210 B7R1.3 N[C@H]1CCCOC1 Amb20241266 [0,0,0,0,0,0|2,0,2]=4 211 B7R1.3 N[C@H]1CCCOC1 Amb34916114 [0,0,0,0,0,0|2,0,2]=4 212 B7R1.3 Nc1ccccc1 Amb1935238 [0,0,0,0,0,0|1,0,3]=4 213 B7R1.3 Nc1ccccc1 Amb33716473 [0,0,0,0,0,0|1,0,3]=4 214 B7R1.3 Nc1ccccc1 Amb6383295 [0,0,0,0,0,0|1,0,3]=4 215 B7R1.3 Nc1ccccc1 Amb6609036 [0,0,0,0,0,0|1,0,3]=4 216 B7R1.3 Nc1ccccc1 Amb8513537 [0,0,0,0,0,0|1,0,3]=4 217 B7R1.3 Nc1ccccc1 Amb8516488 [0,0,0,0,0,0|1,0,3]=4 218 B7R1.3 Nc1ccccn1 Amb22284355 [0,0,0,0,0,0|2,0,2]=4 219 B7R1.3 Nc1ccccn1 Amb6335265 [0,0,0,0,0,0|2,0,2]=4 220 B7R1.3 Nc1cccnc1 Amb2609930 [0,0,0,0,0,0|2,0,2]=4 221 B7R1.3 Nc1cccnn1 Amb22489517 [0,0,0,0,0,0|3,0,1]=4 222 B7R1.3 Nc1cccnn1 Amb5751229 [0,0,0,0,0,0|3,0,1]=4 223 B7R1.3 Nc1ccncc1 Amb1933715 [0,0,0,0,0,0|2,0,2]=4 224 B7R1.3 Nc1ccncc1 Amb24066203 [0,0,0,0,0,0|2,0,2]=4 225 B7R1.3 Nc1ccncn1 Amb10070370 [0,0,0,0,0,0|3,0,1]=4 226 B7R1.3 Nc1ccncn1 Amb2684180 [0,0,0,0,0,0|3,0,1]=4 227 B7R1.3 Nc1ccnnc1 Amb23439148 [0,0,0,0,0,0|3,0,1]=4 228 B7R1.3 Nc1ccnnc1 Amb33544447 [0,0,0,0,0,0|3,0,1]=4 229 B7R1.3 O=C1C=CC=CN1 Amb18039970 [0,0,0,0,0,0|1,0,2]=3 230 B7R1.3 O=C1C=CC=CO1 Amb21951679 [0,0,0,0,0,0|1,0,2]=3 231 B7R1.3 O=C1C=CC=NN1 Amb19372847 [0,0,0,0,0,0|2,0,1]=3 232 B7R1.3 O=C1C=CCC=N1 Amb24076140 [0,0,0,0,0,0|1,0,1]=2 233 B7R1.3 O=C1C=CCCC1 Amb17843126 [0,0,0,0,0,0|0,0,0]=0 234 B7R1.3 O=C1C=CCCN1 Amb22001783 [0,0,0,0,0,0|1,0,0]=1 235 B7R1.3 O=C1C=CCCO1 Amb15693457 [0,0,0,0,0,0|1,0,0]=1 236 B7R1.3 O=C1C=CCOC1 Amb22234519 [0,0,0,0,0,0|1,0,0]=1 237 B7R1.3 O=C1C=CCSC1 Amb26544956 [0,0,0,0,0,0|1,0,0]=1 238 B7R1.3 O=C1C=CN=CN1 Amb19748726 [0,0,0,0,0,0|2,0,1]=3 239 B7R1.3 O=C1C=CNC=C1 Amb18039969 [0,0,0,0,0,0|1,0,2]=3 240 B7R1.3 O=C1C=CNC=N1 Amb20239372 [0,0,0,0,0,0|2,0,1]=3 241 B7R1.3 O=C1C=CNCC1 Amb2700614 [0,0,0,0,0,0|1,0,0]=1 242 B7R1.3 O=C1C=CNN=C1 Amb22235288 [0,0,0,0,0,0|2,0,1]=3 243 B7R1.3 O=C1C=COCC1 Amb22000873 [0,0,0,0,0,0|1,0,0]=1 244 B7R1.3 O=C1C=CSC=C1 Amb22364507 [0,0,0,0,0,0|1,0,2]=3 245 B7R1.3 O=C1C=CSCC1 Amb25375022 [0,0,0,0,0,0|1,0,0]=1 246 B7R1.3 O=C1C=NC=CN1 Amb22406482 [0,0,0,0,0,0|2,0,2]=4 247 B7R1.3 O=C1C=NC=NC1 Amb24093715 [0,0,0,0,0,0|2,0,1]=3 248 B7R1.3 O=C1C=NCCN1 Amb28341190 [0,0,0,0,0,0|2,0,0]=2 249 B7R1.3 O=C1CC=NC=N1 Amb10601894 [0,0,0,0,0,0|2,0,1]=3 250 B7R1.3 O=C1CCC=CN1 Amb26365285 [0,0,0,0,0,0|1,0,1]=2 251 B7R1.3 O=C1CCCCC1 Amb2793026 [0,0,0,0,0,0|0,0,2]=2 252 B7R1.3 O=C1CCCCN1 Amb6892006 [0,0,0,0,0,0|1,0,1]=2 253 B7R1.3 O=C1CCCCO1 Amb8513592 [0,0,0,0,0,0|1,0,1]=2 254 B7R1.3 O=C1CCCCS1 Amb25186924 [0,0,0,0,0,0|1,0,1]=2 255 B7R1.3 O=C1CCCNC1 Amb10070944 [0,0,0,0,0,0|1,0,1]=2 256 B7R1.3 O=C1CCCNC1 Amb10602349 [0,0,0,0,0,0|1,0,1]=2 257 B7R1.3 O=C1CCCNC1 Amb19958010 [0,0,0,0,0,0|1,0,1]=2 258 B7R1.3 O=C1CCCNN1 Amb18061622 [0,0,0,0,0,0|2,0,0]=2 259 B7R1.3 O=C1CCCOC1 Amb19373430 [0,0,0,0,0,0|1,0,1]=2 260 B7R1.3 O=C1CCCON1 Amb26560803 [0,0,0,0,0,0|2,0,0]=2 261 B7R1.3 O=C1CCCSC1 Amb13952257 [0,0,0,0,0,0|1,0,1]=2 262 B7R1.3 O=C1CCN=CN1 Amb27447786 [0,0,0,0,0,0|2,0,0]=2 263 B7R1.3 O=C1CCNCC1 Amb2690392 [0,0,0,0,0,0|1,0,2]=3 264 B7R1.3 O=C1CCNCC1 Amb2793002 [0,0,0,0,0,0|1,0,2]=3 265 B7R1.3 O=C1CCNCC1 Amb8394939 [0,0,0,0,0,0|1,0,2]=3 266 B7R1.3 O=C1CCNCN1 Amb27458283 [0,0,0,0,0,0|2,0,1]=3 267 B7R1.3 O=C1CCOCC1 Amb2725565 [0,0,0,0,0,0|1,0,2]=3 268 B7R1.3 O=C1CCSCC1 Amb1154265 [0,0,0,0,0,0|1,0,2]=3 269 B7R1.3 O=C1CNC=NN1 Amb27817820 [0,0,0,0,0,0|3,0,1]=4 270 B7R1.3 O=C1CNCCN1 Amb4138465 [0,0,0,0,0,0|2,0,1]=3 271 B7R1.3 O=C1CNCCN1 Amb6334808 [0,0,0,0,0,0|2,0,1]=3 272 B7R1.3 O=C1CNCCO1 Amb19958702 [0,0,0,0,0,0|2,0,1]=3 273 B7R1.3 O=C1CNCCO1 Amb32410210 [0,0,0,0,0,0|2,0,1]=3 274 B7R1.3 O=C1COCCN1 Amb15691115 [0,0,0,0,0,0|2,0,1]=3 275 B7R1.3 O=C1COCCO1 Amb17933352 [0,0,0,0,0,0|2,0,1]=3 276 B7R1.3 O=C1CSC=CN1 Amb2386683 [0,0,0,0,0,0|2,0,1]=3 277 B7R1.3 O=C1CSCCN1 Amb674722 [0,0,0,0,0,0|2,0,1]=3 278 B7R1.3 O=C1CSCCO1 Amb28069740 [0,0,0,0,0,0|2,0,1]=3 279 B7R1.3 O=C1CSCCS1 Amb24539369 [0,0,0,0,0,0|2,0,1]=3 280 B7R1.3 O=C1CSCSC1 Amb19148039 [0,0,0,0,0,0|2,0,1]=3 281 B7R1.3 O=C1N=CC=CN1 Amb19261228 [0,0,0,0,0,0|2,0,2]=4 282 B7R1.3 O=C1N=CC=CN1 Amb20241236 [0,0,0,0,0,0|2,0,2]=4 283 B7R1.3 O=C1N=CC=CN1 Amb22489504 [0,0,0,0,0,0|2,0,2]=4 284 B7R1.3 O=C1N=CCCN1 Amb24480889 [0,0,0,0,0,0|2,0,0]=2 285 B7R1.3 O=C1NCCCN1 Amb4034594 [0,0,0,0,0,0|2,0,1]=3 286 B7R1.3 O=C1NCCCO1 Amb10608499 [0,0,0,0,0,0|2,0,1]=3 287 B7R1.3 O=C1NCCCS1 Amb24117134 [0,0,0,0,0,0|2,0,1]=3 288 B7R1.3 O=C1NCCNN1 Amb28341733 [0,0,0,0,0,0|3,0,0]=3 289 B7R1.3 O=C1NCNCN1 Amb25146452 [0,0,0,0,0,0|3,0,1]=4 290 B7R1.3 O=C1NNCCO1 Amb32683554 [0,0,0,0,0,0|3,0,0]=3 291 B7R1.3 O=C1OCCCO1 Amb4034896 [0,0,0,0,0,0|2,0,1]=3 292 B7R1.3 O=S1CCCNC1 Amb27195521 [0,0,0,0,0,0|2,0,1]=3 293 B7R1.3 O=S1CCNCC1 Amb18943760 [0,0,0,0,0,0|2,0,2]=4 294 B7R1.3 O=S1CCNCC1 Amb6307179 [0,0,0,0,0,0|2,0,2]=4 295 B7R1.3 O=S1CCOCC1 Amb26535052 [0,0,0,0,0,0|2,0,2]=4 296 B7R1.3 O=S1CCSCC1 Amb25679286 [0,0,0,0,0,0|2,0,2]=4 297 B7R1.3 O=S1OCCCO1 Amb20240777 [0,0,0,0,0,0|3,0,1]=4 298 B7R1.3 O=c1ccocc1 Amb22233061 [0,0,0,0,0,0|1,0,2]=3 299 B7R1.3 O=n1ccccc1 Amb20622007 [0,0,0,0,0,0|1,0,3]=4 300 B7R1.3 OC1=CN=NCC1 Amb22756935 [0,0,0,0,0,0|2,0,1]=3 301 B7R1.3 OC1=NCCNC1 Amb22330543 [0,0,0,0,0,0|2,0,2]=4 302 B7R1.3 OC1C=CCCC1 Amb4605824 [0,0,0,0,0,0|0,0,2]=2 303 B7R1.3 OC1C=CCNC1 Amb24426687 [0,0,0,0,0,0|1,0,2]=3 304 B7R1.3 OC1C=CCNC1 Amb31291592 [0,0,0,0,0,0|1,0,2]=3 305 B7R1.3 OC1C=CCOC1 Amb25662556 [0,0,0,0,0,0|1,0,2]=3 306 B7R1.3 OC1C=CCSC1 Amb25832664 [0,0,0,0,0,0|1,0,2]=3 307 B7R1.3 OC1CCCCC1 Amb4605832 [0,0,0,0,0,0|0,0,4]=4 308 B7R1.3 OC1CCCCN1 Amb8393085 [0,0,0,0,0,0|1,0,3]=4 309 B7R1.3 OC1CCCCO1 Amb8517292 [0,0,0,0,0,0|1,0,3]=4 310 B7R1.3 OC1CCCNC1 Amb3939221 [0,0,0,0,0,0|1,0,3]=4 311 B7R1.3 OC1CCCNC1 Amb4036802 [0,0,0,0,0,0|1,0,3]=4 312 B7R1.3 OC1CCCOC1 Amb16192108 [0,0,0,0,0,0|1,0,3]=4 313 B7R1.3 OC1CCCSC1 Amb4034626 [0,0,0,0,0,0|1,0,3]=4 314 B7R1.3 ON1CCCCC1 Amb6468702 [0,0,0,0,0,0|1,0,3]=4 315 B7R1.3 O[C@@H]1CCCNC1 Amb20241315 [0,0,0,0,0,0|1,0,3]=4 316 B7R1.3 O[C@@H]1CCCNC1 Amb8628462 [0,0,0,0,0,0|1,0,3]=4 317 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [0,0,0,0,0,0|1,0,3]=4 318 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [0,0,0,0,0,0|0,0,2]=2 319 B7R1.3 O[C@H]1C=CCOC1 Amb8393976 [0,0,0,0,0,0|1,0,2]=3 320 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [0,0,0,0,0,0|1,0,3]=4 321 B7R1.3 O[C@H]1CCCNC1 Amb2688784 [0,0,0,0,0,0|1,0,3]=4 322 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [0,0,0,0,0,0|1,0,3]=4 323 B7R1.3 Oc1ccccc1 Amb2793000 [0,0,0,0,0,0|0,0,4]=4 324 B7R1.3 Oc1ccccc1 Amb34916329 [0,0,0,0,0,0|0,0,4]=4 325 B7R1.3 Oc1ccccn1 Amb2609925 [0,0,0,0,0,0|1,0,3]=4 326 B7R1.3 Oc1ccccn1 Amb33716976 [0,0,0,0,0,0|1,0,3]=4 327 B7R1.3 Oc1cccnc1 Amb534212 [0,0,0,0,0,0|1,0,3]=4 328 B7R1.3 Oc1cccnn1 Amb2610009 [0,0,0,0,0,0|2,0,2]=4 329 B7R1.3 Oc1ccncc1 Amb2610065 [0,0,0,0,0,0|1,0,3]=4 330 B7R1.3 Oc1ccncn1 Amb2591540 [0,0,0,0,0,0|2,0,2]=4 331 B7R1.3 Oc1ccnnc1 Amb10602745 [0,0,0,0,0,0|2,0,2]=4 332 B7R1.3 Oc1ccnnc1 Amb22640973 [0,0,0,0,0,0|2,0,2]=4 333 B7R1.3 Oc1ccnnc1 Amb24053159 [0,0,0,0,0,0|2,0,2]=4 334 B7R1.3 S=C1C=CC=CN1 Amb20246884 [0,0,0,0,0,0|1,1,2]=4 335 B7R1.3 S=C1C=CN=CC1 Amb24062778 [0,0,0,0,0,0|1,1,1]=3 336 B7R1.3 S=C1C=CNC=C1 Amb20093140 [0,0,0,0,0,0|1,1,2]=4 337 B7R1.3 S=C1C=CNC=N1 Amb19414436 [0,0,0,0,0,0|2,1,1]=4 338 B7R1.3 S=C1C=COC=C1 Amb26446862 [0,0,0,0,0,0|1,1,2]=4 339 B7R1.3 S=C1C=CSC=C1 Amb22347568 [0,0,0,0,0,0|1,1,2]=4 340 B7R1.3 S=C1CCCCN1 Amb5720520 [0,0,0,0,0,0|1,1,1]=3 341 B7R1.3 S=C1CCNCC1 Amb27232690 [0,0,0,0,0,0|1,1,2]=4 342 B7R1.3 S=C1CCNCN1 Amb27205983 [0,0,0,0,0,0|2,1,1]=4 343 B7R1.3 S=C1NCCCN1 Amb2690553 [0,0,0,0,0,0|2,1,1]=4 344 B7R1.3 S=C1NCCCO1 Amb22524560 [0,0,0,0,0,0|2,1,1]=4 345 B7R1.3 S=C1NCCCS1 Amb4012551 [0,0,0,0,0,0|2,1,1]=4 346 B7R1.3 S=C1SCCCS1 Amb5717576 [0,0,0,0,0,0|2,1,1]=4 347 B7R1.3 SC1=COCCC1 Amb33319911 [0,0,0,0,0,0|1,1,0]=2 348 B7R1.3 SC1=NCCCN1 Amb2537133 [0,0,0,0,0,0|2,1,1]=4 349 B7R1.3 SC1=NCCCS1 Amb4017252 [0,0,0,0,0,0|2,1,1]=4 350 B7R1.3 SC1CC=CCC1 Amb33318612 [0,0,0,0,0,0|0,1,3]=4 351 B7R1.3 SC1CCCCC1 Amb6608750 [0,0,0,0,0,0|0,1,3]=4 352 B7R1.3 SC1CCCCN1 Amb27639704 [0,0,0,0,0,0|1,1,2]=4 353 B7R1.3 SC1CCCNC1 Amb22371077 [0,0,0,0,0,0|1,1,2]=4 354 B7R1.3 SC1CCCNC1 Amb27453630 [0,0,0,0,0,0|1,1,2]=4 355 B7R1.3 SC1CCCOC1 Amb24066221 [0,0,0,0,0,0|1,1,2]=4 356 B7R1.3 SC1CCCSC1 Amb27480711 [0,0,0,0,0,0|1,1,2]=4 357 B7R1.3 Sc1ccccc1 Amb2793090 [0,0,0,0,0,0|0,1,3]=4 358 B7R1.3 Sc1ccccn1 Amb2689072 [0,0,0,0,0,0|1,1,2]=4 359 B7R1.3 Sc1cccnc1 Amb13887011 [0,0,0,0,0,0|1,1,2]=4 360 B7R1.3 Sc1cccnn1 Amb5751230 [0,0,0,0,0,0|2,1,1]=4 361 B7R1.3 Sc1ccncc1 Amb6271419 [0,0,0,0,0,0|1,1,2]=4 362 B7R1.3 Sc1ccncn1 Amb5716288 [0,0,0,0,0,0|2,1,1]=4 363 B7R1.3 Sc1ccnnc1 Amb23440857 [0,0,0,0,0,0|2,1,1]=4 364 B7R1.3 [Hg+]c1ccccc1 Amb22054115 [0,0,0,0,0,0|1,0,3]=4 365 B7R1.3 [Li]c1ccccc1 Amb8516466 [0,0,0,0,0,0|1,0,3]=4 366 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [0,0,0,0,0,0|1,0,3]=4 367 B7R1.3 [Mg+]c1ccccc1 Amb22045898 [0,0,0,0,0,0|1,0,3]=4 368 B7R1.3 [O-]c1ccc[nH+]c1 Amb22492605 [0,0,0,0,0,0|1,0,3]=4 369 B7R1.3 [O-]c1ccccc1 Amb20240913 [0,0,0,0,0,0|0,0,4]=4 370 B7R1.3 [O-]c1ccccc1 Amb31292462 [0,0,0,0,0,0|0,0,4]=4 371 B7R1.3 [O-]c1cccnc1 Amb8513337 [0,0,0,0,0,0|1,0,3]=4 372 B7R1.3 [S-]c1ccccc1 Amb22360782 [0,0,0,0,0,0|0,1,3]=4 373 B7R1.3 [SH2+]c1ccccc1 Amb24524316 [0,0,0,0,0,0|0,1,3]=4 374 B7R1.3 [SeH]c1ccccc1 Amb8513211 [0,0,0,0,0,0|0,1,3]=4 375 B7R1.3 [SiH3]c1ccccc1 Amb2690322 [0,0,0,0,0,0|1,0,3]=4 376 B6R1.1 C1#CNCCC1 Amb27837888 [1,0,0,0,0,0|1,0,2]=4 377 B6R1.1 C1=CCC=CC1 Amb8513501 [1,0,0,0,0,0|0,0,3]=4 378 B6R1.1 C1=CCCC=C1 Amb6297761 [1,0,0,0,0,0|0,0,1]=2 379 B6R1.1 C1=CCCCC1 Amb6608805 [1,0,0,0,0,0|0,0,1]=2 380 B6R1.1 C1=CCNCC1 Amb2720330 [1,0,0,0,0,0|1,0,1]=3 381 B6R1.1 C1=CCNCC1 Amb3941710 [1,0,0,0,0,0|1,0,1]=3 382 B6R1.1 C1=CCNNC1 Amb24714188 [1,0,0,0,0,0|2,0,1]=4 383 B6R1.1 C1=CCNNC1 Amb32668094 [1,0,0,0,0,0|2,0,1]=4 384 B6R1.1 C1=CCOCC1 Amb16234261 [1,0,0,0,0,0|1,0,1]=3 385 B6R1.1 C1=CCONC1 Amb19651283 [1,0,0,0,0,0|2,0,1]=4 386 B6R1.1 C1=CCONC1 Amb21961474 [1,0,0,0,0,0|2,0,1]=4 387 B6R1.1 C1=CCSCC1 Amb29848083 [1,0,0,0,0,0|1,0,1]=3 388 B6R1.1 C1=CNCCC1 Amb24389577 [1,0,0,0,0,0|1,0,0]=2 389 B6R1.1 C1=CNCCN1 Amb27413386 [1,0,0,0,0,0|2,0,0]=3 390 B6R1.1 C1=CNCN=C1 Amb27644334 [1,0,0,0,0,0|2,0,0]=3 391 B6R1.1 C1=COCCC1 Amb6609004 [1,0,0,0,0,0|1,0,0]=2 392 B6R1.1 C1=COCCN1 Amb27413503 [1,0,0,0,0,0|2,0,0]=3 393 B6R1.1 C1=COCCO1 Amb22043779 [1,0,0,0,0,0|2,0,0]=3 394 B6R1.1 C1=NCCCC1 Amb27752613 [1,0,0,0,0,0|1,0,1]=3 395 B6R1.1 C1=NCCCN1 Amb17620508 [1,0,0,0,0,0|2,0,0]=3 396 B6R1.1 C1=NCNCC1 Amb27175339 [1,0,0,0,0,0|2,0,1]=4 397 B6R1.1 C1=NCNCS1 Amb27750508 [1,0,0,0,0,0|3,0,0]=4 398 B6R1.1 C1=NNCNC1 Amb28074859 [1,0,0,0,0,0|3,0,0]=4 399 B6R1.1 C1=NOCNC1 Amb27230102 [1,0,0,0,0,0|3,0,0]=4 400 B6R1.1 C1=NSCCC1 Amb27266087 [1,0,0,0,0,0|2,0,0]=3 401 B6R1.1 C1=NSCNC1 Amb28061495 [1,0,0,0,0,0|3,0,0]=4 402 B6R1.1 C1CCNCC1 Amb2792840 [1,0,0,0,0,0|1,0,2]=4 403 B6R1.1 C1CCNCC1 Amb2816589 [1,0,0,0,0,0|1,0,2]=4 404 B6R1.1 C1CCNNC1 Amb10975991 [1,0,0,0,0,0|2,0,1]=4 405 B6R1.1 C1CCNNC1 Amb18559485 [1,0,0,0,0,0|2,0,1]=4 406 B6R1.1 C1CCNNC1 Amb22263856 [1,0,0,0,0,0|2,0,1]=4 407 B6R1.1 C1CCONC1 Amb22586922 [1,0,0,0,0,0|2,0,1]=4 408 B6R1.1 C1CCONC1 Amb6365589 [1,0,0,0,0,0|2,0,1]=4 409 B6R1.1 C1CCSCC1 Amb17666898 [1,0,0,0,0,0|1,0,2]=4 410 B6R1.1 C1CCSSC1 Amb27845946 [1,0,0,0,0,0|2,0,1]=4 411 B6R1.1 C1CC[NH2+]CC1 Amb19957935 [1,0,0,0,0,0|1,0,2]=4 412 B6R1.1 C1CC[NH2+]CC1 Amb21856129 [1,0,0,0,0,0|1,0,2]=4 413 B6R1.1 C1CNCNC1 Amb4297135 [1,0,0,0,0,0|2,0,1]=4 414 B6R1.1 C1CNCOC1 Amb17506190 [1,0,0,0,0,0|2,0,1]=4 415 B6R1.1 C1CNCOC1 Amb32652717 [1,0,0,0,0,0|2,0,1]=4 416 B6R1.1 C1CNCSC1 Amb20622778 [1,0,0,0,0,0|2,0,1]=4 417 B6R1.1 C1CNCSC1 Amb22356248 [1,0,0,0,0,0|2,0,1]=4 418 B6R1.1 C1COCOC1 Amb8515936 [1,0,0,0,0,0|2,0,1]=4 419 B6R1.1 C1CSCSC1 Amb8393152 [1,0,0,0,0,0|2,0,1]=4 420 B6R1.1 [CH+]1SCCCS1 Amb28241473 [1,0,0,0,0,0|2,0,1]=4 421 B6R1.1 [c-]1ccccc1 Amb27780724 [1,0,0,0,0,0|0,0,3]=4 422 B6R1.1 c1cc[nH+]cc1 Amb10838355 [1,0,0,0,0,0|1,0,2]=4 423 B6R1.1 c1cc[nH+]cc1 Amb19748292 [1,0,0,0,0,0|1,0,2]=4 424 B6R1.1 c1cc[nH+]cc1 Amb22731658 [1,0,0,0,0,0|1,0,2]=4 425 B6R1.1 c1cc[nH+]cc1 Amb22731943 [1,0,0,0,0,0|1,0,2]=4 426 B6R1.1 c1cc[nH+]cc1 Amb2725623 [1,0,0,0,0,0|1,0,2]=4 427 B6R1.1 c1cc[nH+]cc1 Amb8513536 [1,0,0,0,0,0|1,0,2]=4 428 B6R1.1 c1cc[nH+]cc1 Amb8513800 [1,0,0,0,0,0|1,0,2]=4 429 B6R1.1 c1ccccc1 Amb22054011 [1,0,0,0,0,0|0,0,3]=4 430 B6R1.1 c1ccncc1 Amb22361291 [1,0,0,0,0,0|1,0,2]=4 431 B6R1.1 c1ccncc1 Amb22735749 [1,0,0,0,0,0|1,0,2]=4 432 B6R1.1 c1ccncc1 Amb2610064 [1,0,0,0,0,0|1,0,2]=4 433 B6R1.1 c1ccncc1 Amb33719203 [1,0,0,0,0,0|1,0,2]=4 434 B6R1.1 c1ccncc1 Amb34910815 [1,0,0,0,0,0|1,0,2]=4 435 B6R1.1 c1ccncc1 Amb6366076 [1,0,0,0,0,0|1,0,2]=4 436 B6R1.1 c1ccncc1 Amb8387118 [1,0,0,0,0,0|1,0,2]=4 437 B6R1.1 c1ccncc1 Amb8513315 [1,0,0,0,0,0|1,0,2]=4 438 B6R1.1 c1ccncc1 Amb8513785 [1,0,0,0,0,0|1,0,2]=4 439 B6R1.1 c1ccncc1 Amb8513826 [1,0,0,0,0,0|1,0,2]=4 440 B6R1.1 c1ccncc1 Amb8514615 [1,0,0,0,0,0|1,0,2]=4 441 B6R1.1 c1ccnnc1 Amb22234668 [1,0,0,0,0,0|2,0,1]=4 442 B6R1.1 c1ccnnc1 Amb5720312 [1,0,0,0,0,0|2,0,1]=4 443 B6R1.1 c1cncnc1 Amb2786776 [1,0,0,0,0,0|2,0,1]=4 444 B6R1.1 c1cnnnc1 Amb22497604 [1,0,0,0,0,0|3,0,0]=4 445 B8R1.2 BrC=C1CCCCC1 Amb22337534 [0,1,0,0,0,0|1,0,2]=4 446 B8R1.2 BrCC1=CCCCC1 Amb23439167 [0,1,0,0,0,0|1,0,1]=3 447 B8R1.2 BrCC1=CCOCC1 Amb24483111 [0,1,0,0,0,0|2,0,1]=4 448 B8R1.2 BrCC1=COCCC1 Amb33335785 [0,1,0,0,0,0|2,0,0]=3 449 B8R1.2 BrCC1=COCCO1 Amb29866238 [0,1,0,0,0,0|3,0,0]=4 450 B8R1.2 BrCC1C=CCCC1 Amb25869978 [0,1,0,0,0,0|1,0,1]=3 451 B8R1.2 Br\C=C1\CCCOC1 Amb32656912 [0,1,0,0,0,0|2,0,1]=4 452 B8R1.2 C#CC1=CCCCC1 Amb1102053 [0,1,0,0,0,0|1,0,1]=3 453 B8R1.2 C#CC1=COCCC1 Amb33414889 [0,1,0,0,0,0|2,0,0]=3 454 B8R1.2 C=CC1=CCCCC1 Amb24387238 [0,1,0,0,0,0|1,0,1]=3 455 B8R1.2 C=CC1=CCCNC1 Amb27173273 [0,1,0,0,0,0|2,0,1]=4 456 B8R1.2 C=CC1=COCCC1 Amb25204352 [0,1,0,0,0,0|2,0,0]=3 457 B8R1.2 CC=C1CCCCC1 Amb8513433 [0,1,0,0,0,0|1,0,2]=4 458 B8R1.2 CCC1=CC=CNC1 Amb27643536 [0,1,0,0,0,0|2,0,1]=4 459 B8R1.2 CCC1=CCCCC1 Amb25337001 [0,1,0,0,0,0|1,0,1]=3 460 B8R1.2 CCC1=CNCCC1 Amb27404529 [0,1,0,0,0,0|2,0,0]=3 461 B8R1.2 CCC1=CSCCN1 Amb27838422 [0,1,0,0,0,0|3,0,0]=4 462 B8R1.2 CCC1C=CCCC1 Amb27883191 [0,1,0,0,0,0|1,0,1]=3 463 B8R1.2 CN=C1CCCCC1 Amb27838980 [0,1,0,0,0,0|1,0,2]=4 464 B8R1.2 CNC1=CC[N-]C=C1 Amb26860853 [0,1,0,0,0,0|2,0,1]=4 465 B8R1.2 CNC1=NCCCC1 Amb23570622 [0,1,0,0,0,0|2,0,1]=4 466 B8R1.2 CNC1=NCCCC1 Amb28934861 [0,1,0,0,0,0|2,0,1]=4 467 B8R1.2 CNC1=NOCCC1 Amb27839021 [0,1,0,0,0,0|3,0,0]=4 468 B8R1.2 COC1=CCCCC1 Amb10601667 [0,1,0,0,0,0|0,0,2]=3 469 B8R1.2 COC1=CCNCC1 Amb27174213 [0,1,0,0,0,0|1,0,2]=4 470 B8R1.2 COC1=CCOCC1 Amb21927983 [0,1,0,0,0,0|1,0,2]=4 471 B8R1.2 COC1=NCCCC1 Amb2689803 [0,1,0,0,0,0|1,0,2]=4 472 B8R1.2 COC1C=CCCC1 Amb9787273 [0,1,0,0,0,0|0,0,2]=3 473 B8R1.2 COC1C=CCCO1 Amb27443733 [0,1,0,0,0,0|1,0,2]=4 474 B8R1.2 COC1C=CCNC1 Amb35752374 [0,1,0,0,0,0|1,0,2]=4 475 B8R1.2 COC1C=CCNC1 Amb35753077 [0,1,0,0,0,0|1,0,2]=4 476 B8R1.2 CSC1=CC=CNC1 Amb27205077 [0,1,0,0,0,0|1,1,1]=4 477 B8R1.2 CSC1=CCCCC1 Amb28316123 [0,1,0,0,0,0|0,1,1]=3 478 B8R1.2 C\C=C1/CCCNC1 Amb31161500 [0,1,0,0,0,0|2,0,1]=4 479 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,1,0,0,0,0|2,0,1]=4 480 B8R1.2 ClCC1=COCCO1 Amb28199866 [0,1,0,0,0,0|3,0,0]=4 481 B8R1.2 ClCC1=CSCCO1 Amb27254189 [0,1,0,0,0,0|3,0,0]=4 482 B8R1.2 ClCC1C=CCCC1 Amb17672830 [0,1,0,0,0,0|1,0,1]=3 483 B8R1.2 ClN=C1CCCCC1 Amb25069376 [0,1,0,0,0,0|1,0,2]=4 484 B8R1.2 N#CC1=CC=CNC1 Amb27166581 [0,1,0,0,0,0|2,0,1]=4 485 B8R1.2 N#CC1=CCCCC1 Amb2720853 [0,1,0,0,0,0|1,0,1]=3 486 B8R1.2 N#CC1=CCCCO1 Amb2700340 [0,1,0,0,0,0|2,0,1]=4 487 B8R1.2 N#CC1=CCCNC1 Amb27838385 [0,1,0,0,0,0|2,0,1]=4 488 B8R1.2 N#CC1=CCNCC1 Amb27220885 [0,1,0,0,0,0|2,0,1]=4 489 B8R1.2 N#CC1=CCNCC1 Amb32701604 [0,1,0,0,0,0|2,0,1]=4 490 B8R1.2 N#CC1=CCOCC1 Amb25277232 [0,1,0,0,0,0|2,0,1]=4 491 B8R1.2 N#CC1=CNCCC1 Amb16191903 [0,1,0,0,0,0|2,0,0]=3 492 B8R1.2 N#CC1=COCCC1 Amb19319238 [0,1,0,0,0,0|2,0,0]=3 493 B8R1.2 N#CC1=COCCO1 Amb9677385 [0,1,0,0,0,0|3,0,0]=4 494 B8R1.2 N#CC1C=CCCC1 Amb17593115 [0,1,0,0,0,0|1,0,1]=3 495 B8R1.2 NCC1=CCCCC1 Amb10607847 [0,1,0,0,0,0|1,0,1]=3 496 B8R1.2 NCC1=CCCCC1 Amb22587029 [0,1,0,0,0,0|1,0,1]=3 497 B8R1.2 NCC1=CCCCO1 Amb33457505 [0,1,0,0,0,0|2,0,1]=4 498 B8R1.2 NCC1=CCCCO1 Amb8009853 [0,1,0,0,0,0|2,0,1]=4 499 B8R1.2 NCC1=CCCOC1 Amb24329061 [0,1,0,0,0,0|2,0,1]=4 500 B8R1.2 NCC1=CCCOC1 Amb28934826 [0,1,0,0,0,0|2,0,1]=4 501 B8R1.2 NCC1=CCNCC1 Amb26942552 [0,1,0,0,0,0|2,0,1]=4 502 B8R1.2 NCC1=CCNCC1 Amb33483617 [0,1,0,0,0,0|2,0,1]=4 503 B8R1.2 NCC1=CCOC=C1 Amb28313810 [0,1,0,0,0,0|2,0,1]=4 504 B8R1.2 NCC1=CCOCC1 Amb24608110 [0,1,0,0,0,0|2,0,1]=4 505 B8R1.2 NCC1=CCOCC1 Amb28934924 [0,1,0,0,0,0|2,0,1]=4 506 B8R1.2 NCC1=COCCC1 Amb27202637 [0,1,0,0,0,0|2,0,0]=3 507 B8R1.2 NCC1=COCCO1 Amb9677510 [0,1,0,0,0,0|3,0,0]=4 508 B8R1.2 NCC1C=CCCC1 Amb18641664 [0,1,0,0,0,0|1,0,1]=3 509 B8R1.2 NN=C1CCCCC1 Amb26080931 [0,1,0,0,0,0|1,0,2]=4 510 B8R1.2 NNC1=CCCCC1 Amb27880817 [0,1,0,0,0,0|1,0,1]=3 511 B8R1.2 NNC1=CCCCO1 Amb28125675 [0,1,0,0,0,0|2,0,1]=4 512 B8R1.2 N\N=C1\CCCOC1 Amb27479462 [0,1,0,0,0,0|2,0,1]=4 513 B8R1.2 N\N=C1\CCCSC1 Amb27407928 [0,1,0,0,0,0|2,0,1]=4 514 B8R1.2 O=Bc1ccccc1 Amb25221658 [0,1,0,0,0,0|0,0,3]=4 515 B8R1.2 O=CC1=CC=CSC1 Amb28194907 [0,1,0,0,0,0|1,0,1]=3 516 B8R1.2 O=CC1=CCC=CO1 Amb27437201 [0,1,0,0,0,0|1,0,2]=4 517 B8R1.2 O=CC1=CCCCC1 Amb33545149 [0,1,0,0,0,0|0,0,1]=2 518 B8R1.2 O=CC1=CCCNC1 Amb27833007 [0,1,0,0,0,0|1,0,1]=3 519 B8R1.2 O=CC1=CCCOC1 Amb1102766 [0,1,0,0,0,0|1,0,1]=3 520 B8R1.2 O=CC1=CCCSC1 Amb18642670 [0,1,0,0,0,0|1,0,1]=3 521 B8R1.2 O=CC1=CCOCC1 Amb18641683 [0,1,0,0,0,0|1,0,1]=3 522 B8R1.2 O=CC1=CNC=CC1 Amb27216667 [0,1,0,0,0,0|1,0,2]=4 523 B8R1.2 O=CC1=COCCC1 Amb2433566 [0,1,0,0,0,0|1,0,0]=2 524 B8R1.2 O=CC1=COCCO1 Amb2786548 [0,1,0,0,0,0|2,0,0]=3 525 B8R1.2 O=CC1=CSCCC1 Amb28316147 [0,1,0,0,0,0|1,0,0]=2 526 B8R1.2 O=CC1C=CCCC1 Amb18641614 [0,1,0,0,0,0|0,0,1]=2 527 B8R1.2 O=CC1CC=CCC1 Amb3372080 [0,1,0,0,0,0|0,0,3]=4 528 B8R1.2 O=CC1CCC=CO1 Amb3939141 [0,1,0,0,0,0|1,0,2]=4 529 B8R1.2 O=CC1CCCCC1 Amb3939850 [0,1,0,0,0,0|0,0,3]=4 530 B8R1.2 O=CC1CCCCN1 Amb20242687 [0,1,0,0,0,0|1,0,2]=4 531 B8R1.2 O=CC1CCCCN1 Amb8384317 [0,1,0,0,0,0|1,0,2]=4 532 B8R1.2 O=CC1CCCCO1 Amb8009759 [0,1,0,0,0,0|1,0,2]=4 533 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,1,0,0,0,0|1,0,2]=4 534 B8R1.2 O=CC1CCCNC1 Amb18833063 [0,1,0,0,0,0|1,0,2]=4 535 B8R1.2 O=CC1CCCOC1 Amb8009553 [0,1,0,0,0,0|1,0,2]=4 536 B8R1.2 O=CC1CCCSC1 Amb18642817 [0,1,0,0,0,0|1,0,2]=4 537 B8R1.2 O=CN1C=CCCC1 Amb22371093 [0,1,0,0,0,0|1,0,0]=2 538 B8R1.2 O=CN1C=COCC1 Amb22371094 [0,1,0,0,0,0|2,0,0]=3 539 B8R1.2 O=CN1CCCCC1 Amb2720341 [0,1,0,0,0,0|1,0,2]=4 540 B8R1.2 O=C[C@@H]1CC=CCC1 Amb27966684 [0,1,0,0,0,0|0,0,3]=4 541 B8R1.2 O=C[C@@H]1CCC=CO1 Amb28284610 [0,1,0,0,0,0|1,0,2]=4 542 B8R1.2 O=C[C@@H]1CCCCN1 Amb27468660 [0,1,0,0,0,0|1,0,2]=4 543 B8R1.2 O=C[C@@H]1CCCOC1 Amb27843270 [0,1,0,0,0,0|1,0,2]=4 544 B8R1.2 O=C[C@H]1CC=CCC1 Amb533150 [0,1,0,0,0,0|0,0,3]=4 545 B8R1.2 O=C[C@H]1CCCCN1 Amb27203300 [0,1,0,0,0,0|1,0,2]=4 546 B8R1.2 O=Cc1ccccc1 Amb2792754 [0,1,0,0,0,0|0,0,3]=4 547 B8R1.2 O=Cc1ccccn1 Amb2720349 [0,1,0,0,0,0|1,0,2]=4 548 B8R1.2 O=Cc1cccnc1 Amb2720350 [0,1,0,0,0,0|1,0,2]=4 549 B8R1.2 O=Cc1cccnn1 Amb8010287 [0,1,0,0,0,0|2,0,1]=4 550 B8R1.2 O=Cc1ccncc1 Amb932832 [0,1,0,0,0,0|1,0,2]=4 551 B8R1.2 O=Cc1ccncn1 Amb8009550 [0,1,0,0,0,0|2,0,1]=4 552 B8R1.2 O=Cc1ccnnc1 Amb8010397 [0,1,0,0,0,0|2,0,1]=4 553 B8R1.2 O=NN1CCCCC1 Amb10604043 [0,1,0,0,0,0|1,0,2]=4 554 B8R1.2 O=NN1CCCCO1 Amb27472845 [0,1,0,0,0,0|2,0,1]=4 555 B8R1.2 O=NN1CCCOC1 Amb26515732 [0,1,0,0,0,0|2,0,1]=4 556 B8R1.2 O=Nc1ccccc1 Amb9785158 [0,1,0,0,0,0|0,0,3]=4 557 B8R1.2 O=Nc1ccccn1 Amb31031129 [0,1,0,0,0,0|1,0,2]=4 558 B8R1.2 O=Nc1cccnn1 Amb27962605 [0,1,0,0,0,0|2,0,1]=4 559 B8R1.2 O=Nc1ccnnc1 Amb28368778 [0,1,0,0,0,0|2,0,1]=4 560 B8R1.2 O=[IH2]c1ccccc1 Amb15692855 [0,1,0,0,0,0|0,0,3]=4 561 B8R1.2 OCC1=CCCCC1 Amb24122911 [0,1,0,0,0,0|0,0,2]=3 562 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,1,0,0,0,0|1,0,2]=4 563 B8R1.2 OCC1=CCCOC1 Amb24329074 [0,1,0,0,0,0|1,0,2]=4 564 B8R1.2 OCC1=CCOCC1 Amb27394889 [0,1,0,0,0,0|1,0,2]=4 565 B8R1.2 OCC1=CCSCC1 Amb28189541 [0,1,0,0,0,0|1,0,2]=4 566 B8R1.2 OCC1=COCCC1 Amb24426430 [0,1,0,0,0,0|1,0,1]=3 567 B8R1.2 OCC1=COCCO1 Amb19319714 [0,1,0,0,0,0|2,0,1]=4 568 B8R1.2 OCC1=CSCCS1 Amb27766515 [0,1,0,0,0,0|2,0,1]=4 569 B8R1.2 OCC1=NOCCC1 Amb25675358 [0,1,0,0,0,0|2,0,1]=4 570 B8R1.2 OCC1C=CCCC1 Amb17593156 [0,1,0,0,0,0|0,0,2]=3 571 B8R1.2 OCC1C=CCCN1 Amb32683449 [0,1,0,0,0,0|1,0,2]=4 572 B8R1.2 OCC1C=CCCO1 Amb27249902 [0,1,0,0,0,0|1,0,2]=4 573 B8R1.2 OCC1C=CCOC1 Amb27755980 [0,1,0,0,0,0|1,0,2]=4 574 B8R1.2 OC[C@@H]1C=CCOC1 Amb27398322 [0,1,0,0,0,0|1,0,2]=4 575 B8R1.2 ON=C1CCCCC1 Amb6364727 [0,1,0,0,0,0|0,0,3]=4 576 B8R1.2 O\N=C1/C=CCCC1 Amb28316146 [0,1,0,0,0,0|0,0,1]=2 577 B8R1.2 O\N=C1\CCCCN1 Amb4136429 [0,1,0,0,0,0|1,0,2]=4 578 B8R1.2 SCC1=CCCOC1 Amb32788343 [0,1,0,0,0,0|1,1,1]=4 579 B8R1.2 SCC1=COCCC1 Amb33319974 [0,1,0,0,0,0|1,1,0]=3 580 B8R1.2 [C-]#[N+]C1=CCCCC1 Amb10603087 [0,1,0,0,0,0|1,0,1]=3 581 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,1,0,0,0,0|0,0,3]=4 582 B8R1.3 C=C1CCC(C)CC1 Amb24058250 [0,1,0,0,0,0|1,0,2]=4 583 B8R1.3 C=C1CCC(C)NC1 Amb27626150 [0,1,0,0,0,0|2,0,1]=4 584 B8R1.3 C=C1CCC(C)OC1 Amb30011003 [0,1,0,0,0,0|2,0,1]=4 585 B8R1.3 C=C1CCC(C)SC1 Amb35611382 [0,1,0,0,0,0|2,0,1]=4 586 B8R1.3 C=C1CCC(N)CC1 Amb23599023 [0,1,0,0,0,0|1,0,2]=4 587 B8R1.3 C=C1CCC(N)CC1 Amb33537570 [0,1,0,0,0,0|1,0,2]=4 588 B8R1.3 C=C1CCC(O)CC1 Amb27603595 [0,1,0,0,0,0|1,0,2]=4 589 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,1,0,0,0,0|0,0,2]=3 590 B8R1.3 CC1=CCC(C)CC1 Amb26354597 [0,1,0,0,0,0|1,0,1]=3 591 B8R1.3 CC1=CC[C@@H](N)CC1 Amb27493017 [0,1,0,0,0,0|1,0,1]=3 592 B8R1.3 CC1=CC[C@H](N)CC1 Amb28365931 [0,1,0,0,0,0|1,0,1]=3 593 B8R1.3 CC1=CNC(=O)C=C1 Amb18039971 [0,1,0,0,0,0|1,0,2]=4 594 B8R1.3 CC1=CNC(=O)CO1 Amb27390806 [0,1,0,0,0,0|2,0,1]=4 595 B8R1.3 CC1=COC(=O)C=C1 Amb27595539 [0,1,0,0,0,0|1,0,2]=4 596 B8R1.3 CC1=NNC(=O)C=C1 Amb18372841 [0,1,0,0,0,0|2,0,1]=4 597 B8R1.3 CC1=NNC(=O)C=C1 Amb19373006 [0,1,0,0,0,0|2,0,1]=4 598 B8R1.3 CC1=NNC(=O)C=C1 Amb19894726 [0,1,0,0,0,0|2,0,1]=4 599 B8R1.3 CC1=NNC(=O)CC1 Amb2606146 [0,1,0,0,0,0|2,0,1]=4 600 B8R1.3 CC1C=CC(=N)NC1 Amb25366457 [0,1,0,0,0,0|2,0,0]=3 601 B8R1.3 CC1C=CC(=O)CC1 Amb24556470 [0,1,0,0,0,0|0,0,0]=1 602 B8R1.3 CC1C=CC(C)NC1 Amb27839527 [0,1,0,0,0,0|2,0,1]=4 603 B8R1.3 CC1CC=C(Cl)CC1 Amb27783557 [0,1,0,0,0,0|1,0,1]=3 604 B8R1.3 CC1CCC(=O)CC1 Amb6608654 [0,1,0,0,0,0|0,0,2]=3 605 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [0,1,0,0,0,0|1,0,1]=3 606 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [0,1,0,0,0,0|1,0,1]=3 607 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,1,0,0,0,0|1,0,1]=3 608 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,1,0,0,0,0|1,0,1]=3 609 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,1,0,0,0,0|1,0,1]=3 610 B8R1.3 CC1CCC(=O)NN1 Amb27443930 [0,1,0,0,0,0|2,0,0]=3 611 B8R1.3 CC1CCC(=O)OC1 Amb27667524 [0,1,0,0,0,0|1,0,1]=3 612 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,1,0,0,0,0|2,0,1]=4 613 B8R1.3 CC1CNC(=O)CN1 Amb34912937 [0,1,0,0,0,0|2,0,1]=4 614 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,1,0,0,0,0|2,0,1]=4 615 B8R1.3 CC1OCC(=O)CO1 Amb28316125 [0,1,0,0,0,0|2,0,1]=4 616 B8R1.3 CN1C=CC(=O)CC1 Amb17593148 [0,1,0,0,0,0|1,0,0]=2 617 B8R1.3 CN1C=CC(N)=CC1 Amb25113880 [0,1,0,0,0,0|2,0,1]=4 618 B8R1.3 CN1CC=C(Br)CC1 Amb22728686 [0,1,0,0,0,0|2,0,1]=4 619 B8R1.3 CN1CC=C(I)CC1 Amb27879736 [0,1,0,0,0,0|2,0,1]=4 620 B8R1.3 CN1CCC(=O)CC1 Amb2725656 [0,1,0,0,0,0|1,0,2]=4 621 B8R1.3 C[C@@H]1C=CC(=O)CC1 Amb28144188 [0,1,0,0,0,0|0,0,0]=1 622 B8R1.3 C[C@@H]1C=C[C@@H](Cl)CC1 Amb27853647 [0,1,0,0,0,0|1,0,1]=3 623 B8R1.3 C[C@@H]1CCC(=N)NC1 Amb27429397 [0,1,0,0,0,0|2,0,1]=4 624 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,1,0,0,0,0|1,0,1]=3 625 B8R1.3 C[C@@H]1CCC(=O)OC1 Amb26004046 [0,1,0,0,0,0|1,0,1]=3 626 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,1,0,0,0,0|2,0,1]=4 627 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,1,0,0,0,0|2,0,1]=4 628 B8R1.3 C[C@@H]1CNC(=O)CO1 Amb27470503 [0,1,0,0,0,0|2,0,1]=4 629 B8R1.3 C[C@H]1C=C[C@@H](O)CC1 Amb27186928 [0,1,0,0,0,0|0,0,2]=3 630 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [0,1,0,0,0,0|1,0,1]=3 631 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,1,0,0,0,0|2,0,1]=4 632 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,1,0,0,0,0|2,0,1]=4 633 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,1,0,0,0,0|2,0,1]=4 634 B8R1.3 ClC1=NNC(Cl)C=C1 Amb27649574 [0,1,0,0,0,0|3,0,0]=4 635 B8R1.3 NC1=CNC(=O)C=C1 Amb19958325 [0,1,0,0,0,0|1,0,2]=4 636 B8R1.3 NC1=NNC(=O)C=C1 Amb18124225 [0,1,0,0,0,0|2,0,1]=4 637 B8R1.3 NC1=NNC(=O)C=C1 Amb24271086 [0,1,0,0,0,0|2,0,1]=4 638 B8R1.3 NC1C=CC(Cl)CC1 Amb27779409 [0,1,0,0,0,0|1,0,1]=3 639 B8R1.3 NC1C=CC(N)CC1 Amb27235583 [0,1,0,0,0,0|1,0,1]=3 640 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,1,0,0,0,0|0,0,2]=3 641 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,1,0,0,0,0|0,0,2]=3 642 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,1,0,0,0,0|1,0,1]=3 643 B8R1.3 NC1CCC(=O)NC1 Amb18833034 [0,1,0,0,0,0|1,0,1]=3 644 B8R1.3 NC1CCS(=O)CC1 Amb18943776 [0,1,0,0,0,0|1,0,2]=4 645 B8R1.3 NC1CCS(=O)CC1 Amb21988665 [0,1,0,0,0,0|1,0,2]=4 646 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb2699221 [0,1,0,0,0,0|1,0,1]=3 647 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb27432343 [0,1,0,0,0,0|1,0,1]=3 648 B8R1.3 N[C@H]1CCC(=O)NC1 Amb22748949 [0,1,0,0,0,0|1,0,1]=3 649 B8R1.3 N[C@H]1CCC(=O)NC1 Amb2699220 [0,1,0,0,0,0|1,0,1]=3 650 B8R1.3 O=C1C=CC(=O)C=C1 Amb6600120 [0,1,0,0,0,0|0,0,3]=4 651 B8R1.3 O=C1C=CC(=O)C=C1 Amb8516773 [0,1,0,0,0,0|0,0,3]=4 652 B8R1.3 O=C1C=CC(=O)N=N1 Amb22498641 [0,1,0,0,0,0|2,0,1]=4 653 B8R1.3 O=C1C=CC(=O)NN1 Amb19651991 [0,1,0,0,0,0|2,0,1]=4 654 B8R1.3 O=C1C=CC(Br)=CN1 Amb18010721 [0,1,0,0,0,0|1,0,2]=4 655 B8R1.3 O=C1C=CC(Br)=NN1 Amb22491266 [0,1,0,0,0,0|2,0,1]=4 656 B8R1.3 O=C1C=CC(Cl)=CN1 Amb18039972 [0,1,0,0,0,0|1,0,2]=4 657 B8R1.3 O=C1C=CC(Cl)=CO1 Amb20247269 [0,1,0,0,0,0|1,0,2]=4 658 B8R1.3 O=C1C=CC(Cl)=NN1 Amb19148928 [0,1,0,0,0,0|2,0,1]=4 659 B8R1.3 O=C1C=CC(F)=CN1 Amb18040570 [0,1,0,0,0,0|1,0,2]=4 660 B8R1.3 O=C1C=CC(F)=NN1 Amb22387070 [0,1,0,0,0,0|2,0,1]=4 661 B8R1.3 O=C1C=CC(F)C=C1 Amb28124983 [0,1,0,0,0,0|0,0,2]=3 662 B8R1.3 O=C1C=CC(I)=CN1 Amb22001395 [0,1,0,0,0,0|1,0,2]=4 663 B8R1.3 O=C1C=CC(I)=CO1 Amb20247268 [0,1,0,0,0,0|1,0,2]=4 664 B8R1.3 O=C1C=CC(I)=NN1 Amb24445162 [0,1,0,0,0,0|2,0,1]=4 665 B8R1.3 O=C1C=CC(O)=CN1 Amb19889905 [0,1,0,0,0,0|1,0,2]=4 666 B8R1.3 O=C1C=CC(O)=NN1 Amb22058718 [0,1,0,0,0,0|2,0,1]=4 667 B8R1.3 O=C1C=CC(O)CC1 Amb28048996 [0,1,0,0,0,0|0,0,0]=1 668 B8R1.3 O=C1C=CC(O)OC1 Amb17593180 [0,1,0,0,0,0|1,0,0]=2 669 B8R1.3 O=C1C=CN(O)C=C1 Amb24608607 [0,1,0,0,0,0|1,0,2]=4 670 B8R1.3 O=C1C=CS(=O)CC1 Amb27948688 [0,1,0,0,0,0|1,0,0]=2 671 B8R1.3 O=C1CCC(=O)CC1 Amb6471902 [0,1,0,0,0,0|0,0,3]=4 672 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [0,1,0,0,0,0|1,0,2]=4 673 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [0,1,0,0,0,0|2,0,1]=4 674 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [0,1,0,0,0,0|1,0,2]=4 675 B8R1.3 O=C1CCC(Br)CC1 Amb28342260 [0,1,0,0,0,0|0,0,2]=3 676 B8R1.3 O=C1CCC(Cl)CC1 Amb26585218 [0,1,0,0,0,0|0,0,2]=3 677 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,1,0,0,0,0|0,0,2]=3 678 B8R1.3 O=C1CCC(I)CC1 Amb27232393 [0,1,0,0,0,0|0,0,2]=3 679 B8R1.3 O=C1CCC(O)CC1 Amb2699831 [0,1,0,0,0,0|0,0,2]=3 680 B8R1.3 O=C1CCC(O)CN1 Amb10066907 [0,1,0,0,0,0|1,0,1]=3 681 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [0,1,0,0,0,0|1,0,1]=3 682 B8R1.3 O=C1CCN(Cl)CC1 Amb27430526 [0,1,0,0,0,0|1,0,2]=4 683 B8R1.3 O=C1CCS(=O)CC1 Amb2612398 [0,1,0,0,0,0|1,0,2]=4 684 B8R1.3 O=C1CC[C@@H](O)CN1 Amb2698033 [0,1,0,0,0,0|1,0,1]=3 685 B8R1.3 O=C1CC[C@H](O)CN1 Amb2698032 [0,1,0,0,0,0|1,0,1]=3 686 B8R1.3 O=C1CNC(=O)C=N1 Amb27838363 [0,1,0,0,0,0|2,0,1]=4 687 B8R1.3 O=C1NCC(O)CN1 Amb19516674 [0,1,0,0,0,0|2,0,1]=4 688 B8R1.3 O=C1NCC(O)CO1 Amb27210928 [0,1,0,0,0,0|2,0,1]=4 689 B8R1.3 O=S1CCC(Cl)CC1 Amb21988466 [0,1,0,0,0,0|1,0,2]=4 690 B8R1.3 O=S1CCC(O)CC1 Amb21988465 [0,1,0,0,0,0|1,0,2]=4 691 B8R1.3 O=S1CCC(S)CC1 Amb32788878 [0,1,0,0,0,0|1,0,2]=4 692 B8R1.3 O=c1ccc(Br)co1 Amb22231971 [0,1,0,0,0,0|1,0,2]=4 693 B8R1.3 OC1C=CC(O)CC1 Amb26492877 [0,1,0,0,0,0|0,0,2]=3 694 B8R1.3 O[C@H]1C=C[C@H](Cl)CC1 Amb27444700 [0,1,0,0,0,0|0,0,2]=3 695 B8R1.4 C=C1CCCC(=C)C1 Amb17940138 [0,1,0,0,0,0|1,0,1]=3 696 B8R1.4 C=C1CCCC(=O)C1 Amb28132034 [0,1,0,0,0,0|0,0,1]=2 697 B8R1.4 C=C1CNCC(C)C1 Amb35719512 [0,1,0,0,0,0|2,0,1]=4 698 B8R1.4 C=C1COCC(O)C1 Amb27484750 [0,1,0,0,0,0|2,0,1]=4 699 B8R1.4 CC1=CC(=O)C=CN1 Amb22492433 [0,1,0,0,0,0|1,0,2]=4 700 B8R1.4 CC1=CC(=O)C=CN1 Amb33714765 [0,1,0,0,0,0|1,0,2]=4 701 B8R1.4 CC1=CC(=O)C=CO1 Amb22386932 [0,1,0,0,0,0|1,0,2]=4 702 B8R1.4 CC1=CC(=O)C=NN1 Amb24501997 [0,1,0,0,0,0|2,0,1]=4 703 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,1,0,0,0,0|0,0,0]=1 704 B8R1.4 CC1=CC(=O)CSC1 Amb28316129 [0,1,0,0,0,0|1,0,0]=2 705 B8R1.4 CC1=CC(=O)N=CN1 Amb19879021 [0,1,0,0,0,0|2,0,1]=4 706 B8R1.4 CC1=CC(=O)NC=C1 Amb18034270 [0,1,0,0,0,0|1,0,2]=4 707 B8R1.4 CC1=CC(=O)NC=N1 Amb19116078 [0,1,0,0,0,0|2,0,1]=4 708 B8R1.4 CC1=CC(=O)NC=N1 Amb33621237 [0,1,0,0,0,0|2,0,1]=4 709 B8R1.4 CC1=CC(=O)NCC1 Amb27170325 [0,1,0,0,0,0|1,0,0]=2 710 B8R1.4 CC1=CC(=O)NN=C1 Amb19892393 [0,1,0,0,0,0|2,0,1]=4 711 B8R1.4 CC1=CC(=O)NON1 Amb4004619 [0,1,0,0,0,0|3,0,0]=4 712 B8R1.4 CC1=CC(C)CCC1 Amb26410159 [0,1,0,0,0,0|1,0,1]=3 713 B8R1.4 CC1=CC(C)CNC1 Amb25757457 [0,1,0,0,0,0|2,0,1]=4 714 B8R1.4 CC1=CC(C)CNC1 Amb28934871 [0,1,0,0,0,0|2,0,1]=4 715 B8R1.4 CC1=CC(C)OCC1 Amb17689157 [0,1,0,0,0,0|2,0,1]=4 716 B8R1.4 CC1=CC(Cl)CCC1 Amb27860262 [0,1,0,0,0,0|1,0,1]=3 717 B8R1.4 CC1=CC(Cl)CNC1 Amb32989055 [0,1,0,0,0,0|2,0,1]=4 718 B8R1.4 CC1=CC(N)=NCC1 Amb25336795 [0,1,0,0,0,0|2,0,0]=3 719 B8R1.4 CC1=CC(N)CNC1 Amb32989560 [0,1,0,0,0,0|2,0,1]=4 720 B8R1.4 CC1=CC(O)CCC1 Amb10844732 [0,1,0,0,0,0|0,0,2]=3 721 B8R1.4 CC1=CC(O)CNC1 Amb32989170 [0,1,0,0,0,0|1,0,2]=4 722 B8R1.4 CC1=CC=CC(=O)N1 Amb18540672 [0,1,0,0,0,0|1,0,2]=4 723 B8R1.4 CC1=CC=CC(=O)N1 Amb32789652 [0,1,0,0,0,0|1,0,2]=4 724 B8R1.4 CC1=CC=CC(=O)O1 Amb20247496 [0,1,0,0,0,0|1,0,2]=4 725 B8R1.4 CC1=CCCC(=O)C1 Amb27661853 [0,1,0,0,0,0|0,0,2]=3 726 B8R1.4 CC1=CCCC(=O)N1 Amb27949580 [0,1,0,0,0,0|1,0,1]=3 727 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,1,0,0,0,0|1,0,1]=3 728 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,1,0,0,0,0|2,0,1]=4 729 B8R1.4 CC1=CSCC(=O)N1 Amb2386684 [0,1,0,0,0,0|2,0,1]=4 730 B8R1.4 CC1=C[C@@H](O)CCC1 Amb27466476 [0,1,0,0,0,0|0,0,2]=3 731 B8R1.4 CC1=NC(=O)C=CN1 Amb33552640 [0,1,0,0,0,0|2,0,1]=4 732 B8R1.4 CC1=NC(=O)CCC1 Amb28239945 [0,1,0,0,0,0|1,0,0]=2 733 B8R1.4 CC1=NC(C)CCC1 Amb27589065 [0,1,0,0,0,0|2,0,1]=4 734 B8R1.4 CC1=NC=CC(=O)N1 Amb22058797 [0,1,0,0,0,0|2,0,1]=4 735 B8R1.4 CC1=NC=CC(=O)N1 Amb33719419 [0,1,0,0,0,0|2,0,1]=4 736 B8R1.4 CC1=NCCC(N)=N1 Amb27455523 [0,1,0,0,0,0|3,0,0]=4 737 B8R1.4 CC1C=CCC(C)C1 Amb28187053 [0,1,0,0,0,0|1,0,1]=3 738 B8R1.4 CC1CC(=O)C=CN1 Amb28423365 [0,1,0,0,0,0|1,0,0]=2 739 B8R1.4 CC1CC(=O)C=CO1 Amb25173826 [0,1,0,0,0,0|1,0,0]=2 740 B8R1.4 CC1CC(=O)CCN1 Amb1087926 [0,1,0,0,0,0|1,0,2]=4 741 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,1,0,0,0,0|1,0,2]=4 742 B8R1.4 CC1CC(=O)CCN1 Amb30585094 [0,1,0,0,0,0|1,0,2]=4 743 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,1,0,0,0,0|1,0,2]=4 744 B8R1.4 CC1CC(=O)CCS1 Amb27256424 [0,1,0,0,0,0|1,0,2]=4 745 B8R1.4 CC1CC(O)C=CO1 Amb27835046 [0,1,0,0,0,0|1,0,2]=4 746 B8R1.4 CC1CC=CC(=O)C1 Amb4034490 [0,1,0,0,0,0|0,0,0]=1 747 B8R1.4 CC1CC=CC(=O)N1 Amb27788159 [0,1,0,0,0,0|1,0,0]=2 748 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,1,0,0,0,0|1,0,0]=2 749 B8R1.4 CC1CC=CC(N)C1 Amb27468283 [0,1,0,0,0,0|1,0,1]=3 750 B8R1.4 CC1CC=CC(O)C1 Amb27406837 [0,1,0,0,0,0|0,0,2]=3 751 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,1,0,0,0,0|0,0,2]=3 752 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,1,0,0,0,0|1,0,1]=3 753 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,1,0,0,0,0|1,0,1]=3 754 B8R1.4 CC1CCNC(=O)C1 Amb20668125 [0,1,0,0,0,0|1,0,1]=3 755 B8R1.4 CC1CCNC(=O)N1 Amb27193730 [0,1,0,0,0,0|2,0,1]=4 756 B8R1.4 CC1CCOC(=O)N1 Amb27655650 [0,1,0,0,0,0|2,0,1]=4 757 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [0,1,0,0,0,0|2,0,1]=4 758 B8R1.4 CC1CNCC(=O)C1 Amb26048394 [0,1,0,0,0,0|1,0,1]=3 759 B8R1.4 CC1CNCC(=O)C1 Amb33494302 [0,1,0,0,0,0|1,0,1]=3 760 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,1,0,0,0,0|2,0,1]=4 761 B8R1.4 CC1CNCC(=O)N1 Amb32410668 [0,1,0,0,0,0|2,0,1]=4 762 B8R1.4 CC1CNNC(=O)C1 Amb27800916 [0,1,0,0,0,0|2,0,0]=3 763 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,1,0,0,0,0|2,0,1]=4 764 B8R1.4 CC1NCCC(=O)N1 Amb32418334 [0,1,0,0,0,0|2,0,1]=4 765 B8R1.4 CN1C=NCC(O)C1 Amb35737139 [0,1,0,0,0,0|3,0,0]=4 766 B8R1.4 CN1CC=CC(=O)C1 Amb27186211 [0,1,0,0,0,0|1,0,0]=2 767 B8R1.4 CN1CCC=C(Br)C1 Amb10975875 [0,1,0,0,0,0|2,0,1]=4 768 B8R1.4 CN1CCC=C(Br)C1 Amb13888761 [0,1,0,0,0,0|2,0,1]=4 769 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,1,0,0,0,0|1,0,1]=3 770 B8R1.4 CN1CCCC(=O)C1 Amb22304741 [0,1,0,0,0,0|1,0,1]=3 771 B8R1.4 CN1CCCC(=O)C1 Amb31204623 [0,1,0,0,0,0|1,0,1]=3 772 B8R1.4 CN1CCNC(=O)C1 Amb19958159 [0,1,0,0,0,0|2,0,1]=4 773 B8R1.4 CN1CCOC(=O)C1 Amb21963307 [0,1,0,0,0,0|2,0,1]=4 774 B8R1.4 CN1CCOC(=O)C1 Amb22491652 [0,1,0,0,0,0|2,0,1]=4 775 B8R1.4 C[C@@H]1CC(=O)C=CO1 Amb22748948 [0,1,0,0,0,0|1,0,0]=2 776 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,1,0,0,0,0|1,0,2]=4 777 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,1,0,0,0,0|1,0,2]=4 778 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb27593729 [0,1,0,0,0,0|1,0,2]=4 779 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,1,0,0,0,0|1,0,2]=4 780 B8R1.4 C[C@@H]1CC=CC(=O)C1 Amb27762503 [0,1,0,0,0,0|0,0,0]=1 781 B8R1.4 C[C@@H]1CC=C[C@@H](O)C1 Amb27782178 [0,1,0,0,0,0|0,0,2]=3 782 B8R1.4 C[C@@H]1CCCC(=O)C1 Amb21618704 [0,1,0,0,0,0|0,0,2]=3 783 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,1,0,0,0,0|1,0,1]=3 784 B8R1.4 C[C@@H]1CCCC(=O)O1 Amb4166295 [0,1,0,0,0,0|1,0,1]=3 785 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,1,0,0,0,0|2,0,1]=4 786 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,1,0,0,0,0|2,0,1]=4 787 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,1,0,0,0,0|2,0,1]=4 788 B8R1.4 C[C@H]1C=CCC(O)C1 Amb27778408 [0,1,0,0,0,0|1,0,1]=3 789 B8R1.4 C[C@H]1CC(=O)C=CO1 Amb24483279 [0,1,0,0,0,0|1,0,0]=2 790 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,1,0,0,0,0|1,0,2]=4 791 B8R1.4 C[C@H]1CC(=O)CCN1 Amb28072876 [0,1,0,0,0,0|1,0,2]=4 792 B8R1.4 C[C@H]1CC(=O)CCN1 Amb33801725 [0,1,0,0,0,0|1,0,2]=4 793 B8R1.4 C[C@H]1CC(=O)CCO1 Amb27969730 [0,1,0,0,0,0|1,0,2]=4 794 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,1,0,0,0,0|1,0,0]=2 795 B8R1.4 C[C@H]1CC=C[C@@H](O)O1 Amb28435676 [0,1,0,0,0,0|1,0,2]=4 796 B8R1.4 C[C@H]1CC=C[C@H](O)C1 Amb27641891 [0,1,0,0,0,0|0,0,2]=3 797 B8R1.4 C[C@H]1CC=C[C@H](O)O1 Amb28455646 [0,1,0,0,0,0|1,0,2]=4 798 B8R1.4 C[C@H]1CCCC(=O)C1 Amb22799724 [0,1,0,0,0,0|0,0,2]=3 799 B8R1.4 C[C@H]1CCCC(=O)O1 Amb26865751 [0,1,0,0,0,0|1,0,1]=3 800 B8R1.4 C[C@H]1CCNC(=O)C1 Amb25739591 [0,1,0,0,0,0|1,0,1]=3 801 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,1,0,0,0,0|2,0,1]=4 802 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,1,0,0,0,0|2,0,1]=4 803 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,1,0,0,0,0|2,0,1]=4 804 B8R1.4 N=C1CCSC(=O)N1 Amb28434696 [0,1,0,0,0,0|2,0,0]=3 805 B8R1.4 N=C1NC(=O)CCS1 Amb24666714 [0,1,0,0,0,0|2,0,0]=3 806 B8R1.4 N=C1NNCC(=O)N1 Amb27227984 [0,1,0,0,0,0|3,0,0]=4 807 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,1,0,0,0,0|0,0,0]=1 808 B8R1.4 NC1=CC(=O)COC1 Amb25785409 [0,1,0,0,0,0|1,0,0]=2 809 B8R1.4 NC1=CC(=O)CSC1 Amb28066865 [0,1,0,0,0,0|1,0,0]=2 810 B8R1.4 NC1=CC(=O)N=CN1 Amb22489480 [0,1,0,0,0,0|2,0,1]=4 811 B8R1.4 NC1=CC(=O)NC=C1 Amb18641608 [0,1,0,0,0,0|1,0,2]=4 812 B8R1.4 NC1=CC(=O)NC=C1 Amb33716235 [0,1,0,0,0,0|1,0,2]=4 813 B8R1.4 NC1=CC(=O)NCC1 Amb22229455 [0,1,0,0,0,0|1,0,0]=2 814 B8R1.4 NC1=CC(=O)NN=C1 Amb18641633 [0,1,0,0,0,0|2,0,1]=4 815 B8R1.4 NC1=CC(=S)CCC1 Amb27839581 [0,1,0,0,0,0|0,1,0]=2 816 B8R1.4 NC1=CC(O)CCC1 Amb28127332 [0,1,0,0,0,0|0,0,2]=3 817 B8R1.4 NC1=CC=CC(=O)N1 Amb18641610 [0,1,0,0,0,0|1,0,2]=4 818 B8R1.4 NC1=CC=NC(O)N1 Amb28239207 [0,1,0,0,0,0|3,0,0]=4 819 B8R1.4 NC1=CCNC(=O)N1 Amb25799600 [0,1,0,0,0,0|2,0,1]=4 820 B8R1.4 NC1=NC(=O)C=CN1 Amb21951843 [0,1,0,0,0,0|2,0,1]=4 821 B8R1.4 NC1=NC=CC(=O)N1 Amb18278001 [0,1,0,0,0,0|2,0,1]=4 822 B8R1.4 NC1=NOCC(=O)N1 Amb27786326 [0,1,0,0,0,0|3,0,0]=4 823 B8R1.4 NC1C=CNC(=O)N1 Amb28397982 [0,1,0,0,0,0|2,0,1]=4 824 B8R1.4 NC1CCCC(=O)C1 Amb23440459 [0,1,0,0,0,0|0,0,2]=3 825 B8R1.4 NC1CCCC(=O)C1 Amb8387391 [0,1,0,0,0,0|0,0,2]=3 826 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,1,0,0,0,0|1,0,1]=3 827 B8R1.4 NC1CCNC(=O)C1 Amb19957631 [0,1,0,0,0,0|1,0,1]=3 828 B8R1.4 NC1CCNC(=O)C1 Amb21960626 [0,1,0,0,0,0|1,0,1]=3 829 B8R1.4 NC1COCC(=O)C1 Amb33623050 [0,1,0,0,0,0|1,0,1]=3 830 B8R1.4 NC1COCC(=O)C1 Amb33716160 [0,1,0,0,0,0|1,0,1]=3 831 B8R1.4 N[C@@H]1CCCS(=O)C1 Amb25168909 [0,1,0,0,0,0|1,0,2]=4 832 B8R1.4 N[C@@H]1CCNC(=O)C1 Amb27489147 [0,1,0,0,0,0|1,0,1]=3 833 B8R1.4 N[C@H]1CCCS(=O)C1 Amb27838286 [0,1,0,0,0,0|1,0,2]=4 834 B8R1.4 N[C@H]1CCNC(=O)C1 Amb25168718 [0,1,0,0,0,0|1,0,1]=3 835 B8R1.4 O=C1C=C(Br)C=CN1 Amb22292027 [0,1,0,0,0,0|1,0,2]=4 836 B8R1.4 O=C1C=C(Br)C=NN1 Amb24481408 [0,1,0,0,0,0|2,0,1]=4 837 B8R1.4 O=C1C=C(Br)CCC1 Amb33542768 [0,1,0,0,0,0|0,0,0]=1 838 B8R1.4 O=C1C=C(Br)CCN1 Amb23402186 [0,1,0,0,0,0|1,0,0]=2 839 B8R1.4 O=C1C=C(Br)N=CC1 Amb23401280 [0,1,0,0,0,0|1,0,1]=3 840 B8R1.4 O=C1C=C(Cl)C=CN1 Amb18625105 [0,1,0,0,0,0|1,0,2]=4 841 B8R1.4 O=C1C=C(Cl)C=CO1 Amb22001907 [0,1,0,0,0,0|1,0,2]=4 842 B8R1.4 O=C1C=C(Cl)C=NN1 Amb19664791 [0,1,0,0,0,0|2,0,1]=4 843 B8R1.4 O=C1C=C(Cl)CCC1 Amb2697044 [0,1,0,0,0,0|0,0,0]=1 844 B8R1.4 O=C1C=C(Cl)N=CC1 Amb22500053 [0,1,0,0,0,0|1,0,1]=3 845 B8R1.4 O=C1C=C(Cl)NC=N1 Amb20620851 [0,1,0,0,0,0|2,0,1]=4 846 B8R1.4 O=C1C=C(F)C=CN1 Amb22008561 [0,1,0,0,0,0|1,0,2]=4 847 B8R1.4 O=C1C=C(F)C=NN1 Amb25089266 [0,1,0,0,0,0|2,0,1]=4 848 B8R1.4 O=C1C=C(I)C=CN1 Amb19664790 [0,1,0,0,0,0|1,0,2]=4 849 B8R1.4 O=C1C=C(I)C=NN1 Amb19958225 [0,1,0,0,0,0|2,0,1]=4 850 B8R1.4 O=C1C=C(I)CCC1 Amb25706767 [0,1,0,0,0,0|0,0,0]=1 851 B8R1.4 O=C1C=C(I)N=CN1 Amb26362491 [0,1,0,0,0,0|2,0,1]=4 852 B8R1.4 O=C1C=C(O)C=CN1 Amb19958639 [0,1,0,0,0,0|1,0,2]=4 853 B8R1.4 O=C1C=C(O)CCC1 Amb17844413 [0,1,0,0,0,0|0,0,0]=1 854 B8R1.4 O=C1C=C(O)COC1 Amb28048998 [0,1,0,0,0,0|1,0,0]=2 855 B8R1.4 O=C1C=C(O)N=CN1 Amb19131914 [0,1,0,0,0,0|2,0,1]=4 856 B8R1.4 O=C1C=C(S)NC=N1 Amb20620608 [0,1,0,0,0,0|2,0,1]=4 857 B8R1.4 O=C1C=C=CC(=O)C1 Amb27486115 [0,1,0,0,0,0|0,0,3]=4 858 B8R1.4 O=C1C=CC=C(Br)N1 Amb18040563 [0,1,0,0,0,0|1,0,2]=4 859 B8R1.4 O=C1C=CC=C(Cl)N1 Amb20623033 [0,1,0,0,0,0|1,0,2]=4 860 B8R1.4 O=C1C=CC=C(Cl)O1 Amb22337145 [0,1,0,0,0,0|1,0,2]=4 861 B8R1.4 O=C1C=CC=C(I)N1 Amb24651389 [0,1,0,0,0,0|1,0,2]=4 862 B8R1.4 O=C1C=CC=C(O)N1 Amb22347822 [0,1,0,0,0,0|1,0,2]=4 863 B8R1.4 O=C1C=CC=[N+]([O-])N1 Amb27985357 [0,1,0,0,0,0|2,0,1]=4 864 B8R1.4 O=C1C=CCC(=O)O1 Amb453190 [0,1,0,0,0,0|1,0,1]=3 865 B8R1.4 O=C1C=CCC(O)C1 Amb27227199 [0,1,0,0,0,0|0,0,0]=1 866 B8R1.4 O=C1C=CNC(=O)N1 Amb18028577 [0,1,0,0,0,0|2,0,1]=4 867 B8R1.4 O=C1C=CNC(=O)O1 Amb21937546 [0,1,0,0,0,0|2,0,1]=4 868 B8R1.4 O=C1C=CNC(=S)C1 Amb27207898 [0,1,0,0,0,0|1,0,1]=3 869 B8R1.4 O=C1C=CNC(=S)N1 Amb18028423 [0,1,0,0,0,0|2,0,1]=4 870 B8R1.4 O=C1C=CNC(Cl)=C1 Amb22489481 [0,1,0,0,0,0|1,0,2]=4 871 B8R1.4 O=C1C=COC(=O)C1 Amb25358147 [0,1,0,0,0,0|1,0,1]=3 872 B8R1.4 O=C1C=COC(O)=C1 Amb28456629 [0,1,0,0,0,0|1,0,2]=4 873 B8R1.4 O=C1C=[N+]([O-])CCC1 Amb27751417 [0,1,0,0,0,0|1,0,0]=2 874 B8R1.4 O=C1CC(=O)NC=N1 Amb2542511 [0,1,0,0,0,0|2,0,1]=4 875 B8R1.4 O=C1CC(=O)NCN1 Amb27949946 [0,1,0,0,0,0|2,0,1]=4 876 B8R1.4 O=C1CC(F)CCN1 Amb27459538 [0,1,0,0,0,0|1,0,1]=3 877 B8R1.4 O=C1CC(O)=NC=N1 Amb19748545 [0,1,0,0,0,0|2,0,1]=4 878 B8R1.4 O=C1CC(O)CCN1 Amb10602744 [0,1,0,0,0,0|1,0,1]=3 879 B8R1.4 O=C1CC(S)NCN1 Amb28245543 [0,1,0,0,0,0|2,0,1]=4 880 B8R1.4 O=C1CC=CC(Cl)=N1 Amb2609501 [0,1,0,0,0,0|1,0,2]=4 881 B8R1.4 O=C1CCCC(=O)C1 Amb932798 [0,1,0,0,0,0|0,0,1]=2 882 B8R1.4 O=C1CCCC(=O)N1 Amb8386485 [0,1,0,0,0,0|1,0,0]=2 883 B8R1.4 O=C1CCCC(=O)O1 Amb6608952 [0,1,0,0,0,0|1,0,0]=2 884 B8R1.4 O=C1CCCC(=O)S1 Amb27849467 [0,1,0,0,0,0|1,0,0]=2 885 B8R1.4 O=C1CCCC(Br)C1 Amb27850962 [0,1,0,0,0,0|0,0,2]=3 886 B8R1.4 O=C1CCCC(Cl)C1 Amb26946112 [0,1,0,0,0,0|0,0,2]=3 887 B8R1.4 O=C1CCCC(Cl)N1 Amb28423467 [0,1,0,0,0,0|1,0,1]=3 888 B8R1.4 O=C1CCCC(F)C1 Amb24578309 [0,1,0,0,0,0|0,0,2]=3 889 B8R1.4 O=C1CCCC(I)C1 Amb24436778 [0,1,0,0,0,0|0,0,2]=3 890 B8R1.4 O=C1CCCC(O)C1 Amb22754759 [0,1,0,0,0,0|0,0,2]=3 891 B8R1.4 O=C1CCCC(O)N1 Amb26394230 [0,1,0,0,0,0|1,0,1]=3 892 B8R1.4 O=C1CCC[C@@H](O)C1 Amb25320136 [0,1,0,0,0,0|0,0,2]=3 893 B8R1.4 O=C1CCC[C@H](O)C1 Amb27432456 [0,1,0,0,0,0|0,0,2]=3 894 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,1,0,0,0,0|1,0,1]=3 895 B8R1.4 O=C1CCNC(=O)N1 Amb1042477 [0,1,0,0,0,0|2,0,0]=3 896 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,1,0,0,0,0|2,0,0]=3 897 B8R1.4 O=C1CCNC(=O)S1 Amb27786235 [0,1,0,0,0,0|2,0,0]=3 898 B8R1.4 O=C1CCOC(=O)C1 Amb26459895 [0,1,0,0,0,0|1,0,1]=3 899 B8R1.4 O=C1CCSC(=O)N1 Amb1150323 [0,1,0,0,0,0|2,0,0]=3 900 B8R1.4 O=C1CNCC(=O)C1 Amb26464137 [0,1,0,0,0,0|1,0,1]=3 901 B8R1.4 O=C1CNCC(=O)N1 Amb18641768 [0,1,0,0,0,0|2,0,0]=3 902 B8R1.4 O=C1CNCC(=O)N1 Amb19148314 [0,1,0,0,0,0|2,0,0]=3 903 B8R1.4 O=C1CNCC(=O)S1 Amb27390859 [0,1,0,0,0,0|2,0,0]=3 904 B8R1.4 O=C1CNNC(=S)N1 Amb27468600 [0,1,0,0,0,0|3,0,0]=4 905 B8R1.4 O=C1COCC(=O)C1 Amb8392404 [0,1,0,0,0,0|1,0,1]=3 906 B8R1.4 O=C1COCC(=O)N1 Amb10808497 [0,1,0,0,0,0|2,0,0]=3 907 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,1,0,0,0,0|2,0,0]=3 908 B8R1.4 O=C1CS(=O)CCN1 Amb27184590 [0,1,0,0,0,0|2,0,1]=4 909 B8R1.4 O=C1CSCC(=O)C1 Amb2499999 [0,1,0,0,0,0|1,0,1]=3 910 B8R1.4 O=C1CSCC(=O)N1 Amb7173003 [0,1,0,0,0,0|2,0,0]=3 911 B8R1.4 O=C1CSCC(=O)O1 Amb2725405 [0,1,0,0,0,0|2,0,0]=3 912 B8R1.4 O=C1C[C@@H](O)CCN1 Amb22744924 [0,1,0,0,0,0|1,0,1]=3 913 B8R1.4 O=C1C[C@H](O)CCN1 Amb17845212 [0,1,0,0,0,0|1,0,1]=3 914 B8R1.4 O=C1N=CCC(=S)N1 Amb22015328 [0,1,0,0,0,0|2,0,1]=4 915 B8R1.4 O=C1NC(=S)CCS1 Amb2470197 [0,1,0,0,0,0|2,0,0]=3 916 B8R1.4 O=C1NC(S)=CCS1 Amb27816433 [0,1,0,0,0,0|2,0,1]=4 917 B8R1.4 O=C1NCNC(=O)N1 Amb4010672 [0,1,0,0,0,0|3,0,0]=4 918 B8R1.4 O=S1CCCC(Br)C1 Amb26370333 [0,1,0,0,0,0|1,0,2]=4 919 B8R1.4 O=S1CCCC(Cl)C1 Amb27876412 [0,1,0,0,0,0|1,0,2]=4 920 B8R1.4 O=S1CCCC(O)C1 Amb26354128 [0,1,0,0,0,0|1,0,2]=4 921 B8R1.4 O=S1CCCS(=O)C1 Amb22363746 [0,1,0,0,0,0|2,0,1]=4 922 B8R1.4 O=S1CCC[C@H](O)C1 Amb28206445 [0,1,0,0,0,0|1,0,2]=4 923 B8R1.4 OC1C=C(Cl)CCC1 Amb28138656 [0,1,0,0,0,0|0,0,2]=3 924 B8R1.4 O[C@@H]1CN=C[C@H](O)C1 Amb27641459 [0,1,0,0,0,0|1,0,2]=4 925 B8R1.4 O[C@H]1C=C(Br)CCC1 Amb27980419 [0,1,0,0,0,0|0,0,2]=3 926 B8R1.4 S=C1CCSC(=S)N1 Amb1054209 [0,1,0,0,0,0|2,1,0]=4 927 B8R1.4 [O-][NH+]1C=CC=C(F)C1 Amb28315880 [0,1,0,0,0,0|2,0,1]=4 928 B8R1.5 BrC1=CCCCC1Br Amb25255682 [0,1,0,0,0,0|1,0,1]=3 929 B8R1.5 C=C1CC=CCC1O Amb28139511 [0,1,0,0,0,0|1,0,2]=4 930 B8R1.5 C=C1CCCCC1=C Amb8392110 [0,1,0,0,0,0|1,0,1]=3 931 B8R1.5 C=C1CCCCC1=O Amb18561347 [0,1,0,0,0,0|0,0,1]=2 932 B8R1.5 C=C1CCCCC1C Amb25203919 [0,1,0,0,0,0|1,0,2]=4 933 B8R1.5 C=C1CCCCC1Cl Amb27858823 [0,1,0,0,0,0|1,0,2]=4 934 B8R1.5 C=C1CCCCC1O Amb28316215 [0,1,0,0,0,0|0,0,3]=4 935 B8R1.5 C=C1CCCC[C@@H]1N Amb27252272 [0,1,0,0,0,0|1,0,2]=4 936 B8R1.5 C=C1COCCC1=O Amb18063600 [0,1,0,0,0,0|1,0,1]=3 937 B8R1.5 C=C1CSC=CC1=O Amb27598782 [0,1,0,0,0,0|1,0,1]=3 938 B8R1.5 C=C1NCCCC1F Amb28384341 [0,1,0,0,0,0|2,0,1]=4 939 B8R1.5 CC1=C(Br)CNCC1 Amb25046045 [0,1,0,0,0,0|2,0,1]=4 940 B8R1.5 CC1=C(Br)CNCC1 Amb33473572 [0,1,0,0,0,0|2,0,1]=4 941 B8R1.5 CC1=C(C)CCCC1 Amb4019565 [0,1,0,0,0,0|1,0,1]=3 942 B8R1.5 CC1=C(C)CNCC1 Amb18641667 [0,1,0,0,0,0|2,0,1]=4 943 B8R1.5 CC1=C(C)CNCC1 Amb28934860 [0,1,0,0,0,0|2,0,1]=4 944 B8R1.5 CC1=C(C)NCCC1 Amb27489342 [0,1,0,0,0,0|2,0,0]=3 945 B8R1.5 CC1=CC=CNC1=O Amb18028406 [0,1,0,0,0,0|1,0,2]=4 946 B8R1.5 CC1=CC=CNC1N Amb27633696 [0,1,0,0,0,0|2,0,1]=4 947 B8R1.5 CC1=CC=COC1N Amb27981010 [0,1,0,0,0,0|2,0,1]=4 948 B8R1.5 CC1=CC=NNC1=O Amb21960917 [0,1,0,0,0,0|2,0,1]=4 949 B8R1.5 CC1=CCCCC1=O Amb15693479 [0,1,0,0,0,0|0,0,0]=1 950 B8R1.5 CC1=CCCCC1Br Amb27856502 [0,1,0,0,0,0|1,0,1]=3 951 B8R1.5 CC1=CCCCC1C Amb22489910 [0,1,0,0,0,0|1,0,1]=3 952 B8R1.5 CC1=CCCCC1Cl Amb28207840 [0,1,0,0,0,0|1,0,1]=3 953 B8R1.5 CC1=CCCCC1O Amb22365276 [0,1,0,0,0,0|0,0,2]=3 954 B8R1.5 CC1=CCOCC1O Amb28411303 [0,1,0,0,0,0|1,0,2]=4 955 B8R1.5 CC1=CN=CNC1=O Amb21937121 [0,1,0,0,0,0|2,0,1]=4 956 B8R1.5 CC1=CNC=CC1=O Amb33714756 [0,1,0,0,0,0|1,0,2]=4 957 B8R1.5 CC1=COCCC1=O Amb28048981 [0,1,0,0,0,0|1,0,0]=2 958 B8R1.5 CC1=NCCCC1=O Amb27803670 [0,1,0,0,0,0|1,0,0]=2 959 B8R1.5 CC1=NCCCN1C Amb1035887 [0,1,0,0,0,0|3,0,0]=4 960 B8R1.5 CC1=NCCN=C1C Amb24183284 [0,1,0,0,0,0|3,0,0]=4 961 B8R1.5 CC1=NCCN=C1O Amb25178610 [0,1,0,0,0,0|2,0,1]=4 962 B8R1.5 CC1=NCCOC1=O Amb27623377 [0,1,0,0,0,0|2,0,0]=3 963 B8R1.5 CC1C=CCCC1Cl Amb27816488 [0,1,0,0,0,0|1,0,1]=3 964 B8R1.5 CC1C=CCCC1N Amb27623320 [0,1,0,0,0,0|1,0,1]=3 965 B8R1.5 CC1C=NC=CC1=S Amb34915431 [0,1,0,0,0,0|1,1,1]=4 966 B8R1.5 CC1CC=CCC1=O Amb17593140 [0,1,0,0,0,0|0,0,2]=3 967 B8R1.5 CC1CC=NNC1=O Amb22752103 [0,1,0,0,0,0|2,0,1]=4 968 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,1,0,0,0,0|0,0,0]=1 969 B8R1.5 CC1CCC=CC1N Amb18641660 [0,1,0,0,0,0|1,0,1]=3 970 B8R1.5 CC1CCCCC1=O Amb6608749 [0,1,0,0,0,0|0,0,2]=3 971 B8R1.5 CC1CCCN=C1N Amb26551145 [0,1,0,0,0,0|2,0,1]=4 972 B8R1.5 CC1CCCNC1=O Amb2778949 [0,1,0,0,0,0|1,0,1]=3 973 B8R1.5 CC1CCCOC1=O Amb26933974 [0,1,0,0,0,0|1,0,1]=3 974 B8R1.5 CC1CCNCC1=O Amb28990014 [0,1,0,0,0,0|1,0,1]=3 975 B8R1.5 CC1CCNCC1=O Amb8388554 [0,1,0,0,0,0|1,0,1]=3 976 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,0,0,0|1,0,1]=3 977 B8R1.5 CC1CNCCC1=O Amb19888361 [0,1,0,0,0,0|1,0,2]=4 978 B8R1.5 CC1CNCCC1=O Amb8393082 [0,1,0,0,0,0|1,0,2]=4 979 B8R1.5 CC1COC=CC1=O Amb28124249 [0,1,0,0,0,0|1,0,0]=2 980 B8R1.5 CC1COCCC1=O Amb21856147 [0,1,0,0,0,0|1,0,2]=4 981 B8R1.5 CC1CSCCC1=O Amb26404796 [0,1,0,0,0,0|1,0,2]=4 982 B8R1.5 CC1NCCCC1=O Amb26633057 [0,1,0,0,0,0|1,0,1]=3 983 B8R1.5 CC1NCCCC1=O Amb32695440 [0,1,0,0,0,0|1,0,1]=3 984 B8R1.5 CC1NCCNC1=O Amb5846691 [0,1,0,0,0,0|2,0,1]=4 985 B8R1.5 CC1NCCNC1=O Amb9778910 [0,1,0,0,0,0|2,0,1]=4 986 B8R1.5 CC1NCCSC1=O Amb27489291 [0,1,0,0,0,0|2,0,1]=4 987 B8R1.5 CC1OCC=CC1=O Amb28316168 [0,1,0,0,0,0|1,0,0]=2 988 B8R1.5 CC1OCC=CC1O Amb27978022 [0,1,0,0,0,0|1,0,2]=4 989 B8R1.5 CC1OCCCC1=O Amb28048940 [0,1,0,0,0,0|1,0,1]=3 990 B8R1.5 CC1OCCNC1=O Amb19517095 [0,1,0,0,0,0|2,0,1]=4 991 B8R1.5 CC1SCCCC1=O Amb25989585 [0,1,0,0,0,0|1,0,1]=3 992 B8R1.5 CC1SCCNC1=O Amb4009235 [0,1,0,0,0,0|2,0,1]=4 993 B8R1.5 CN1C=CC=CC1=O Amb19664826 [0,1,0,0,0,0|1,0,2]=4 994 B8R1.5 CN1CCC=CC1=O Amb22500738 [0,1,0,0,0,0|1,0,0]=2 995 B8R1.5 CN1CCCN=C1N Amb27838391 [0,1,0,0,0,0|3,0,0]=4 996 B8R1.5 CN1CCCNC1=O Amb10608416 [0,1,0,0,0,0|2,0,1]=4 997 B8R1.5 CN1CCCNC1=O Amb32665804 [0,1,0,0,0,0|2,0,1]=4 998 B8R1.5 CN1CCCNC1=S Amb4012380 [0,1,0,0,0,0|3,0,0]=4 999 B8R1.5 CN1CCC[NH+]=C1N Amb4006104 [0,1,0,0,0,0|3,0,0]=4 1000 B8R1.5 CN1CCNCC1=O Amb1834069 [0,1,0,0,0,0|2,0,1]=4 1001 B8R1.5 CN1CCNCC1=O Amb6540859 [0,1,0,0,0,0|2,0,1]=4 1002 B8R1.5 CN1CCOCC1=O Amb22301593 [0,1,0,0,0,0|2,0,1]=4 1003 B8R1.5 CN1CNCCC1=O Amb27409650 [0,1,0,0,0,0|2,0,1]=4 1004 B8R1.5 CN1N=CC=CC1=O Amb28122931 [0,1,0,0,0,0|2,0,1]=4 1005 B8R1.5 CN1NCCCC1=O Amb18559232 [0,1,0,0,0,0|2,0,0]=3 1006 B8R1.5 C[C@@H]1C=CCC[C@@H]1Cl Amb27235850 [0,1,0,0,0,0|1,0,1]=3 1007 B8R1.5 C[C@@H]1C=CCC[C@@H]1O Amb27208180 [0,1,0,0,0,0|1,0,1]=3 1008 B8R1.5 C[C@@H]1C=CCC[C@H]1O Amb27442958 [0,1,0,0,0,0|1,0,1]=3 1009 B8R1.5 C[C@@H]1CCC=CC1=O Amb28316223 [0,1,0,0,0,0|0,0,0]=1 1010 B8R1.5 C[C@@H]1CCC=CC1O Amb28435732 [0,1,0,0,0,0|0,0,2]=3 1011 B8R1.5 C[C@@H]1CCC=C[C@@H]1Cl Amb28134614 [0,1,0,0,0,0|1,0,1]=3 1012 B8R1.5 C[C@@H]1CCC=C[C@@H]1O Amb27652339 [0,1,0,0,0,0|0,0,2]=3 1013 B8R1.5 C[C@@H]1CCC=C[C@H]1N Amb27487557 [0,1,0,0,0,0|1,0,1]=3 1014 B8R1.5 C[C@@H]1CCC=C[C@H]1O Amb28053681 [0,1,0,0,0,0|0,0,2]=3 1015 B8R1.5 C[C@@H]1NCCNC1=O Amb18203363 [0,1,0,0,0,0|2,0,1]=4 1016 B8R1.5 C[C@@H]1OCCCC1=O Amb28202118 [0,1,0,0,0,0|1,0,1]=3 1017 B8R1.5 C[C@@H]1SCCNC1=O Amb34915743 [0,1,0,0,0,0|2,0,1]=4 1018 B8R1.5 C[C@H]1CCC=CC1=O Amb28316171 [0,1,0,0,0,0|0,0,0]=1 1019 B8R1.5 C[C@H]1CCC=C[C@@H]1O Amb27443159 [0,1,0,0,0,0|0,0,2]=3 1020 B8R1.5 C[C@H]1CCCNC1=O Amb27648584 [0,1,0,0,0,0|1,0,1]=3 1021 B8R1.5 C[C@H]1NCCNC1=O Amb22336965 [0,1,0,0,0,0|2,0,1]=4 1022 B8R1.5 C[C@H]1SCCNC1=O Amb27810802 [0,1,0,0,0,0|2,0,1]=4 1023 B8R1.5 ClC1=C(Cl)CNCC1 Amb24467867 [0,1,0,0,0,0|2,0,1]=4 1024 B8R1.5 ClC1=C(Cl)CNCC1 Amb33291346 [0,1,0,0,0,0|2,0,1]=4 1025 B8R1.5 ClC1=C(Cl)COC=C1 Amb27830823 [0,1,0,0,0,0|2,0,1]=4 1026 B8R1.5 ClC1C=CCCC1Cl Amb24707559 [0,1,0,0,0,0|1,0,1]=3 1027 B8R1.5 Cn1ccccc1=O Amb2609945 [0,1,0,0,0,0|1,0,2]=4 1028 B8R1.5 Cn1cnccc1=O Amb2609512 [0,1,0,0,0,0|2,0,1]=4 1029 B8R1.5 FC1=CCCCC1Br Amb28325638 [0,1,0,0,0,0|1,0,1]=3 1030 B8R1.5 NC1=C(N)NCCN1 Amb27221355 [0,1,0,0,0,0|3,0,0]=4 1031 B8R1.5 NC1=C(N)NCNC1 Amb33512905 [0,1,0,0,0,0|3,0,0]=4 1032 B8R1.5 NC1=CC=CNC1=O Amb18641609 [0,1,0,0,0,0|1,0,2]=4 1033 B8R1.5 NC1=CC=NNC1=O Amb18641632 [0,1,0,0,0,0|2,0,1]=4 1034 B8R1.5 NC1=CN=CNC1=O Amb33544216 [0,1,0,0,0,0|2,0,1]=4 1035 B8R1.5 NC1=CNC=CC1=O Amb22489482 [0,1,0,0,0,0|1,0,2]=4 1036 B8R1.5 NC1=NCCCC1=O Amb28399329 [0,1,0,0,0,0|1,0,0]=2 1037 B8R1.5 NC1=NCCCC1Cl Amb27391114 [0,1,0,0,0,0|2,0,1]=4 1038 B8R1.5 NC1=NCCCC1O Amb27985373 [0,1,0,0,0,0|1,0,2]=4 1039 B8R1.5 NC1=NN=CCC1=O Amb27468610 [0,1,0,0,0,0|2,0,1]=4 1040 B8R1.5 NC1C=CCCC1N Amb26045190 [0,1,0,0,0,0|1,0,1]=3 1041 B8R1.5 NC1C=NC=NC1=O Amb22015333 [0,1,0,0,0,0|2,0,1]=4 1042 B8R1.5 NC1C=NN=CC1=O Amb27630032 [0,1,0,0,0,0|2,0,1]=4 1043 B8R1.5 NC1CCCC=C1Br Amb27974263 [0,1,0,0,0,0|1,0,1]=3 1044 B8R1.5 NC1CCCC=C1Br Amb33338965 [0,1,0,0,0,0|1,0,1]=3 1045 B8R1.5 NC1CCCC=C1Cl Amb18124341 [0,1,0,0,0,0|1,0,1]=3 1046 B8R1.5 NC1CCCCC1=O Amb17939051 [0,1,0,0,0,0|0,0,2]=3 1047 B8R1.5 NC1CCCCC1=O Amb22001819 [0,1,0,0,0,0|0,0,2]=3 1048 B8R1.5 NC1CCCNC1=O Amb1088746 [0,1,0,0,0,0|1,0,1]=3 1049 B8R1.5 NC1CCCNC1=O Amb8428208 [0,1,0,0,0,0|1,0,1]=3 1050 B8R1.5 NC1CCONC1=O Amb22295935 [0,1,0,0,0,0|2,0,0]=3 1051 B8R1.5 NC1CNCCC1=O Amb27635311 [0,1,0,0,0,0|1,0,2]=4 1052 B8R1.5 NC1COCCC1=O Amb18833021 [0,1,0,0,0,0|1,0,2]=4 1053 B8R1.5 NC1COCCC1=O Amb32670691 [0,1,0,0,0,0|1,0,2]=4 1054 B8R1.5 NC1CSCCC1=O Amb4296938 [0,1,0,0,0,0|1,0,2]=4 1055 B8R1.5 NC1N=CC=NC1=O Amb32411851 [0,1,0,0,0,0|2,0,1]=4 1056 B8R1.5 NN1C=CC=CC1=O Amb18641421 [0,1,0,0,0,0|1,0,2]=4 1057 B8R1.5 NN1CCCCC1=O Amb13952152 [0,1,0,0,0,0|1,0,1]=3 1058 B8R1.5 NN1CCCCC1=O Amb22275946 [0,1,0,0,0,0|1,0,1]=3 1059 B8R1.5 NN1CCCNC1=O Amb25343173 [0,1,0,0,0,0|2,0,1]=4 1060 B8R1.5 NN1CCCOC1=O Amb17608306 [0,1,0,0,0,0|2,0,1]=4 1061 B8R1.5 NN1CCOCC1=O Amb27238452 [0,1,0,0,0,0|2,0,1]=4 1062 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,1,0,0,0,0|1,0,1]=3 1063 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,1,0,0,0,0|1,0,1]=3 1064 B8R1.5 N[C@H]1CCCNC1=O Amb10603272 [0,1,0,0,0,0|1,0,1]=3 1065 B8R1.5 N[C@H]1CCCNC1=O Amb8631316 [0,1,0,0,0,0|1,0,1]=3 1066 B8R1.5 O=C1C=CC=CC1=O Amb17593118 [0,1,0,0,0,0|0,0,3]=4 1067 B8R1.5 O=C1C=CC=CN1O Amb20622284 [0,1,0,0,0,0|1,0,2]=4 1068 B8R1.5 O=C1C=CC=NC1=O Amb27802733 [0,1,0,0,0,0|1,0,2]=4 1069 B8R1.5 O=C1C=CCC=C1Cl Amb27181091 [0,1,0,0,0,0|0,0,2]=3 1070 B8R1.5 O=C1C=CCCC1=O Amb28049024 [0,1,0,0,0,0|0,0,1]=2 1071 B8R1.5 O=C1C=CCCC1Br Amb27477843 [0,1,0,0,0,0|0,0,0]=1 1072 B8R1.5 O=C1C=CCCC1O Amb27165534 [0,1,0,0,0,0|0,0,0]=1 1073 B8R1.5 O=C1C=CNC=C1I Amb22465984 [0,1,0,0,0,0|1,0,2]=4 1074 B8R1.5 O=C1C=COC=C1Br Amb28324212 [0,1,0,0,0,0|1,0,2]=4 1075 B8R1.5 O=C1C=COC=C1O Amb19133754 [0,1,0,0,0,0|1,0,2]=4 1076 B8R1.5 O=C1CC=CCC1Cl Amb27471139 [0,1,0,0,0,0|0,0,2]=3 1077 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,1,0,0,0,0|0,0,0]=1 1078 B8R1.5 O=C1CCCC=C1F Amb28253992 [0,1,0,0,0,0|0,0,0]=1 1079 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,1,0,0,0,0|0,0,0]=1 1080 B8R1.5 O=C1CCCC=C1O Amb2699837 [0,1,0,0,0,0|0,0,0]=1 1081 B8R1.5 O=C1CCCCC1=O Amb1154131 [0,1,0,0,0,0|0,0,1]=2 1082 B8R1.5 O=C1CCCCC1Br Amb8394127 [0,1,0,0,0,0|0,0,2]=3 1083 B8R1.5 O=C1CCCCC1Cl Amb1154371 [0,1,0,0,0,0|0,0,2]=3 1084 B8R1.5 O=C1CCCCC1F Amb10605769 [0,1,0,0,0,0|0,0,2]=3 1085 B8R1.5 O=C1CCCCC1I Amb28239314 [0,1,0,0,0,0|0,0,2]=3 1086 B8R1.5 O=C1CCCCC1O Amb8390042 [0,1,0,0,0,0|0,0,2]=3 1087 B8R1.5 O=C1CCCCC1S Amb25839265 [0,1,0,0,0,0|0,0,2]=3 1088 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,1,0,0,0,0|0,0,2]=3 1089 B8R1.5 O=C1CCCC[C@@H]1O Amb28316212 [0,1,0,0,0,0|0,0,2]=3 1090 B8R1.5 O=C1CCCC[C@H]1Cl Amb28119800 [0,1,0,0,0,0|0,0,2]=3 1091 B8R1.5 O=C1CCCNC1=O Amb2445649 [0,1,0,0,0,0|1,0,0]=2 1092 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,1,0,0,0,0|1,0,0]=2 1093 B8R1.5 O=C1CCCSC1Cl Amb26534671 [0,1,0,0,0,0|1,0,1]=3 1094 B8R1.5 O=C1CCNCC1Br Amb21520330 [0,1,0,0,0,0|1,0,2]=4 1095 B8R1.5 O=C1CCNCC1F Amb13885958 [0,1,0,0,0,0|1,0,2]=4 1096 B8R1.5 O=C1CCNCC1F Amb22002662 [0,1,0,0,0,0|1,0,2]=4 1097 B8R1.5 O=C1CCNCC1O Amb24075970 [0,1,0,0,0,0|1,0,2]=4 1098 B8R1.5 O=C1CCNCC1O Amb27230548 [0,1,0,0,0,0|1,0,2]=4 1099 B8R1.5 O=C1CCNCN1O Amb24120639 [0,1,0,0,0,0|2,0,1]=4 1100 B8R1.5 O=C1CCNC[C@H]1F Amb27467922 [0,1,0,0,0,0|1,0,2]=4 1101 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,1,0,0,0,0|1,0,2]=4 1102 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,1,0,0,0,0|1,0,2]=4 1103 B8R1.5 O=C1CCOCC1F Amb19958536 [0,1,0,0,0,0|1,0,2]=4 1104 B8R1.5 O=C1CCOCC1O Amb26966688 [0,1,0,0,0,0|1,0,2]=4 1105 B8R1.5 O=C1CCOC[C@@H]1Br Amb26936362 [0,1,0,0,0,0|1,0,2]=4 1106 B8R1.5 O=C1CCOC[C@@H]1F Amb27813369 [0,1,0,0,0,0|1,0,2]=4 1107 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,1,0,0,0,0|1,0,2]=4 1108 B8R1.5 O=C1CCSC=C1Cl Amb27856607 [0,1,0,0,0,0|1,0,0]=2 1109 B8R1.5 O=C1CCSCC1Br Amb22493812 [0,1,0,0,0,0|1,0,2]=4 1110 B8R1.5 O=C1CCSCC1O Amb27762936 [0,1,0,0,0,0|1,0,2]=4 1111 B8R1.5 O=C1CCSC[C@@H]1O Amb28316128 [0,1,0,0,0,0|1,0,2]=4 1112 B8R1.5 O=C1CN=NC=C1O Amb27794999 [0,1,0,0,0,0|2,0,0]=3 1113 B8R1.5 O=C1COC=CC1=S Amb27835579 [0,1,0,0,0,0|1,0,1]=3 1114 B8R1.5 O=C1COC=C[C@H]1F Amb28292426 [0,1,0,0,0,0|1,0,2]=4 1115 B8R1.5 O=C1COCCC1Br Amb24416092 [0,1,0,0,0,0|1,0,1]=3 1116 B8R1.5 O=C1COCCC1F Amb28048950 [0,1,0,0,0,0|1,0,1]=3 1117 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [0,1,0,0,0,0|1,0,1]=3 1118 B8R1.5 O=C1CON=NC1=O Amb28316169 [0,1,0,0,0,0|3,0,0]=4 1119 B8R1.5 O=C1N=CNC=C1Br Amb22043912 [0,1,0,0,0,0|2,0,1]=4 1120 B8R1.5 O=C1N=CNC=C1Cl Amb22490583 [0,1,0,0,0,0|2,0,1]=4 1121 B8R1.5 O=C1NC=CC=C1Br Amb18542924 [0,1,0,0,0,0|1,0,2]=4 1122 B8R1.5 O=C1NC=CC=C1Cl Amb20243356 [0,1,0,0,0,0|1,0,2]=4 1123 B8R1.5 O=C1NC=CC=C1I Amb22001887 [0,1,0,0,0,0|1,0,2]=4 1124 B8R1.5 O=C1NC=CC=C1O Amb18537411 [0,1,0,0,0,0|1,0,2]=4 1125 B8R1.5 O=C1NC=CC=C1S Amb25261155 [0,1,0,0,0,0|1,0,2]=4 1126 B8R1.5 O=C1NC=CSC1O Amb27882387 [0,1,0,0,0,0|2,0,1]=4 1127 B8R1.5 O=C1NC=NC=C1F Amb22489479 [0,1,0,0,0,0|2,0,1]=4 1128 B8R1.5 O=C1NC=NC=C1I Amb22371454 [0,1,0,0,0,0|2,0,1]=4 1129 B8R1.5 O=C1NC=NC=C1O Amb22436766 [0,1,0,0,0,0|2,0,1]=4 1130 B8R1.5 O=C1NC=NC=C1O Amb22728033 [0,1,0,0,0,0|2,0,1]=4 1131 B8R1.5 O=C1NC=NC=C1S Amb28422458 [0,1,0,0,0,0|2,0,1]=4 1132 B8R1.5 O=C1NCCC=C1Cl Amb26349713 [0,1,0,0,0,0|1,0,0]=2 1133 B8R1.5 O=C1NCCCC1Br Amb33543864 [0,1,0,0,0,0|1,0,1]=3 1134 B8R1.5 O=C1NCCCC1F Amb13888988 [0,1,0,0,0,0|1,0,1]=3 1135 B8R1.5 O=C1NCCCC1O Amb10602315 [0,1,0,0,0,0|1,0,1]=3 1136 B8R1.5 O=C1NCCC[C@@H]1O Amb22226682 [0,1,0,0,0,0|1,0,1]=3 1137 B8R1.5 O=C1NCCC[C@H]1O Amb22225342 [0,1,0,0,0,0|1,0,1]=3 1138 B8R1.5 O=C1NCCNC1=O Amb4005151 [0,1,0,0,0,0|2,0,0]=3 1139 B8R1.5 O=C1NCCOC1=O Amb24120265 [0,1,0,0,0,0|2,0,0]=3 1140 B8R1.5 O=C1NCNCC1Br Amb28060398 [0,1,0,0,0,0|2,0,1]=4 1141 B8R1.5 O=C1NN=CC=C1Br Amb23455497 [0,1,0,0,0,0|2,0,1]=4 1142 B8R1.5 O=C1NN=CC=C1Cl Amb33543639 [0,1,0,0,0,0|2,0,1]=4 1143 B8R1.5 O=C1NN=CC=C1F Amb24659506 [0,1,0,0,0,0|2,0,1]=4 1144 B8R1.5 O=C1NN=CC=C1I Amb25329683 [0,1,0,0,0,0|2,0,1]=4 1145 B8R1.5 O=C1NNCCC1Cl Amb26453975 [0,1,0,0,0,0|2,0,0]=3 1146 B8R1.5 O=C1OC=CC=C1Br Amb26073988 [0,1,0,0,0,0|1,0,2]=4 1147 B8R1.5 O=C1OC=CC=C1Cl Amb20247271 [0,1,0,0,0,0|1,0,2]=4 1148 B8R1.5 O=C1OC=CC=C1I Amb20247272 [0,1,0,0,0,0|1,0,2]=4 1149 B8R1.5 O=C1OC=CC=C1O Amb17933813 [0,1,0,0,0,0|1,0,2]=4 1150 B8R1.5 O=C1OCC=CC1O Amb27795928 [0,1,0,0,0,0|1,0,2]=4 1151 B8R1.5 O=C1OCCC=C1Br Amb27838412 [0,1,0,0,0,0|1,0,0]=2 1152 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,1,0,0,0,0|1,0,1]=3 1153 B8R1.5 O=C1OCCCC1Cl Amb28195106 [0,1,0,0,0,0|1,0,1]=3 1154 B8R1.5 O=C1OCCCC1O Amb19959000 [0,1,0,0,0,0|1,0,1]=3 1155 B8R1.5 O=C1OCCOC1=O Amb4010211 [0,1,0,0,0,0|2,0,0]=3 1156 B8R1.5 O=C1OCCSC1Br Amb27776793 [0,1,0,0,0,0|2,0,1]=4 1157 B8R1.5 O=C1SCCSC1Cl Amb25026142 [0,1,0,0,0,0|2,0,1]=4 1158 B8R1.5 O=S1CCCCC1Cl Amb27669604 [0,1,0,0,0,0|1,0,2]=4 1159 B8R1.5 O=S1CCCC[C@H]1Cl Amb28343131 [0,1,0,0,0,0|1,0,2]=4 1160 B8R1.5 O=c1ccocc1O Amb7172743 [0,1,0,0,0,0|1,0,2]=4 1161 B8R1.5 OC1=CC=CNC1O Amb28045872 [0,1,0,0,0,0|1,0,2]=4 1162 B8R1.5 OC1C=CSCC1O Amb27399718 [0,1,0,0,0,0|1,0,2]=4 1163 B8R1.5 OC1CCCC=C1Br Amb17594500 [0,1,0,0,0,0|0,0,2]=3 1164 B8R1.5 OC1CCCC=C1Cl Amb27970979 [0,1,0,0,0,0|0,0,2]=3 1165 B8R1.5 O[C@@H]1C=CCC[C@H]1Br Amb28245256 [0,1,0,0,0,0|0,0,2]=3 1166 B8R1.5 O[C@@H]1CCCC=C1Br Amb25687871 [0,1,0,0,0,0|0,0,2]=3 1167 B8R1.5 O[C@@H]1CCCC=C1Cl Amb28067316 [0,1,0,0,0,0|0,0,2]=3 1168 B8R1.5 O[C@H]1CCCC=C1Br Amb24505024 [0,1,0,0,0,0|0,0,2]=3 1169 B8R1.72 CC1(C)C=CCCC1 Amb27812109 [0,1,0,0,0,0|1,0,1]=3 1170 B8R1.72 CC1(C)C=COCC1 Amb32419165 [0,1,0,0,0,0|2,0,1]=4 1171 B8R1.72 CC1(C)C=NCCC1 Amb27409306 [0,1,0,0,0,0|2,0,1]=4 1172 B8R1.72 CC1(O)C=CCCC1 Amb25074839 [0,1,0,0,0,0|0,0,2]=3 1173 B8R1.72 N=S1(=O)CCCCC1 Amb25258608 [0,1,0,0,0,0|1,0,2]=4 1174 B8R1.72 O=S1(=O)C=CCCC1 Amb25058323 [0,1,0,0,0,0|1,0,0]=2 1175 B8R1.72 O=S1(=O)CC=CCC1 Amb27408085 [0,1,0,0,0,0|1,0,2]=4 1176 B8R1.72 O=S1(=O)CCCCN1 Amb10068561 [0,1,0,0,0,0|2,0,1]=4 1177 B8R1.72 O=S1(=O)CCCCO1 Amb6608747 [0,1,0,0,0,0|2,0,1]=4 1178 B8R1.72 O=S1(=O)CCCNC1 Amb27838312 [0,1,0,0,0,0|2,0,1]=4 1179 B8R1.72 O=S1(=O)CCCNC1 Amb32670599 [0,1,0,0,0,0|2,0,1]=4 1180 B6R0.1 C#CC(=O)CCC Amb25696103 [0,0,1,0,0,0|0,0,2]=3 1181 B6R0.1 C#CC(=O)COC Amb27794422 [0,0,1,0,0,0|1,0,2]=4 1182 B6R0.1 C#CC(=O)CSC Amb27667610 [0,0,1,0,0,0|1,0,2]=4 1183 B6R0.1 C#CC(=O)NCC Amb24057137 [0,0,1,0,0,0|1,0,2]=4 1184 B6R0.1 C#CC(=O)OCC Amb2182884 [0,0,1,0,0,0|1,0,2]=4 1185 B6R0.1 C#CC(=O)\C=C\C Amb26354606 [0,0,1,0,0,0|0,0,2]=3 1186 B6R0.1 C=C(C=O)CCF Amb28253937 [0,0,1,0,0,0|3,0,0]=4 1187 B6R0.1 C=C(C=O)COC Amb28066424 [0,0,1,0,0,0|3,0,0]=4 1188 B6R0.1 C=C(C=O)SCC Amb28050273 [0,0,1,0,0,0|3,0,0]=4 1189 B6R0.1 C=C(CBr)CCC Amb26493276 [0,0,1,0,0,0|2,0,1]=4 1190 B6R0.1 C=C(CC)CCC Amb22228810 [0,0,1,0,0,0|1,0,2]=4 1191 B6R0.1 C=C(CC)CNC Amb27639465 [0,0,1,0,0,0|2,0,1]=4 1192 B6R0.1 C=C(CCC)OC Amb27433625 [0,0,1,0,0,0|2,0,1]=4 1193 B6R0.1 C=C(CCl)CCC Amb25871331 [0,0,1,0,0,0|2,0,1]=4 1194 B6R0.1 C=C(CN)CCC Amb33204217 [0,0,1,0,0,0|2,0,1]=4 1195 B6R0.1 C=C=CC(=O)C=C Amb28200674 [0,0,1,0,0,0|0,0,3]=4 1196 B6R0.1 C=C=CC(=O)CBr Amb28326028 [0,0,1,0,0,0|1,0,2]=4 1197 B6R0.1 C=C=CC(=O)CC Amb17593059 [0,0,1,0,0,0|0,0,2]=3 1198 B6R0.1 C=C=CC(=O)OC Amb24478408 [0,0,1,0,0,0|1,0,2]=4 1199 B6R0.1 C=CC(=C)CCBr Amb27791690 [0,0,1,0,0,0|2,0,0]=3 1200 B6R0.1 C=CC(=C)CCI Amb27408441 [0,0,1,0,0,0|2,0,0]=3 1201 B6R0.1 C=CC(=N)OCC Amb27160809 [0,0,1,0,0,0|2,0,0]=3 1202 B6R0.1 C=CC(=O)CCC Amb8630773 [0,0,1,0,0,0|0,0,0]=1 1203 B6R0.1 C=CC(=O)CCCl Amb24446646 [0,0,1,0,0,0|1,0,0]=2 1204 B6R0.1 C=CC(=O)CCF Amb33480698 [0,0,1,0,0,0|1,0,0]=2 1205 B6R0.1 C=CC(=O)COC Amb22168158 [0,0,1,0,0,0|1,0,0]=2 1206 B6R0.1 C=CC(=O)CSC Amb26974013 [0,0,1,0,0,0|1,0,0]=2 1207 B6R0.1 C=CC(=O)N=C=O Amb26075015 [0,0,1,0,0,0|2,0,1]=4 1208 B6R0.1 C=CC(=O)N=C=S Amb27759565 [0,0,1,0,0,0|2,0,1]=4 1209 B6R0.1 C=CC(=O)N=[N+]=[N-] Amb27816322 [0,0,1,0,0,0|3,0,0]=4 1210 B6R0.1 C=CC(=O)NC#N Amb27838273 [0,0,1,0,0,0|2,0,1]=4 1211 B6R0.1 C=CC(=O)NCC Amb9480404 [0,0,1,0,0,0|1,0,0]=2 1212 B6R0.1 C=CC(=O)OCC Amb3941513 [0,0,1,0,0,0|1,0,0]=2 1213 B6R0.1 C=CC(=O)\C=C\Cl Amb27233658 [0,0,1,0,0,0|1,0,2]=4 1214 B6R0.1 C=CC(C)CCBr Amb25888332 [0,0,1,0,0,0|2,0,1]=4 1215 B6R0.1 C=CC(C)CCC Amb4019542 [0,0,1,0,0,0|1,0,1]=3 1216 B6R0.1 C=CC(C)CCN Amb27950155 [0,0,1,0,0,0|2,0,1]=4 1217 B6R0.1 C=CC(C)CCO Amb22641463 [0,0,1,0,0,0|2,0,1]=4 1218 B6R0.1 C=CC(C)CNC Amb18523792 [0,0,1,0,0,0|2,0,1]=4 1219 B6R0.1 C=CC(C)CNC Amb32729380 [0,0,1,0,0,0|2,0,1]=4 1220 B6R0.1 C=CC(C)OCC Amb33425058 [0,0,1,0,0,0|2,0,1]=4 1221 B6R0.1 C=CC(N)CCC Amb27814468 [0,0,1,0,0,0|1,0,1]=3 1222 B6R0.1 C=CC(N)CCO Amb22496689 [0,0,1,0,0,0|2,0,1]=4 1223 B6R0.1 C=CC(N)COC Amb25252949 [0,0,1,0,0,0|2,0,1]=4 1224 B6R0.1 C=CC(O)CCBr Amb2720722 [0,0,1,0,0,0|1,0,2]=4 1225 B6R0.1 C=CC(O)CCC Amb22002474 [0,0,1,0,0,0|0,0,2]=3 1226 B6R0.1 C=CC(O)CCF Amb33480803 [0,0,1,0,0,0|1,0,2]=4 1227 B6R0.1 C=CC(O)CCO Amb27978087 [0,0,1,0,0,0|1,0,2]=4 1228 B6R0.1 C=CC(O)COC Amb26347976 [0,0,1,0,0,0|1,0,2]=4 1229 B6R0.1 C=CC(O)CSC Amb25969067 [0,0,1,0,0,0|1,0,2]=4 1230 B6R0.1 C=CCC(=O)C=C Amb27164626 [0,0,1,0,0,0|0,0,2]=3 1231 B6R0.1 C=CCC(=O)CC Amb27173052 [0,0,1,0,0,0|0,0,2]=3 1232 B6R0.1 C=CCC(=O)CN Amb32410102 [0,0,1,0,0,0|1,0,2]=4 1233 B6R0.1 C=CCC(=O)NC Amb24479782 [0,0,1,0,0,0|1,0,2]=4 1234 B6R0.1 C=CNC(=O)C=C Amb27848738 [0,0,1,0,0,0|1,0,2]=4 1235 B6R0.1 C=CNC(=O)OC Amb24479688 [0,0,1,0,0,0|2,0,1]=4 1236 B6R0.1 C=COC(=O)C=C Amb22231745 [0,0,1,0,0,0|1,0,2]=4 1237 B6R0.1 C=COC(=O)CBr Amb22732072 [0,0,1,0,0,0|2,0,1]=4 1238 B6R0.1 C=COC(=O)CC Amb4018556 [0,0,1,0,0,0|1,0,1]=3 1239 B6R0.1 C=COC(=O)CI Amb17934194 [0,0,1,0,0,0|2,0,1]=4 1240 B6R0.1 C=CS(=O)CCCl Amb28347638 [0,0,1,0,0,0|2,0,0]=3 1241 B6R0.1 C=CSC(=O)NC Amb27969936 [0,0,1,0,0,0|2,0,1]=4 1242 B6R0.1 C=C[C@@H](C)CCBr Amb27484165 [0,0,1,0,0,0|2,0,1]=4 1243 B6R0.1 C=C[C@@H](O)CCO Amb28318694 [0,0,1,0,0,0|1,0,2]=4 1244 B6R0.1 C=C[C@H](N)COC Amb28069182 [0,0,1,0,0,0|2,0,1]=4 1245 B6R0.1 C=C\C(Br)=C/CCl Amb28118478 [0,0,1,0,0,0|2,0,1]=4 1246 B6R0.1 C=C\C(C)=C/CC Amb27493400 [0,0,1,0,0,0|1,0,1]=3 1247 B6R0.1 C=C\C(C)=C/CCl Amb25025997 [0,0,1,0,0,0|2,0,1]=4 1248 B6R0.1 C=C\C=C(/C)CBr Amb27634848 [0,0,1,0,0,0|2,0,1]=4 1249 B6R0.1 C=C\C=C(/C)CO Amb17843900 [0,0,1,0,0,0|2,0,1]=4 1250 B6R0.1 C=C\C=C(\F)CCl Amb27236794 [0,0,1,0,0,0|2,0,1]=4 1251 B6R0.1 CC#CC(=O)CC Amb26041340 [0,0,1,0,0,0|0,0,2]=3 1252 B6R0.1 CC#CC(=O)CCl Amb27257962 [0,0,1,0,0,0|1,0,2]=4 1253 B6R0.1 CC#CC(=O)OC Amb2689389 [0,0,1,0,0,0|1,0,2]=4 1254 B6R0.1 CC=C=C(C)CO Amb28048302 [0,0,1,0,0,0|2,0,1]=4 1255 B6R0.1 CCC(=O)C=[N+]=[N-] Amb26855145 [0,0,1,0,0,0|2,0,0]=3 1256 B6R0.1 CCC(=O)CC#N Amb9205370 [0,0,1,0,0,0|1,0,2]=4 1257 B6R0.1 CCC(=O)CCBr Amb27401869 [0,0,1,0,0,0|1,0,2]=4 1258 B6R0.1 CCC(=O)CCI Amb27232362 [0,0,1,0,0,0|1,0,2]=4 1259 B6R0.1 CCC(=O)CCN Amb18202790 [0,0,1,0,0,0|1,0,2]=4 1260 B6R0.1 CCC(=O)CCO Amb26872941 [0,0,1,0,0,0|1,0,2]=4 1261 B6R0.1 CCC(=O)CCS Amb24733984 [0,0,1,0,0,0|1,0,2]=4 1262 B6R0.1 CCC(=O)CNC Amb26408381 [0,0,1,0,0,0|1,0,1]=3 1263 B6R0.1 CCC(=O)CNC Amb32410106 [0,0,1,0,0,0|1,0,1]=3 1264 B6R0.1 CCC(=O)CNO Amb27434221 [0,0,1,0,0,0|2,0,1]=4 1265 B6R0.1 CCC(=O)COC Amb19515551 [0,0,1,0,0,0|1,0,1]=3 1266 B6R0.1 CCC(=O)CSC Amb8393183 [0,0,1,0,0,0|1,0,1]=3 1267 B6R0.1 CCC(=O)N=C=O Amb17231803 [0,0,1,0,0,0|2,0,1]=4 1268 B6R0.1 CCC(=O)N=C=S Amb1120954 [0,0,1,0,0,0|2,0,1]=4 1269 B6R0.1 CCC(=O)N=[N+]=[N-] Amb25187023 [0,0,1,0,0,0|3,0,0]=4 1270 B6R0.1 CCC(=O)NC=N Amb28341185 [0,0,1,0,0,0|2,0,0]=3 1271 B6R0.1 CCC(=O)NCO Amb27235623 [0,0,1,0,0,0|2,0,1]=4 1272 B6R0.1 CCC(=O)OCBr Amb26425071 [0,0,1,0,0,0|2,0,1]=4 1273 B6R0.1 CCC(=O)OCCl Amb26580339 [0,0,1,0,0,0|2,0,1]=4 1274 B6R0.1 CCC(=O)OCN Amb27592382 [0,0,1,0,0,0|2,0,1]=4 1275 B6R0.1 CCC(=O)OCS Amb27593467 [0,0,1,0,0,0|2,0,1]=4 1276 B6R0.1 CCC(=O)\C=C/Cl Amb28351606 [0,0,1,0,0,0|1,0,0]=2 1277 B6R0.1 CCC(=O)\C=C\Cl Amb17593220 [0,0,1,0,0,0|1,0,0]=2 1278 B6R0.1 CCC(=O)\C=C\N Amb26341655 [0,0,1,0,0,0|1,0,0]=2 1279 B6R0.1 CCC(=O)\C=N\O Amb27787349 [0,0,1,0,0,0|2,0,0]=3 1280 B6R0.1 CCC(Cl)\C=C\Cl Amb27432413 [0,0,1,0,0,0|2,0,1]=4 1281 B6R0.1 CCCC(=N)NC Amb27254401 [0,0,1,0,0,0|2,0,1]=4 1282 B6R0.1 CCCC(=O)CBr Amb24433274 [0,0,1,0,0,0|1,0,1]=3 1283 B6R0.1 CCCC(=O)CC Amb8513390 [0,0,1,0,0,0|0,0,2]=3 1284 B6R0.1 CCCC(=O)CCl Amb19372924 [0,0,1,0,0,0|1,0,1]=3 1285 B6R0.1 CCCC(=O)CI Amb27876205 [0,0,1,0,0,0|1,0,1]=3 1286 B6R0.1 CCCC(=O)CN Amb17593086 [0,0,1,0,0,0|1,0,1]=3 1287 B6R0.1 CCCC(=O)CN Amb28827644 [0,0,1,0,0,0|1,0,1]=3 1288 B6R0.1 CCCC(=O)CO Amb25125092 [0,0,1,0,0,0|1,0,1]=3 1289 B6R0.1 CCCC(=O)NC Amb3886531 [0,0,1,0,0,0|1,0,1]=3 1290 B6R0.1 CCCC(=O)NN Amb6366352 [0,0,1,0,0,0|2,0,0]=3 1291 B6R0.1 CCCC(=O)NO Amb6260495 [0,0,1,0,0,0|2,0,0]=3 1292 B6R0.1 CCCC(=O)OC Amb8516697 [0,0,1,0,0,0|1,0,1]=3 1293 B6R0.1 CCCC(=O)SC Amb8393184 [0,0,1,0,0,0|1,0,1]=3 1294 B6R0.1 CCCC(=S)NC Amb27259343 [0,0,1,0,0,0|1,1,1]=4 1295 B6R0.1 CCCC(=S)OC Amb22043317 [0,0,1,0,0,0|1,1,1]=4 1296 B6R0.1 CCCC(C)C=O Amb3939898 [0,0,1,0,0,0|2,0,1]=4 1297 B6R0.1 CCCC(Cl)C=O Amb18124277 [0,0,1,0,0,0|2,0,1]=4 1298 B6R0.1 CCCN(N)C=O Amb18121867 [0,0,1,0,0,0|3,0,0]=4 1299 B6R0.1 CCC[C@H](C)C=O Amb28248332 [0,0,1,0,0,0|2,0,1]=4 1300 B6R0.1 CCC[C@H](F)C=O Amb27644096 [0,0,1,0,0,0|2,0,1]=4 1301 B6R0.1 CCC[C@H](N)C=O Amb27488589 [0,0,1,0,0,0|2,0,1]=4 1302 B6R0.1 CCC\C(C)=N\O Amb24693854 [0,0,1,0,0,0|3,0,0]=4 1303 B6R0.1 CCC\C(Cl)=N\O Amb27829565 [0,0,1,0,0,0|3,0,0]=4 1304 B6R0.1 CCC\C(N)=N\N Amb2696446 [0,0,1,0,0,0|3,0,0]=4 1305 B6R0.1 CCC\C(N)=N\O Amb19890174 [0,0,1,0,0,0|3,0,0]=4 1306 B6R0.1 CCC\C(N)=N\O Amb2724965 [0,0,1,0,0,0|3,0,0]=4 1307 B6R0.1 CCNC(=O)CBr Amb2090261 [0,0,1,0,0,0|2,0,1]=4 1308 B6R0.1 CCNC(=O)CC Amb3886529 [0,0,1,0,0,0|1,0,1]=3 1309 B6R0.1 CCNC(=O)CCl Amb1643925 [0,0,1,0,0,0|2,0,1]=4 1310 B6R0.1 CCNC(=O)CF Amb28316230 [0,0,1,0,0,0|2,0,1]=4 1311 B6R0.1 CCNC(=O)CI Amb23512617 [0,0,1,0,0,0|2,0,1]=4 1312 B6R0.1 CCNC(=O)CN Amb21956656 [0,0,1,0,0,0|2,0,1]=4 1313 B6R0.1 CCNC(=O)CN Amb426696 [0,0,1,0,0,0|2,0,1]=4 1314 B6R0.1 CCNC(=O)CO Amb9421415 [0,0,1,0,0,0|2,0,1]=4 1315 B6R0.1 CCNC(=O)NC Amb24120627 [0,0,1,0,0,0|2,0,1]=4 1316 B6R0.1 CCNC(=O)NN Amb8854035 [0,0,1,0,0,0|3,0,0]=4 1317 B6R0.1 CCNC(=O)NO Amb28345704 [0,0,1,0,0,0|3,0,0]=4 1318 B6R0.1 CCNC(=O)OC Amb22734099 [0,0,1,0,0,0|2,0,1]=4 1319 B6R0.1 CCOC(=N)CC Amb17673175 [0,0,1,0,0,0|2,0,1]=4 1320 B6R0.1 CCOC(=N)CC Amb20673165 [0,0,1,0,0,0|2,0,1]=4 1321 B6R0.1 CCOC(=O)C#N Amb8513165 [0,0,1,0,0,0|2,0,1]=4 1322 B6R0.1 CCOC(=O)C=O Amb8394919 [0,0,1,0,0,0|2,0,0]=3 1323 B6R0.1 CCOC(=O)CBr Amb2687783 [0,0,1,0,0,0|2,0,1]=4 1324 B6R0.1 CCOC(=O)CC Amb8513446 [0,0,1,0,0,0|1,0,1]=3 1325 B6R0.1 CCOC(=O)CCl Amb3941486 [0,0,1,0,0,0|2,0,1]=4 1326 B6R0.1 CCOC(=O)CF Amb2687849 [0,0,1,0,0,0|2,0,1]=4 1327 B6R0.1 CCOC(=O)CI Amb8514613 [0,0,1,0,0,0|2,0,1]=4 1328 B6R0.1 CCOC(=O)CN Amb2697340 [0,0,1,0,0,0|2,0,1]=4 1329 B6R0.1 CCOC(=O)CN Amb8513174 [0,0,1,0,0,0|2,0,1]=4 1330 B6R0.1 CCOC(=O)CO Amb3939196 [0,0,1,0,0,0|2,0,1]=4 1331 B6R0.1 CCOC(=O)CS Amb6608734 [0,0,1,0,0,0|2,0,1]=4 1332 B6R0.1 CCOC(=O)C[NH3+] Amb24113741 [0,0,1,0,0,0|2,0,1]=4 1333 B6R0.1 CCOC(=O)NC Amb8516631 [0,0,1,0,0,0|2,0,1]=4 1334 B6R0.1 CCOC(=O)NCl Amb24381604 [0,0,1,0,0,0|3,0,0]=4 1335 B6R0.1 CCOC(=O)NN Amb2780496 [0,0,1,0,0,0|3,0,0]=4 1336 B6R0.1 CCOC(=O)NO Amb8384324 [0,0,1,0,0,0|3,0,0]=4 1337 B6R0.1 CCOC(=O)OC Amb22732530 [0,0,1,0,0,0|2,0,1]=4 1338 B6R0.1 CCOC(=S)CC Amb26873773 [0,0,1,0,0,0|1,1,1]=4 1339 B6R0.1 CCO\C(C)=C\Br Amb28384131 [0,0,1,0,0,0|3,0,0]=4 1340 B6R0.1 CCO\C(Cl)=C/Cl Amb24479861 [0,0,1,0,0,0|3,0,0]=4 1341 B6R0.1 CCSC(=O)C=O Amb27403471 [0,0,1,0,0,0|2,0,0]=3 1342 B6R0.1 CCSC(=O)CC Amb22043397 [0,0,1,0,0,0|1,0,1]=3 1343 B6R0.1 CCSC(=O)NC Amb28368964 [0,0,1,0,0,0|2,0,1]=4 1344 B6R0.1 CCSC(=S)CC Amb27244778 [0,0,1,0,0,0|1,1,1]=4 1345 B6R0.1 CCSS(=O)CC Amb27437935 [0,0,1,0,0,0|2,0,1]=4 1346 B6R0.1 CC\C(C)=C\C=O Amb28251868 [0,0,1,0,0,0|2,0,0]=3 1347 B6R0.1 CC\C(C)=C\CN Amb31097719 [0,0,1,0,0,0|2,0,1]=4 1348 B6R0.1 CC\C(C)=C\CO Amb24623050 [0,0,1,0,0,0|2,0,1]=4 1349 B6R0.1 CC\C(Cl)=C\C=O Amb28202587 [0,0,1,0,0,0|2,0,0]=3 1350 B6R0.1 CC\C([O-])=C\C#N Amb33803095 [0,0,1,0,0,0|1,0,2]=4 1351 B6R0.1 CC\C=C(/C)C=O Amb3940425 [0,0,1,0,0,0|2,0,1]=4 1352 B6R0.1 CC\C=C(/C)CC Amb24379721 [0,0,1,0,0,0|1,0,1]=3 1353 B6R0.1 CC\C=C(/C)CO Amb22347713 [0,0,1,0,0,0|2,0,1]=4 1354 B6R0.1 CC\C=C(/Cl)C=O Amb28050393 [0,0,1,0,0,0|2,0,1]=4 1355 B6R0.1 CC\C=C(/O)C=O Amb27849683 [0,0,1,0,0,0|1,0,2]=4 1356 B6R0.1 CC\C=C(\C)CC Amb4019552 [0,0,1,0,0,0|1,0,1]=3 1357 B6R0.1 CC\C=C(\C)CO Amb24677771 [0,0,1,0,0,0|2,0,1]=4 1358 B6R0.1 CC\C=C(\O)C=O Amb27195226 [0,0,1,0,0,0|1,0,2]=4 1359 B6R0.1 CNC(=O)CCBr Amb17332890 [0,0,1,0,0,0|2,0,1]=4 1360 B6R0.1 CNC(=O)CCCl Amb1130566 [0,0,1,0,0,0|2,0,1]=4 1361 B6R0.1 CNC(=O)CCN Amb1139824 [0,0,1,0,0,0|2,0,1]=4 1362 B6R0.1 CNC(=O)CCN Amb6893005 [0,0,1,0,0,0|2,0,1]=4 1363 B6R0.1 CNC(=O)CCO Amb10608414 [0,0,1,0,0,0|2,0,1]=4 1364 B6R0.1 CNC(=O)CCS Amb25727705 [0,0,1,0,0,0|2,0,1]=4 1365 B6R0.1 CNC(=O)COC Amb22275885 [0,0,1,0,0,0|2,0,1]=4 1366 B6R0.1 CNC(=O)\C=C/Br Amb27425015 [0,0,1,0,0,0|2,0,0]=3 1367 B6R0.1 CNC(=O)\C=C\I Amb27966681 [0,0,1,0,0,0|2,0,0]=3 1368 B6R0.1 CNCC(=O)CF Amb33377251 [0,0,1,0,0,0|2,0,1]=4 1369 B6R0.1 CNCC(=O)NC Amb2371052 [0,0,1,0,0,0|2,0,1]=4 1370 B6R0.1 CNCC(=O)NC Amb423473 [0,0,1,0,0,0|2,0,1]=4 1371 B6R0.1 CNCC(=O)NN Amb16186920 [0,0,1,0,0,0|3,0,0]=4 1372 B6R0.1 CNCC(=O)NN Amb32667538 [0,0,1,0,0,0|3,0,0]=4 1373 B6R0.1 CNCC(=O)OC Amb1153975 [0,0,1,0,0,0|2,0,1]=4 1374 B6R0.1 CNCC(=O)OC Amb2371116 [0,0,1,0,0,0|2,0,1]=4 1375 B6R0.1 CNC\C(C)=C\Br Amb27958846 [0,0,1,0,0,0|3,0,0]=4 1376 B6R0.1 CNC\C(C)=C\Cl Amb27857601 [0,0,1,0,0,0|3,0,0]=4 1377 B6R0.1 CNNC(=O)NC Amb27461318 [0,0,1,0,0,0|3,0,0]=4 1378 B6R0.1 CNNC(=O)OC Amb22411352 [0,0,1,0,0,0|3,0,0]=4 1379 B6R0.1 COC(=O)C=[N+]=[N-] Amb25746091 [0,0,1,0,0,0|3,0,0]=4 1380 B6R0.1 COC(=O)CC=O Amb18199826 [0,0,1,0,0,0|2,0,1]=4 1381 B6R0.1 COC(=O)CCBr Amb3940216 [0,0,1,0,0,0|2,0,1]=4 1382 B6R0.1 COC(=O)CCCl Amb8387395 [0,0,1,0,0,0|2,0,1]=4 1383 B6R0.1 COC(=O)CCI Amb24442243 [0,0,1,0,0,0|2,0,1]=4 1384 B6R0.1 COC(=O)CCN Amb1105940 [0,0,1,0,0,0|2,0,1]=4 1385 B6R0.1 COC(=O)CCN Amb2605985 [0,0,1,0,0,0|2,0,1]=4 1386 B6R0.1 COC(=O)CCO Amb8855137 [0,0,1,0,0,0|2,0,1]=4 1387 B6R0.1 COC(=O)CCS Amb2725528 [0,0,1,0,0,0|2,0,1]=4 1388 B6R0.1 COC(=O)CSC Amb2689527 [0,0,1,0,0,0|2,0,1]=4 1389 B6R0.1 COC(=O)\C=C/Br Amb10067501 [0,0,1,0,0,0|2,0,0]=3 1390 B6R0.1 COC(=O)\C=C/Cl Amb27878734 [0,0,1,0,0,0|2,0,0]=3 1391 B6R0.1 COC(=O)\C=C/I Amb2455616 [0,0,1,0,0,0|2,0,0]=3 1392 B6R0.1 COC(=O)\C=C\Br Amb33986032 [0,0,1,0,0,0|2,0,0]=3 1393 B6R0.1 COC(=O)\C=C\I Amb33986599 [0,0,1,0,0,0|2,0,0]=3 1394 B6R0.1 COC(=O)\C=C\N Amb8386481 [0,0,1,0,0,0|2,0,0]=3 1395 B6R0.1 COC(=O)\C=C\[O-] Amb32729428 [0,0,1,0,0,0|2,0,0]=3 1396 B6R0.1 COCC(=O)CCl Amb24523799 [0,0,1,0,0,0|2,0,1]=4 1397 B6R0.1 COCC(=O)CI Amb27414026 [0,0,1,0,0,0|2,0,1]=4 1398 B6R0.1 COCC(=O)CN Amb18833134 [0,0,1,0,0,0|2,0,1]=4 1399 B6R0.1 COCC(=O)NN Amb6548366 [0,0,1,0,0,0|3,0,0]=4 1400 B6R0.1 COCC(=O)OC Amb8513624 [0,0,1,0,0,0|2,0,1]=4 1401 B6R0.1 CONC(=O)CCl Amb7969376 [0,0,1,0,0,0|3,0,0]=4 1402 B6R0.1 CONC(=O)CN Amb20669419 [0,0,1,0,0,0|3,0,0]=4 1403 B6R0.1 CONC(=O)CN Amb27398660 [0,0,1,0,0,0|3,0,0]=4 1404 B6R0.1 CONC(=O)CO Amb28344874 [0,0,1,0,0,0|3,0,0]=4 1405 B6R0.1 CO\C=C(/F)CO Amb22546782 [0,0,1,0,0,0|3,0,0]=4 1406 B6R0.1 CSC(=O)CCO Amb27662309 [0,0,1,0,0,0|2,0,1]=4 1407 B6R0.1 CSCC(=O)CCl Amb25965373 [0,0,1,0,0,0|2,0,1]=4 1408 B6R0.1 CSCC(=O)CN Amb33225415 [0,0,1,0,0,0|2,0,1]=4 1409 B6R0.1 CSCC(=O)NN Amb22058723 [0,0,1,0,0,0|3,0,0]=4 1410 B6R0.1 CSCC(=O)NO Amb28057751 [0,0,1,0,0,0|3,0,0]=4 1411 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [0,0,1,0,0,0|2,0,1]=4 1412 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [0,0,1,0,0,0|2,0,1]=4 1413 B6R0.1 C\C(=C/C=O)CBr Amb28396628 [0,0,1,0,0,0|3,0,0]=4 1414 B6R0.1 C\C(=C/C=O)CCl Amb27224793 [0,0,1,0,0,0|3,0,0]=4 1415 B6R0.1 C\C(=C/I)CCO Amb27977006 [0,0,1,0,0,0|3,0,0]=4 1416 B6R0.1 C\C(=C/N)CCN Amb27668659 [0,0,1,0,0,0|3,0,0]=4 1417 B6R0.1 C\C=C(/C)CCBr Amb27165785 [0,0,1,0,0,0|2,0,1]=4 1418 B6R0.1 C\C=C(/C)CCC Amb25744974 [0,0,1,0,0,0|1,0,1]=3 1419 B6R0.1 C\C=C(/C)CCI Amb27423553 [0,0,1,0,0,0|2,0,1]=4 1420 B6R0.1 C\C=C(/C)CCN Amb18639509 [0,0,1,0,0,0|2,0,1]=4 1421 B6R0.1 C\C=C(/C)CCO Amb24674649 [0,0,1,0,0,0|2,0,1]=4 1422 B6R0.1 C\C=C(/C)CNC Amb28241639 [0,0,1,0,0,0|2,0,1]=4 1423 B6R0.1 C\C=C(\C)CCO Amb28077117 [0,0,1,0,0,0|2,0,1]=4 1424 B6R0.1 C\C=C/C(Br)=C/Cl Amb27396622 [0,0,1,0,0,0|2,0,1]=4 1425 B6R0.1 C\C=C/C(C)CC Amb4019547 [0,0,1,0,0,0|1,0,1]=3 1426 B6R0.1 C\C=C/C(Cl)=C\Br Amb27407128 [0,0,1,0,0,0|2,0,1]=4 1427 B6R0.1 C\C=C/[C@H](C)NC Amb27848817 [0,0,1,0,0,0|2,0,1]=4 1428 B6R0.1 C\C=C\C(=O)C#N Amb27434248 [0,0,1,0,0,0|1,0,1]=3 1429 B6R0.1 C\C=C\C(=O)C=O Amb27838207 [0,0,1,0,0,0|1,0,1]=3 1430 B6R0.1 C\C=C\C(=O)CC Amb8517594 [0,0,1,0,0,0|0,0,0]=1 1431 B6R0.1 C\C=C\C(=O)CCl Amb26438240 [0,0,1,0,0,0|1,0,0]=2 1432 B6R0.1 C\C=C\C(=O)NN Amb25796185 [0,0,1,0,0,0|2,0,0]=3 1433 B6R0.1 C\C=C\C(=O)OC Amb8513568 [0,0,1,0,0,0|1,0,0]=2 1434 B6R0.1 C\C=C\C(=S)NC Amb27252022 [0,0,1,0,0,0|1,1,0]=3 1435 B6R0.1 C\C=C\C(Br)=C\Cl Amb28248126 [0,0,1,0,0,0|2,0,1]=4 1436 B6R0.1 C\C=C\C(Br)CC Amb28121149 [0,0,1,0,0,0|1,0,1]=3 1437 B6R0.1 C\C=C\C(C)=C\Cl Amb27640596 [0,0,1,0,0,0|2,0,1]=4 1438 B6R0.1 C\C=C\C(C)CC Amb22232014 [0,0,1,0,0,0|1,0,1]=3 1439 B6R0.1 C\C=C\C(C)CO Amb28074694 [0,0,1,0,0,0|2,0,1]=4 1440 B6R0.1 C\C=C\C(C)NC Amb18639480 [0,0,1,0,0,0|2,0,1]=4 1441 B6R0.1 C\C=C\C(C)OC Amb27473820 [0,0,1,0,0,0|2,0,1]=4 1442 B6R0.1 C\C=C\C(Cl)CC Amb26441343 [0,0,1,0,0,0|1,0,1]=3 1443 B6R0.1 C\C=C\C(F)CO Amb27207741 [0,0,1,0,0,0|2,0,1]=4 1444 B6R0.1 C\C=C\C(N)CC Amb27818157 [0,0,1,0,0,0|1,0,1]=3 1445 B6R0.1 C\C=C\C(N)CF Amb27203310 [0,0,1,0,0,0|2,0,1]=4 1446 B6R0.1 C\C=C\C(O)CC Amb22731799 [0,0,1,0,0,0|0,0,2]=3 1447 B6R0.1 C\C=C\C(O)CCl Amb25919359 [0,0,1,0,0,0|1,0,2]=4 1448 B6R0.1 C\C=C\C(O)CO Amb27764770 [0,0,1,0,0,0|1,0,2]=4 1449 B6R0.1 C\C=C\[C@@H](C)CO Amb27423303 [0,0,1,0,0,0|2,0,1]=4 1450 B6R0.1 C\C=C\[C@@H](N)CC Amb27852159 [0,0,1,0,0,0|1,0,1]=3 1451 B6R0.1 C\C=C\[C@@H](O)CN Amb27814562 [0,0,1,0,0,0|1,0,2]=4 1452 B6R0.1 C\C=C\[C@@H](O)CO Amb27448465 [0,0,1,0,0,0|1,0,2]=4 1453 B6R0.1 C\C=C\[C@H](O)CCl Amb28144520 [0,0,1,0,0,0|1,0,2]=4 1454 B6R0.1 C\C=N\S(=O)CC Amb35685229 [0,0,1,0,0,0|2,0,0]=3 1455 B6R0.1 NCC(=O)CCF Amb26604148 [0,0,1,0,0,0|2,0,1]=4 1456 B6R0.1 NCCC(=O)CF Amb33377162 [0,0,1,0,0,0|2,0,1]=4 1457 B6R0.1 NCCC(=O)CN Amb18121893 [0,0,1,0,0,0|2,0,1]=4 1458 B6R0.1 NCCC(=O)NN Amb18559344 [0,0,1,0,0,0|3,0,0]=4 1459 B6R0.1 NCCC(=O)NO Amb33543073 [0,0,1,0,0,0|3,0,0]=4 1460 B6R0.1 NNC(=O)CCO Amb20622339 [0,0,1,0,0,0|3,0,0]=4 1461 B6R0.1 NNC(=O)CCS Amb20622690 [0,0,1,0,0,0|3,0,0]=4 1462 B6R0.1 O=C(CBr)CCBr Amb26567374 [0,0,1,0,0,0|2,0,1]=4 1463 B6R0.1 O=C(CBr)CCCl Amb27984732 [0,0,1,0,0,0|2,0,1]=4 1464 B6R0.1 O=C(CCBr)NO Amb28195718 [0,0,1,0,0,0|3,0,0]=4 1465 B6R0.1 O=C(CCCl)NO Amb25865278 [0,0,1,0,0,0|3,0,0]=4 1466 B6R0.1 O=C(CCl)CCCl Amb22395038 [0,0,1,0,0,0|2,0,1]=4 1467 B6R0.1 O=C(CCl)CCF Amb33413998 [0,0,1,0,0,0|2,0,1]=4 1468 B6R0.1 O=C(CF)CCF Amb28424077 [0,0,1,0,0,0|2,0,1]=4 1469 B6R0.1 O=C(CO)CCO Amb10603377 [0,0,1,0,0,0|2,0,1]=4 1470 B6R0.1 O=C(\C=C/Br)CCl Amb28050548 [0,0,1,0,0,0|2,0,0]=3 1471 B6R0.1 O=C(\C=C\Cl)CCl Amb13952715 [0,0,1,0,0,0|2,0,0]=3 1472 B6R0.1 O=C=CC(=O)CF Amb27838227 [0,0,1,0,0,0|2,0,1]=4 1473 B6R0.1 O=CC(=O)CCO Amb28050238 [0,0,1,0,0,0|2,0,0]=3 1474 B6R0.1 O=COC(=O)CO Amb27457699 [0,0,1,0,0,0|3,0,0]=4 1475 B6R0.4 C#CCCC(=C)C Amb18634222 [0,0,1,0,0,0|1,0,2]=4 1476 B6R0.4 C#CCCC(=O)Cl Amb26949181 [0,0,1,0,0,0|1,0,2]=4 1477 B6R0.4 C#CCCC(=O)O Amb33532622 [0,0,1,0,0,0|1,0,2]=4 1478 B6R0.4 C#CCCC(=O)[O-] Amb22232009 [0,0,1,0,0,0|1,0,2]=4 1479 B6R0.4 C#CCCC(C)=O Amb8869638 [0,0,1,0,0,0|0,0,3]=4 1480 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [0,0,1,0,0,0|1,0,2]=4 1481 B6R0.4 C=C(Br)CCCCl Amb28320778 [0,0,1,0,0,0|2,0,0]=3 1482 B6R0.4 C=C(Br)CCCN Amb27219336 [0,0,1,0,0,0|2,0,0]=3 1483 B6R0.4 C=C(Br)CCCO Amb27471781 [0,0,1,0,0,0|2,0,0]=3 1484 B6R0.4 C=C(Br)CSCC Amb28063803 [0,0,1,0,0,0|2,0,1]=4 1485 B6R0.4 C=C(C)C#CCC Amb2721682 [0,0,1,0,0,0|1,0,2]=4 1486 B6R0.4 C=C(C)CCC#N Amb2778548 [0,0,1,0,0,0|2,0,1]=4 1487 B6R0.4 C=C(C)CCCBr Amb22886717 [0,0,1,0,0,0|2,0,0]=3 1488 B6R0.4 C=C(C)CCCC Amb2721685 [0,0,1,0,0,0|1,0,1]=3 1489 B6R0.4 C=C(C)CCCCl Amb24089299 [0,0,1,0,0,0|2,0,0]=3 1490 B6R0.4 C=C(C)CCCN Amb24761452 [0,0,1,0,0,0|2,0,0]=3 1491 B6R0.4 C=C(C)CCCN Amb33534233 [0,0,1,0,0,0|2,0,0]=3 1492 B6R0.4 C=C(C)CCCO Amb22886814 [0,0,1,0,0,0|2,0,0]=3 1493 B6R0.4 C=C(C)CCCS Amb33198962 [0,0,1,0,0,0|2,0,0]=3 1494 B6R0.4 C=C(C)CCNC Amb18993045 [0,0,1,0,0,0|2,0,1]=4 1495 B6R0.4 C=C(C)CCOC Amb33546340 [0,0,1,0,0,0|2,0,1]=4 1496 B6R0.4 C=C(C)CCON Amb25862621 [0,0,1,0,0,0|3,0,0]=4 1497 B6R0.4 C=C(C)CCSC Amb28400079 [0,0,1,0,0,0|2,0,1]=4 1498 B6R0.4 C=C(C)CNCC Amb3940049 [0,0,1,0,0,0|2,0,1]=4 1499 B6R0.4 C=C(C)COCCl Amb27424965 [0,0,1,0,0,0|3,0,0]=4 1500 B6R0.4 C=C(C)\C=C\C=O Amb18120435 [0,0,1,0,0,0|2,0,1]=4 1501 B6R0.4 C=C(C)\C=C\CCl Amb25991091 [0,0,1,0,0,0|2,0,0]=3 1502 B6R0.4 C=C(C)\C=C\CN Amb33199533 [0,0,1,0,0,0|2,0,0]=3 1503 B6R0.4 C=C(C)\C=C\CO Amb33473880 [0,0,1,0,0,0|2,0,0]=3 1504 B6R0.4 C=C(Cl)CCCBr Amb25811643 [0,0,1,0,0,0|2,0,0]=3 1505 B6R0.4 C=C(Cl)CCCCl Amb24635037 [0,0,1,0,0,0|2,0,0]=3 1506 B6R0.4 C=C(Cl)CCCN Amb27413032 [0,0,1,0,0,0|2,0,0]=3 1507 B6R0.4 C=C(Cl)CCCO Amb28065233 [0,0,1,0,0,0|2,0,0]=3 1508 B6R0.4 C=C(Cl)CSCC Amb27972493 [0,0,1,0,0,0|2,0,1]=4 1509 B6R0.4 C=C(F)CCCO Amb25811029 [0,0,1,0,0,0|2,0,0]=3 1510 B6R0.4 C=C(F)\C=C\CCl Amb28363835 [0,0,1,0,0,0|2,0,1]=4 1511 B6R0.4 C=C(I)CCCCl Amb27239930 [0,0,1,0,0,0|2,0,0]=3 1512 B6R0.4 C=C=C=CC(C)=O Amb28201583 [0,0,1,0,0,0|0,0,3]=4 1513 B6R0.4 C=C=CCC(=O)O Amb26657414 [0,0,1,0,0,0|1,0,2]=4 1514 B6R0.4 C=CCCC(=C)C Amb22228883 [0,0,1,0,0,0|1,0,1]=3 1515 B6R0.4 C=CCCC(=N)N Amb25326954 [0,0,1,0,0,0|2,0,1]=4 1516 B6R0.4 C=CCCC(=O)Cl Amb3939003 [0,0,1,0,0,0|1,0,1]=3 1517 B6R0.4 C=CCCC(=O)O Amb3940112 [0,0,1,0,0,0|1,0,1]=3 1518 B6R0.4 C=CCCC(C)=O Amb2721704 [0,0,1,0,0,0|0,0,2]=3 1519 B6R0.4 C=CCCC(N)=O Amb28136349 [0,0,1,0,0,0|1,0,1]=3 1520 B6R0.4 C=CCCS(=O)[O-] Amb25680826 [0,0,1,0,0,0|2,0,1]=4 1521 B6R0.4 C=CCNC(C)=O Amb5797445 [0,0,1,0,0,0|1,0,2]=4 1522 B6R0.4 C=CCNC(N)=O Amb6599864 [0,0,1,0,0,0|2,0,1]=4 1523 B6R0.4 C=CCOC(=O)Cl Amb6600570 [0,0,1,0,0,0|2,0,1]=4 1524 B6R0.4 C=CCOC(N)=O Amb4017585 [0,0,1,0,0,0|2,0,1]=4 1525 B6R0.4 C=CNCC(=O)O Amb28346027 [0,0,1,0,0,0|2,0,1]=4 1526 B6R0.4 C=COCC(=C)C Amb26873422 [0,0,1,0,0,0|2,0,1]=4 1527 B6R0.4 C=COCC(=O)O Amb27247261 [0,0,1,0,0,0|2,0,1]=4 1528 B6R0.4 C=COCC(C)=O Amb27838258 [0,0,1,0,0,0|1,0,2]=4 1529 B6R0.4 C=C\C=C/C(C)=O Amb27165543 [0,0,1,0,0,0|0,0,2]=3 1530 B6R0.4 C=C\C=C\C(=O)Cl Amb26530329 [0,0,1,0,0,0|1,0,2]=4 1531 B6R0.4 CC#CCC(C)=O Amb27648528 [0,0,1,0,0,0|0,0,3]=4 1532 B6R0.4 CC(=O)CCC#N Amb17334046 [0,0,1,0,0,0|1,0,2]=4 1533 B6R0.4 CC(=O)CCC=O Amb18639597 [0,0,1,0,0,0|1,0,2]=4 1534 B6R0.4 CC(=O)CCCBr Amb8394105 [0,0,1,0,0,0|1,0,1]=3 1535 B6R0.4 CC(=O)CCCCl Amb3940272 [0,0,1,0,0,0|1,0,1]=3 1536 B6R0.4 CC(=O)CCCF Amb25068187 [0,0,1,0,0,0|1,0,1]=3 1537 B6R0.4 CC(=O)CCCN Amb18121547 [0,0,1,0,0,0|1,0,1]=3 1538 B6R0.4 CC(=O)CCCN Amb32661221 [0,0,1,0,0,0|1,0,1]=3 1539 B6R0.4 CC(=O)CCCN Amb32661286 [0,0,1,0,0,0|1,0,1]=3 1540 B6R0.4 CC(=O)CCCO Amb3940340 [0,0,1,0,0,0|1,0,1]=3 1541 B6R0.4 CC(=O)C\C=N\O Amb27750272 [0,0,1,0,0,0|2,0,1]=4 1542 B6R0.4 CC(=O)NCCBr Amb4311522 [0,0,1,0,0,0|2,0,1]=4 1543 B6R0.4 CC(=O)NCCCl Amb423758 [0,0,1,0,0,0|2,0,1]=4 1544 B6R0.4 CC(=O)NCCN Amb1218225 [0,0,1,0,0,0|2,0,1]=4 1545 B6R0.4 CC(=O)NCCO Amb2720909 [0,0,1,0,0,0|2,0,1]=4 1546 B6R0.4 CC(=O)NCCS Amb22230992 [0,0,1,0,0,0|2,0,1]=4 1547 B6R0.4 CC(=O)N\C=C/S Amb27246451 [0,0,1,0,0,0|2,0,1]=4 1548 B6R0.4 CC(=O)N\C=C\Cl Amb28132682 [0,0,1,0,0,0|2,0,1]=4 1549 B6R0.4 CC(=O)N\C=N\O Amb27255534 [0,0,1,0,0,0|3,0,0]=4 1550 B6R0.4 CC(=O)OCCBr Amb3940209 [0,0,1,0,0,0|2,0,1]=4 1551 B6R0.4 CC(=O)OCCN Amb18121947 [0,0,1,0,0,0|2,0,1]=4 1552 B6R0.4 CC(=O)OCCN Amb28827650 [0,0,1,0,0,0|2,0,1]=4 1553 B6R0.4 CC(=O)OCCO Amb3941004 [0,0,1,0,0,0|2,0,1]=4 1554 B6R0.4 CC(=O)O\C=C/Br Amb27484017 [0,0,1,0,0,0|2,0,1]=4 1555 B6R0.4 CC(=O)SCCBr Amb24608039 [0,0,1,0,0,0|2,0,1]=4 1556 B6R0.4 CC(=O)SCCN Amb21953963 [0,0,1,0,0,0|2,0,1]=4 1557 B6R0.4 CC(=O)SCCN Amb22011516 [0,0,1,0,0,0|2,0,1]=4 1558 B6R0.4 CC(=O)SCCN Amb31291049 [0,0,1,0,0,0|2,0,1]=4 1559 B6R0.4 CC(=O)SCCO Amb27481182 [0,0,1,0,0,0|2,0,1]=4 1560 B6R0.4 CC(=O)\C=C/C#N Amb28050527 [0,0,1,0,0,0|1,0,1]=3 1561 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [0,0,1,0,0,0|1,0,1]=3 1562 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [0,0,1,0,0,0|1,0,0]=2 1563 B6R0.4 CC(=O)\C=C\CF Amb33379250 [0,0,1,0,0,0|1,0,0]=2 1564 B6R0.4 CC(C)=C=CCO Amb17593073 [0,0,1,0,0,0|2,0,1]=4 1565 B6R0.4 CC(C)=CCCBr Amb3941652 [0,0,1,0,0,0|2,0,1]=4 1566 B6R0.4 CC(C)=CCCCl Amb27865707 [0,0,1,0,0,0|2,0,1]=4 1567 B6R0.4 CC(C)=CCCI Amb22395000 [0,0,1,0,0,0|2,0,1]=4 1568 B6R0.4 CC(C)=CCCN Amb18962494 [0,0,1,0,0,0|2,0,1]=4 1569 B6R0.4 CC(C)=CCCO Amb22002283 [0,0,1,0,0,0|2,0,1]=4 1570 B6R0.4 CC(C)=CCCS Amb35588788 [0,0,1,0,0,0|2,0,1]=4 1571 B6R0.4 CC(C)=C\C=C\Br Amb28244792 [0,0,1,0,0,0|2,0,1]=4 1572 B6R0.4 CC(C)=C\C=C\Cl Amb27760419 [0,0,1,0,0,0|2,0,1]=4 1573 B6R0.4 CC(C)\C=C\CBr Amb25138767 [0,0,1,0,0,0|2,0,1]=4 1574 B6R0.4 CC(C)\C=C\CN Amb25939521 [0,0,1,0,0,0|2,0,1]=4 1575 B6R0.4 CC(C)\C=C\CO Amb25802048 [0,0,1,0,0,0|2,0,1]=4 1576 B6R0.4 CC(Cl)\C=C\CBr Amb27205161 [0,0,1,0,0,0|2,0,1]=4 1577 B6R0.4 CC(N)\C=C\CF Amb33379248 [0,0,1,0,0,0|2,0,1]=4 1578 B6R0.4 CC(O)\C=C/CO Amb30621794 [0,0,1,0,0,0|1,0,2]=4 1579 B6R0.4 CC=C=CC(=O)O Amb17593065 [0,0,1,0,0,0|1,0,2]=4 1580 B6R0.4 CCC#CC(=O)O Amb6336503 [0,0,1,0,0,0|1,0,2]=4 1581 B6R0.4 CCC#CC(C)=O Amb2721702 [0,0,1,0,0,0|0,0,2]=3 1582 B6R0.4 CCCC=C(C)C Amb4035860 [0,0,1,0,0,0|1,0,1]=3 1583 B6R0.4 CCCCC(=N)N Amb10066937 [0,0,1,0,0,0|2,0,1]=4 1584 B6R0.4 CCCCC(=N)N Amb2696360 [0,0,1,0,0,0|2,0,1]=4 1585 B6R0.4 CCCCC(=O)Cl Amb3939066 [0,0,1,0,0,0|1,0,1]=3 1586 B6R0.4 CCCCC(=O)O Amb3939877 [0,0,1,0,0,0|1,0,1]=3 1587 B6R0.4 CCCCC(=O)[O-] Amb22056343 [0,0,1,0,0,0|1,0,1]=3 1588 B6R0.4 CCCCC(=S)S Amb27195855 [0,0,1,0,0,0|1,1,1]=4 1589 B6R0.4 CCCCC(C)=O Amb6608652 [0,0,1,0,0,0|0,0,2]=3 1590 B6R0.4 CCCCC(N)=O Amb6891958 [0,0,1,0,0,0|1,0,1]=3 1591 B6R0.4 CCCCC(N)=S Amb6249558 [0,0,1,0,0,0|1,1,1]=4 1592 B6R0.4 CCCCS(=O)Cl Amb24551332 [0,0,1,0,0,0|2,0,1]=4 1593 B6R0.4 CCCCS(=O)[O-] Amb19889352 [0,0,1,0,0,0|2,0,1]=4 1594 B6R0.4 CCCCS(N)=O Amb32720302 [0,0,1,0,0,0|2,0,1]=4 1595 B6R0.4 CCCC[N+](=O)[O-] Amb6298783 [0,0,1,0,0,0|2,0,1]=4 1596 B6R0.4 CCCC[PH](=O)O Amb8391286 [0,0,1,0,0,0|2,0,1]=4 1597 B6R0.4 CCCNC(=O)Cl Amb25688616 [0,0,1,0,0,0|2,0,1]=4 1598 B6R0.4 CCCNC(C)=O Amb5835710 [0,0,1,0,0,0|1,0,1]=3 1599 B6R0.4 CCCNC(N)=O Amb1152241 [0,0,1,0,0,0|2,0,1]=4 1600 B6R0.4 CCCOC(=O)Cl Amb10604123 [0,0,1,0,0,0|2,0,1]=4 1601 B6R0.4 CCCOC(=O)F Amb32667886 [0,0,1,0,0,0|2,0,1]=4 1602 B6R0.4 CCCOC(N)=O Amb6334809 [0,0,1,0,0,0|2,0,1]=4 1603 B6R0.4 CCCSC(C)=O Amb22043301 [0,0,1,0,0,0|1,0,1]=3 1604 B6R0.4 CCCSC(N)=O Amb27167907 [0,0,1,0,0,0|2,0,1]=4 1605 B6R0.4 CCNCC(=O)Cl Amb27948279 [0,0,1,0,0,0|2,0,1]=4 1606 B6R0.4 CCNCC(=O)O Amb10609667 [0,0,1,0,0,0|2,0,1]=4 1607 B6R0.4 CCNCC(=O)O Amb7764661 [0,0,1,0,0,0|2,0,1]=4 1608 B6R0.4 CCNCC(C)=O Amb24545893 [0,0,1,0,0,0|1,0,1]=3 1609 B6R0.4 CCNCC(C)=O Amb32661185 [0,0,1,0,0,0|1,0,1]=3 1610 B6R0.4 CCNCC(N)=O Amb1128676 [0,0,1,0,0,0|2,0,1]=4 1611 B6R0.4 CCNCC(N)=O Amb4035424 [0,0,1,0,0,0|2,0,1]=4 1612 B6R0.4 CCOC=C(C)C Amb27667358 [0,0,1,0,0,0|2,0,0]=3 1613 B6R0.4 CCOCC(=O)Cl Amb33528415 [0,0,1,0,0,0|2,0,1]=4 1614 B6R0.4 CCOCC(=O)O Amb3939880 [0,0,1,0,0,0|2,0,1]=4 1615 B6R0.4 CCOCC(=O)S Amb27813482 [0,0,1,0,0,0|2,0,1]=4 1616 B6R0.4 CCOCC(C)=O Amb9666086 [0,0,1,0,0,0|1,0,1]=3 1617 B6R0.4 CCONC(C)=O Amb22230675 [0,0,1,0,0,0|2,0,0]=3 1618 B6R0.4 CCONS(C)=O Amb27974850 [0,0,1,0,0,0|3,0,0]=4 1619 B6R0.4 CCPCC(=O)O Amb28321137 [0,0,1,0,0,0|2,0,1]=4 1620 B6R0.4 CCSCC(=O)O Amb1125185 [0,0,1,0,0,0|2,0,1]=4 1621 B6R0.4 CCSCC(C)=O Amb4018179 [0,0,1,0,0,0|1,0,1]=3 1622 B6R0.4 CC\C=C/C(=O)O Amb28429841 [0,0,1,0,0,0|1,0,0]=2 1623 B6R0.4 CC\C=C/C(C)=O Amb27835645 [0,0,1,0,0,0|0,0,0]=1 1624 B6R0.4 CC\C=C\B(O)O Amb24078362 [0,0,1,0,0,0|2,0,1]=4 1625 B6R0.4 CC\C=C\C(=N)N Amb33171614 [0,0,1,0,0,0|2,0,0]=3 1626 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [0,0,1,0,0,0|1,0,0]=2 1627 B6R0.4 CC\C=C\C(=O)O Amb6608967 [0,0,1,0,0,0|1,0,0]=2 1628 B6R0.4 CC\C=C\C(C)=O Amb26022886 [0,0,1,0,0,0|0,0,0]=1 1629 B6R0.4 CC\C=C\C(C)C Amb4019550 [0,0,1,0,0,0|1,0,1]=3 1630 B6R0.4 CC\C=C\C(C)N Amb26580418 [0,0,1,0,0,0|1,0,1]=3 1631 B6R0.4 CC\C=C\C(C)O Amb25888544 [0,0,1,0,0,0|0,0,2]=3 1632 B6R0.4 CC\C=C\C(N)=O Amb25770876 [0,0,1,0,0,0|1,0,0]=2 1633 B6R0.4 CC\C=C\C(N)=S Amb33272632 [0,0,1,0,0,0|1,1,0]=3 1634 B6R0.4 CC\C=C\[C@@H](C)N Amb33268692 [0,0,1,0,0,0|1,0,1]=3 1635 B6R0.4 CC\C=C\[C@@H](C)O Amb33429815 [0,0,1,0,0,0|0,0,2]=3 1636 B6R0.4 CC\C=C\[C@H](C)N Amb33268691 [0,0,1,0,0,0|1,0,1]=3 1637 B6R0.4 CC\C=C\[C@H](C)O Amb33449173 [0,0,1,0,0,0|0,0,2]=3 1638 B6R0.4 CC\C=C\[N+](=O)[O-] Amb25190046 [0,0,1,0,0,0|2,0,0]=3 1639 B6R0.4 CC\C=N\S(C)=O Amb35681661 [0,0,1,0,0,0|2,0,0]=3 1640 B6R0.4 CC\N=C\C(=O)O Amb28041425 [0,0,1,0,0,0|2,0,0]=3 1641 B6R0.4 CC\N=C\C(C)=O Amb27854982 [0,0,1,0,0,0|1,0,0]=2 1642 B6R0.4 CNCCC(=O)Cl Amb27422890 [0,0,1,0,0,0|2,0,1]=4 1643 B6R0.4 CNCCC(=O)O Amb10609760 [0,0,1,0,0,0|2,0,1]=4 1644 B6R0.4 CNCCC(=O)O Amb7766400 [0,0,1,0,0,0|2,0,1]=4 1645 B6R0.4 CNCCC(C)=O Amb24560306 [0,0,1,0,0,0|1,0,2]=4 1646 B6R0.4 CNCCC(C)=O Amb28827637 [0,0,1,0,0,0|1,0,2]=4 1647 B6R0.4 CNCCC(N)=O Amb19959913 [0,0,1,0,0,0|2,0,1]=4 1648 B6R0.4 CNCCC(N)=O Amb33538309 [0,0,1,0,0,0|2,0,1]=4 1649 B6R0.4 CN\C=C\C(C)=O Amb17593076 [0,0,1,0,0,0|1,0,0]=2 1650 B6R0.4 CN\C=C\C(C)C Amb27488647 [0,0,1,0,0,0|2,0,1]=4 1651 B6R0.4 COCCC(=O)Cl Amb2689274 [0,0,1,0,0,0|2,0,1]=4 1652 B6R0.4 COCCC(=O)O Amb3938990 [0,0,1,0,0,0|2,0,1]=4 1653 B6R0.4 COCCC(C)=O Amb7764907 [0,0,1,0,0,0|1,0,2]=4 1654 B6R0.4 COCCC(N)=O Amb33538943 [0,0,1,0,0,0|2,0,1]=4 1655 B6R0.4 CO\C=C/C(C)=O Amb27264758 [0,0,1,0,0,0|1,0,0]=2 1656 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [0,0,1,0,0,0|2,0,0]=3 1657 B6R0.4 CO\C=C\C(=O)O Amb18121767 [0,0,1,0,0,0|2,0,0]=3 1658 B6R0.4 CO\C=C\C(C)=O Amb8385700 [0,0,1,0,0,0|1,0,0]=2 1659 B6R0.4 CO\C=C\C(N)=O Amb27153308 [0,0,1,0,0,0|2,0,0]=3 1660 B6R0.4 CO\N=C\C(=O)O Amb10976081 [0,0,1,0,0,0|3,0,0]=4 1661 B6R0.4 CS(=O)CCCN Amb18974527 [0,0,1,0,0,0|2,0,1]=4 1662 B6R0.4 CS(=O)CCCN Amb32684177 [0,0,1,0,0,0|2,0,1]=4 1663 B6R0.4 CSCC=C(C)C Amb27594692 [0,0,1,0,0,0|2,0,1]=4 1664 B6R0.4 CSCCC(=O)O Amb3939879 [0,0,1,0,0,0|2,0,1]=4 1665 B6R0.4 CSCCC(C)=O Amb8392858 [0,0,1,0,0,0|1,0,2]=4 1666 B6R0.4 CSCSC(C)=O Amb27876851 [0,0,1,0,0,0|2,0,1]=4 1667 B6R0.4 CS\C=C/C(C)=O Amb27471812 [0,0,1,0,0,0|1,0,0]=2 1668 B6R0.4 CS\C=C\C(=O)O Amb30584688 [0,0,1,0,0,0|2,0,0]=3 1669 B6R0.4 CS\C=C\[N+](=O)[O-] Amb35704405 [0,0,1,0,0,0|3,0,0]=4 1670 B6R0.4 C[C@@H](Cl)\C=C\CCl Amb28042414 [0,0,1,0,0,0|2,0,1]=4 1671 B6R0.4 C\C(Br)=C\CCCl Amb28054738 [0,0,1,0,0,0|2,0,1]=4 1672 B6R0.4 C\C(Br)=C\CCN Amb28060834 [0,0,1,0,0,0|2,0,1]=4 1673 B6R0.4 C\C(Cl)=C\CCCl Amb27786934 [0,0,1,0,0,0|2,0,1]=4 1674 B6R0.4 C\C(Cl)=C\CCO Amb27956430 [0,0,1,0,0,0|2,0,1]=4 1675 B6R0.4 C\C=C/NC(C)=S Amb28282715 [0,0,1,0,0,0|1,1,1]=4 1676 B6R0.4 C\C=C\CC(=O)O Amb3941538 [0,0,1,0,0,0|1,0,2]=4 1677 B6R0.4 C\C=C\CC(N)=O Amb26589975 [0,0,1,0,0,0|1,0,2]=4 1678 B6R0.4 C\C=C\NC(C)=S Amb27881690 [0,0,1,0,0,0|1,1,1]=4 1679 B6R0.4 C\N=C\CC(C)=O Amb28202181 [0,0,1,0,0,0|1,0,1]=3 1680 B6R0.4 N#CCCC(=O)Cl Amb25106570 [0,0,1,0,0,0|2,0,1]=4 1681 B6R0.4 N#CCCC(=O)O Amb2694975 [0,0,1,0,0,0|2,0,1]=4 1682 B6R0.4 N#CCCC(N)=O Amb8841150 [0,0,1,0,0,0|2,0,1]=4 1683 B6R0.4 N#C\C=C\C(=O)O Amb25853809 [0,0,1,0,0,0|2,0,1]=4 1684 B6R0.4 N=C(N)CCCBr Amb4297022 [0,0,1,0,0,0|3,0,0]=4 1685 B6R0.4 N=C(N)CCCCl Amb4297061 [0,0,1,0,0,0|3,0,0]=4 1686 B6R0.4 N=C(N)CCCF Amb27231400 [0,0,1,0,0,0|3,0,0]=4 1687 B6R0.4 N=C(N)CCCN Amb25888970 [0,0,1,0,0,0|3,0,0]=4 1688 B6R0.4 N=C(N)CCCN Amb33299271 [0,0,1,0,0,0|3,0,0]=4 1689 B6R0.4 N=C(N)CCCO Amb33038287 [0,0,1,0,0,0|3,0,0]=4 1690 B6R0.4 NC(=O)CCCCl Amb1138237 [0,0,1,0,0,0|2,0,0]=3 1691 B6R0.4 NC(=O)CCCF Amb28073400 [0,0,1,0,0,0|2,0,0]=3 1692 B6R0.4 NC(=O)CCCO Amb20623438 [0,0,1,0,0,0|2,0,0]=3 1693 B6R0.4 NC(=O)CCCS Amb27174778 [0,0,1,0,0,0|2,0,0]=3 1694 B6R0.4 NC(=O)NCCBr Amb28385599 [0,0,1,0,0,0|3,0,0]=4 1695 B6R0.4 NC(=O)NCCF Amb27446994 [0,0,1,0,0,0|3,0,0]=4 1696 B6R0.4 NC(=O)NCCI Amb27454955 [0,0,1,0,0,0|3,0,0]=4 1697 B6R0.4 NC(=O)NCCO Amb1146041 [0,0,1,0,0,0|3,0,0]=4 1698 B6R0.4 NC(=O)OCCCl Amb3940645 [0,0,1,0,0,0|3,0,0]=4 1699 B6R0.4 NC(=O)OCCO Amb20623788 [0,0,1,0,0,0|3,0,0]=4 1700 B6R0.4 NC(=O)SCCCl Amb27619850 [0,0,1,0,0,0|3,0,0]=4 1701 B6R0.4 NC(=S)CCCBr Amb33328371 [0,0,1,0,0,0|2,1,0]=4 1702 B6R0.4 NC(=S)CCCCl Amb33328364 [0,0,1,0,0,0|2,1,0]=4 1703 B6R0.4 NC(=S)CCCO Amb9215001 [0,0,1,0,0,0|2,1,0]=4 1704 B6R0.4 NCCCC(=O)Cl Amb1935063 [0,0,1,0,0,0|2,0,0]=3 1705 B6R0.4 NCCCC(=O)O Amb1935210 [0,0,1,0,0,0|2,0,0]=3 1706 B6R0.4 NCCCC(N)=O Amb2099583 [0,0,1,0,0,0|2,0,0]=3 1707 B6R0.4 NCCCC(N)=O Amb6543438 [0,0,1,0,0,0|2,0,0]=3 1708 B6R0.4 NCCCS(=O)O Amb25185942 [0,0,1,0,0,0|3,0,0]=4 1709 B6R0.4 NCCC[N+](=O)[O-] Amb18833132 [0,0,1,0,0,0|3,0,0]=4 1710 B6R0.4 NCCC[PH](=O)O Amb22370049 [0,0,1,0,0,0|3,0,0]=4 1711 B6R0.4 NCCNC(N)=O Amb19374121 [0,0,1,0,0,0|3,0,0]=4 1712 B6R0.4 NCCNC(N)=O Amb32665340 [0,0,1,0,0,0|3,0,0]=4 1713 B6R0.4 NCCNC(N)=O Amb6254968 [0,0,1,0,0,0|3,0,0]=4 1714 B6R0.4 NCCOC(N)=O Amb22059480 [0,0,1,0,0,0|3,0,0]=4 1715 B6R0.4 NCCOC(N)=O Amb24271076 [0,0,1,0,0,0|3,0,0]=4 1716 B6R0.4 NC\C=C/C(=O)O Amb24117018 [0,0,1,0,0,0|2,0,0]=3 1717 B6R0.4 NC\C=C\C(=O)O Amb33422010 [0,0,1,0,0,0|2,0,0]=3 1718 B6R0.4 NC\C=C\C(=O)O Amb33422035 [0,0,1,0,0,0|2,0,0]=3 1719 B6R0.4 NNCCC(=O)O Amb33756816 [0,0,1,0,0,0|3,0,0]=4 1720 B6R0.4 NOCCC(=O)O Amb17569891 [0,0,1,0,0,0|3,0,0]=4 1721 B6R0.4 NOCCC(=O)O Amb32693437 [0,0,1,0,0,0|3,0,0]=4 1722 B6R0.4 NOCCC(N)=O Amb27838275 [0,0,1,0,0,0|3,0,0]=4 1723 B6R0.4 NS(=O)CCCBr Amb32720400 [0,0,1,0,0,0|3,0,0]=4 1724 B6R0.4 NS(=O)CCCCl Amb32720303 [0,0,1,0,0,0|3,0,0]=4 1725 B6R0.4 NS(=O)CCCF Amb32720390 [0,0,1,0,0,0|3,0,0]=4 1726 B6R0.4 O=C(Br)CCCBr Amb25724818 [0,0,1,0,0,0|2,0,0]=3 1727 B6R0.4 O=C(Cl)CCCBr Amb3940241 [0,0,1,0,0,0|2,0,0]=3 1728 B6R0.4 O=C(Cl)CCCCl Amb6608638 [0,0,1,0,0,0|2,0,0]=3 1729 B6R0.4 O=C(Cl)NCCBr Amb28123956 [0,0,1,0,0,0|3,0,0]=4 1730 B6R0.4 O=C(Cl)NCCCl Amb24479815 [0,0,1,0,0,0|3,0,0]=4 1731 B6R0.4 O=C(Cl)NCCF Amb35633248 [0,0,1,0,0,0|3,0,0]=4 1732 B6R0.4 O=C(Cl)OCCBr Amb8514406 [0,0,1,0,0,0|3,0,0]=4 1733 B6R0.4 O=C(Cl)OCCCl Amb6608837 [0,0,1,0,0,0|3,0,0]=4 1734 B6R0.4 O=C(Cl)OCCF Amb21618836 [0,0,1,0,0,0|3,0,0]=4 1735 B6R0.4 O=C(Cl)\C=C\CCl Amb33294776 [0,0,1,0,0,0|2,0,0]=3 1736 B6R0.4 O=C(O)CCCBr Amb8393276 [0,0,1,0,0,0|2,0,0]=3 1737 B6R0.4 O=C(O)CCCCl Amb3940333 [0,0,1,0,0,0|2,0,0]=3 1738 B6R0.4 O=C(O)CCCF Amb17593104 [0,0,1,0,0,0|2,0,0]=3 1739 B6R0.4 O=C(O)CCCI Amb22295911 [0,0,1,0,0,0|2,0,0]=3 1740 B6R0.4 O=C(O)CCCO Amb18640332 [0,0,1,0,0,0|2,0,0]=3 1741 B6R0.4 O=C(O)CCCS Amb16185429 [0,0,1,0,0,0|2,0,0]=3 1742 B6R0.4 O=C(O)CCNO Amb28067767 [0,0,1,0,0,0|3,0,0]=4 1743 B6R0.4 O=C(O)CCSCl Amb28387511 [0,0,1,0,0,0|3,0,0]=4 1744 B6R0.4 O=C(O)COCF Amb33378705 [0,0,1,0,0,0|3,0,0]=4 1745 B6R0.4 O=C(O)CPCO Amb28340565 [0,0,1,0,0,0|3,0,0]=4 1746 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [0,0,1,0,0,0|2,0,0]=3 1747 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [0,0,1,0,0,0|2,0,0]=3 1748 B6R0.4 O=C(O)\C=C\CF Amb33470171 [0,0,1,0,0,0|2,0,0]=3 1749 B6R0.4 O=C(O)\C=C\CO Amb32662006 [0,0,1,0,0,0|2,0,0]=3 1750 B6R0.4 O=C(S)NCCO Amb27430045 [0,0,1,0,0,0|3,0,0]=4 1751 B6R0.4 O=C([O-])CCCO Amb3429667 [0,0,1,0,0,0|2,0,0]=3 1752 B6R0.4 O=C([O-])CNCO Amb8383630 [0,0,1,0,0,0|3,0,0]=4 1753 B6R0.4 O=C([O-])\C=C\CO Amb33542275 [0,0,1,0,0,0|2,0,0]=3 1754 B6R0.4 O=CCCC(=O)O Amb17673897 [0,0,1,0,0,0|2,0,1]=4 1755 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [0,0,1,0,0,0|2,0,1]=4 1756 B6R0.4 O=S(Cl)CCCBr Amb32720399 [0,0,1,0,0,0|3,0,0]=4 1757 B6R0.4 O=S(Cl)CCCCl Amb25791632 [0,0,1,0,0,0|3,0,0]=4 1758 B6R0.4 O=S(Cl)CCCF Amb32720389 [0,0,1,0,0,0|3,0,0]=4 1759 B6R0.4 O=S([O-])CCCBr Amb32754123 [0,0,1,0,0,0|3,0,0]=4 1760 B6R0.4 O=S([O-])CCCCl Amb26370094 [0,0,1,0,0,0|3,0,0]=4 1761 B6R0.4 O=S([O-])CCCF Amb32754093 [0,0,1,0,0,0|3,0,0]=4 1762 B6R0.4 O=S([O-])CCCO Amb27221257 [0,0,1,0,0,0|3,0,0]=4 1763 B6R0.4 O=[N+]([O-])CCCCl Amb25267487 [0,0,1,0,0,0|3,0,0]=4 1764 B6R0.4 O=[N+]([O-])CCCF Amb25234942 [0,0,1,0,0,0|3,0,0]=4 1765 B6R0.4 O=[N+]([O-])CCCO Amb20247690 [0,0,1,0,0,0|3,0,0]=4 1766 B6R0.4 O=[N+]([O-])\C=C\CF Amb33379297 [0,0,1,0,0,0|3,0,0]=4 1767 B6R0.4 O=[PH](O)CCCO Amb28345330 [0,0,1,0,0,0|3,0,0]=4 1768 B6R0.4 [C-]#[N+]CCC(=C)C Amb33199608 [0,0,1,0,0,0|2,0,1]=4 1769 B6R0.6 C#CCCCC=C Amb22227961 [0,0,1,0,0,0|1,0,1]=3 1770 B6R0.6 C#CCCCC=O Amb17593060 [0,0,1,0,0,0|0,0,2]=3 1771 B6R0.6 C#CCCNC=O Amb27447032 [0,0,1,0,0,0|1,0,2]=4 1772 B6R0.6 C#CCNCC=C Amb21953877 [0,0,1,0,0,0|2,0,1]=4 1773 B6R0.6 C#CCNCC=C Amb6365586 [0,0,1,0,0,0|2,0,1]=4 1774 B6R0.6 C#CCOCC=C Amb26362527 [0,0,1,0,0,0|2,0,1]=4 1775 B6R0.6 C#CCSCC=C Amb27641794 [0,0,1,0,0,0|2,0,1]=4 1776 B6R0.6 C#C\C=C\CCC Amb33424839 [0,0,1,0,0,0|1,0,1]=3 1777 B6R0.6 C=C=CCCC=O Amb28208489 [0,0,1,0,0,0|0,0,2]=3 1778 B6R0.6 C=CC#CCCC Amb17673843 [0,0,1,0,0,0|1,0,2]=4 1779 B6R0.6 C=CCC#CC=O Amb28388610 [0,0,1,0,0,0|0,0,2]=3 1780 B6R0.6 C=CCCC#CC Amb35680296 [0,0,1,0,0,0|1,0,2]=4 1781 B6R0.6 C=CCCCC#N Amb6298890 [0,0,1,0,0,0|1,0,1]=3 1782 B6R0.6 C=CCCCC=C Amb22227760 [0,0,1,0,0,0|1,0,0]=2 1783 B6R0.6 C=CCCCC=O Amb13883672 [0,0,1,0,0,0|0,0,0]=1 1784 B6R0.6 C=CCCCCBr Amb3940222 [0,0,1,0,0,0|1,0,1]=3 1785 B6R0.6 C=CCCCCC Amb3940498 [0,0,1,0,0,0|1,0,1]=3 1786 B6R0.6 C=CCCCCCl Amb2692039 [0,0,1,0,0,0|1,0,1]=3 1787 B6R0.6 C=CCCCCF Amb24409527 [0,0,1,0,0,0|1,0,1]=3 1788 B6R0.6 C=CCCCCI Amb26858458 [0,0,1,0,0,0|1,0,1]=3 1789 B6R0.6 C=CCCCCN Amb18639514 [0,0,1,0,0,0|1,0,1]=3 1790 B6R0.6 C=CCCCCO Amb3940341 [0,0,1,0,0,0|0,0,2]=3 1791 B6R0.6 C=CCCCNC Amb18523846 [0,0,1,0,0,0|2,0,0]=3 1792 B6R0.6 C=CCCCNC Amb32651835 [0,0,1,0,0,0|2,0,0]=3 1793 B6R0.6 C=CCCCNO Amb27437399 [0,0,1,0,0,0|1,0,1]=3 1794 B6R0.6 C=CCCCOC Amb24432882 [0,0,1,0,0,0|2,0,0]=3 1795 B6R0.6 C=CCCN=C=O Amb28076943 [0,0,1,0,0,0|1,0,1]=3 1796 B6R0.6 C=CCCN=C=S Amb24054319 [0,0,1,0,0,0|1,1,1]=4 1797 B6R0.6 C=CCCN=[N+]=[N-] Amb33545543 [0,0,1,0,0,0|3,0,0]=4 1798 B6R0.6 C=CCCNC#N Amb26878076 [0,0,1,0,0,0|2,0,1]=4 1799 B6R0.6 C=CCCOCCl Amb2696084 [0,0,1,0,0,0|2,0,1]=4 1800 B6R0.6 C=CCCSCC Amb27213772 [0,0,1,0,0,0|2,0,1]=4 1801 B6R0.6 C=CCC\C=C\C Amb22734684 [0,0,1,0,0,0|1,0,1]=3 1802 B6R0.6 C=CCNCC#N Amb6706494 [0,0,1,0,0,0|2,0,1]=4 1803 B6R0.6 C=CCNCC=C Amb3940050 [0,0,1,0,0,0|2,0,0]=3 1804 B6R0.6 C=CCNCCC Amb22587187 [0,0,1,0,0,0|2,0,1]=4 1805 B6R0.6 C=CCNCCC Amb6683949 [0,0,1,0,0,0|2,0,1]=4 1806 B6R0.6 C=CCNCCCl Amb17334072 [0,0,1,0,0,0|2,0,1]=4 1807 B6R0.6 C=CCNCCN Amb17091015 [0,0,1,0,0,0|2,0,1]=4 1808 B6R0.6 C=CCNCCO Amb6706545 [0,0,1,0,0,0|1,0,2]=4 1809 B6R0.6 C=CCNCOC Amb27973157 [0,0,1,0,0,0|3,0,0]=4 1810 B6R0.6 C=CCOCC#N Amb9208775 [0,0,1,0,0,0|2,0,1]=4 1811 B6R0.6 C=CCOCC=C Amb8515934 [0,0,1,0,0,0|2,0,0]=3 1812 B6R0.6 C=CCOCC=O Amb27402231 [0,0,1,0,0,0|1,0,0]=2 1813 B6R0.6 C=CCOCCBr Amb33531510 [0,0,1,0,0,0|2,0,1]=4 1814 B6R0.6 C=CCOCCC Amb3940491 [0,0,1,0,0,0|2,0,1]=4 1815 B6R0.6 C=CCOCCCl Amb2696085 [0,0,1,0,0,0|2,0,1]=4 1816 B6R0.6 C=CCOCCI Amb24739964 [0,0,1,0,0,0|2,0,1]=4 1817 B6R0.6 C=CCOCCN Amb32667523 [0,0,1,0,0,0|2,0,1]=4 1818 B6R0.6 C=CCOCCN Amb33530047 [0,0,1,0,0,0|2,0,1]=4 1819 B6R0.6 C=CCOCCO Amb3940609 [0,0,1,0,0,0|1,0,2]=4 1820 B6R0.6 C=CCOCOC Amb24385255 [0,0,1,0,0,0|3,0,0]=4 1821 B6R0.6 C=CCSCC=C Amb8393147 [0,0,1,0,0,0|2,0,0]=3 1822 B6R0.6 C=CCSCC=O Amb18641509 [0,0,1,0,0,0|1,0,0]=2 1823 B6R0.6 C=CCSCCCl Amb28042684 [0,0,1,0,0,0|2,0,1]=4 1824 B6R0.6 C=CCSCCN Amb13951462 [0,0,1,0,0,0|2,0,1]=4 1825 B6R0.6 C=CCSCCN Amb6273787 [0,0,1,0,0,0|2,0,1]=4 1826 B6R0.6 C=COCCCC Amb8513427 [0,0,1,0,0,0|2,0,1]=4 1827 B6R0.6 C=COCCCCl Amb27613489 [0,0,1,0,0,0|2,0,1]=4 1828 B6R0.6 C=COCCCF Amb22008255 [0,0,1,0,0,0|2,0,1]=4 1829 B6R0.6 C=COCCCN Amb3997182 [0,0,1,0,0,0|2,0,1]=4 1830 B6R0.6 C=COCCNN Amb28421647 [0,0,1,0,0,0|3,0,0]=4 1831 B6R0.6 C=COCCOC Amb21520356 [0,0,1,0,0,0|3,0,0]=4 1832 B6R0.6 C=COCCON Amb22001402 [0,0,1,0,0,0|3,0,0]=4 1833 B6R0.6 C=COCOC=C Amb27963528 [0,0,1,0,0,0|3,0,0]=4 1834 B6R0.6 C=CSCCCN Amb27800121 [0,0,1,0,0,0|2,0,1]=4 1835 B6R0.6 C=C\C=C\C=C\C Amb27627431 [0,0,1,0,0,0|1,0,2]=4 1836 B6R0.6 C=C\C=C\CCBr Amb32679337 [0,0,1,0,0,0|2,0,0]=3 1837 B6R0.6 C=C\C=C\CCC Amb33171502 [0,0,1,0,0,0|1,0,0]=2 1838 B6R0.6 C=C\C=C\CCN Amb18639048 [0,0,1,0,0,0|2,0,0]=3 1839 B6R0.6 C=C\C=C\CCN Amb32679368 [0,0,1,0,0,0|2,0,0]=3 1840 B6R0.6 C=C\C=C\CCO Amb34916666 [0,0,1,0,0,0|2,0,0]=3 1841 B6R0.6 C=C\C=C\CNC Amb25244153 [0,0,1,0,0,0|2,0,0]=3 1842 B6R0.6 CC#C\C=C\C=O Amb28050254 [0,0,1,0,0,0|0,0,2]=3 1843 B6R0.6 CC=C=CCCI Amb27777241 [0,0,1,0,0,0|2,0,1]=4 1844 B6R0.6 CC=C=CCCO Amb25888408 [0,0,1,0,0,0|2,0,1]=4 1845 B6R0.6 CCC#CCC=O Amb28396959 [0,0,1,0,0,0|0,0,3]=4 1846 B6R0.6 CCC#C\C=C\Br Amb27666907 [0,0,1,0,0,0|1,0,2]=4 1847 B6R0.6 CCC=C=CC=O Amb27237589 [0,0,1,0,0,0|0,0,2]=3 1848 B6R0.6 CCCC#CC=O Amb27244852 [0,0,1,0,0,0|0,0,2]=3 1849 B6R0.6 CCCC=C=CBr Amb27477883 [0,0,1,0,0,0|1,0,1]=3 1850 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [0,0,1,0,0,0|2,0,1]=4 1851 B6R0.6 CCCCCC=O Amb3939522 [0,0,1,0,0,0|0,0,2]=3 1852 B6R0.6 CCCCN=C=O Amb3939310 [0,0,1,0,0,0|1,0,2]=4 1853 B6R0.6 CCCCNC=O Amb4017838 [0,0,1,0,0,0|1,0,1]=3 1854 B6R0.6 CCCCOB=O Amb26900238 [0,0,1,0,0,0|2,0,1]=4 1855 B6R0.6 CCCCOC=O Amb6608882 [0,0,1,0,0,0|1,0,1]=3 1856 B6R0.6 CCCCON=O Amb8515227 [0,0,1,0,0,0|2,0,1]=4 1857 B6R0.6 CCCC\C=C\I Amb25173925 [0,0,1,0,0,0|1,0,1]=3 1858 B6R0.6 CCCN\C=N\N Amb28049932 [0,0,1,0,0,0|3,0,0]=4 1859 B6R0.6 CCC\C=C/C=O Amb25885814 [0,0,1,0,0,0|0,0,0]=1 1860 B6R0.6 CCC\C=C\C=O Amb3940431 [0,0,1,0,0,0|0,0,0]=1 1861 B6R0.6 CCC\C=C\CCl Amb27482813 [0,0,1,0,0,0|1,0,1]=3 1862 B6R0.6 CCC\C=C\CN Amb33475254 [0,0,1,0,0,0|1,0,1]=3 1863 B6R0.6 CCC\C=C\CO Amb32660968 [0,0,1,0,0,0|0,0,2]=3 1864 B6R0.6 CCC\C=C\CS Amb33373719 [0,0,1,0,0,0|0,1,1]=3 1865 B6R0.6 CCNCNC=O Amb27252409 [0,0,1,0,0,0|2,0,1]=4 1866 B6R0.6 CCNC\C=C/I Amb23539308 [0,0,1,0,0,0|2,0,1]=4 1867 B6R0.6 CCN\C=C/C=O Amb27793118 [0,0,1,0,0,0|1,0,0]=2 1868 B6R0.6 CCOCCC=O Amb25688261 [0,0,1,0,0,0|1,0,2]=4 1869 B6R0.6 CCOCNC=O Amb28252363 [0,0,1,0,0,0|2,0,1]=4 1870 B6R0.6 CCOC\C=C\Br Amb28244732 [0,0,1,0,0,0|2,0,1]=4 1871 B6R0.6 CCO\C=C/C#N Amb16233146 [0,0,1,0,0,0|2,0,1]=4 1872 B6R0.6 CCO\C=C/C=O Amb27423444 [0,0,1,0,0,0|1,0,0]=2 1873 B6R0.6 CCO\C=C\C#N Amb8514953 [0,0,1,0,0,0|2,0,1]=4 1874 B6R0.6 CCO\C=C\C=O Amb18639560 [0,0,1,0,0,0|1,0,0]=2 1875 B6R0.6 CCO\C=C\SC Amb30621789 [0,0,1,0,0,0|3,0,0]=4 1876 B6R0.6 CCSCCC=O Amb27254551 [0,0,1,0,0,0|1,0,2]=4 1877 B6R0.6 CCSCNC=O Amb28315587 [0,0,1,0,0,0|2,0,1]=4 1878 B6R0.6 CC\C=C/CC=O Amb18639157 [0,0,1,0,0,0|0,0,2]=3 1879 B6R0.6 CC\C=C/CCC Amb26600858 [0,0,1,0,0,0|1,0,1]=3 1880 B6R0.6 CC\C=C/CCCl Amb27815138 [0,0,1,0,0,0|2,0,1]=4 1881 B6R0.6 CC\C=C/CCI Amb28399922 [0,0,1,0,0,0|2,0,1]=4 1882 B6R0.6 CC\C=C/CCO Amb2720771 [0,0,1,0,0,0|2,0,1]=4 1883 B6R0.6 CC\C=C\C=C/Br Amb27392254 [0,0,1,0,0,0|1,0,1]=3 1884 B6R0.6 CC\C=C\C=C\Br Amb27233492 [0,0,1,0,0,0|1,0,1]=3 1885 B6R0.6 CC\C=C\CCBr Amb17570067 [0,0,1,0,0,0|2,0,1]=4 1886 B6R0.6 CC\C=C\CCC Amb19930065 [0,0,1,0,0,0|1,0,1]=3 1887 B6R0.6 CC\C=C\CCCl Amb27452933 [0,0,1,0,0,0|2,0,1]=4 1888 B6R0.6 CC\C=C\CCN Amb17569886 [0,0,1,0,0,0|2,0,1]=4 1889 B6R0.6 CC\C=C\CCO Amb3940339 [0,0,1,0,0,0|2,0,1]=4 1890 B6R0.6 CC\C=C\CCS Amb32882654 [0,0,1,0,0,0|2,0,1]=4 1891 B6R0.6 CC\C=C\CNC Amb26618015 [0,0,1,0,0,0|2,0,1]=4 1892 B6R0.6 CC\C=C\OCC Amb33986090 [0,0,1,0,0,0|2,0,1]=4 1893 B6R0.6 CNCC\C=C\Cl Amb27605601 [0,0,1,0,0,0|2,0,1]=4 1894 B6R0.6 CNC\C=C\CCl Amb28050469 [0,0,1,0,0,0|2,0,1]=4 1895 B6R0.6 COCCCC=O Amb33530955 [0,0,1,0,0,0|1,0,1]=3 1896 B6R0.6 COCCNC=O Amb24334241 [0,0,1,0,0,0|2,0,1]=4 1897 B6R0.6 COCOCC=O Amb27409311 [0,0,1,0,0,0|2,0,1]=4 1898 B6R0.6 COC\C=C\C#N Amb18120668 [0,0,1,0,0,0|2,0,1]=4 1899 B6R0.6 COC\C=C\C=O Amb33473884 [0,0,1,0,0,0|1,0,0]=2 1900 B6R0.6 COC\C=C\CBr Amb28050318 [0,0,1,0,0,0|2,0,1]=4 1901 B6R0.6 COC\C=C\CN Amb28341719 [0,0,1,0,0,0|2,0,1]=4 1902 B6R0.6 COC\C=C\CO Amb33428788 [0,0,1,0,0,0|1,0,2]=4 1903 B6R0.6 CO\C=C\C=C/Cl Amb27863084 [0,0,1,0,0,0|2,0,1]=4 1904 B6R0.6 CSCCCC=O Amb25992553 [0,0,1,0,0,0|1,0,1]=3 1905 B6R0.6 CSCCNC=O Amb28437305 [0,0,1,0,0,0|2,0,1]=4 1906 B6R0.6 CSC\C=C\C=O Amb33271737 [0,0,1,0,0,0|1,0,0]=2 1907 B6R0.6 CSC\C=C\CCl Amb27473343 [0,0,1,0,0,0|2,0,1]=4 1908 B6R0.6 CSC\C=C\CN Amb33474032 [0,0,1,0,0,0|2,0,1]=4 1909 B6R0.6 CSC\C=C\CO Amb33079758 [0,0,1,0,0,0|1,0,2]=4 1910 B6R0.6 C\C=C/CCC=O Amb28202620 [0,0,1,0,0,0|0,0,2]=3 1911 B6R0.6 C\C=C/CCCC Amb24467666 [0,0,1,0,0,0|1,0,1]=3 1912 B6R0.6 C\C=C/CCCN Amb27658374 [0,0,1,0,0,0|2,0,1]=4 1913 B6R0.6 C\C=C/CCCO Amb17614951 [0,0,1,0,0,0|2,0,1]=4 1914 B6R0.6 C\C=C\C=C\C=O Amb33986154 [0,0,1,0,0,0|0,0,2]=3 1915 B6R0.6 C\C=C\C=C\CBr Amb27433479 [0,0,1,0,0,0|2,0,1]=4 1916 B6R0.6 C\C=C\C=C\CCl Amb32652238 [0,0,1,0,0,0|2,0,1]=4 1917 B6R0.6 C\C=C\C=C\CN Amb18639062 [0,0,1,0,0,0|2,0,1]=4 1918 B6R0.6 C\C=C\C=C\CN Amb24117256 [0,0,1,0,0,0|2,0,1]=4 1919 B6R0.6 C\C=C\C=C\CO Amb27848287 [0,0,1,0,0,0|2,0,1]=4 1920 B6R0.6 C\C=C\CCC=O Amb17593074 [0,0,1,0,0,0|0,0,2]=3 1921 B6R0.6 C\C=C\CCCC Amb8515158 [0,0,1,0,0,0|1,0,1]=3 1922 B6R0.6 C\C=C\CCCI Amb25837122 [0,0,1,0,0,0|2,0,1]=4 1923 B6R0.6 C\C=C\CCCO Amb22347882 [0,0,1,0,0,0|2,0,1]=4 1924 B6R0.6 C\C=C\SCCC Amb22168314 [0,0,1,0,0,0|2,0,0]=3 1925 B6R0.6 Cl\C=C/OCCCl Amb27843981 [0,0,1,0,0,0|3,0,0]=4 1926 B6R0.6 Cl\C=C\SCCCl Amb28197764 [0,0,1,0,0,0|3,0,0]=4 1927 B6R0.6 N#CCCCC=O Amb18120556 [0,0,1,0,0,0|1,0,1]=3 1928 B6R0.6 N#CC\C=C\C=O Amb25073805 [0,0,1,0,0,0|1,0,1]=3 1929 B6R0.6 N#CS\C=C\C=O Amb27793341 [0,0,1,0,0,0|2,0,1]=4 1930 B6R0.6 N#C\C=C/CCCl Amb28074025 [0,0,1,0,0,0|2,0,1]=4 1931 B6R0.6 NCCCCC=O Amb26627836 [0,0,1,0,0,0|1,0,1]=3 1932 B6R0.6 NCCCNC=O Amb5723517 [0,0,1,0,0,0|2,0,1]=4 1933 B6R0.6 NCCC\C=C/I Amb28050291 [0,0,1,0,0,0|2,0,1]=4 1934 B6R0.6 NC\C=C\CCF Amb33196118 [0,0,1,0,0,0|2,0,1]=4 1935 B6R0.6 NC\C=C\CCN Amb24113141 [0,0,1,0,0,0|2,0,1]=4 1936 B6R0.6 NC\C=C\CCN Amb24113896 [0,0,1,0,0,0|2,0,1]=4 1937 B6R0.6 NC\C=C\CCO Amb27969293 [0,0,1,0,0,0|2,0,1]=4 1938 B6R0.6 N\C=C/C=C/C=O Amb27838284 [0,0,1,0,0,0|1,0,2]=4 1939 B6R0.6 N\C=C\C=C\C=O Amb27873733 [0,0,1,0,0,0|1,0,2]=4 1940 B6R0.6 O=C=C\C=C/C=O Amb28128301 [0,0,1,0,0,0|1,0,2]=4 1941 B6R0.6 O=CCCCC=O Amb6600455 [0,0,1,0,0,0|1,0,0]=2 1942 B6R0.6 O=CCCCCBr Amb18126353 [0,0,1,0,0,0|1,0,1]=3 1943 B6R0.6 O=CCCCCCl Amb18123550 [0,0,1,0,0,0|1,0,1]=3 1944 B6R0.6 O=CCCCCO Amb10603837 [0,0,1,0,0,0|1,0,1]=3 1945 B6R0.6 O=CCCCN=O Amb27838215 [0,0,1,0,0,0|2,0,0]=3 1946 B6R0.6 O=CCC\C=C/Br Amb27838206 [0,0,1,0,0,0|1,0,1]=3 1947 B6R0.6 O=CCC\C=C\Cl Amb27955198 [0,0,1,0,0,0|1,0,1]=3 1948 B6R0.6 O=CNCCCO Amb27248821 [0,0,1,0,0,0|2,0,1]=4 1949 B6R0.6 O=CNCNC=O Amb4017373 [0,0,1,0,0,0|3,0,0]=4 1950 B6R0.6 O=C\C=C/C=C\S Amb27166146 [0,0,1,0,0,0|1,0,2]=4 1951 B6R0.6 O=C\C=C/CC=O Amb28050289 [0,0,1,0,0,0|1,0,1]=3 1952 B6R0.6 O=C\C=C/CCO Amb27235316 [0,0,1,0,0,0|1,0,0]=2 1953 B6R0.6 O=C\C=C\C=C\Br Amb16233577 [0,0,1,0,0,0|1,0,2]=4 1954 B6R0.6 O=C\C=C\C=C\Cl Amb27760447 [0,0,1,0,0,0|1,0,2]=4 1955 B6R0.6 O=C\C=C\C=C\O Amb27646525 [0,0,1,0,0,0|1,0,2]=4 1956 B6R0.6 O=C\C=C\C=C\S Amb28051864 [0,0,1,0,0,0|1,0,2]=4 1957 B6R0.6 O=C\C=C\CC=O Amb17593064 [0,0,1,0,0,0|1,0,1]=3 1958 B6R0.6 O=C\C=C\CCF Amb33429802 [0,0,1,0,0,0|1,0,0]=2 1959 B6R0.6 OCCC\C=C\Br Amb27483322 [0,0,1,0,0,0|2,0,1]=4 1960 B6R0.6 OCCC\C=C\I Amb27879078 [0,0,1,0,0,0|2,0,1]=4 1961 B6R0.6 OCC\C=C/CBr Amb27750410 [0,0,1,0,0,0|2,0,1]=4 1962 B6R0.6 OCC\C=C\CCl Amb27227431 [0,0,1,0,0,0|2,0,1]=4 1963 B6R0.6 OC\C=C\C=C\Br Amb27750080 [0,0,1,0,0,0|2,0,1]=4 1964 B6R0.6 OC\C=C\C=C\Cl Amb27858902 [0,0,1,0,0,0|2,0,1]=4 1965 B6R0.6 OC\C=C\CCF Amb33196119 [0,0,1,0,0,0|1,0,2]=4 1966 B6R0.6 OC\C=C\CCO Amb26017278 [0,0,1,0,0,0|1,0,2]=4 1967 B6R0.6 [N-]=[N+]=NCCC=O Amb28050185 [0,0,1,0,0,0|3,0,0]=4 1968 B8R2.5 O=C1NC2N=CC12 Amb28132681 [0,0,0,1,0,0|2,0,1]=4 1969 B8R2.5 O=C1N[C@@H]2C=C[C@H]12 Amb25174979 [0,0,0,1,0,0|1,0,2]=4 1970 B8R2.11 O=C1C2CCCC12 Amb27838225 [0,0,0,1,0,0|0,0,2]=3 1971 B8R2.11 O=C1c2ccsc21 Amb27802559 [0,0,0,1,0,0|1,0,2]=4 1972 B8R2.18 O=C1CC2CC2C1 Amb25750119 [0,0,0,1,0,0|0,0,2]=3 1973 B8R2.18 O=C1CC2OC2C1 Amb25050255 [0,0,0,1,0,0|1,0,2]=4 1974 B8R2.18 O=C1C[C@@H]2C[C@@H]2C1 Amb28350467 [0,0,0,1,0,0|0,0,2]=3 1975 B8R2.25 C1=CC2=CC2C=N1 Amb27228609 [0,0,0,1,0,0|2,0,1]=4 1976 B8R2.25 C1=CC2OC2CC1 Amb26551205 [0,0,0,1,0,0|0,0,2]=3 1977 B8R2.34 C1=C2CCC(C1)C2 Amb28196687 [0,0,0,1,0,0|1,0,1]=3 1978 B8R2.34 C1=CC2CC1CN2 Amb30584680 [0,0,0,1,0,0|2,0,1]=4 1979 B8R2.34 C1=CC2CC1CN2 Amb30633720 [0,0,0,1,0,0|2,0,1]=4 1980 B8R2.34 C1=CC2CC1CN2 Amb9783351 [0,0,0,1,0,0|2,0,1]=4 1981 B8R2.34 C1=CC2CC1CO2 Amb28050221 [0,0,0,1,0,0|2,0,1]=4 1982 B8R2.34 C1=CC2CCC1C2 Amb4034631 [0,0,0,1,0,0|1,0,1]=3 1983 B8R2.34 C1=CC2CCC1N2 Amb18120362 [0,0,0,1,0,0|1,0,1]=3 1984 B8R2.34 C1=CC2CCC1O2 Amb24545043 [0,0,0,1,0,0|0,0,2]=3 1985 B8R2.34 C1=C[C@@H]2CC[C@H]1C2 Amb20670482 [0,0,0,1,0,0|1,0,1]=3 1986 B8R2.34 C1=C[C@@H]2CN[C@H]1C2 Amb10844894 [0,0,0,1,0,0|2,0,1]=4 1987 B8R2.34 C1=C[C@H]2CC[C@H]1C2 Amb28058306 [0,0,0,1,0,0|1,0,1]=3 1988 B8R2.34 C1=C[C@H]2CC[C@H]1O2 Amb27804473 [0,0,0,1,0,0|0,0,2]=3 1989 B8R2.34 C1=C[C@H]2C[C@@H]1CN2 Amb24054358 [0,0,0,1,0,0|2,0,1]=4 1990 B8R2.34 C1=C[C@H]2C[C@@H]1CN2 Amb24118056 [0,0,0,1,0,0|2,0,1]=4 1991 B8R2.38 C=C1CCC2CC12 Amb27836170 [0,0,0,1,0,0|1,0,2]=4 1992 B8R2.38 ClC1C=CC2CC12 Amb27967265 [0,0,0,1,0,0|1,0,1]=3 1993 B8R2.38 ClC1C=C[C@H]2C[C@@H]12 Amb28131831 [0,0,0,1,0,0|1,0,1]=3 1994 B8R2.38 O=C1C=CC2=CC12 Amb27861243 [0,0,0,1,0,0|0,0,2]=3 1995 B8R2.38 O=C1C=CC2OC12 Amb27775734 [0,0,0,1,0,0|1,0,0]=2 1996 B8R2.38 O=C1C=C[C@@H]2C[C@H]12 Amb28052364 [0,0,0,1,0,0|0,0,0]=1 1997 B8R2.38 O=C1CCC2CC12 Amb22736104 [0,0,0,1,0,0|0,0,2]=3 1998 B8R2.38 O=C1CCC2OC12 Amb28141441 [0,0,0,1,0,0|1,0,1]=3 1999 B8R2.38 O=C1CC[C@@H]2C[C@H]12 Amb24623125 [0,0,0,1,0,0|0,0,2]=3 2000 B8R2.38 O=C1CC[C@H]2C[C@@H]12 Amb27845572 [0,0,0,1,0,0|0,0,2]=3 2001 B8R2.38 O=C1CNC2CC12 Amb34142462 [0,0,0,1,0,0|1,0,1]=3 2002 B8R2.38 O=C1CN[C@@H]2C[C@H]12 Amb27630008 [0,0,0,1,0,0|1,0,1]=3 2003 B8R2.38 O=C1NCC2CC12 Amb22546330 [0,0,0,1,0,0|1,0,1]=3 2004 B8R2.38 O=C1NCC2OC12 Amb28143671 [0,0,0,1,0,0|2,0,1]=4 2005 B8R2.38 O=C1NC[C@@H]2C[C@H]12 Amb27961231 [0,0,0,1,0,0|1,0,1]=3 2006 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,1,0,0|1,0,1]=3 2007 B8R2.38 O=C1OC[C@H]2C[C@@H]12 Amb27421949 [0,0,0,1,0,0|1,0,1]=3 2008 B8R2.38 O[C@H]1C=CC2CC21 Amb27805383 [0,0,0,1,0,0|0,0,2]=3 2009 B6R1.2 Bc1ccco1 Amb28286917 [0,0,0,0,1,0|2,0,1]=4 2010 B6R1.2 BrC1=CCCC1 Amb10067271 [0,0,0,0,1,0|1,0,0]=2 2011 B6R1.2 BrC1=CCCO1 Amb24322605 [0,0,0,0,1,0|2,0,0]=3 2012 B6R1.2 BrC1=COCC1 Amb24322594 [0,0,0,0,1,0|2,0,0]=3 2013 B6R1.2 BrC1=NCCN1 Amb28382662 [0,0,0,0,1,0|3,0,0]=4 2014 B6R1.2 BrC1=NCCS1 Amb25987679 [0,0,0,0,1,0|3,0,0]=4 2015 B6R1.2 BrC1CCCC1 Amb2686651 [0,0,0,0,1,0|1,0,2]=4 2016 B6R1.2 BrC1CCCO1 Amb24322808 [0,0,0,0,1,0|2,0,1]=4 2017 B6R1.2 Brc1ccc[se]1 Amb21964756 [0,0,0,0,1,0|2,0,1]=4 2018 B6R1.2 Brc1ccco1 Amb2723041 [0,0,0,0,1,0|2,0,1]=4 2019 B6R1.2 Brc1cccs1 Amb2685504 [0,0,0,0,1,0|2,0,1]=4 2020 B6R1.2 Brc1ccno1 Amb20242149 [0,0,0,0,1,0|3,0,0]=4 2021 B6R1.2 Brc1ccns1 Amb33544135 [0,0,0,0,1,0|3,0,0]=4 2022 B6R1.2 Brc1ccoc1 Amb2720289 [0,0,0,0,1,0|2,0,1]=4 2023 B6R1.2 Brc1ccon1 Amb13890359 [0,0,0,0,1,0|3,0,0]=4 2024 B6R1.2 Brc1ccsc1 Amb2685505 [0,0,0,0,1,0|2,0,1]=4 2025 B6R1.2 Brc1ccsn1 Amb18828880 [0,0,0,0,1,0|3,0,0]=4 2026 B6R1.2 C=C1CCCC1 Amb22337671 [0,0,0,0,1,0|1,0,1]=3 2027 B6R1.2 C=C1CCCS1 Amb28137153 [0,0,0,0,1,0|2,0,0]=3 2028 B6R1.2 C=C1CCNC1 Amb22490848 [0,0,0,0,1,0|2,0,1]=4 2029 B6R1.2 C=C1CCNC1 Amb27782898 [0,0,0,0,1,0|2,0,1]=4 2030 B6R1.2 C=C1CCSC1 Amb26477950 [0,0,0,0,1,0|2,0,1]=4 2031 B6R1.2 C=C1N=CCS1 Amb27796505 [0,0,0,0,1,0|3,0,0]=4 2032 B6R1.2 C=C1OCCO1 Amb24477046 [0,0,0,0,1,0|3,0,0]=4 2033 B6R1.2 CC1=CC=CC1 Amb26338978 [0,0,0,0,1,0|1,0,1]=3 2034 B6R1.2 CC1=CCCC1 Amb8513250 [0,0,0,0,1,0|1,0,0]=2 2035 B6R1.2 CC1=CCCO1 Amb20621083 [0,0,0,0,1,0|2,0,0]=3 2036 B6R1.2 CC1=CSCC1 Amb26495749 [0,0,0,0,1,0|2,0,0]=3 2037 B6R1.2 CC1=NCCC1 Amb8513341 [0,0,0,0,1,0|2,0,0]=3 2038 B6R1.2 CC1=NCCN1 Amb1294344 [0,0,0,0,1,0|3,0,0]=4 2039 B6R1.2 CC1=NCCO1 Amb8395082 [0,0,0,0,1,0|3,0,0]=4 2040 B6R1.2 CC1=NCCS1 Amb6608778 [0,0,0,0,1,0|3,0,0]=4 2041 B6R1.2 CC1=NNCC1 Amb8492492 [0,0,0,0,1,0|3,0,0]=4 2042 B6R1.2 CC1C=CCC1 Amb17674168 [0,0,0,0,1,0|1,0,1]=3 2043 B6R1.2 CC1C=CCN1 Amb24120626 [0,0,0,0,1,0|2,0,1]=4 2044 B6R1.2 CC1C=CCS1 Amb27847945 [0,0,0,0,1,0|2,0,1]=4 2045 B6R1.2 CC1C=CNC1 Amb28040927 [0,0,0,0,1,0|2,0,1]=4 2046 B6R1.2 CC1CCCC1 Amb8516028 [0,0,0,0,1,0|1,0,2]=4 2047 B6R1.2 CC1CCCN1 Amb8387002 [0,0,0,0,1,0|2,0,1]=4 2048 B6R1.2 CC1CCCN1 Amb9713910 [0,0,0,0,1,0|2,0,1]=4 2049 B6R1.2 CC1CCCO1 Amb8385612 [0,0,0,0,1,0|2,0,1]=4 2050 B6R1.2 CC1CCCS1 Amb2689709 [0,0,0,0,1,0|2,0,1]=4 2051 B6R1.2 CC1CCC[Cl+]1 Amb27233495 [0,0,0,0,1,0|2,0,1]=4 2052 B6R1.2 CN1C=NCC1 Amb10565894 [0,0,0,0,1,0|3,0,0]=4 2053 B6R1.2 CN1CCCC1 Amb8513261 [0,0,0,0,1,0|2,0,1]=4 2054 B6R1.2 CN1CCCN1 Amb28058528 [0,0,0,0,1,0|3,0,0]=4 2055 B6R1.2 CN1CCCN1 Amb35826246 [0,0,0,0,1,0|3,0,0]=4 2056 B6R1.2 C[C@@H]1CCCN1 Amb10071006 [0,0,0,0,1,0|2,0,1]=4 2057 B6R1.2 C[C@@H]1CCCN1 Amb8628964 [0,0,0,0,1,0|2,0,1]=4 2058 B6R1.2 C[C@H]1CCCN1 Amb10071007 [0,0,0,0,1,0|2,0,1]=4 2059 B6R1.2 C[C@H]1CCCN1 Amb8387004 [0,0,0,0,1,0|2,0,1]=4 2060 B6R1.2 Cc1ccco1 Amb2447070 [0,0,0,0,1,0|2,0,1]=4 2061 B6R1.2 Cc1cccs1 Amb2447069 [0,0,0,0,1,0|2,0,1]=4 2062 B6R1.2 Cc1ccno1 Amb33544333 [0,0,0,0,1,0|3,0,0]=4 2063 B6R1.2 Cc1ccns1 Amb22734260 [0,0,0,0,1,0|3,0,0]=4 2064 B6R1.2 Cc1ccoc1 Amb2447077 [0,0,0,0,1,0|2,0,1]=4 2065 B6R1.2 Cc1ccon1 Amb4005631 [0,0,0,0,1,0|3,0,0]=4 2066 B6R1.2 Cc1ccsc1 Amb2447071 [0,0,0,0,1,0|2,0,1]=4 2067 B6R1.2 Cc1ccsn1 Amb20621563 [0,0,0,0,1,0|3,0,0]=4 2068 B6R1.2 ClC1=CCC=C1 Amb22584067 [0,0,0,0,1,0|1,0,1]=3 2069 B6R1.2 ClC1=NCCN1 Amb27624895 [0,0,0,0,1,0|3,0,0]=4 2070 B6R1.2 ClC1=NCCO1 Amb8396614 [0,0,0,0,1,0|3,0,0]=4 2071 B6R1.2 ClC1=NCCS1 Amb24621482 [0,0,0,0,1,0|3,0,0]=4 2072 B6R1.2 ClC1C=CCC1 Amb17672585 [0,0,0,0,1,0|1,0,1]=3 2073 B6R1.2 ClC1CCCC1 Amb3940287 [0,0,0,0,1,0|1,0,2]=4 2074 B6R1.2 Clc1ccco1 Amb27805575 [0,0,0,0,1,0|2,0,1]=4 2075 B6R1.2 Clc1cccs1 Amb2686481 [0,0,0,0,1,0|2,0,1]=4 2076 B6R1.2 Clc1ccoc1 Amb24333769 [0,0,0,0,1,0|2,0,1]=4 2077 B6R1.2 Clc1ccon1 Amb33543597 [0,0,0,0,1,0|3,0,0]=4 2078 B6R1.2 Clc1ccsc1 Amb2686482 [0,0,0,0,1,0|2,0,1]=4 2079 B6R1.2 Clc1ccsn1 Amb21927817 [0,0,0,0,1,0|3,0,0]=4 2080 B6R1.2 FC1=CCNC1 Amb35751388 [0,0,0,0,1,0|2,0,0]=3 2081 B6R1.2 FC1=CCNC1 Amb35752602 [0,0,0,0,1,0|2,0,0]=3 2082 B6R1.2 FC1=COCC1 Amb24322813 [0,0,0,0,1,0|2,0,0]=3 2083 B6R1.2 FC1=NCCS1 Amb26341808 [0,0,0,0,1,0|3,0,0]=4 2084 B6R1.2 FC1CCCC1 Amb10839457 [0,0,0,0,1,0|1,0,2]=4 2085 B6R1.2 FC1CCCN1 Amb27590475 [0,0,0,0,1,0|2,0,1]=4 2086 B6R1.2 Fc1ccco1 Amb27470402 [0,0,0,0,1,0|2,0,1]=4 2087 B6R1.2 Fc1cccs1 Amb8388025 [0,0,0,0,1,0|2,0,1]=4 2088 B6R1.2 Fc1ccoc1 Amb26369802 [0,0,0,0,1,0|2,0,1]=4 2089 B6R1.2 Fc1ccsc1 Amb33543454 [0,0,0,0,1,0|2,0,1]=4 2090 B6R1.2 IC1=CCCC1 Amb24332192 [0,0,0,0,1,0|1,0,0]=2 2091 B6R1.2 IC1=CCCO1 Amb24322816 [0,0,0,0,1,0|2,0,0]=3 2092 B6R1.2 IC1=COCC1 Amb24322814 [0,0,0,0,1,0|2,0,0]=3 2093 B6R1.2 IC1CCCC1 Amb3941530 [0,0,0,0,1,0|1,0,2]=4 2094 B6R1.2 IN1CCCC1 Amb27765883 [0,0,0,0,1,0|2,0,1]=4 2095 B6R1.2 Ic1ccco1 Amb17672748 [0,0,0,0,1,0|2,0,1]=4 2096 B6R1.2 Ic1cccs1 Amb2688889 [0,0,0,0,1,0|2,0,1]=4 2097 B6R1.2 Ic1ccns1 Amb25136169 [0,0,0,0,1,0|3,0,0]=4 2098 B6R1.2 Ic1ccoc1 Amb24686192 [0,0,0,0,1,0|2,0,1]=4 2099 B6R1.2 Ic1ccsc1 Amb8393328 [0,0,0,0,1,0|2,0,1]=4 2100 B6R1.2 Ic1ccsn1 Amb32685567 [0,0,0,0,1,0|3,0,0]=4 2101 B6R1.2 N=C1C=CNC1 Amb28135748 [0,0,0,0,1,0|2,0,0]=3 2102 B6R1.2 N=C1CCC=N1 Amb28436317 [0,0,0,0,1,0|2,0,0]=3 2103 B6R1.2 N=C1CCCN1 Amb2371632 [0,0,0,0,1,0|2,0,0]=3 2104 B6R1.2 N=C1CCCN1 Amb501585 [0,0,0,0,1,0|2,0,0]=3 2105 B6R1.2 N=C1CCCS1 Amb10072429 [0,0,0,0,1,0|2,0,0]=3 2106 B6R1.2 N=C1CCCS1 Amb9825646 [0,0,0,0,1,0|2,0,0]=3 2107 B6R1.2 N=C1NCCN1 Amb21859025 [0,0,0,0,1,0|3,0,0]=4 2108 B6R1.2 N=C1NCCO1 Amb20623979 [0,0,0,0,1,0|3,0,0]=4 2109 B6R1.2 N=C1NCCS1 Amb8470061 [0,0,0,0,1,0|3,0,0]=4 2110 B6R1.2 N=C1SCCS1 Amb22168117 [0,0,0,0,1,0|3,0,0]=4 2111 B6R1.2 NC1=CCNN1 Amb22346141 [0,0,0,0,1,0|3,0,0]=4 2112 B6R1.2 NC1=CCNN1 Amb24053526 [0,0,0,0,1,0|3,0,0]=4 2113 B6R1.2 NC1=CCNN1 Amb24080576 [0,0,0,0,1,0|3,0,0]=4 2114 B6R1.2 NC1=CCNN1 Amb6889369 [0,0,0,0,1,0|3,0,0]=4 2115 B6R1.2 NC1=NCC=C1 Amb25208790 [0,0,0,0,1,0|2,0,0]=3 2116 B6R1.2 NC1=NCCC1 Amb10976565 [0,0,0,0,1,0|2,0,0]=3 2117 B6R1.2 NC1=NCCC1 Amb8342250 [0,0,0,0,1,0|2,0,0]=3 2118 B6R1.2 NC1=NCCN1 Amb10810372 [0,0,0,0,1,0|3,0,0]=4 2119 B6R1.2 NC1=NCCO1 Amb24325166 [0,0,0,0,1,0|3,0,0]=4 2120 B6R1.2 NC1=NCCS1 Amb1924859 [0,0,0,0,1,0|3,0,0]=4 2121 B6R1.2 NC1=NCCS1 Amb2684532 [0,0,0,0,1,0|3,0,0]=4 2122 B6R1.2 NC1=NCCS1 Amb6860805 [0,0,0,0,1,0|3,0,0]=4 2123 B6R1.2 NC1=NNCC1 Amb22330617 [0,0,0,0,1,0|3,0,0]=4 2124 B6R1.2 NC1=NNCC1 Amb28555323 [0,0,0,0,1,0|3,0,0]=4 2125 B6R1.2 NC1=NOCC1 Amb27975619 [0,0,0,0,1,0|3,0,0]=4 2126 B6R1.2 NC1C=CCC1 Amb23385329 [0,0,0,0,1,0|1,0,1]=3 2127 B6R1.2 NC1C=CCC1 Amb26367288 [0,0,0,0,1,0|1,0,1]=3 2128 B6R1.2 NC1C=COC1 Amb28068172 [0,0,0,0,1,0|2,0,1]=4 2129 B6R1.2 NC1CCCC1 Amb2792832 [0,0,0,0,1,0|1,0,2]=4 2130 B6R1.2 NC1CCCO1 Amb16233703 [0,0,0,0,1,0|2,0,1]=4 2131 B6R1.2 NN1CCCC1 Amb2720328 [0,0,0,0,1,0|2,0,1]=4 2132 B6R1.2 NN1CCCC1 Amb32651939 [0,0,0,0,1,0|2,0,1]=4 2133 B6R1.2 NN1CCCC1 Amb836837 [0,0,0,0,1,0|2,0,1]=4 2134 B6R1.2 Nc1ccco1 Amb18203215 [0,0,0,0,1,0|2,0,1]=4 2135 B6R1.2 Nc1ccno1 Amb33528297 [0,0,0,0,1,0|3,0,0]=4 2136 B6R1.2 Nc1ccns1 Amb18203020 [0,0,0,0,1,0|3,0,0]=4 2137 B6R1.2 Nc1ccns1 Amb28555333 [0,0,0,0,1,0|3,0,0]=4 2138 B6R1.2 Nc1ccoc1 Amb22230735 [0,0,0,0,1,0|2,0,1]=4 2139 B6R1.2 Nc1ccon1 Amb613464 [0,0,0,0,1,0|3,0,0]=4 2140 B6R1.2 Nc1ccsc1 Amb13889594 [0,0,0,0,1,0|2,0,1]=4 2141 B6R1.2 Nc1ccsc1 Amb17935671 [0,0,0,0,1,0|2,0,1]=4 2142 B6R1.2 Nc1ccsc1 Amb19515444 [0,0,0,0,1,0|2,0,1]=4 2143 B6R1.2 Nc1ccsc1 Amb22405919 [0,0,0,0,1,0|2,0,1]=4 2144 B6R1.2 Nc1ccsn1 Amb22235783 [0,0,0,0,1,0|3,0,0]=4 2145 B6R1.2 Nc1ccsn1 Amb33553648 [0,0,0,0,1,0|3,0,0]=4 2146 B6R1.2 O=C1C=CCC1 Amb4019519 [0,0,0,0,1,0|0,0,0]=1 2147 B6R1.2 O=C1C=CCN1 Amb20241082 [0,0,0,0,1,0|1,0,0]=2 2148 B6R1.2 O=C1C=CCO1 Amb2792769 [0,0,0,0,1,0|1,0,0]=2 2149 B6R1.2 O=C1C=CCS1 Amb22336458 [0,0,0,0,1,0|1,0,0]=2 2150 B6R1.2 O=C1C=CN=N1 Amb22230022 [0,0,0,0,1,0|2,0,0]=3 2151 B6R1.2 O=C1C=CNN1 Amb19958916 [0,0,0,0,1,0|2,0,0]=3 2152 B6R1.2 O=C1C=COC1 Amb24107591 [0,0,0,0,1,0|1,0,0]=2 2153 B6R1.2 O=C1C=CSN1 Amb19895016 [0,0,0,0,1,0|2,0,0]=3 2154 B6R1.2 O=C1C=CSS1 Amb27421370 [0,0,0,0,1,0|2,0,0]=3 2155 B6R1.2 O=C1C=NCN1 Amb26572891 [0,0,0,0,1,0|2,0,0]=3 2156 B6R1.2 O=C1C=NCO1 Amb25786221 [0,0,0,0,1,0|2,0,0]=3 2157 B6R1.2 O=C1C=NN=C1 Amb28351406 [0,0,0,0,1,0|2,0,1]=4 2158 B6R1.2 O=C1CC=CC1 Amb2686649 [0,0,0,0,1,0|0,0,2]=3 2159 B6R1.2 O=C1CC=CN1 Amb22235167 [0,0,0,0,1,0|1,0,1]=3 2160 B6R1.2 O=C1CC=NN1 Amb3428206 [0,0,0,0,1,0|2,0,1]=4 2161 B6R1.2 O=C1CC=NO1 Amb27654112 [0,0,0,0,1,0|2,0,1]=4 2162 B6R1.2 O=C1CCCC1 Amb2793024 [0,0,0,0,1,0|0,0,1]=2 2163 B6R1.2 O=C1CCCN1 Amb22169686 [0,0,0,0,1,0|1,0,0]=2 2164 B6R1.2 O=C1CCCN1 Amb6608645 [0,0,0,0,1,0|1,0,0]=2 2165 B6R1.2 O=C1CCCO1 Amb3940401 [0,0,0,0,1,0|1,0,0]=2 2166 B6R1.2 O=C1CCCS1 Amb22338102 [0,0,0,0,1,0|1,0,0]=2 2167 B6R1.2 O=C1CCNC1 Amb2700623 [0,0,0,0,1,0|1,0,1]=3 2168 B6R1.2 O=C1CCNC1 Amb8386645 [0,0,0,0,1,0|1,0,1]=3 2169 B6R1.2 O=C1CCNN1 Amb33551041 [0,0,0,0,1,0|2,0,0]=3 2170 B6R1.2 O=C1CCNN1 Amb3428540 [0,0,0,0,1,0|2,0,0]=3 2171 B6R1.2 O=C1CCOC1 Amb7990143 [0,0,0,0,1,0|1,0,1]=3 2172 B6R1.2 O=C1CCON1 Amb22235009 [0,0,0,0,1,0|2,0,0]=3 2173 B6R1.2 O=C1CCSC1 Amb2720904 [0,0,0,0,1,0|1,0,1]=3 2174 B6R1.2 O=C1CN=CS1 Amb27963219 [0,0,0,0,1,0|2,0,0]=3 2175 B6R1.2 O=C1CNCN1 Amb19957368 [0,0,0,0,1,0|2,0,0]=3 2176 B6R1.2 O=C1CNCS1 Amb27443758 [0,0,0,0,1,0|2,0,0]=3 2177 B6R1.2 O=C1COCN1 Amb28132686 [0,0,0,0,1,0|2,0,0]=3 2178 B6R1.2 O=C1CSCN1 Amb28187121 [0,0,0,0,1,0|2,0,0]=3 2179 B6R1.2 O=C1CSSC1 Amb28351444 [0,0,0,0,1,0|2,0,1]=4 2180 B6R1.2 O=C1N=CC=N1 Amb25138138 [0,0,0,0,1,0|2,0,1]=4 2181 B6R1.2 O=C1N=CN=N1 Amb3614275 [0,0,0,0,1,0|3,0,0]=4 2182 B6R1.2 O=C1NC=CN1 Amb19516737 [0,0,0,0,1,0|2,0,1]=4 2183 B6R1.2 O=C1NC=CO1 Amb20671008 [0,0,0,0,1,0|2,0,1]=4 2184 B6R1.2 O=C1NC=CS1 Amb19271596 [0,0,0,0,1,0|2,0,1]=4 2185 B6R1.2 O=C1NC=NN1 Amb20243425 [0,0,0,0,1,0|3,0,0]=4 2186 B6R1.2 O=C1NCCN1 Amb6357221 [0,0,0,0,1,0|2,0,0]=3 2187 B6R1.2 O=C1NCCN1 Amb6608941 [0,0,0,0,1,0|2,0,0]=3 2188 B6R1.2 O=C1NCCO1 Amb6608807 [0,0,0,0,1,0|2,0,0]=3 2189 B6R1.2 O=C1NCCS1 Amb431322 [0,0,0,0,1,0|2,0,0]=3 2190 B6R1.2 O=C1NN=CO1 Amb20667671 [0,0,0,0,1,0|3,0,0]=4 2191 B6R1.2 O=C1NN=CS1 Amb22491285 [0,0,0,0,1,0|3,0,0]=4 2192 B6R1.2 O=C1OC=CO1 Amb20239430 [0,0,0,0,1,0|2,0,1]=4 2193 B6R1.2 O=C1OCCO1 Amb4057710 [0,0,0,0,1,0|2,0,0]=3 2194 B6R1.2 O=C1OCCS1 Amb27398683 [0,0,0,0,1,0|2,0,0]=3 2195 B6R1.2 O=S1C=CC=C1 Amb27787698 [0,0,0,0,1,0|1,0,2]=4 2196 B6R1.2 O=S1CCCC1 Amb2690579 [0,0,0,0,1,0|1,0,1]=3 2197 B6R1.2 O=S1CCNC1 Amb28075495 [0,0,0,0,1,0|2,0,1]=4 2198 B6R1.2 O=S1OCCO1 Amb8383890 [0,0,0,0,1,0|3,0,0]=4 2199 B6R1.2 O=[PH]1CC=CC1 Amb35747085 [0,0,0,0,1,0|1,0,2]=4 2200 B6R1.2 O=[PH]1CCCC1 Amb33804724 [0,0,0,0,1,0|1,0,1]=3 2201 B6R1.2 O=[PH]1OCCO1 Amb22346149 [0,0,0,0,1,0|3,0,0]=4 2202 B6R1.2 OC1=NC=NC1 Amb26446352 [0,0,0,0,1,0|2,0,1]=4 2203 B6R1.2 OC1=NNCC1 Amb2111955 [0,0,0,0,1,0|2,0,1]=4 2204 B6R1.2 OC1=NNCC1 Amb844737 [0,0,0,0,1,0|2,0,1]=4 2205 B6R1.2 OC1C=CCC1 Amb33546881 [0,0,0,0,1,0|0,0,2]=3 2206 B6R1.2 OC1CCCC1 Amb3939016 [0,0,0,0,1,0|0,0,3]=4 2207 B6R1.2 OC1CCCN1 Amb28120620 [0,0,0,0,1,0|1,0,2]=4 2208 B6R1.2 OC1CCCO1 Amb17615892 [0,0,0,0,1,0|1,0,2]=4 2209 B6R1.2 OC1CCCS1 Amb27864587 [0,0,0,0,1,0|1,0,2]=4 2210 B6R1.2 ON1CCCC1 Amb30988006 [0,0,0,0,1,0|1,0,2]=4 2211 B6R1.2 ON1CCCC1 Amb4035438 [0,0,0,0,1,0|1,0,2]=4 2212 B6R1.2 O[C@H]1C=CCC1 Amb28133982 [0,0,0,0,1,0|0,0,2]=3 2213 B6R1.2 O[C@H]1C=COC1 Amb27242778 [0,0,0,0,1,0|1,0,2]=4 2214 B6R1.2 Oc1ccco1 Amb25991417 [0,0,0,0,1,0|1,0,2]=4 2215 B6R1.2 Oc1cccs1 Amb17201836 [0,0,0,0,1,0|1,0,2]=4 2216 B6R1.2 Oc1ccon1 Amb33547602 [0,0,0,0,1,0|2,0,1]=4 2217 B6R1.2 Oc1ccsc1 Amb16231253 [0,0,0,0,1,0|1,0,2]=4 2218 B6R1.2 Oc1ccsn1 Amb22371253 [0,0,0,0,1,0|2,0,1]=4 2219 B6R1.2 PN1CCCC1 Amb27430446 [0,0,0,0,1,0|2,0,1]=4 2220 B6R1.2 S=C1C=CCO1 Amb27971151 [0,0,0,0,1,0|1,1,0]=3 2221 B6R1.2 S=C1C=CSS1 Amb19132030 [0,0,0,0,1,0|2,1,0]=4 2222 B6R1.2 S=C1CC=CN1 Amb27239207 [0,0,0,0,1,0|1,1,1]=4 2223 B6R1.2 S=C1CCCC1 Amb28049287 [0,0,0,0,1,0|0,1,1]=3 2224 B6R1.2 S=C1CCCN1 Amb2778514 [0,0,0,0,1,0|1,1,0]=3 2225 B6R1.2 S=C1CCCO1 Amb27808589 [0,0,0,0,1,0|1,1,0]=3 2226 B6R1.2 S=C1CN=CS1 Amb24093708 [0,0,0,0,1,0|2,1,0]=4 2227 B6R1.2 S=C1COC=N1 Amb27636708 [0,0,0,0,1,0|2,1,0]=4 2228 B6R1.2 S=C1NCCN1 Amb2720352 [0,0,0,0,1,0|2,1,0]=4 2229 B6R1.2 S=C1NCCO1 Amb2371644 [0,0,0,0,1,0|2,1,0]=4 2230 B6R1.2 S=C1NCCS1 Amb4010551 [0,0,0,0,1,0|2,1,0]=4 2231 B6R1.2 S=C1SCCS1 Amb8517514 [0,0,0,0,1,0|2,1,0]=4 2232 B6R1.2 SC1=NCCN1 Amb3778841 [0,0,0,0,1,0|2,1,0]=4 2233 B6R1.2 SC1=NCCS1 Amb2720331 [0,0,0,0,1,0|2,1,0]=4 2234 B6R1.2 SC1C=CCC1 Amb32788808 [0,0,0,0,1,0|0,1,1]=3 2235 B6R1.2 SC1CCCC1 Amb6608767 [0,0,0,0,1,0|0,1,2]=4 2236 B6R1.2 Sc1ccco1 Amb26641519 [0,0,0,0,1,0|1,1,1]=4 2237 B6R1.2 Sc1cccs1 Amb2689075 [0,0,0,0,1,0|1,1,1]=4 2238 B6R1.2 Sc1ccoc1 Amb25979686 [0,0,0,0,1,0|1,1,1]=4 2239 B6R1.2 Sc1ccon1 Amb26338955 [0,0,0,0,1,0|2,1,0]=4 2240 B6R1.2 Sc1ccsc1 Amb16232450 [0,0,0,0,1,0|1,1,1]=4 2241 B6R1.2 [O-][N+]1=CCCC1 Amb28066729 [0,0,0,0,1,0|1,0,1]=3 2242 B6R1.2 [O-][N+]1=CCNC1 Amb27963190 [0,0,0,0,1,0|2,0,1]=4 2243 B6R1.2 [SiH3]C1CCCC1 Amb22229567 [0,0,0,0,1,0|1,0,2]=4 2244 B8R1.22 BrC1=CCCCCC1 Amb10071167 [0,0,0,0,0,1|1,0,1]=3 2245 B8R1.22 BrC1=CCOCOC1 Amb24087656 [0,0,0,0,0,1|2,0,1]=4 2246 B8R1.22 BrC1C=CC=CCC1 Amb27629198 [0,0,0,0,0,1|1,0,2]=4 2247 B8R1.22 C=C1CCCNCC1 Amb30982578 [0,0,0,0,0,1|1,0,2]=4 2248 B8R1.22 C=C1CCCSCC1 Amb35674113 [0,0,0,0,0,1|1,0,2]=4 2249 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,0,0,0,0,1|2,0,1]=4 2250 B8R1.22 CC1=CC=NCCN1 Amb27844506 [0,0,0,0,0,1|2,0,0]=3 2251 B8R1.22 CC1=CCCCCC1 Amb22227978 [0,0,0,0,0,1|1,0,1]=3 2252 B8R1.22 NC1=NCCCCC1 Amb19514661 [0,0,0,0,0,1|1,0,2]=4 2253 B8R1.22 NC1=NCCCCC1 Amb4451463 [0,0,0,0,0,1|1,0,2]=4 2254 B8R1.22 NC1=NCCCCN1 Amb28119984 [0,0,0,0,0,1|2,0,1]=4 2255 B8R1.22 NC1=NCCCCS1 Amb27592425 [0,0,0,0,0,1|2,0,1]=4 2256 B8R1.22 NC1=NCCCSC1 Amb25688170 [0,0,0,0,0,1|2,0,1]=4 2257 B8R1.22 NC1C=CCCCC1 Amb24377373 [0,0,0,0,0,1|1,0,1]=3 2258 B8R1.22 NC1CC=CCCC1 Amb27408037 [0,0,0,0,0,1|1,0,1]=3 2259 B8R1.22 O=C1C=CC=CC=C1 Amb19883798 [0,0,0,0,0,1|0,0,3]=4 2260 B8R1.22 O=C1C=CC=CCC1 Amb17593120 [0,0,0,0,0,1|0,0,1]=2 2261 B8R1.22 O=C1C=CC=NC=C1 Amb27599481 [0,0,0,0,0,1|0,0,3]=4 2262 B8R1.22 O=C1C=CCC=CC1 Amb28316220 [0,0,0,0,0,1|0,0,1]=2 2263 B8R1.22 O=C1C=CCCC=C1 Amb22364722 [0,0,0,0,0,1|0,0,1]=2 2264 B8R1.22 O=C1C=CCCCC1 Amb10601704 [0,0,0,0,0,1|0,0,0]=1 2265 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,0,0,0,0,1|0,0,0]=1 2266 B8R1.22 O=C1C=CNCCS1 Amb27655609 [0,0,0,0,0,1|1,0,0]=2 2267 B8R1.22 O=C1C=CSCCN1 Amb27202061 [0,0,0,0,0,1|1,0,0]=2 2268 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,0,0,0,0,1|0,0,0]=1 2269 B8R1.22 O=C1CC=CCCN1 Amb27830230 [0,0,0,0,0,1|1,0,0]=2 2270 B8R1.22 O=C1CC=COCC1 Amb27835241 [0,0,0,0,0,1|1,0,0]=2 2271 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,0,0,0,0,1|0,0,2]=3 2272 B8R1.22 O=C1CCC=COC1 Amb27812549 [0,0,0,0,0,1|0,0,2]=3 2273 B8R1.22 O=C1CCCCCC1 Amb4135729 [0,0,0,0,0,1|0,0,2]=3 2274 B8R1.22 O=C1CCCCCN1 Amb6364991 [0,0,0,0,0,1|0,0,2]=3 2275 B8R1.22 O=C1CCCCCO1 Amb8513719 [0,0,0,0,0,1|0,0,2]=3 2276 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,0,0,0,0,1|0,0,2]=3 2277 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,0,0,0,0,1|0,0,2]=3 2278 B8R1.22 O=C1CCCCNC1 Amb22000936 [0,0,0,0,0,1|0,0,2]=3 2279 B8R1.22 O=C1CCCCNC1 Amb25922210 [0,0,0,0,0,1|0,0,2]=3 2280 B8R1.22 O=C1CCCNCC1 Amb8393630 [0,0,0,0,0,1|0,0,2]=3 2281 B8R1.22 O=C1CCCNCC1 Amb9174228 [0,0,0,0,0,1|0,0,2]=3 2282 B8R1.22 O=C1CCCOCC1 Amb25873789 [0,0,0,0,0,1|0,0,2]=3 2283 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,0,0,0,0,1|0,0,2]=3 2284 B8R1.22 O=C1CCCSCN1 Amb27879423 [0,0,0,0,0,1|1,0,1]=3 2285 B8R1.22 O=C1CCNCCN1 Amb10069937 [0,0,0,0,0,1|1,0,1]=3 2286 B8R1.22 O=C1CCNCCN1 Amb1107713 [0,0,0,0,0,1|1,0,1]=3 2287 B8R1.22 O=C1CCNCCN1 Amb483265 [0,0,0,0,0,1|1,0,1]=3 2288 B8R1.22 O=C1CCNCCO1 Amb27760600 [0,0,0,0,0,1|1,0,1]=3 2289 B8R1.22 O=C1CCNNCC1 Amb28421828 [0,0,0,0,0,1|1,0,2]=4 2290 B8R1.22 O=C1CCOCCN1 Amb13951193 [0,0,0,0,0,1|1,0,1]=3 2291 B8R1.22 O=C1CCOCOC1 Amb27434094 [0,0,0,0,0,1|1,0,1]=3 2292 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,0,0,0,0,1|1,0,1]=3 2293 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,0,0,0,0,1|1,0,1]=3 2294 B8R1.22 O=C1CNCCCN1 Amb6739889 [0,0,0,0,0,1|1,0,1]=3 2295 B8R1.22 O=C1CNCCNC1 Amb30867934 [0,0,0,0,0,1|1,0,1]=3 2296 B8R1.22 O=C1COCCCN1 Amb22371065 [0,0,0,0,0,1|1,0,1]=3 2297 B8R1.22 O=C1COCCOC1 Amb22284314 [0,0,0,0,0,1|1,0,1]=3 2298 B8R1.22 O=C1CSCCSC1 Amb8503291 [0,0,0,0,0,1|1,0,1]=3 2299 B8R1.22 O=C1NCCCCN1 Amb25960043 [0,0,0,0,0,1|1,0,1]=3 2300 B8R1.22 O=C1NCCCCO1 Amb27405440 [0,0,0,0,0,1|1,0,1]=3 2301 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,0,0,0,0,1|1,0,1]=3 2302 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,0,0,0,0,1|1,0,2]=4 2303 B8R1.22 O=S1OCCCCO1 Amb9787325 [0,0,0,0,0,1|2,0,1]=4 2304 B8R1.22 OC1C=CC=CCC1 Amb27766443 [0,0,0,0,0,1|0,0,3]=4 2305 B8R1.22 OC1C=CCCCC1 Amb26034783 [0,0,0,0,0,1|0,0,2]=3 2306 B8R1.22 OC1C=COCOC1 Amb27653186 [0,0,0,0,0,1|1,0,2]=4 2307 B8R1.22 O[C@@H]1C=CCCCC1 Amb28205998 [0,0,0,0,0,1|0,0,2]=3 2308 B8R1.22 S=C1C=CSCCN1 Amb27398650 [0,0,0,0,0,1|1,1,0]=3 2309 B8R1.22 S=C1CCCCCN1 Amb1935077 [0,0,0,0,0,1|0,1,2]=4 2310 B8R1.22 S=C1NCCCCN1 Amb2724259 [0,0,0,0,0,1|1,1,1]=4 2311 B5R0.1 BC(=O)NCC Amb27430059 [1,0,1,0,0,0|2,0,0]=4 2312 B5R0.1 C=C(Br)CCBr Amb25827098 [1,0,1,0,0,0|2,0,0]=4 2313 B5R0.1 C=C(Br)CCCl Amb8391241 [1,0,1,0,0,0|2,0,0]=4 2314 B5R0.1 C=C(Br)CCO Amb4014497 [1,0,1,0,0,0|2,0,0]=4 2315 B5R0.1 C=C(Br)CNC Amb18950247 [1,0,1,0,0,0|2,0,0]=4 2316 B5R0.1 C=C(Br)COC Amb25361496 [1,0,1,0,0,0|2,0,0]=4 2317 B5R0.1 C=C(Br)CSC Amb28313326 [1,0,1,0,0,0|2,0,0]=4 2318 B5R0.1 C=C(C)CCBr Amb21857866 [1,0,1,0,0,0|2,0,0]=4 2319 B5R0.1 C=C(C)CCC Amb8513259 [1,0,1,0,0,0|1,0,0]=3 2320 B5R0.1 C=C(C)CCCl Amb27810807 [1,0,1,0,0,0|2,0,0]=4 2321 B5R0.1 C=C(C)CCI Amb26649317 [1,0,1,0,0,0|2,0,0]=4 2322 B5R0.1 C=C(C)CCN Amb17673481 [1,0,1,0,0,0|2,0,0]=4 2323 B5R0.1 C=C(C)CCN Amb33543001 [1,0,1,0,0,0|2,0,0]=4 2324 B5R0.1 C=C(C)CCO Amb34916534 [1,0,1,0,0,0|2,0,0]=4 2325 B5R0.1 C=C(C)CCO Amb8513522 [1,0,1,0,0,0|2,0,0]=4 2326 B5R0.1 C=C(C)CCS Amb25887673 [1,0,1,0,0,0|2,0,0]=4 2327 B5R0.1 C=C(C)CNC Amb30625043 [1,0,1,0,0,0|2,0,0]=4 2328 B5R0.1 C=C(C)CNC Amb3941317 [1,0,1,0,0,0|2,0,0]=4 2329 B5R0.1 C=C(C)COC Amb26589016 [1,0,1,0,0,0|2,0,0]=4 2330 B5R0.1 C=C(C)CSC Amb20671946 [1,0,1,0,0,0|2,0,0]=4 2331 B5R0.1 C=C(C)OCC Amb8393241 [1,0,1,0,0,0|2,0,0]=4 2332 B5R0.1 C=C(Cl)CCI Amb28187982 [1,0,1,0,0,0|2,0,0]=4 2333 B5R0.1 C=C(Cl)CCN Amb27493165 [1,0,1,0,0,0|2,0,0]=4 2334 B5R0.1 C=C(F)CNC Amb28194424 [1,0,1,0,0,0|2,0,0]=4 2335 B5R0.1 C=CC=C(C)C Amb22229813 [1,0,1,0,0,0|1,0,1]=4 2336 B5R0.1 C=CCC(=C)C Amb22347764 [1,0,1,0,0,0|1,0,1]=4 2337 B5R0.1 C=CCC(=O)Cl Amb33543701 [1,0,1,0,0,0|1,0,1]=4 2338 B5R0.1 C=CCC(=O)O Amb3940098 [1,0,1,0,0,0|1,0,1]=4 2339 B5R0.1 C=CCC(C)=O Amb8396482 [1,0,1,0,0,0|0,0,2]=4 2340 B5R0.1 C=CCC(N)=O Amb17610156 [1,0,1,0,0,0|1,0,1]=4 2341 B5R0.1 C=CNC(C)=O Amb24323579 [1,0,1,0,0,0|1,0,1]=4 2342 B5R0.1 C=COC(C)=O Amb8513382 [1,0,1,0,0,0|1,0,1]=4 2343 B5R0.1 C=NCC(N)=O Amb26548445 [1,0,1,0,0,0|2,0,0]=4 2344 B5R0.1 CC#CC(C)=O Amb17593016 [1,0,1,0,0,0|0,0,2]=4 2345 B5R0.1 CC(=O)C=C=O Amb10603952 [1,0,1,0,0,0|1,0,1]=4 2346 B5R0.1 CC(=O)C=[N+]=[N-] Amb27808588 [1,0,1,0,0,0|2,0,0]=4 2347 B5R0.1 CC(=O)CC=N Amb28285098 [1,0,1,0,0,0|1,0,1]=4 2348 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,1,0,0,0|1,0,1]=4 2349 B5R0.1 CC(=O)CCCl Amb2720823 [1,0,1,0,0,0|1,0,1]=4 2350 B5R0.1 CC(=O)CCF Amb26427773 [1,0,1,0,0,0|1,0,1]=4 2351 B5R0.1 CC(=O)CCN Amb18632933 [1,0,1,0,0,0|1,0,1]=4 2352 B5R0.1 CC(=O)CCN Amb33544540 [1,0,1,0,0,0|1,0,1]=4 2353 B5R0.1 CC(=O)CCO Amb836357 [1,0,1,0,0,0|1,0,1]=4 2354 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [1,0,1,0,0,0|1,0,1]=4 2355 B5R0.1 CC(=O)NC=O Amb27850191 [1,0,1,0,0,0|2,0,0]=4 2356 B5R0.1 CC(=O)NCO Amb8516057 [1,0,1,0,0,0|2,0,0]=4 2357 B5R0.1 CC(=O)OC=O Amb25283525 [1,0,1,0,0,0|2,0,0]=4 2358 B5R0.1 CC(=O)OCBr Amb3941481 [1,0,1,0,0,0|2,0,0]=4 2359 B5R0.1 CC(=O)OCCl Amb33542858 [1,0,1,0,0,0|2,0,0]=4 2360 B5R0.1 CC(=O)OCI Amb25226851 [1,0,1,0,0,0|2,0,0]=4 2361 B5R0.1 CC(=O)SCBr Amb25349900 [1,0,1,0,0,0|2,0,0]=4 2362 B5R0.1 CC(=O)SCI Amb33339258 [1,0,1,0,0,0|2,0,0]=4 2363 B5R0.1 CC(=O)SCO Amb27255261 [1,0,1,0,0,0|2,0,0]=4 2364 B5R0.1 CC(=O)\C=C/N Amb25147403 [1,0,1,0,0,0|1,0,0]=3 2365 B5R0.1 CC(=O)\C=C/[O-] Amb30876865 [1,0,1,0,0,0|1,0,0]=3 2366 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [1,0,1,0,0,0|1,0,0]=3 2367 B5R0.1 CC(=O)\C=C\N Amb8395283 [1,0,1,0,0,0|1,0,0]=3 2368 B5R0.1 CC(=O)\C=C\[O-] Amb32644521 [1,0,1,0,0,0|1,0,0]=3 2369 B5R0.1 CC(=O)\C=N/O Amb26474151 [1,0,1,0,0,0|2,0,0]=4 2370 B5R0.1 CC(=O)\C=N\O Amb33719017 [1,0,1,0,0,0|2,0,0]=4 2371 B5R0.1 CC(=O)\C=N\O Amb8395285 [1,0,1,0,0,0|2,0,0]=4 2372 B5R0.1 CC(C)=CC=O Amb8385061 [1,0,1,0,0,0|2,0,0]=4 2373 B5R0.1 CC(C)=CCBr Amb3940211 [1,0,1,0,0,0|2,0,0]=4 2374 B5R0.1 CC(C)=CCCl Amb2371433 [1,0,1,0,0,0|2,0,0]=4 2375 B5R0.1 CC(C)=CCN Amb10601678 [1,0,1,0,0,0|2,0,0]=4 2376 B5R0.1 CC(C)=CCN Amb10601679 [1,0,1,0,0,0|2,0,0]=4 2377 B5R0.1 CC(C)=CCO Amb4605830 [1,0,1,0,0,0|2,0,0]=4 2378 B5R0.1 CC(C)=CCS Amb17617244 [1,0,1,0,0,0|2,0,0]=4 2379 B5R0.1 CCC=C(Br)Br Amb25887651 [1,0,1,0,0,0|2,0,0]=4 2380 B5R0.1 CCC=C(C)C Amb22336412 [1,0,1,0,0,0|1,0,0]=3 2381 B5R0.1 CCC=C(F)F Amb10839842 [1,0,1,0,0,0|2,0,0]=4 2382 B5R0.1 CCCC(=N)N Amb10610381 [1,0,1,0,0,0|2,0,0]=4 2383 B5R0.1 CCCC(=N)N Amb2695914 [1,0,1,0,0,0|2,0,0]=4 2384 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,1,0,0,0|1,0,0]=3 2385 B5R0.1 CCCC(=O)Cl Amb2792903 [1,0,1,0,0,0|1,0,0]=3 2386 B5R0.1 CCCC(=O)O Amb3939012 [1,0,1,0,0,0|1,0,0]=3 2387 B5R0.1 CCCC(=O)[O-] Amb8514901 [1,0,1,0,0,0|1,0,0]=3 2388 B5R0.1 CCCC(=S)Cl Amb24626931 [1,0,1,0,0,0|1,1,0]=4 2389 B5R0.1 CCCC(C)=O Amb6608910 [1,0,1,0,0,0|0,0,1]=3 2390 B5R0.1 CCCC(N)=O Amb3886524 [1,0,1,0,0,0|1,0,0]=3 2391 B5R0.1 CCCC(N)=S Amb6245403 [1,0,1,0,0,0|1,1,0]=4 2392 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [1,0,1,0,0,0|2,0,0]=4 2393 B5R0.1 CCCC(O)=S Amb22229383 [1,0,1,0,0,0|1,0,1]=4 2394 B5R0.1 CCCS(=O)Cl Amb25025566 [1,0,1,0,0,0|2,0,0]=4 2395 B5R0.1 CCCS(=O)[O-] Amb19929119 [1,0,1,0,0,0|2,0,0]=4 2396 B5R0.1 CCCS(N)=O Amb24733579 [1,0,1,0,0,0|2,0,0]=4 2397 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [1,0,1,0,0,0|2,0,0]=4 2398 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,1,0,0,0|2,0,0]=4 2399 B5R0.1 CCNC(C)=O Amb2780415 [1,0,1,0,0,0|1,0,0]=3 2400 B5R0.1 CCNC(N)=O Amb6608844 [1,0,1,0,0,0|2,0,0]=4 2401 B5R0.1 CCOC(=O)Cl Amb2793045 [1,0,1,0,0,0|2,0,0]=4 2402 B5R0.1 CCOC(=O)O Amb8393208 [1,0,1,0,0,0|2,0,0]=4 2403 B5R0.1 CCOC(C)=N Amb8394853 [1,0,1,0,0,0|2,0,0]=4 2404 B5R0.1 CCOC(C)=N Amb8514666 [1,0,1,0,0,0|2,0,0]=4 2405 B5R0.1 CCOC(C)=O Amb3940488 [1,0,1,0,0,0|1,0,0]=3 2406 B5R0.1 CCOC(C)=S Amb22047276 [1,0,1,0,0,0|1,1,0]=4 2407 B5R0.1 CCOC(N)=O Amb6608672 [1,0,1,0,0,0|2,0,0]=4 2408 B5R0.1 CCSC(=O)Cl Amb8516064 [1,0,1,0,0,0|2,0,0]=4 2409 B5R0.1 CCSC(C)=S Amb8394854 [1,0,1,0,0,0|1,1,0]=4 2410 B5R0.1 CNC=C(C)C Amb28313754 [1,0,1,0,0,0|2,0,0]=4 2411 B5R0.1 CNCC(=O)O Amb6298808 [1,0,1,0,0,0|2,0,0]=4 2412 B5R0.1 CNCC(=O)O Amb6599996 [1,0,1,0,0,0|2,0,0]=4 2413 B5R0.1 CNCC(=O)[O-] Amb20246714 [1,0,1,0,0,0|2,0,0]=4 2414 B5R0.1 CNCC(C)=O Amb17621974 [1,0,1,0,0,0|1,0,1]=4 2415 B5R0.1 CNCC(C)=O Amb21959975 [1,0,1,0,0,0|1,0,1]=4 2416 B5R0.1 CNCC(N)=O Amb19134307 [1,0,1,0,0,0|2,0,0]=4 2417 B5R0.1 CNCC(N)=O Amb3940074 [1,0,1,0,0,0|2,0,0]=4 2418 B5R0.1 CNCC(N)=O Amb9151172 [1,0,1,0,0,0|2,0,0]=4 2419 B5R0.1 COC=C(C)C Amb25063853 [1,0,1,0,0,0|2,0,0]=4 2420 B5R0.1 COCC(=O)Cl Amb3939326 [1,0,1,0,0,0|2,0,0]=4 2421 B5R0.1 COCC(=O)O Amb3939876 [1,0,1,0,0,0|2,0,0]=4 2422 B5R0.1 COCC(C)=O Amb8513767 [1,0,1,0,0,0|1,0,1]=4 2423 B5R0.1 COCC(N)=O Amb1153776 [1,0,1,0,0,0|2,0,0]=4 2424 B5R0.1 CONC(C)=O Amb25046114 [1,0,1,0,0,0|2,0,0]=4 2425 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,1,0,0,0|2,0,0]=4 2426 B5R0.1 CSCC(=O)O Amb1152425 [1,0,1,0,0,0|2,0,0]=4 2427 B5R0.1 CSCC(C)=O Amb20621731 [1,0,1,0,0,0|1,0,1]=4 2428 B5R0.1 CSCC(N)=O Amb19515874 [1,0,1,0,0,0|2,0,0]=4 2429 B5R0.1 CSNC(C)=O Amb22500292 [1,0,1,0,0,0|2,0,0]=4 2430 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [1,0,1,0,0,0|2,0,0]=4 2431 B5R0.1 C\C(Br)=C/C=O Amb27202112 [1,0,1,0,0,0|2,0,0]=4 2432 B5R0.1 C\C(Br)=C/CO Amb30621790 [1,0,1,0,0,0|2,0,0]=4 2433 B5R0.1 C\C(Br)=C\C=O Amb27201671 [1,0,1,0,0,0|2,0,0]=4 2434 B5R0.1 C\C(Cl)=C/CCl Amb25917865 [1,0,1,0,0,0|2,0,0]=4 2435 B5R0.1 C\C(Cl)=C\CCl Amb24564316 [1,0,1,0,0,0|2,0,0]=4 2436 B5R0.1 C\C(Cl)=C\CI Amb27185852 [1,0,1,0,0,0|2,0,0]=4 2437 B5R0.1 C\C(Cl)=C\CN Amb2693573 [1,0,1,0,0,0|2,0,0]=4 2438 B5R0.1 C\C(Cl)=C\CO Amb25663061 [1,0,1,0,0,0|2,0,0]=4 2439 B5R0.1 C\C(I)=C/CO Amb17616110 [1,0,1,0,0,0|2,0,0]=4 2440 B5R0.1 C\C(I)=C\CCl Amb27619763 [1,0,1,0,0,0|2,0,0]=4 2441 B5R0.1 C\C(I)=C\CI Amb27843437 [1,0,1,0,0,0|2,0,0]=4 2442 B5R0.1 C\C(I)=C\CN Amb27216485 [1,0,1,0,0,0|2,0,0]=4 2443 B5R0.1 C\C(I)=C\CO Amb30621783 [1,0,1,0,0,0|2,0,0]=4 2444 B5R0.1 C\C(N)=C/C=O Amb2612039 [1,0,1,0,0,0|2,0,0]=4 2445 B5R0.1 C\C(O)=C\CN Amb33294274 [1,0,1,0,0,0|1,0,1]=4 2446 B5R0.1 C\C=C/C(=O)O Amb27779315 [1,0,1,0,0,0|1,0,0]=3 2447 B5R0.1 C\C=C/C(C)=O Amb28351405 [1,0,1,0,0,0|0,0,0]=2 2448 B5R0.1 C\C=C/C(C)C Amb20618870 [1,0,1,0,0,0|1,0,1]=4 2449 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,1,0,0,0|1,0,0]=3 2450 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [1,0,1,0,0,0|1,0,0]=3 2451 B5R0.1 C\C=C\C(=O)O Amb8385856 [1,0,1,0,0,0|1,0,0]=3 2452 B5R0.1 C\C=C\C(C)=O Amb33941980 [1,0,1,0,0,0|0,0,0]=2 2453 B5R0.1 C\C=C\C(C)Br Amb24725263 [1,0,1,0,0,0|1,0,1]=4 2454 B5R0.1 C\C=C\C(C)C Amb4019538 [1,0,1,0,0,0|1,0,1]=4 2455 B5R0.1 C\C=C\C(C)Cl Amb24377224 [1,0,1,0,0,0|1,0,1]=4 2456 B5R0.1 C\C=C\C(C)N Amb19514513 [1,0,1,0,0,0|1,0,1]=4 2457 B5R0.1 C\C=C\C(C)N Amb33295164 [1,0,1,0,0,0|1,0,1]=4 2458 B5R0.1 C\C=C\C(C)O Amb2721243 [1,0,1,0,0,0|0,0,2]=4 2459 B5R0.1 C\C=C\C(N)=O Amb4025906 [1,0,1,0,0,0|1,0,0]=3 2460 B5R0.1 C\C=C\S(=O)[O-] Amb32754562 [1,0,1,0,0,0|2,0,0]=4 2461 B5R0.1 C\C=C\[N+](=O)[O-] Amb25943859 [1,0,1,0,0,0|2,0,0]=4 2462 B5R0.1 C\C=N\S(C)=O Amb35718869 [1,0,1,0,0,0|2,0,0]=4 2463 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,1,0,0,0|2,0,0]=4 2464 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,1,0,0,0|2,0,0]=4 2465 B5R0.1 NC(=O)CCF Amb28289353 [1,0,1,0,0,0|2,0,0]=4 2466 B5R0.1 NC(=O)CCI Amb27966778 [1,0,1,0,0,0|2,0,0]=4 2467 B5R0.1 NC(=O)CCO Amb9421407 [1,0,1,0,0,0|2,0,0]=4 2468 B5R0.1 NC(=O)CCS Amb27154802 [1,0,1,0,0,0|2,0,0]=4 2469 B5R0.1 NC(=O)\C=C\I Amb27791850 [1,0,1,0,0,0|2,0,0]=4 2470 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,1,0,0,0|2,0,0]=4 2471 B5R0.1 NCCC(=O)O Amb1935127 [1,0,1,0,0,0|2,0,0]=4 2472 B5R0.1 NCCC(=O)[O-] Amb28991330 [1,0,1,0,0,0|2,0,0]=4 2473 B5R0.1 NCCC(N)=O Amb1137251 [1,0,1,0,0,0|2,0,0]=4 2474 B5R0.1 NCCC(N)=O Amb9147573 [1,0,1,0,0,0|2,0,0]=4 2475 B5R0.1 N\C=C\C(=O)O Amb27217920 [1,0,1,0,0,0|2,0,0]=4 2476 B5R0.1 N\C=C\C(N)=O Amb27237320 [1,0,1,0,0,0|2,0,0]=4 2477 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,1,0,0,0|2,0,0]=4 2478 B5R0.1 O=C(Cl)CCBr Amb3941484 [1,0,1,0,0,0|2,0,0]=4 2479 B5R0.1 O=C(Cl)CCCl Amb3939313 [1,0,1,0,0,0|2,0,0]=4 2480 B5R0.1 O=C(Cl)CCF Amb27148631 [1,0,1,0,0,0|2,0,0]=4 2481 B5R0.1 O=C(Cl)CCI Amb28454579 [1,0,1,0,0,0|2,0,0]=4 2482 B5R0.1 O=C(Cl)CCO Amb27270014 [1,0,1,0,0,0|2,0,0]=4 2483 B5R0.1 O=C(Cl)\C=C/Cl Amb27463694 [1,0,1,0,0,0|2,0,0]=4 2484 B5R0.1 O=C(F)CCCl Amb27257545 [1,0,1,0,0,0|2,0,0]=4 2485 B5R0.1 O=C(O)CCBr Amb2685479 [1,0,1,0,0,0|2,0,0]=4 2486 B5R0.1 O=C(O)CCCl Amb5395408 [1,0,1,0,0,0|2,0,0]=4 2487 B5R0.1 O=C(O)CCF Amb10603694 [1,0,1,0,0,0|2,0,0]=4 2488 B5R0.1 O=C(O)CCI Amb2688882 [1,0,1,0,0,0|2,0,0]=4 2489 B5R0.1 O=C(O)CCO Amb2688785 [1,0,1,0,0,0|2,0,0]=4 2490 B5R0.1 O=C(O)CCS Amb6608916 [1,0,1,0,0,0|2,0,0]=4 2491 B5R0.1 O=C(O)\C=C/Br Amb18644453 [1,0,1,0,0,0|2,0,0]=4 2492 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [1,0,1,0,0,0|2,0,0]=4 2493 B5R0.1 O=C(O)\C=C/I Amb28315824 [1,0,1,0,0,0|2,0,0]=4 2494 B5R0.1 O=C(O)\C=C\Br Amb27423608 [1,0,1,0,0,0|2,0,0]=4 2495 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [1,0,1,0,0,0|2,0,0]=4 2496 B5R0.1 O=C(O)\C=C\I Amb30584673 [1,0,1,0,0,0|2,0,0]=4 2497 B5R0.1 O=C(O)\C=C\O Amb26055842 [1,0,1,0,0,0|2,0,0]=4 2498 B5R0.1 O=C(O)\C=C\S Amb28401590 [1,0,1,0,0,0|2,0,0]=4 2499 B5R0.1 O=C(S)CCCl Amb27461454 [1,0,1,0,0,0|2,0,0]=4 2500 B5R0.1 O=C([O-])CCO Amb22055495 [1,0,1,0,0,0|2,0,0]=4 2501 B5R0.2 Br\C=C\CCBr Amb25663040 [1,0,1,0,0,0|2,0,0]=4 2502 B5R0.2 C#CCCC=C Amb18117518 [1,0,1,0,0,0|0,0,2]=4 2503 B5R0.2 C#CCCC=O Amb28049678 [1,0,1,0,0,0|0,0,2]=4 2504 B5R0.2 C#C\C=C\C=O Amb17593013 [1,0,1,0,0,0|0,0,2]=4 2505 B5R0.2 C#C\C=C\CC Amb33267987 [1,0,1,0,0,0|0,0,2]=4 2506 B5R0.2 C=C=CCC=O Amb27234481 [1,0,1,0,0,0|0,0,2]=4 2507 B5R0.2 C=C=CCCBr Amb27634940 [1,0,1,0,0,0|1,0,1]=4 2508 B5R0.2 C=C=CCCI Amb25885871 [1,0,1,0,0,0|1,0,1]=4 2509 B5R0.2 C=C=CCCN Amb27252647 [1,0,1,0,0,0|1,0,1]=4 2510 B5R0.2 C=C=CCCO Amb17593020 [1,0,1,0,0,0|1,0,1]=4 2511 B5R0.2 C=CC#CC=O Amb28284761 [1,0,1,0,0,0|0,0,2]=4 2512 B5R0.2 C=CC#CCC Amb24333935 [1,0,1,0,0,0|0,0,2]=4 2513 B5R0.2 C=CCCC#N Amb10605750 [1,0,1,0,0,0|1,0,1]=4 2514 B5R0.2 C=CCCC=C Amb8513514 [1,0,1,0,0,0|0,0,1]=3 2515 B5R0.2 C=CCCC=O Amb4358616 [1,0,1,0,0,0|0,0,0]=2 2516 B5R0.2 C=CCCCBr Amb3940219 [1,0,1,0,0,0|1,0,0]=3 2517 B5R0.2 C=CCCCC Amb3940497 [1,0,1,0,0,0|0,0,1]=3 2518 B5R0.2 C=CCCCCl Amb22229585 [1,0,1,0,0,0|1,0,0]=3 2519 B5R0.2 C=CCCCF Amb25689705 [1,0,1,0,0,0|1,0,0]=3 2520 B5R0.2 C=CCCCI Amb25278794 [1,0,1,0,0,0|1,0,0]=3 2521 B5R0.2 C=CCCCN Amb18299670 [1,0,1,0,0,0|1,0,0]=3 2522 B5R0.2 C=CCCCN Amb22001451 [1,0,1,0,0,0|1,0,0]=3 2523 B5R0.2 C=CCCCO Amb8513439 [1,0,1,0,0,0|0,0,1]=3 2524 B5R0.2 C=CCCC[CH2-] Amb32644015 [1,0,1,0,0,0|0,0,1]=3 2525 B5R0.2 C=CCCNC Amb18993048 [1,0,1,0,0,0|1,0,1]=4 2526 B5R0.2 C=CCCNC Amb33553635 [1,0,1,0,0,0|1,0,1]=4 2527 B5R0.2 C=CCCOC Amb28065418 [1,0,1,0,0,0|1,0,1]=4 2528 B5R0.2 C=CCCON Amb22233632 [1,0,1,0,0,0|2,0,0]=4 2529 B5R0.2 C=CCCON Amb22896384 [1,0,1,0,0,0|2,0,0]=4 2530 B5R0.2 C=CCCSC Amb24431590 [1,0,1,0,0,0|1,0,1]=4 2531 B5R0.2 C=CCN=C=O Amb3939127 [1,0,1,0,0,0|1,0,1]=4 2532 B5R0.2 C=CCNC=C Amb28134893 [1,0,1,0,0,0|1,0,1]=4 2533 B5R0.2 C=CCNC=O Amb2781857 [1,0,1,0,0,0|1,0,0]=3 2534 B5R0.2 C=CCNCC Amb13951161 [1,0,1,0,0,0|1,0,1]=4 2535 B5R0.2 C=CCNCC Amb6683951 [1,0,1,0,0,0|1,0,1]=4 2536 B5R0.2 C=CCOC=C Amb17933943 [1,0,1,0,0,0|1,0,1]=4 2537 B5R0.2 C=CCOCBr Amb28384107 [1,0,1,0,0,0|2,0,0]=4 2538 B5R0.2 C=CCOCC Amb2684299 [1,0,1,0,0,0|1,0,1]=4 2539 B5R0.2 C=CCOCCl Amb28429831 [1,0,1,0,0,0|2,0,0]=4 2540 B5R0.2 C=CCSCC Amb6366495 [1,0,1,0,0,0|1,0,1]=4 2541 B5R0.2 C=CCSCCl Amb25859631 [1,0,1,0,0,0|2,0,0]=4 2542 B5R0.2 C=CC\C=C/C Amb26426294 [1,0,1,0,0,0|1,0,1]=4 2543 B5R0.2 C=CNCCC Amb27461242 [1,0,1,0,0,0|1,0,0]=3 2544 B5R0.2 C=COCCC Amb17940706 [1,0,1,0,0,0|1,0,0]=3 2545 B5R0.2 C=COCCI Amb28245341 [1,0,1,0,0,0|2,0,0]=4 2546 B5R0.2 C=COCCN Amb17593030 [1,0,1,0,0,0|2,0,0]=4 2547 B5R0.2 C=COCCN Amb32409664 [1,0,1,0,0,0|2,0,0]=4 2548 B5R0.2 C=COCCO Amb17674184 [1,0,1,0,0,0|1,0,1]=4 2549 B5R0.2 C=COCOC Amb28131655 [1,0,1,0,0,0|2,0,0]=4 2550 B5R0.2 C=CSCCCl Amb27390785 [1,0,1,0,0,0|2,0,0]=4 2551 B5R0.2 C=CSCCO Amb27607172 [1,0,1,0,0,0|1,0,1]=4 2552 B5R0.2 C=C\C=C\C=O Amb26369847 [1,0,1,0,0,0|0,0,2]=4 2553 B5R0.2 C=C\C=C\CBr Amb24350542 [1,0,1,0,0,0|1,0,1]=4 2554 B5R0.2 C=C\C=C\CC Amb8513434 [1,0,1,0,0,0|0,0,1]=3 2555 B5R0.2 C=C\C=C\CCl Amb24401492 [1,0,1,0,0,0|1,0,1]=4 2556 B5R0.2 C=C\C=C\CN Amb26011188 [1,0,1,0,0,0|1,0,1]=4 2557 B5R0.2 C=C\C=C\CN Amb32824809 [1,0,1,0,0,0|1,0,1]=4 2558 B5R0.2 C=NCCCCl Amb28346586 [1,0,1,0,0,0|2,0,0]=4 2559 B5R0.2 CC=C=CCCl Amb27859655 [1,0,1,0,0,0|1,0,1]=4 2560 B5R0.2 CCC#CC=O Amb25663194 [1,0,1,0,0,0|0,0,2]=4 2561 B5R0.2 CCC=C=CBr Amb27194333 [1,0,1,0,0,0|1,0,1]=4 2562 B5R0.2 CCCCC=O Amb3939655 [1,0,1,0,0,0|0,0,1]=3 2563 B5R0.2 CCCN=C=O Amb3939331 [1,0,1,0,0,0|1,0,1]=4 2564 B5R0.2 CCCNC=S Amb27754027 [1,0,1,0,0,0|1,1,0]=4 2565 B5R0.2 CCC\C=C\Br Amb17673688 [1,0,1,0,0,0|1,0,0]=3 2566 B5R0.2 CCC\C=C\Cl Amb25026521 [1,0,1,0,0,0|1,0,0]=3 2567 B5R0.2 CCC\C=C\N Amb27217273 [1,0,1,0,0,0|1,0,0]=3 2568 B5R0.2 CCC\C=N\O Amb27213413 [1,0,1,0,0,0|1,0,1]=4 2569 B5R0.2 CCO\C=C/Br Amb2455970 [1,0,1,0,0,0|2,0,0]=4 2570 B5R0.2 CCO\C=C/Cl Amb28315611 [1,0,1,0,0,0|2,0,0]=4 2571 B5R0.2 CCO\C=C\Br Amb10068669 [1,0,1,0,0,0|2,0,0]=4 2572 B5R0.2 CCSCC=O Amb17940620 [1,0,1,0,0,0|1,0,1]=4 2573 B5R0.2 CCS\C=C/Cl Amb28244706 [1,0,1,0,0,0|2,0,0]=4 2574 B5R0.2 CC\C=C/C#N Amb25707862 [1,0,1,0,0,0|1,0,1]=4 2575 B5R0.2 CC\C=C/CBr Amb33483269 [1,0,1,0,0,0|1,0,1]=4 2576 B5R0.2 CC\C=C/CC Amb8517211 [1,0,1,0,0,0|0,0,1]=3 2577 B5R0.2 CC\C=C/CO Amb10975881 [1,0,1,0,0,0|0,0,2]=4 2578 B5R0.2 CC\C=C\C#N Amb9703178 [1,0,1,0,0,0|1,0,1]=4 2579 B5R0.2 CC\C=C\C=O Amb33986391 [1,0,1,0,0,0|0,0,0]=2 2580 B5R0.2 CC\C=C\CBr Amb3940176 [1,0,1,0,0,0|1,0,1]=4 2581 B5R0.2 CC\C=C\CC Amb4016243 [1,0,1,0,0,0|0,0,1]=3 2582 B5R0.2 CC\C=C\CCl Amb33051993 [1,0,1,0,0,0|1,0,1]=4 2583 B5R0.2 CC\C=C\CI Amb27634949 [1,0,1,0,0,0|1,0,1]=4 2584 B5R0.2 CC\C=C\CN Amb27447017 [1,0,1,0,0,0|1,0,1]=4 2585 B5R0.2 CC\C=C\CN Amb33526952 [1,0,1,0,0,0|1,0,1]=4 2586 B5R0.2 CC\C=C\CO Amb22347892 [1,0,1,0,0,0|0,0,2]=4 2587 B5R0.2 CC\C=C\CS Amb33341360 [1,0,1,0,0,0|0,1,1]=4 2588 B5R0.2 CNC\C=C/I Amb23539307 [1,0,1,0,0,0|2,0,0]=4 2589 B5R0.2 CN\C=C\C=O Amb24564349 [1,0,1,0,0,0|1,0,0]=3 2590 B5R0.2 CN\C=C\NC Amb26415734 [1,0,1,0,0,0|2,0,0]=4 2591 B5R0.2 COCCC=O Amb10602324 [1,0,1,0,0,0|1,0,1]=4 2592 B5R0.2 COCNC=O Amb28049834 [1,0,1,0,0,0|2,0,0]=4 2593 B5R0.2 CO\C=C/C=O Amb28049941 [1,0,1,0,0,0|1,0,0]=3 2594 B5R0.2 CO\C=C\C=O Amb26873964 [1,0,1,0,0,0|1,0,0]=3 2595 B5R0.2 CO\C=C\OC Amb25986508 [1,0,1,0,0,0|2,0,0]=4 2596 B5R0.2 CSCCC=O Amb3939952 [1,0,1,0,0,0|1,0,1]=4 2597 B5R0.2 CS\C=C\CCl Amb26494423 [1,0,1,0,0,0|2,0,0]=4 2598 B5R0.2 C\C=C/C=C/C Amb26318493 [1,0,1,0,0,0|0,0,1]=3 2599 B5R0.2 C\C=C/CCC Amb6366719 [1,0,1,0,0,0|0,0,1]=3 2600 B5R0.2 C\C=C/CCO Amb19930204 [1,0,1,0,0,0|1,0,1]=4 2601 B5R0.2 C\C=C\C=C\Br Amb27791828 [1,0,1,0,0,0|1,0,1]=4 2602 B5R0.2 C\C=C\C=C\C Amb27622458 [1,0,1,0,0,0|0,0,1]=3 2603 B5R0.2 C\C=C\CC=O Amb26655030 [1,0,1,0,0,0|0,0,2]=4 2604 B5R0.2 C\C=C\CCBr Amb32667161 [1,0,1,0,0,0|1,0,1]=4 2605 B5R0.2 C\C=C\CCCl Amb26978891 [1,0,1,0,0,0|1,0,1]=4 2606 B5R0.2 C\C=C\CCN Amb19374038 [1,0,1,0,0,0|1,0,1]=4 2607 B5R0.2 C\C=C\CCN Amb33038294 [1,0,1,0,0,0|1,0,1]=4 2608 B5R0.2 C\C=C\CCO Amb24655557 [1,0,1,0,0,0|1,0,1]=4 2609 B5R0.2 C\C=C\CNC Amb28049814 [1,0,1,0,0,0|1,0,1]=4 2610 B5R0.2 C\C=C\OCC Amb8516635 [1,0,1,0,0,0|1,0,0]=3 2611 B5R0.2 C\C=C\SSC Amb9790327 [1,0,1,0,0,0|2,0,0]=4 2612 B5R0.2 C\C=N\CCC Amb27954749 [1,0,1,0,0,0|1,0,1]=4 2613 B5R0.2 Cl\C=C\CCCl Amb25929864 [1,0,1,0,0,0|2,0,0]=4 2614 B5R0.2 Cl\C=C\CCI Amb27647471 [1,0,1,0,0,0|2,0,0]=4 2615 B5R0.2 N#CCCC=O Amb3941009 [1,0,1,0,0,0|1,0,1]=4 2616 B5R0.2 NCCCC=O Amb26851044 [1,0,1,0,0,0|1,0,0]=3 2617 B5R0.2 NCCCN=O Amb28049442 [1,0,1,0,0,0|2,0,0]=4 2618 B5R0.2 NCCOC=O Amb24612320 [1,0,1,0,0,0|2,0,0]=4 2619 B5R0.2 NCC\C=C\Cl Amb27391191 [1,0,1,0,0,0|2,0,0]=4 2620 B5R0.2 O=CCCC=O Amb8395090 [1,0,1,0,0,0|1,0,0]=3 2621 B5R0.2 O=CCCCBr Amb18644189 [1,0,1,0,0,0|1,0,0]=3 2622 B5R0.2 O=CCCCCl Amb8395190 [1,0,1,0,0,0|1,0,0]=3 2623 B5R0.2 O=CCCCF Amb24056028 [1,0,1,0,0,0|1,0,0]=3 2624 B5R0.2 O=CCCCI Amb27249641 [1,0,1,0,0,0|1,0,0]=3 2625 B5R0.2 O=CCCCO Amb24589235 [1,0,1,0,0,0|1,0,0]=3 2626 B5R0.2 O=CCCSS Amb22524519 [1,0,1,0,0,0|2,0,0]=4 2627 B5R0.2 O=CCNC=O Amb26370295 [1,0,1,0,0,0|2,0,0]=4 2628 B5R0.2 O=CC\C=C\Cl Amb24571938 [1,0,1,0,0,0|1,0,1]=4 2629 B5R0.2 O=CNCCF Amb28205988 [1,0,1,0,0,0|2,0,0]=4 2630 B5R0.2 O=COCCBr Amb27816149 [1,0,1,0,0,0|2,0,0]=4 2631 B5R0.2 O=COCCO Amb26625741 [1,0,1,0,0,0|2,0,0]=4 2632 B5R0.2 O=C\C=C/C=O Amb28146767 [1,0,1,0,0,0|1,0,1]=4 2633 B5R0.2 O=C\C=C\C=O Amb17593019 [1,0,1,0,0,0|1,0,1]=4 2634 B5R0.2 O=C\C=C\CCl Amb18122401 [1,0,1,0,0,0|1,0,0]=3 2635 B5R0.2 O=C\C=C\CF Amb33475269 [1,0,1,0,0,0|1,0,0]=3 2636 B5R0.2 O=C\C=C\CO Amb24356008 [1,0,1,0,0,0|1,0,0]=3 2637 B5R0.2 OCC\C=C\Br Amb27425005 [1,0,1,0,0,0|2,0,0]=4 2638 B5R0.2 OCC\C=C\Cl Amb27859286 [1,0,1,0,0,0|2,0,0]=4 2639 B5R0.3 C#CC(=O)C=C Amb27954057 [1,0,1,0,0,0|0,0,2]=4 2640 B5R0.3 C#CC(=O)CC Amb25989183 [1,0,1,0,0,0|0,0,2]=4 2641 B5R0.3 C=C(C=O)CC Amb17940102 [1,0,1,0,0,0|2,0,0]=4 2642 B5R0.3 C=C(CC)CC Amb17940707 [1,0,1,0,0,0|1,0,1]=4 2643 B5R0.3 C=CC(=C)CBr Amb24451750 [1,0,1,0,0,0|2,0,0]=4 2644 B5R0.3 C=CC(=C)CC Amb28141349 [1,0,1,0,0,0|1,0,0]=3 2645 B5R0.3 C=CC(=C)OC Amb28145100 [1,0,1,0,0,0|2,0,0]=4 2646 B5R0.3 C=CC(=O)C=C Amb22265893 [1,0,1,0,0,0|0,0,2]=4 2647 B5R0.3 C=CC(=O)CBr Amb10602446 [1,0,1,0,0,0|1,0,0]=3 2648 B5R0.3 C=CC(=O)CC Amb3940490 [1,0,1,0,0,0|0,0,0]=2 2649 B5R0.3 C=CC(=O)CCl Amb27211112 [1,0,1,0,0,0|1,0,0]=3 2650 B5R0.3 C=CC(=O)CO Amb28074769 [1,0,1,0,0,0|1,0,0]=3 2651 B5R0.3 C=CC(=O)NC Amb9480402 [1,0,1,0,0,0|1,0,0]=3 2652 B5R0.3 C=CC(=O)NN Amb25134207 [1,0,1,0,0,0|2,0,0]=4 2653 B5R0.3 C=CC(=O)NN Amb33330767 [1,0,1,0,0,0|2,0,0]=4 2654 B5R0.3 C=CC(=O)NO Amb28049735 [1,0,1,0,0,0|2,0,0]=4 2655 B5R0.3 C=CC(=O)OC Amb22351400 [1,0,1,0,0,0|1,0,0]=3 2656 B5R0.3 C=CC(=O)OC Amb2793072 [1,0,1,0,0,0|1,0,0]=3 2657 B5R0.3 C=CC(=O)O[Na] Amb22336198 [1,0,1,0,0,0|2,0,0]=4 2658 B5R0.3 C=CC(C)CC Amb8513436 [1,0,1,0,0,0|1,0,1]=4 2659 B5R0.3 C=CC(N)CC Amb26349978 [1,0,1,0,0,0|1,0,1]=4 2660 B5R0.3 C=CC(N)CC Amb31291608 [1,0,1,0,0,0|1,0,1]=4 2661 B5R0.3 C=CC(O)CC Amb3940382 [1,0,1,0,0,0|0,0,2]=4 2662 B5R0.3 C=CN(C)CC Amb27242626 [1,0,1,0,0,0|2,0,0]=4 2663 B5R0.3 C=C[C@@H](O)CC Amb27813799 [1,0,1,0,0,0|0,0,2]=4 2664 B5R0.3 CCC(=O)C#N Amb17231799 [1,0,1,0,0,0|1,0,1]=4 2665 B5R0.3 CCC(=O)C=O Amb22228532 [1,0,1,0,0,0|1,0,0]=3 2666 B5R0.3 CCC(=O)CBr Amb2684976 [1,0,1,0,0,0|1,0,1]=4 2667 B5R0.3 CCC(=O)CC Amb4605995 [1,0,1,0,0,0|0,0,1]=3 2668 B5R0.3 CCC(=O)CCl Amb19338105 [1,0,1,0,0,0|1,0,1]=4 2669 B5R0.3 CCC(=O)CF Amb23454809 [1,0,1,0,0,0|1,0,1]=4 2670 B5R0.3 CCC(=O)CN Amb18203134 [1,0,1,0,0,0|1,0,1]=4 2671 B5R0.3 CCC(=O)CN Amb19959206 [1,0,1,0,0,0|1,0,1]=4 2672 B5R0.3 CCC(=O)CO Amb22227965 [1,0,1,0,0,0|1,0,1]=4 2673 B5R0.3 CCC(=O)CO Amb33529428 [1,0,1,0,0,0|1,0,1]=4 2674 B5R0.3 CCC(=O)CS Amb27843254 [1,0,1,0,0,0|1,0,1]=4 2675 B5R0.3 CCC(=O)NN Amb1104708 [1,0,1,0,0,0|2,0,0]=4 2676 B5R0.3 CCC(=O)NO Amb6273963 [1,0,1,0,0,0|2,0,0]=4 2677 B5R0.3 CCC(=O)OC Amb8513418 [1,0,1,0,0,0|1,0,0]=3 2678 B5R0.3 CCC(=S)OC Amb22168046 [1,0,1,0,0,0|1,1,0]=4 2679 B5R0.3 CCC(=[OH-])CC Amb27749891 [1,0,1,0,0,0|0,0,2]=4 2680 B5R0.3 CC[PH](=O)CC Amb28049809 [1,0,1,0,0,0|1,0,1]=4 2681 B5R0.3 CC\C(C)=C\Cl Amb27848092 [1,0,1,0,0,0|2,0,0]=4 2682 B5R0.3 CNC(=O)CBr Amb33541701 [1,0,1,0,0,0|2,0,0]=4 2683 B5R0.3 CNC(=O)CCl Amb6365480 [1,0,1,0,0,0|2,0,0]=4 2684 B5R0.3 CNC(=O)CI Amb23512488 [1,0,1,0,0,0|2,0,0]=4 2685 B5R0.3 CNC(=O)CN Amb2371053 [1,0,1,0,0,0|2,0,0]=4 2686 B5R0.3 CNC(=O)CN Amb436613 [1,0,1,0,0,0|2,0,0]=4 2687 B5R0.3 CNC(=O)CO Amb3375431 [1,0,1,0,0,0|2,0,0]=4 2688 B5R0.3 CNC(=O)CS Amb22348209 [1,0,1,0,0,0|2,0,0]=4 2689 B5R0.3 CNC(=O)NC Amb4037273 [1,0,1,0,0,0|2,0,0]=4 2690 B5R0.3 CNC(=O)OC Amb16185431 [1,0,1,0,0,0|2,0,0]=4 2691 B5R0.3 COC(=O)C=O Amb29083438 [1,0,1,0,0,0|2,0,0]=4 2692 B5R0.3 COC(=O)C=O Amb8384463 [1,0,1,0,0,0|2,0,0]=4 2693 B5R0.3 COC(=O)CBr Amb3939968 [1,0,1,0,0,0|2,0,0]=4 2694 B5R0.3 COC(=O)CCl Amb2792917 [1,0,1,0,0,0|2,0,0]=4 2695 B5R0.3 COC(=O)CF Amb2689433 [1,0,1,0,0,0|2,0,0]=4 2696 B5R0.3 COC(=O)CI Amb22036593 [1,0,1,0,0,0|2,0,0]=4 2697 B5R0.3 COC(=O)CN Amb1153098 [1,0,1,0,0,0|2,0,0]=4 2698 B5R0.3 COC(=O)CN Amb534106 [1,0,1,0,0,0|2,0,0]=4 2699 B5R0.3 COC(=O)CO Amb2778433 [1,0,1,0,0,0|2,0,0]=4 2700 B5R0.3 COC(=O)CS Amb6608893 [1,0,1,0,0,0|2,0,0]=4 2701 B5R0.3 COC(=O)OC Amb6609028 [1,0,1,0,0,0|2,0,0]=4 2702 B5R0.3 CSC(=O)C=O Amb28284177 [1,0,1,0,0,0|2,0,0]=4 2703 B5R0.3 CSC(=O)CN Amb27482013 [1,0,1,0,0,0|2,0,0]=4 2704 B5R0.3 CSC(=O)SC Amb19944681 [1,0,1,0,0,0|2,0,0]=4 2705 B5R0.3 C\C=C(/C)CBr Amb27954750 [1,0,1,0,0,0|2,0,0]=4 2706 B5R0.3 C\C=C(/C)CC Amb26540266 [1,0,1,0,0,0|1,0,0]=3 2707 B5R0.3 C\C=C(/C)CCl Amb33483104 [1,0,1,0,0,0|2,0,0]=4 2708 B5R0.3 C\C=C(/C)CI Amb27750414 [1,0,1,0,0,0|2,0,0]=4 2709 B5R0.3 C\C=C(/C)CO Amb26998405 [1,0,1,0,0,0|2,0,0]=4 2710 B5R0.3 C\C=C(/F)CBr Amb22546798 [1,0,1,0,0,0|2,0,0]=4 2711 B5R0.3 C\C=C(/F)CO Amb22546797 [1,0,1,0,0,0|2,0,0]=4 2712 B5R0.3 C\C=C(/I)CN Amb27392321 [1,0,1,0,0,0|2,0,0]=4 2713 B5R0.3 C\C=C(\Br)CBr Amb28053383 [1,0,1,0,0,0|2,0,0]=4 2714 B5R0.3 C\C=C(\Br)CN Amb27650590 [1,0,1,0,0,0|2,0,0]=4 2715 B5R0.3 C\C=C(\Br)CO Amb25809972 [1,0,1,0,0,0|2,0,0]=4 2716 B5R0.3 C\C=C(\C)CC Amb25332651 [1,0,1,0,0,0|1,0,0]=3 2717 B5R0.3 C\C=C(\C)CCl Amb27655615 [1,0,1,0,0,0|2,0,0]=4 2718 B5R0.3 C\C=C(\C)CO Amb26581579 [1,0,1,0,0,0|2,0,0]=4 2719 B5R0.3 C\C=C(\Cl)CCl Amb25727694 [1,0,1,0,0,0|2,0,0]=4 2720 B5R0.3 C\C=C(\F)CO Amb28384940 [1,0,1,0,0,0|2,0,0]=4 2721 B5R0.3 C\C=C(\I)CBr Amb27263914 [1,0,1,0,0,0|2,0,0]=4 2722 B5R0.3 O=CC(=O)CO Amb17593031 [1,0,1,0,0,0|2,0,0]=4 2723 B7R0.2 C#CC(=O)CC(C)C Amb28345618 [0,1,1,0,0,0|0,0,2]=4 2724 B7R0.2 C#CC(=O)CC(C)N Amb28285224 [0,1,1,0,0,0|0,0,2]=4 2725 B7R0.2 C=C(C)CC(=O)CC Amb27600284 [0,1,1,0,0,0|0,0,1]=3 2726 B7R0.2 C=C(C)\C=C(\C)CCl Amb27962969 [0,1,1,0,0,0|2,0,0]=4 2727 B7R0.2 C=C(C)\C=C(\C)CO Amb27972292 [0,1,1,0,0,0|2,0,0]=4 2728 B7R0.2 C=C(CC)OC(C)=O Amb25202254 [0,1,1,0,0,0|2,0,0]=4 2729 B7R0.2 C=C=C(C)C[C@@H](C)O Amb27981629 [0,1,1,0,0,0|1,0,1]=4 2730 B7R0.2 C=CC(=C)CC(C)=O Amb27668846 [0,1,1,0,0,0|1,0,1]=4 2731 B7R0.2 C=CC(=C)C[C@H](C)O Amb27978244 [0,1,1,0,0,0|1,0,0]=3 2732 B7R0.2 C=CC(=O)CC(=C)C Amb28048969 [0,1,1,0,0,0|0,0,1]=3 2733 B7R0.2 C=CC(=O)CC(C)=O Amb27470884 [0,1,1,0,0,0|0,0,1]=3 2734 B7R0.2 C=CC(=O)CC(C)C Amb27412805 [0,1,1,0,0,0|0,0,0]=2 2735 B7R0.2 C=CC(=O)CC(C)N Amb28342099 [0,1,1,0,0,0|0,0,0]=2 2736 B7R0.2 C=CC(=O)CC(C)O Amb27861172 [0,1,1,0,0,0|0,0,0]=2 2737 B7R0.2 C=CC(=O)C[C@@H](C)O Amb28316225 [0,1,1,0,0,0|0,0,0]=2 2738 B7R0.2 C=CC(=O)NC(C)C Amb3940719 [0,1,1,0,0,0|1,0,0]=3 2739 B7R0.2 C=CC(=O)OC(C)C Amb22734220 [0,1,1,0,0,0|1,0,0]=3 2740 B7R0.2 C=CC(=O)OC(C)Cl Amb27592116 [0,1,1,0,0,0|1,0,0]=3 2741 B7R0.2 C=CC(=O)\C=C(/C)Br Amb28316132 [0,1,1,0,0,0|0,0,2]=4 2742 B7R0.2 C=CC(=O)\C=C(\C)Br Amb27861245 [0,1,1,0,0,0|0,0,2]=4 2743 B7R0.2 C=CC(Br)CC(C)C Amb27984920 [0,1,1,0,0,0|1,0,1]=4 2744 B7R0.2 C=CC(C)CC(C)C Amb22229087 [0,1,1,0,0,0|1,0,1]=4 2745 B7R0.2 C=CC(N)CC(C)C Amb25743094 [0,1,1,0,0,0|1,0,1]=4 2746 B7R0.2 C=CC(O)CC(C)C Amb24532138 [0,1,1,0,0,0|0,0,2]=4 2747 B7R0.2 C=CC(O)CC(C)N Amb35583445 [0,1,1,0,0,0|0,0,2]=4 2748 B7R0.2 C=C[C@@H](C)C[C@@H](C)O Amb28138655 [0,1,1,0,0,0|1,0,1]=4 2749 B7R0.2 C=C[C@@H](O)CC(C)C Amb28429716 [0,1,1,0,0,0|0,0,2]=4 2750 B7R0.2 C=C[C@@H](O)C[C@H](C)O Amb28318465 [0,1,1,0,0,0|0,0,2]=4 2751 B7R0.2 C=C[C@H](C)C[C@H](C)O Amb27221624 [0,1,1,0,0,0|1,0,1]=4 2752 B7R0.2 C=C[C@H](N)CC(C)C Amb27202733 [0,1,1,0,0,0|1,0,1]=4 2753 B7R0.2 C=C[C@H](O)CC(C)C Amb28366037 [0,1,1,0,0,0|0,0,2]=4 2754 B7R0.2 C=C\C(Br)=C/[C@H](C)O Amb27768632 [0,1,1,0,0,0|1,0,1]=4 2755 B7R0.2 C=C\C(C)=C/C(C)O Amb28061923 [0,1,1,0,0,0|1,0,1]=4 2756 B7R0.2 CC(=O)CC(=O)CO Amb28316150 [0,1,1,0,0,0|1,0,1]=4 2757 B7R0.2 CC(=O)NC(=O)CBr Amb33541733 [0,1,1,0,0,0|2,0,0]=4 2758 B7R0.2 CC(=O)NC(=O)CCl Amb1105796 [0,1,1,0,0,0|2,0,0]=4 2759 B7R0.2 CC(=O)NC(=O)CN Amb24117061 [0,1,1,0,0,0|2,0,0]=4 2760 B7R0.2 CC(=O)OC(=O)CCl Amb27977084 [0,1,1,0,0,0|2,0,0]=4 2761 B7R0.2 CC(=O)OC(=O)CN Amb28240797 [0,1,1,0,0,0|2,0,0]=4 2762 B7R0.2 CC(=O)\C=C(/C)CO Amb25240045 [0,1,1,0,0,0|2,0,0]=4 2763 B7R0.2 CC(=O)\C=C(/Cl)CCl Amb27832426 [0,1,1,0,0,0|2,0,0]=4 2764 B7R0.2 CC(=O)\C=C(/N)CO Amb27839108 [0,1,1,0,0,0|2,0,0]=4 2765 B7R0.2 CC(=O)\C=C(/O)CCl Amb27768762 [0,1,1,0,0,0|1,0,1]=4 2766 B7R0.2 CC(=O)\C=C(\C)CO Amb24518297 [0,1,1,0,0,0|2,0,0]=4 2767 B7R0.2 CC(=O)\C=C(\O)CCl Amb27259051 [0,1,1,0,0,0|1,0,1]=4 2768 B7R0.2 CC(C)=CC(=O)CBr Amb17594501 [0,1,1,0,0,0|1,0,0]=3 2769 B7R0.2 CC(C)=CC(=O)CCl Amb28313535 [0,1,1,0,0,0|1,0,0]=3 2770 B7R0.2 CC(C)=CC(=O)CO Amb28048944 [0,1,1,0,0,0|1,0,0]=3 2771 B7R0.2 CC(C)=CC(=O)NN Amb27830541 [0,1,1,0,0,0|2,0,0]=4 2772 B7R0.2 CC(C)=CC(=O)NO Amb27835078 [0,1,1,0,0,0|2,0,0]=4 2773 B7R0.2 CC(C)CC(=O)C#N Amb4019436 [0,1,1,0,0,0|1,0,1]=4 2774 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [0,1,1,0,0,0|1,0,0]=3 2775 B7R0.2 CC(C)CC(=O)CBr Amb22396854 [0,1,1,0,0,0|1,0,1]=4 2776 B7R0.2 CC(C)CC(=O)CCl Amb20622841 [0,1,1,0,0,0|1,0,1]=4 2777 B7R0.2 CC(C)CC(=O)CF Amb23454719 [0,1,1,0,0,0|1,0,1]=4 2778 B7R0.2 CC(C)CC(=O)CN Amb18641847 [0,1,1,0,0,0|1,0,1]=4 2779 B7R0.2 CC(C)CC(=O)CN Amb30982570 [0,1,1,0,0,0|1,0,1]=4 2780 B7R0.2 CC(C)CC(=O)CO Amb18559774 [0,1,1,0,0,0|1,0,1]=4 2781 B7R0.2 CC(C)CC(=O)CS Amb28316226 [0,1,1,0,0,0|1,0,1]=4 2782 B7R0.2 CC(C)CC(=O)NN Amb1154207 [0,1,1,0,0,0|2,0,0]=4 2783 B7R0.2 CC(C)CC(=O)NO Amb6280209 [0,1,1,0,0,0|2,0,0]=4 2784 B7R0.2 CC(C)NC(=O)C=O Amb27881630 [0,1,1,0,0,0|2,0,0]=4 2785 B7R0.2 CC(Cl)CC(=O)CN Amb28048961 [0,1,1,0,0,0|1,0,1]=4 2786 B7R0.2 CC(Cl)CC(=O)CN Amb33473605 [0,1,1,0,0,0|1,0,1]=4 2787 B7R0.2 CC(Cl)C\C(Cl)=C\Cl Amb28121071 [0,1,1,0,0,0|2,0,0]=4 2788 B7R0.2 CC(O)CC(=O)NN Amb6548973 [0,1,1,0,0,0|2,0,0]=4 2789 B7R0.2 CC(S)CC(=O)NN Amb27970702 [0,1,1,0,0,0|2,0,0]=4 2790 B7R0.2 CCC(=O)C=C(C)C Amb25715052 [0,1,1,0,0,0|0,0,0]=2 2791 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [0,1,1,0,0,0|1,0,1]=4 2792 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [0,1,1,0,0,0|0,0,1]=3 2793 B7R0.2 CCC(=O)CC(C)C Amb17138363 [0,1,1,0,0,0|0,0,2]=4 2794 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [0,1,1,0,0,0|1,0,1]=4 2795 B7R0.2 CCC(=O)CS(C)=O Amb27464042 [0,1,1,0,0,0|1,0,1]=4 2796 B7R0.2 CCC(=O)C[C@@H](C)O Amb28316195 [0,1,1,0,0,0|0,0,2]=4 2797 B7R0.2 CCC(=O)NC(=N)N Amb19148005 [0,1,1,0,0,0|2,0,0]=4 2798 B7R0.2 CCC(=O)NC(C)=O Amb27800787 [0,1,1,0,0,0|1,0,0]=3 2799 B7R0.2 CCC(=O)NC(C)=S Amb28287319 [0,1,1,0,0,0|1,0,0]=3 2800 B7R0.2 CCC(=O)NC(C)C Amb5797517 [0,1,1,0,0,0|1,0,1]=4 2801 B7R0.2 CCC(=O)NC(N)=O Amb27643460 [0,1,1,0,0,0|2,0,0]=4 2802 B7R0.2 CCC(=O)NC(N)=S Amb26551125 [0,1,1,0,0,0|2,0,0]=4 2803 B7R0.2 CCC(=O)NN(C)C Amb28316116 [0,1,1,0,0,0|2,0,0]=4 2804 B7R0.2 CCC(=O)OC(C)=O Amb21858081 [0,1,1,0,0,0|1,0,0]=3 2805 B7R0.2 CCC(=O)OC(C)Br Amb27455631 [0,1,1,0,0,0|1,0,1]=4 2806 B7R0.2 CCC(=O)OC(C)Cl Amb27477113 [0,1,1,0,0,0|1,0,1]=4 2807 B7R0.2 CCC(=O)O[C@@H](C)N Amb27437862 [0,1,1,0,0,0|1,0,1]=4 2808 B7R0.2 CCC(=O)SC(=N)N Amb27445157 [0,1,1,0,0,0|2,0,0]=4 2809 B7R0.2 CCC(=O)SC(C)C Amb25993951 [0,1,1,0,0,0|1,0,1]=4 2810 B7R0.2 CCC(=O)SC(N)=S Amb27839514 [0,1,1,0,0,0|2,0,0]=4 2811 B7R0.2 CCC(=O)\C=C(/C)Br Amb28315626 [0,1,1,0,0,0|0,0,0]=2 2812 B7R0.2 CCC(=O)\C=C(\C)N Amb26526823 [0,1,1,0,0,0|0,0,0]=2 2813 B7R0.2 CCC(Br)C=C(C)C Amb27831341 [0,1,1,0,0,0|1,0,1]=4 2814 B7R0.2 CCC(N)C=C(C)C Amb27450297 [0,1,1,0,0,0|1,0,1]=4 2815 B7R0.2 CCS(=O)CC(C)=O Amb26873160 [0,1,1,0,0,0|1,0,1]=4 2816 B7R0.2 CCS(=O)N=C(C)C Amb35681490 [0,1,1,0,0,0|2,0,0]=4 2817 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [0,1,1,0,0,0|2,0,0]=4 2818 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [0,1,1,0,0,0|2,0,0]=4 2819 B7R0.2 CC\C(C)=C/C(C)=O Amb27424977 [0,1,1,0,0,0|1,0,0]=3 2820 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [0,1,1,0,0,0|2,0,0]=4 2821 B7R0.2 CC\C(C)=C\C(C)=O Amb27985733 [0,1,1,0,0,0|1,0,0]=3 2822 B7R0.2 CC\C(C)=C\C(C)O Amb28128461 [0,1,1,0,0,0|1,0,1]=4 2823 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [0,1,1,0,0,0|2,0,0]=4 2824 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [0,1,1,0,0,0|2,0,0]=4 2825 B7R0.2 CC\C(N)=C\C(N)=O Amb27621383 [0,1,1,0,0,0|2,0,0]=4 2826 B7R0.2 CC\C(N)=N\C(C)=O Amb27391863 [0,1,1,0,0,0|2,0,0]=4 2827 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [0,1,1,0,0,0|1,0,1]=4 2828 B7R0.2 CC\C(S)=C\C(C)=O Amb27775797 [0,1,1,0,0,0|0,1,0]=3 2829 B7R0.2 CC\C([O-])=C\C(C)=O Amb19960031 [0,1,1,0,0,0|0,0,1]=3 2830 B7R0.2 CNC(=O)C=C(C)C Amb27838918 [0,1,1,0,0,0|1,0,0]=3 2831 B7R0.2 CNC(=O)CC(C)=O Amb6891968 [0,1,1,0,0,0|1,0,1]=4 2832 B7R0.2 CNC(=O)CC(C)N Amb18949898 [0,1,1,0,0,0|1,0,1]=4 2833 B7R0.2 CNC(=O)CC(C)N Amb33548084 [0,1,1,0,0,0|1,0,1]=4 2834 B7R0.2 CNC(=O)CC(C)O Amb24525315 [0,1,1,0,0,0|1,0,1]=4 2835 B7R0.2 CNC(=O)C[C@H](C)N Amb27400875 [0,1,1,0,0,0|1,0,1]=4 2836 B7R0.2 CNC(=O)NC(C)=O Amb2782874 [0,1,1,0,0,0|2,0,0]=4 2837 B7R0.2 CNC(=O)\C=C(/C)N Amb27253694 [0,1,1,0,0,0|1,0,0]=3 2838 B7R0.2 CNC(=S)C=C(C)C Amb27411406 [0,1,1,0,0,0|1,1,0]=4 2839 B7R0.2 CN\C(C)=C/C(C)=O Amb15691784 [0,1,1,0,0,0|2,0,0]=4 2840 B7R0.2 CN\C(C)=C\C(C)=O Amb27486166 [0,1,1,0,0,0|2,0,0]=4 2841 B7R0.2 COC(=O)C=C(C)C Amb8384897 [0,1,1,0,0,0|1,0,0]=3 2842 B7R0.2 COC(=O)CC(C)=O Amb6608655 [0,1,1,0,0,0|1,0,1]=4 2843 B7R0.2 COC(=O)CC(C)Br Amb10603675 [0,1,1,0,0,0|1,0,1]=4 2844 B7R0.2 COC(=O)CC(C)C Amb9241810 [0,1,1,0,0,0|1,0,1]=4 2845 B7R0.2 COC(=O)CC(C)Cl Amb4017877 [0,1,1,0,0,0|1,0,1]=4 2846 B7R0.2 COC(=O)CC(C)N Amb2371489 [0,1,1,0,0,0|1,0,1]=4 2847 B7R0.2 COC(=O)CC(C)N Amb461639 [0,1,1,0,0,0|1,0,1]=4 2848 B7R0.2 COC(=O)CC(C)O Amb9277785 [0,1,1,0,0,0|1,0,1]=4 2849 B7R0.2 COC(=O)CC(C)S Amb19515267 [0,1,1,0,0,0|1,0,1]=4 2850 B7R0.2 COC(=O)C[C@@H](C)N Amb22898912 [0,1,1,0,0,0|1,0,1]=4 2851 B7R0.2 COC(=O)C[C@@H](C)N Amb8395866 [0,1,1,0,0,0|1,0,1]=4 2852 B7R0.2 COC(=O)C[C@@H](C)O Amb2725551 [0,1,1,0,0,0|1,0,1]=4 2853 B7R0.2 COC(=O)C[C@H](C)N Amb25789928 [0,1,1,0,0,0|1,0,1]=4 2854 B7R0.2 COC(=O)C[C@H](C)N Amb33847401 [0,1,1,0,0,0|1,0,1]=4 2855 B7R0.2 COC(=O)C[C@H](C)O Amb8397299 [0,1,1,0,0,0|1,0,1]=4 2856 B7R0.2 COC(=O)\C=C(/C)N Amb1157857 [0,1,1,0,0,0|1,0,0]=3 2857 B7R0.2 COC(=O)\C=C(\C)N Amb4018177 [0,1,1,0,0,0|1,0,0]=3 2858 B7R0.2 CO\C(C)=C/C(C)=O Amb28145644 [0,1,1,0,0,0|2,0,0]=4 2859 B7R0.2 CO\C(N)=C\C(C)=O Amb27947759 [0,1,1,0,0,0|2,0,0]=4 2860 B7R0.2 CS\C(C)=C\C(C)=O Amb28315811 [0,1,1,0,0,0|2,0,0]=4 2861 B7R0.2 CS\C(N)=C/C(C)=O Amb8554013 [0,1,1,0,0,0|2,0,0]=4 2862 B7R0.2 CS\C(N)=C\C(C)=O Amb27420945 [0,1,1,0,0,0|2,0,0]=4 2863 B7R0.2 C[C@@H](O)CC(=O)NN Amb27452910 [0,1,1,0,0,0|2,0,0]=4 2864 B7R0.2 C[C@H](O)CC(=O)NN Amb27409334 [0,1,1,0,0,0|2,0,0]=4 2865 B7R0.2 C\C(=C/Cl)CC(C)N Amb29879755 [0,1,1,0,0,0|2,0,0]=4 2866 B7R0.2 C\C(=C\Cl)CC(C)C Amb30621737 [0,1,1,0,0,0|2,0,0]=4 2867 B7R0.2 C\C=C(/C)CC(C)C Amb27459658 [0,1,1,0,0,0|1,0,1]=4 2868 B7R0.2 C\C=C(\C)CC(C)C Amb24566930 [0,1,1,0,0,0|1,0,1]=4 2869 B7R0.2 C\N=C(C)/C=C(\C)O Amb27637850 [0,1,1,0,0,0|2,0,0]=4 2870 B7R0.3 C#CC(=O)CCCC Amb28128200 [0,1,1,0,0,0|0,0,2]=4 2871 B7R0.3 C#CC(=O)CCCCl Amb27669507 [0,1,1,0,0,0|0,0,2]=4 2872 B7R0.3 C#CC(=O)CCCN Amb27631285 [0,1,1,0,0,0|0,0,2]=4 2873 B7R0.3 C#CC(=O)CCCO Amb27593195 [0,1,1,0,0,0|0,0,2]=4 2874 B7R0.3 C#CC(=O)OCCC Amb27761363 [0,1,1,0,0,0|0,0,2]=4 2875 B7R0.3 C#CCNC(=O)C=C Amb9480568 [0,1,1,0,0,0|0,0,2]=4 2876 B7R0.3 C#CCOC(=O)C=C Amb2721619 [0,1,1,0,0,0|0,0,2]=4 2877 B7R0.3 C=C(C=O)CCCC Amb4025817 [0,1,1,0,0,0|2,0,0]=4 2878 B7R0.3 C=C(C=O)CCCO Amb28128165 [0,1,1,0,0,0|2,0,0]=4 2879 B7R0.3 C=C(C=O)CCOC Amb27948778 [0,1,1,0,0,0|2,0,0]=4 2880 B7R0.3 C=C(\C=C\CC)CBr Amb33480597 [0,1,1,0,0,0|2,0,0]=4 2881 B7R0.3 C=C(\C=C\CC)CCl Amb33057664 [0,1,1,0,0,0|2,0,0]=4 2882 B7R0.3 C=C(\C=C\CC)CN Amb33225015 [0,1,1,0,0,0|2,0,0]=4 2883 B7R0.3 C=C=C(C)CCCBr Amb27876055 [0,1,1,0,0,0|1,0,1]=4 2884 B7R0.3 C=C=C(C)CCCN Amb27839400 [0,1,1,0,0,0|1,0,1]=4 2885 B7R0.3 C=C=C(C)CCCO Amb28321385 [0,1,1,0,0,0|1,0,1]=4 2886 B7R0.3 C=CC#CC(=O)CC Amb28315706 [0,1,1,0,0,0|0,0,2]=4 2887 B7R0.3 C=CC(=C)OCCCl Amb27391159 [0,1,1,0,0,0|2,0,0]=4 2888 B7R0.3 C=CC(=O)CCCC Amb25062494 [0,1,1,0,0,0|0,0,0]=2 2889 B7R0.3 C=CC(=O)CCCCl Amb24568327 [0,1,1,0,0,0|0,0,0]=2 2890 B7R0.3 C=CC(=O)CCOC Amb24744935 [0,1,1,0,0,0|0,0,0]=2 2891 B7R0.3 C=CC(=O)CCSC Amb25334636 [0,1,1,0,0,0|0,0,0]=2 2892 B7R0.3 C=CC(=O)COCC Amb27248148 [0,1,1,0,0,0|0,0,0]=2 2893 B7R0.3 C=CC(=O)CSCC Amb25865187 [0,1,1,0,0,0|0,0,0]=2 2894 B7R0.3 C=CC(=O)C\C=C\C Amb26475455 [0,1,1,0,0,0|0,0,1]=3 2895 B7R0.3 C=CC(=O)NCCBr Amb28325545 [0,1,1,0,0,0|1,0,0]=3 2896 B7R0.3 C=CC(=O)NCCC Amb9480391 [0,1,1,0,0,0|0,0,0]=2 2897 B7R0.3 C=CC(=O)NCCCl Amb20668986 [0,1,1,0,0,0|1,0,0]=3 2898 B7R0.3 C=CC(=O)NCCF Amb27805492 [0,1,1,0,0,0|1,0,0]=3 2899 B7R0.3 C=CC(=O)NCCN Amb18291565 [0,1,1,0,0,0|1,0,0]=3 2900 B7R0.3 C=CC(=O)NCCN Amb19514971 [0,1,1,0,0,0|1,0,0]=3 2901 B7R0.3 C=CC(=O)NCCO Amb9361225 [0,1,1,0,0,0|1,0,0]=3 2902 B7R0.3 C=CC(=O)NCOC Amb27467338 [0,1,1,0,0,0|1,0,0]=3 2903 B7R0.3 C=CC(=O)NCSC Amb27167368 [0,1,1,0,0,0|1,0,0]=3 2904 B7R0.3 C=CC(=O)NOCC Amb27234385 [0,1,1,0,0,0|1,0,0]=3 2905 B7R0.3 C=CC(=O)OCCC Amb22045218 [0,1,1,0,0,0|0,0,0]=2 2906 B7R0.3 C=CC(=O)OCCF Amb2688098 [0,1,1,0,0,0|1,0,0]=3 2907 B7R0.3 C=CC(=O)\C=C\CC Amb27156684 [0,1,1,0,0,0|0,0,1]=3 2908 B7R0.3 C=CC(Br)CCCC Amb25758328 [0,1,1,0,0,0|1,0,1]=4 2909 B7R0.3 C=CC(C)CCCC Amb22641469 [0,1,1,0,0,0|1,0,1]=4 2910 B7R0.3 C=CC(C)CCCCl Amb27412986 [0,1,1,0,0,0|1,0,1]=4 2911 B7R0.3 C=CC(C)CCCO Amb22641468 [0,1,1,0,0,0|1,0,1]=4 2912 B7R0.3 C=CC(Cl)CCOC Amb25989152 [0,1,1,0,0,0|1,0,1]=4 2913 B7R0.3 C=CC(N)CCSC Amb28316202 [0,1,1,0,0,0|1,0,1]=4 2914 B7R0.3 C=CC(N)COCC Amb27248147 [0,1,1,0,0,0|1,0,1]=4 2915 B7R0.3 C=CC(N)CSCC Amb27648478 [0,1,1,0,0,0|1,0,1]=4 2916 B7R0.3 C=CC(O)CCOC Amb27868318 [0,1,1,0,0,0|0,0,2]=4 2917 B7R0.3 C=CC(O)CCSC Amb28123529 [0,1,1,0,0,0|0,0,2]=4 2918 B7R0.3 C=CC(O)COCC Amb28316201 [0,1,1,0,0,0|0,0,2]=4 2919 B7R0.3 C=CC(O)CSCC Amb24543994 [0,1,1,0,0,0|0,0,2]=4 2920 B7R0.3 C=CCCC(=O)CC Amb9031676 [0,1,1,0,0,0|0,0,2]=4 2921 B7R0.3 C=CCNC(=O)C=C Amb9480567 [0,1,1,0,0,0|0,0,2]=4 2922 B7R0.3 C=CCOC(=O)C=C Amb4034462 [0,1,1,0,0,0|0,0,2]=4 2923 B7R0.3 C=CCOC(=O)CC Amb22050537 [0,1,1,0,0,0|0,0,2]=4 2924 B7R0.3 C=CCSC(=O)CC Amb22043318 [0,1,1,0,0,0|0,0,2]=4 2925 B7R0.3 C=CC\C=C(/C)CC Amb24694420 [0,1,1,0,0,0|1,0,1]=4 2926 B7R0.3 C=C[C@@H](Cl)CCCC Amb27954902 [0,1,1,0,0,0|1,0,1]=4 2927 B7R0.3 C=C[C@@H](N)CCCC Amb27477524 [0,1,1,0,0,0|1,0,1]=4 2928 B7R0.3 C=C[C@H](Cl)CCCC Amb27590978 [0,1,1,0,0,0|1,0,1]=4 2929 B7R0.3 C=C[C@H](O)CCCO Amb27423134 [0,1,1,0,0,0|0,0,2]=4 2930 B7R0.3 C=C\C(C)=C/CCN Amb27494431 [0,1,1,0,0,0|1,0,1]=4 2931 B7R0.3 C=C\C(C)=C\CCCl Amb28282554 [0,1,1,0,0,0|1,0,1]=4 2932 B7R0.3 C=C\C=C\C(=O)OC Amb22350484 [0,1,1,0,0,0|1,0,1]=4 2933 B7R0.3 CC=C=CC(=O)OC Amb26575881 [0,1,1,0,0,0|1,0,0]=3 2934 B7R0.3 CCC(=O)CCCBr Amb25765636 [0,1,1,0,0,0|0,0,2]=4 2935 B7R0.3 CCC(=O)CCCCl Amb17593423 [0,1,1,0,0,0|0,0,2]=4 2936 B7R0.3 CCC(=O)CCCN Amb18833012 [0,1,1,0,0,0|0,0,2]=4 2937 B7R0.3 CCC(=O)CCNC Amb27963044 [0,1,1,0,0,0|0,0,2]=4 2938 B7R0.3 CCC(=O)CCSC Amb25680024 [0,1,1,0,0,0|0,0,2]=4 2939 B7R0.3 CCC(=O)C\C=C\Cl Amb28349318 [0,1,1,0,0,0|1,0,0]=3 2940 B7R0.3 CCC(=O)NCC=O Amb17102054 [0,1,1,0,0,0|1,0,1]=4 2941 B7R0.3 CCC(=O)NCCCl Amb17103188 [0,1,1,0,0,0|1,0,1]=4 2942 B7R0.3 CCC(=O)NCCF Amb27972779 [0,1,1,0,0,0|1,0,1]=4 2943 B7R0.3 CCC(=O)NCCN Amb1137732 [0,1,1,0,0,0|1,0,1]=4 2944 B7R0.3 CCC(=O)NCCN Amb32434788 [0,1,1,0,0,0|1,0,1]=4 2945 B7R0.3 CCC(=O)NCCN Amb33741516 [0,1,1,0,0,0|1,0,1]=4 2946 B7R0.3 CCC(=O)NCCO Amb5797470 [0,1,1,0,0,0|1,0,1]=4 2947 B7R0.3 CCC(=O)NCCS Amb24505089 [0,1,1,0,0,0|1,0,1]=4 2948 B7R0.3 CCC(=O)NNC=O Amb27835377 [0,1,1,0,0,0|2,0,0]=4 2949 B7R0.3 CCC(=O)OCCBr Amb27424669 [0,1,1,0,0,0|1,0,1]=4 2950 B7R0.3 CCC(=O)OCCF Amb27981291 [0,1,1,0,0,0|1,0,1]=4 2951 B7R0.3 CCC(=O)OCCO Amb27217859 [0,1,1,0,0,0|1,0,1]=4 2952 B7R0.3 CCC(=O)SCCBr Amb27865550 [0,1,1,0,0,0|1,0,1]=4 2953 B7R0.3 CCC(=O)\C=C\C=O Amb18641682 [0,1,1,0,0,0|0,0,1]=3 2954 B7R0.3 CCC(=S)\C=C\NC Amb27838915 [0,1,1,0,0,0|0,1,0]=3 2955 B7R0.3 CCC(C)\C=C\CBr Amb27233120 [0,1,1,0,0,0|1,0,1]=4 2956 B7R0.3 CCC(C)\C=C\CN Amb33171992 [0,1,1,0,0,0|1,0,1]=4 2957 B7R0.3 CCC(C)\C=C\CO Amb32954901 [0,1,1,0,0,0|1,0,1]=4 2958 B7R0.3 CCC(O)\C=C\SC Amb27641903 [0,1,1,0,0,0|0,0,2]=4 2959 B7R0.3 CCCCC(=O)C#N Amb22729179 [0,1,1,0,0,0|1,0,1]=4 2960 B7R0.3 CCCCC(=O)CBr Amb24563421 [0,1,1,0,0,0|1,0,1]=4 2961 B7R0.3 CCCCC(=O)CC Amb4605999 [0,1,1,0,0,0|0,0,2]=4 2962 B7R0.3 CCCCC(=O)CCl Amb17593420 [0,1,1,0,0,0|1,0,1]=4 2963 B7R0.3 CCCCC(=O)CN Amb24473062 [0,1,1,0,0,0|1,0,1]=4 2964 B7R0.3 CCCCC(=O)CO Amb26073501 [0,1,1,0,0,0|1,0,1]=4 2965 B7R0.3 CCCCC(=O)NC Amb5797766 [0,1,1,0,0,0|1,0,1]=4 2966 B7R0.3 CCCCC(=O)NN Amb534136 [0,1,1,0,0,0|2,0,0]=4 2967 B7R0.3 CCCCC(=O)NO Amb6269796 [0,1,1,0,0,0|2,0,0]=4 2968 B7R0.3 CCCC\C(Br)=C\Cl Amb27484205 [0,1,1,0,0,0|2,0,0]=4 2969 B7R0.3 CCCNC(=O)CBr Amb17330843 [0,1,1,0,0,0|1,0,1]=4 2970 B7R0.3 CCCNC(=O)CC Amb5797516 [0,1,1,0,0,0|0,0,2]=4 2971 B7R0.3 CCCNC(=O)CCl Amb1207068 [0,1,1,0,0,0|1,0,1]=4 2972 B7R0.3 CCCNC(=O)CI Amb23512283 [0,1,1,0,0,0|1,0,1]=4 2973 B7R0.3 CCCNC(=O)CN Amb10781813 [0,1,1,0,0,0|1,0,1]=4 2974 B7R0.3 CCCNC(=O)CN Amb426858 [0,1,1,0,0,0|1,0,1]=4 2975 B7R0.3 CCCNC(=O)CO Amb5798169 [0,1,1,0,0,0|1,0,1]=4 2976 B7R0.3 CCCNC(=O)NCl Amb28057729 [0,1,1,0,0,0|2,0,0]=4 2977 B7R0.3 CCCNC(=O)NN Amb8854021 [0,1,1,0,0,0|2,0,0]=4 2978 B7R0.3 CCCOC(=O)C=O Amb18641875 [0,1,1,0,0,0|1,0,0]=3 2979 B7R0.3 CCCOC(=O)CCl Amb9787444 [0,1,1,0,0,0|1,0,1]=4 2980 B7R0.3 CCCOC(=O)CN Amb9826861 [0,1,1,0,0,0|1,0,1]=4 2981 B7R0.3 CCCOC(=O)CO Amb25964379 [0,1,1,0,0,0|1,0,1]=4 2982 B7R0.3 CCCOC(=O)OC Amb27153532 [0,1,1,0,0,0|1,0,1]=4 2983 B7R0.3 CCCSC(=O)CBr Amb28385643 [0,1,1,0,0,0|1,0,1]=4 2984 B7R0.3 CCCSC(=O)CC Amb25882938 [0,1,1,0,0,0|0,0,2]=4 2985 B7R0.3 CCCSC(=O)NC Amb27788550 [0,1,1,0,0,0|1,0,1]=4 2986 B7R0.3 CCCSC(=O)NN Amb27769595 [0,1,1,0,0,0|2,0,0]=4 2987 B7R0.3 CCC\C=C(/C)CC Amb25260956 [0,1,1,0,0,0|1,0,1]=4 2988 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [0,1,1,0,0,0|2,0,0]=4 2989 B7R0.3 CCNCC(=O)NC Amb32680747 [0,1,1,0,0,0|1,0,1]=4 2990 B7R0.3 CCNCC(=O)NC Amb6251820 [0,1,1,0,0,0|1,0,1]=4 2991 B7R0.3 CCNCC(=O)NO Amb27755137 [0,1,1,0,0,0|2,0,0]=4 2992 B7R0.3 CCNCC(=O)OC Amb19514718 [0,1,1,0,0,0|1,0,1]=4 2993 B7R0.3 CCNCC(=O)OC Amb6687125 [0,1,1,0,0,0|1,0,1]=4 2994 B7R0.3 CCOCC(=O)CC Amb27406475 [0,1,1,0,0,0|0,0,2]=4 2995 B7R0.3 CCOCC(=O)CCl Amb25087764 [0,1,1,0,0,0|1,0,1]=4 2996 B7R0.3 CCOCC(=O)CF Amb28316133 [0,1,1,0,0,0|1,0,1]=4 2997 B7R0.3 CCOCC(=O)CN Amb27453616 [0,1,1,0,0,0|1,0,1]=4 2998 B7R0.3 CCOCC(=O)CO Amb28066809 [0,1,1,0,0,0|1,0,1]=4 2999 B7R0.3 CCOCC(=O)NN Amb2111918 [0,1,1,0,0,0|2,0,0]=4 3000 B7R0.3 CCOCC(=O)NN Amb6744505 [0,1,1,0,0,0|2,0,0]=4 3001 B7R0.3 CCOCC(=O)OC Amb7753022 [0,1,1,0,0,0|1,0,1]=4 3002 B7R0.3 CCOC\C(C)=C/Cl Amb27201335 [0,1,1,0,0,0|2,0,0]=4 3003 B7R0.3 CCSCC(=O)CCl Amb24545960 [0,1,1,0,0,0|1,0,1]=4 3004 B7R0.3 CCSCC(=O)CN Amb33324079 [0,1,1,0,0,0|1,0,1]=4 3005 B7R0.3 CCSCC(=O)NN Amb2610654 [0,1,1,0,0,0|2,0,0]=4 3006 B7R0.3 CCSCC(=O)OC Amb7753193 [0,1,1,0,0,0|1,0,1]=4 3007 B7R0.3 CC\C(Br)=C\CCO Amb28453501 [0,1,1,0,0,0|1,0,1]=4 3008 B7R0.3 CC\C(C)=C/CCO Amb25264354 [0,1,1,0,0,0|1,0,1]=4 3009 B7R0.3 CC\C(C)=C\CCBr Amb10070627 [0,1,1,0,0,0|1,0,1]=4 3010 B7R0.3 CC\C(C)=C\CCN Amb27243209 [0,1,1,0,0,0|1,0,1]=4 3011 B7R0.3 CC\C(C)=C\CCO Amb28388883 [0,1,1,0,0,0|1,0,1]=4 3012 B7R0.3 CC\C(C)=C\CNC Amb31161536 [0,1,1,0,0,0|1,0,1]=4 3013 B7R0.3 CC\C=C\C(=O)CBr Amb25251595 [0,1,1,0,0,0|1,0,0]=3 3014 B7R0.3 CC\C=C\C(=O)CC Amb25283354 [0,1,1,0,0,0|0,0,0]=2 3015 B7R0.3 CC\C=C\C(=O)CCl Amb33057661 [0,1,1,0,0,0|1,0,0]=3 3016 B7R0.3 CC\C=C\C(=O)CN Amb33268678 [0,1,1,0,0,0|1,0,0]=3 3017 B7R0.3 CC\C=C\C(=O)OC Amb2689583 [0,1,1,0,0,0|1,0,0]=3 3018 B7R0.3 CC\C=C\C(C)CC Amb26433198 [0,1,1,0,0,0|1,0,1]=4 3019 B7R0.3 CC\C=C\C(O)CC Amb27619562 [0,1,1,0,0,0|0,0,2]=4 3020 B7R0.3 CC\C=C\[C@@H](O)CC Amb28188274 [0,1,1,0,0,0|0,0,2]=4 3021 B7R0.3 CC\C=N\S(=O)CC Amb35726547 [0,1,1,0,0,0|1,0,1]=4 3022 B7R0.3 CNC(=O)CCCCl Amb1137464 [0,1,1,0,0,0|1,0,1]=4 3023 B7R0.3 CNC(=O)CCCI Amb27625606 [0,1,1,0,0,0|1,0,1]=4 3024 B7R0.3 CNC(=O)CCCN Amb6263864 [0,1,1,0,0,0|1,0,1]=4 3025 B7R0.3 CNC(=O)CCCN Amb9176288 [0,1,1,0,0,0|1,0,1]=4 3026 B7R0.3 CNC(=O)CCCO Amb17231829 [0,1,1,0,0,0|1,0,1]=4 3027 B7R0.3 CNC(=O)CCCS Amb27259921 [0,1,1,0,0,0|1,0,1]=4 3028 B7R0.3 CNC(=O)CCOC Amb27655430 [0,1,1,0,0,0|1,0,1]=4 3029 B7R0.3 CNC(=O)\C=C\CN Amb27196933 [0,1,1,0,0,0|1,0,0]=3 3030 B7R0.3 CNC(=O)\C=C\CN Amb29083397 [0,1,1,0,0,0|1,0,0]=3 3031 B7R0.3 CNCCC(=O)NC Amb19959924 [0,1,1,0,0,0|1,0,1]=4 3032 B7R0.3 CNCCC(=O)NC Amb8428200 [0,1,1,0,0,0|1,0,1]=4 3033 B7R0.3 CNCCC(=O)NN Amb28143068 [0,1,1,0,0,0|2,0,0]=4 3034 B7R0.3 CNCCC(=O)NO Amb27763537 [0,1,1,0,0,0|2,0,0]=4 3035 B7R0.3 CNCCC(=O)OC Amb22168213 [0,1,1,0,0,0|1,0,1]=4 3036 B7R0.3 CNCCC(=O)OC Amb7969878 [0,1,1,0,0,0|1,0,1]=4 3037 B7R0.3 CNCC\C(C)=C\Cl Amb27594199 [0,1,1,0,0,0|2,0,0]=4 3038 B7R0.3 COC(=O)CCCBr Amb8516943 [0,1,1,0,0,0|1,0,1]=4 3039 B7R0.3 COC(=O)CCCCl Amb3940271 [0,1,1,0,0,0|1,0,1]=4 3040 B7R0.3 COC(=O)CCCI Amb3941711 [0,1,1,0,0,0|1,0,1]=4 3041 B7R0.3 COC(=O)CCCN Amb402626 [0,1,1,0,0,0|1,0,1]=4 3042 B7R0.3 COC(=O)CCCS Amb19373761 [0,1,1,0,0,0|1,0,1]=4 3043 B7R0.3 COC(=O)CCC[NH3+] Amb2778689 [0,1,1,0,0,0|1,0,1]=4 3044 B7R0.3 COC(=O)CCSC Amb8393179 [0,1,1,0,0,0|1,0,1]=4 3045 B7R0.3 COC(=O)C\C=C\Cl Amb28458363 [0,1,1,0,0,0|2,0,0]=4 3046 B7R0.3 COC(=O)\C=C\C=O Amb18641759 [0,1,1,0,0,0|1,0,1]=4 3047 B7R0.3 COC(=O)\C=C\CBr Amb8513243 [0,1,1,0,0,0|1,0,0]=3 3048 B7R0.3 COC(=O)\C=C\CF Amb35747826 [0,1,1,0,0,0|1,0,0]=3 3049 B7R0.3 COC(=O)\C=C\CN Amb24117125 [0,1,1,0,0,0|1,0,0]=3 3050 B7R0.3 COC(=O)\C=C\CN Amb30634316 [0,1,1,0,0,0|1,0,0]=3 3051 B7R0.3 COC(=O)\C=C\NO Amb28315962 [0,1,1,0,0,0|2,0,0]=4 3052 B7R0.3 COC(=O)\C=C\SC Amb33473626 [0,1,1,0,0,0|1,0,0]=3 3053 B7R0.3 COCCC(=O)CCl Amb20622320 [0,1,1,0,0,0|1,0,1]=4 3054 B7R0.3 COCCC(=O)CN Amb26515688 [0,1,1,0,0,0|1,0,1]=4 3055 B7R0.3 COCCC(=O)NN Amb2689273 [0,1,1,0,0,0|2,0,0]=4 3056 B7R0.3 COCCC(=O)OC Amb6296150 [0,1,1,0,0,0|1,0,1]=4 3057 B7R0.3 COCC\C(N)=C\O Amb28364926 [0,1,1,0,0,0|2,0,0]=4 3058 B7R0.3 CO\C=C\C(=O)CBr Amb26323620 [0,1,1,0,0,0|1,0,0]=3 3059 B7R0.3 CO\C=C\C(=O)OC Amb6600489 [0,1,1,0,0,0|1,0,0]=3 3060 B7R0.3 CSC(=O)CCCCl Amb27249585 [0,1,1,0,0,0|1,0,1]=4 3061 B7R0.3 CSCCC(=O)CCl Amb25910902 [0,1,1,0,0,0|1,0,1]=4 3062 B7R0.3 CSCCC(=O)CF Amb28316167 [0,1,1,0,0,0|1,0,1]=4 3063 B7R0.3 CSCCC(=O)CN Amb33199125 [0,1,1,0,0,0|1,0,1]=4 3064 B7R0.3 CS\C=C\C(=O)NN Amb27458500 [0,1,1,0,0,0|2,0,0]=4 3065 B7R0.3 C\C=C(/C)CCCC Amb22229367 [0,1,1,0,0,0|1,0,1]=4 3066 B7R0.3 C\C=C(/C)NCCC Amb27881221 [0,1,1,0,0,0|1,0,1]=4 3067 B7R0.3 C\C=C(/Cl)CCCCl Amb27832144 [0,1,1,0,0,0|1,0,1]=4 3068 B7R0.3 C\C=C(\C)CCCBr Amb28325651 [0,1,1,0,0,0|1,0,1]=4 3069 B7R0.3 C\C=C(\C)CCCN Amb27412873 [0,1,1,0,0,0|1,0,1]=4 3070 B7R0.3 C\C=C(\Cl)CCCCl Amb27421928 [0,1,1,0,0,0|1,0,1]=4 3071 B7R0.3 C\C=C/CC(Cl)CC Amb27760501 [0,1,1,0,0,0|1,0,1]=4 3072 B7R0.3 C\C=C\CC(=N)OC Amb28058157 [0,1,1,0,0,0|2,0,0]=4 3073 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [0,1,1,0,0,0|1,0,0]=3 3074 B7R0.3 C\C=C\CN(C)CC Amb27956345 [0,1,1,0,0,0|2,0,0]=4 3075 B7R0.3 C\C=C\NC(=O)NC Amb24585267 [0,1,1,0,0,0|1,0,0]=3 3076 B7R0.3 C\C=C\NC(=O)OC Amb27838402 [0,1,1,0,0,0|1,0,0]=3 3077 B7R0.3 C\C=C\OC(=O)CCl Amb8387724 [0,1,1,0,0,0|1,0,0]=3 3078 B7R0.3 C\C=C\SC(Cl)CC Amb28138039 [0,1,1,0,0,0|1,0,1]=4 3079 B7R0.3 C\C=N\NC(=O)CCl Amb28345569 [0,1,1,0,0,0|2,0,0]=4 3080 B7R0.3 C\N=C(C)\C=C/NC Amb28398404 [0,1,1,0,0,0|2,0,0]=4 3081 B7R0.3 C\N=C(C)\C=C\NC Amb27489242 [0,1,1,0,0,0|2,0,0]=4 3082 B7R0.3 C\N=C\C=C(/C)NC Amb27489012 [0,1,1,0,0,0|2,0,0]=4 3083 B7R0.3 N#CC(=O)CCCCl Amb28410737 [0,1,1,0,0,0|1,0,1]=4 3084 B7R0.3 N#CC(=O)\C=C\CBr Amb26075400 [0,1,1,0,0,0|1,0,1]=4 3085 B7R0.3 N#CCCC(=O)C=O Amb27792293 [0,1,1,0,0,0|1,0,1]=4 3086 B7R0.3 NCCCC(=O)NN Amb18061734 [0,1,1,0,0,0|2,0,0]=4 3087 B7R0.3 NNC(=O)CCCCl Amb9818914 [0,1,1,0,0,0|2,0,0]=4 3088 B7R0.3 NNC(=O)CCCO Amb535400 [0,1,1,0,0,0|2,0,0]=4 3089 B7R0.3 O=C(CBr)CCCBr Amb27153779 [0,1,1,0,0,0|1,0,1]=4 3090 B7R0.3 O=C(CBr)CCCCl Amb27875989 [0,1,1,0,0,0|1,0,1]=4 3091 B7R0.3 O=C(CCCCl)NO Amb28061167 [0,1,1,0,0,0|2,0,0]=4 3092 B7R0.3 O=C(CCCF)NO Amb28185008 [0,1,1,0,0,0|2,0,0]=4 3093 B7R0.3 O=C(CCl)CCCBr Amb22395325 [0,1,1,0,0,0|1,0,1]=4 3094 B7R0.3 O=C(CCl)CCCCl Amb22395285 [0,1,1,0,0,0|1,0,1]=4 3095 B7R0.3 O=C(CCl)O\C=C/Cl Amb27453620 [0,1,1,0,0,0|2,0,0]=4 3096 B7R0.3 O=C(CCl)O\C=C\Cl Amb27204913 [0,1,1,0,0,0|2,0,0]=4 3097 B7R0.3 O=C(CO)CCCO Amb27227084 [0,1,1,0,0,0|1,0,1]=4 3098 B7R0.3 O=CC(=O)CCCO Amb27751348 [0,1,1,0,0,0|1,0,0]=3 3099 B7R0.3 O=C\C=C\C(=O)CO Amb24574003 [0,1,1,0,0,0|1,0,1]=4 3100 B7R0.5 C=C(Br)C(=O)OCC Amb19516136 [0,1,1,0,0,0|1,0,0]=3 3101 B7R0.5 C=C(C)C(=C)CCN Amb33199210 [0,1,1,0,0,0|2,0,0]=4 3102 B7R0.5 C=C(C)C(=C)CNC Amb28250877 [0,1,1,0,0,0|2,0,0]=4 3103 B7R0.5 C=C(C)C(=N)OCC Amb26382068 [0,1,1,0,0,0|2,0,0]=4 3104 B7R0.5 C=C(C)C(=O)CCC Amb25862437 [0,1,1,0,0,0|0,0,0]=2 3105 B7R0.5 C=C(C)C(=O)CCN Amb25694471 [0,1,1,0,0,0|1,0,0]=3 3106 B7R0.5 C=C(C)C(=O)CNC Amb26901887 [0,1,1,0,0,0|1,0,0]=3 3107 B7R0.5 C=C(C)C(=O)NCC Amb17934052 [0,1,1,0,0,0|1,0,0]=3 3108 B7R0.5 C=C(C)C(=O)NCO Amb6869615 [0,1,1,0,0,0|2,0,0]=4 3109 B7R0.5 C=C(C)C(=O)OCC Amb8395008 [0,1,1,0,0,0|1,0,0]=3 3110 B7R0.5 C=C(C)C(=O)OCCl Amb28313699 [0,1,1,0,0,0|2,0,0]=4 3111 B7R0.5 C=C(C)C(=O)\C=C\C Amb24422389 [0,1,1,0,0,0|0,0,1]=3 3112 B7R0.5 C=C(C)C(Cl)CCC Amb28121399 [0,1,1,0,0,0|1,0,1]=4 3113 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [0,1,1,0,0,0|2,0,0]=4 3114 B7R0.5 C=C(Cl)C(=O)OCC Amb22734210 [0,1,1,0,0,0|1,0,0]=3 3115 B7R0.5 C=C(F)C(O)CCC Amb27833609 [0,1,1,0,0,0|0,0,2]=4 3116 B7R0.5 C=C(\C=C\C)C(C)=O Amb25712751 [0,1,1,0,0,0|1,0,1]=4 3117 B7R0.5 C=CCC(=O)C(=C)C Amb17593136 [0,1,1,0,0,0|0,0,2]=4 3118 B7R0.5 C=CCC(=O)[C@@H](C)N Amb30024575 [0,1,1,0,0,0|0,0,2]=4 3119 B7R0.5 C=CCC(=O)[C@H](C)N Amb35617898 [0,1,1,0,0,0|0,0,2]=4 3120 B7R0.5 C=CNC(=O)C(C)C Amb28252471 [0,1,1,0,0,0|1,0,1]=4 3121 B7R0.5 C=CNC(=O)C(C)O Amb27872694 [0,1,1,0,0,0|1,0,1]=4 3122 B7R0.5 C=COC(=O)C(C)C Amb26422505 [0,1,1,0,0,0|1,0,1]=4 3123 B7R0.5 C=COC(=O)C(C)O Amb17593197 [0,1,1,0,0,0|1,0,1]=4 3124 B7R0.5 C=C\C=C(/C)C(C)N Amb28456278 [0,1,1,0,0,0|1,0,1]=4 3125 B7R0.5 CC(=O)C(=O)CCCl Amb28077243 [0,1,1,0,0,0|1,0,1]=4 3126 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,1,1,0,0,0|1,0,1]=4 3127 B7R0.5 CC(C)C(=O)C=[N+]=[N-] Amb24557187 [0,1,1,0,0,0|2,0,0]=4 3128 B7R0.5 CC(C)C(=O)CC=O Amb25771325 [0,1,1,0,0,0|1,0,1]=4 3129 B7R0.5 CC(C)C(=O)\C=C\Cl Amb34915330 [0,1,1,0,0,0|1,0,0]=3 3130 B7R0.5 CC(C)C(=O)\C=C\N Amb25083174 [0,1,1,0,0,0|1,0,0]=3 3131 B7R0.5 CC(C)C(=O)\C=C\[O-] Amb27837535 [0,1,1,0,0,0|1,0,0]=3 3132 B7R0.5 CC(C)C(=O)\C=N\O Amb28382384 [0,1,1,0,0,0|2,0,0]=4 3133 B7R0.5 CC(C)C(=O)\N=C\S Amb27949045 [0,1,1,0,0,0|2,0,0]=4 3134 B7R0.5 CC(Cl)C(=O)\C=C\Cl Amb17593817 [0,1,1,0,0,0|1,0,0]=3 3135 B7R0.5 CC=C=C(C)C(C)N Amb27222315 [0,1,1,0,0,0|1,0,1]=4 3136 B7R0.5 CC=C=C(Cl)C(C)O Amb27763418 [0,1,1,0,0,0|1,0,1]=4 3137 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [0,1,1,0,0,0|1,0,0]=3 3138 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [0,1,1,0,0,0|0,0,1]=3 3139 B7R0.5 CCCC(=O)C(C)Br Amb26586776 [0,1,1,0,0,0|0,0,2]=4 3140 B7R0.5 CCCC(=O)C(C)C Amb8394855 [0,1,1,0,0,0|0,0,2]=4 3141 B7R0.5 CCCC(=O)C(C)N Amb18641850 [0,1,1,0,0,0|0,0,2]=4 3142 B7R0.5 CCCC(=O)C(C)O Amb24481443 [0,1,1,0,0,0|0,0,2]=4 3143 B7R0.5 CCCC(=O)C(F)F Amb28396843 [0,1,1,0,0,0|1,0,1]=4 3144 B7R0.5 CCCC(=O)N(C)C Amb2721151 [0,1,1,0,0,0|1,0,1]=4 3145 B7R0.5 CCCC(=O)N(C)N Amb33191427 [0,1,1,0,0,0|1,0,1]=4 3146 B7R0.5 CCCC(=O)N(C)O Amb27229047 [0,1,1,0,0,0|1,0,1]=4 3147 B7R0.5 CCCC(=O)[C@@H](C)N Amb30023710 [0,1,1,0,0,0|0,0,2]=4 3148 B7R0.5 CCCC(=O)[C@H](C)N Amb35617900 [0,1,1,0,0,0|0,0,2]=4 3149 B7R0.5 CCCC(=O)[C@H](C)O Amb24546365 [0,1,1,0,0,0|0,0,2]=4 3150 B7R0.5 CCCC(C)=C(C)C Amb4019545 [0,1,1,0,0,0|1,0,1]=4 3151 B7R0.5 CCCC(F)=C(F)F Amb10838535 [0,1,1,0,0,0|2,0,0]=4 3152 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [0,1,1,0,0,0|2,0,0]=4 3153 B7R0.5 CCNC(=O)C(C)=O Amb17399798 [0,1,1,0,0,0|1,0,1]=4 3154 B7R0.5 CCNC(=O)C(C)Br Amb17326728 [0,1,1,0,0,0|1,0,1]=4 3155 B7R0.5 CCNC(=O)C(C)Cl Amb9745748 [0,1,1,0,0,0|1,0,1]=4 3156 B7R0.5 CCNC(=O)C(C)N Amb6892333 [0,1,1,0,0,0|1,0,1]=4 3157 B7R0.5 CCNC(=O)C(C)N Amb9719931 [0,1,1,0,0,0|1,0,1]=4 3158 B7R0.5 CCNC(=O)C(C)O Amb9421391 [0,1,1,0,0,0|1,0,1]=4 3159 B7R0.5 CCNC(=O)C(N)=O Amb27969146 [0,1,1,0,0,0|2,0,0]=4 3160 B7R0.5 CCNC(=O)C(N)=S Amb19514543 [0,1,1,0,0,0|2,0,0]=4 3161 B7R0.5 CCNC(=O)[C@@H](C)O Amb27402988 [0,1,1,0,0,0|1,0,1]=4 3162 B7R0.5 CCNC(=O)[C@H](C)N Amb17231828 [0,1,1,0,0,0|1,0,1]=4 3163 B7R0.5 CCNC(=O)[C@H](C)O Amb28250860 [0,1,1,0,0,0|1,0,1]=4 3164 B7R0.5 CCOC(=O)C(=O)Cl Amb932808 [0,1,1,0,0,0|2,0,0]=4 3165 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,1,1,0,0,0|2,0,0]=4 3166 B7R0.5 CCOC(=O)C(=O)[O-] Amb16192061 [0,1,1,0,0,0|2,0,0]=4 3167 B7R0.5 CCOC(=O)C(C)=O Amb2793051 [0,1,1,0,0,0|1,0,1]=4 3168 B7R0.5 CCOC(=O)C(C)Br Amb2687789 [0,1,1,0,0,0|1,0,1]=4 3169 B7R0.5 CCOC(=O)C(C)C Amb3940129 [0,1,1,0,0,0|1,0,1]=4 3170 B7R0.5 CCOC(=O)C(C)Cl Amb3940250 [0,1,1,0,0,0|1,0,1]=4 3171 B7R0.5 CCOC(=O)C(C)F Amb8394610 [0,1,1,0,0,0|1,0,1]=4 3172 B7R0.5 CCOC(=O)C(C)I Amb24325123 [0,1,1,0,0,0|1,0,1]=4 3173 B7R0.5 CCOC(=O)C(C)N Amb2684292 [0,1,1,0,0,0|1,0,1]=4 3174 B7R0.5 CCOC(=O)C(C)N Amb4019258 [0,1,1,0,0,0|1,0,1]=4 3175 B7R0.5 CCOC(=O)C(C)O Amb8517047 [0,1,1,0,0,0|1,0,1]=4 3176 B7R0.5 CCOC(=O)C(N)=O Amb3886540 [0,1,1,0,0,0|2,0,0]=4 3177 B7R0.5 CCOC(=O)C(N)=S Amb17776596 [0,1,1,0,0,0|2,0,0]=4 3178 B7R0.5 CCOC(=O)[C@@H](C)F Amb24088350 [0,1,1,0,0,0|1,0,1]=4 3179 B7R0.5 CCOC(=O)[C@@H](C)N Amb27807204 [0,1,1,0,0,0|1,0,1]=4 3180 B7R0.5 CCOC(=O)[C@@H](C)N Amb8395170 [0,1,1,0,0,0|1,0,1]=4 3181 B7R0.5 CCOC(=O)[C@@H](C)O Amb17614096 [0,1,1,0,0,0|1,0,1]=4 3182 B7R0.5 CCOC(=O)[C@H](C)Cl Amb25923024 [0,1,1,0,0,0|1,0,1]=4 3183 B7R0.5 CCOC(=O)[C@H](C)N Amb2725105 [0,1,1,0,0,0|1,0,1]=4 3184 B7R0.5 CCOC(=O)[C@H](C)N Amb3940042 [0,1,1,0,0,0|1,0,1]=4 3185 B7R0.5 CCOC(=O)[C@H](C)O Amb3939669 [0,1,1,0,0,0|1,0,1]=4 3186 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [0,1,1,0,0,0|2,0,0]=4 3187 B7R0.5 CCSC(=O)C(C)=O Amb27972957 [0,1,1,0,0,0|1,0,1]=4 3188 B7R0.5 CCSC(=O)C(C)Br Amb27484074 [0,1,1,0,0,0|1,0,1]=4 3189 B7R0.5 CC\C=C(/C)C(C)C Amb4016284 [0,1,1,0,0,0|1,0,1]=4 3190 B7R0.5 CC\C=C(/C)C(C)O Amb27761819 [0,1,1,0,0,0|1,0,1]=4 3191 B7R0.5 CC\C=C(\C)C(C)N Amb27817590 [0,1,1,0,0,0|1,0,1]=4 3192 B7R0.5 CC\C=C(\C)[C@@H](C)O Amb27484789 [0,1,1,0,0,0|1,0,1]=4 3193 B7R0.5 CNCC(=O)C(C)C Amb27838338 [0,1,1,0,0,0|1,0,1]=4 3194 B7R0.5 COCC(=O)C(C)=O Amb24694271 [0,1,1,0,0,0|1,0,1]=4 3195 B7R0.5 COCC(=O)C(C)C Amb19375017 [0,1,1,0,0,0|1,0,1]=4 3196 B7R0.5 COCC(=O)C(C)N Amb18825587 [0,1,1,0,0,0|1,0,1]=4 3197 B7R0.5 COCC(=O)[C@@H](C)N Amb30024709 [0,1,1,0,0,0|1,0,1]=4 3198 B7R0.5 COCC(=O)[C@H](C)N Amb35617901 [0,1,1,0,0,0|1,0,1]=4 3199 B7R0.5 CONC(=O)C(C)Br Amb27659000 [0,1,1,0,0,0|2,0,0]=4 3200 B7R0.5 CONC(=O)C(C)Cl Amb27777111 [0,1,1,0,0,0|2,0,0]=4 3201 B7R0.5 CONC(=O)C(C)N Amb27461391 [0,1,1,0,0,0|2,0,0]=4 3202 B7R0.5 CONC(=O)[C@@H](C)N Amb27955810 [0,1,1,0,0,0|2,0,0]=4 3203 B7R0.5 CONC(=O)[C@H](C)N Amb27838965 [0,1,1,0,0,0|2,0,0]=4 3204 B7R0.5 CSCC(=O)C(C)N Amb33225478 [0,1,1,0,0,0|1,0,1]=4 3205 B7R0.5 C\C(=C/C=O)C(C)C Amb18641697 [0,1,1,0,0,0|2,0,0]=4 3206 B7R0.5 C\C(=C\C=O)C(C)C Amb27872238 [0,1,1,0,0,0|2,0,0]=4 3207 B7R0.5 C\C=C/[C@@H](Cl)[C@H](C)Cl Amb27477900 [0,1,1,0,0,0|1,0,1]=4 3208 B7R0.5 C\C=C\C(=O)C(C)C Amb25718415 [0,1,1,0,0,0|0,0,0]=2 3209 B7R0.5 C\C=C\C(=O)C(Cl)Cl Amb27204170 [0,1,1,0,0,0|1,0,0]=3 3210 B7R0.5 C\C=C\C(=O)N(C)C Amb28058173 [0,1,1,0,0,0|1,0,0]=3 3211 B7R0.5 C\C=C\C(=O)N(C)N Amb33191429 [0,1,1,0,0,0|1,0,0]=3 3212 B7R0.5 C\C=C\C(Br)C(C)C Amb24333001 [0,1,1,0,0,0|1,0,1]=4 3213 B7R0.5 C\C=C\C(C)C(C)O Amb32944797 [0,1,1,0,0,0|1,0,1]=4 3214 B7R0.5 C\C=C\C(Cl)C(C)Cl Amb27233690 [0,1,1,0,0,0|1,0,1]=4 3215 B7R0.5 C\C=C\C(N)C(C)C Amb24473868 [0,1,1,0,0,0|1,0,1]=4 3216 B7R0.5 C\C=C\C(O)C(C)C Amb22231665 [0,1,1,0,0,0|0,0,2]=4 3217 B7R0.5 C\C=C\C(O)C(C)O Amb28429731 [0,1,1,0,0,0|0,0,2]=4 3218 B7R0.5 C\C=C\[C@H](O)[C@H](C)N Amb27168687 [0,1,1,0,0,0|0,0,2]=4 3219 B7R0.5 C\C=N\S(=O)C(C)C Amb29861453 [0,1,1,0,0,0|2,0,0]=4 3220 B7R0.5 C\N=C\C(=O)C(C)C Amb28048921 [0,1,1,0,0,0|1,0,0]=3 3221 B7R0.5 N\C=C\C(=O)C(Cl)Cl Amb25773354 [0,1,1,0,0,0|2,0,0]=4 3222 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [0,1,1,0,0,0|2,0,0]=4 3223 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [0,1,1,0,0,0|2,0,0]=4 3224 B7R0.7 C#CCC(=O)CC=C Amb27411341 [0,1,1,0,0,0|0,0,2]=4 3225 B7R0.7 C=C(\C=C/Br)OCC Amb27409775 [0,1,1,0,0,0|2,0,0]=4 3226 B7R0.7 C=C=CC(=O)OCC Amb16230924 [0,1,1,0,0,0|1,0,0]=3 3227 B7R0.7 C=CCC(=O)CC=C Amb24706994 [0,1,1,0,0,0|0,0,2]=4 3228 B7R0.7 C=CCC(=O)COC Amb27168366 [0,1,1,0,0,0|1,0,0]=3 3229 B7R0.7 C=CCC(=O)OC=C Amb27242220 [0,1,1,0,0,0|0,0,2]=4 3230 B7R0.7 C=CCC(=O)OCC Amb17672947 [0,1,1,0,0,0|1,0,0]=3 3231 B7R0.7 C=CCC(=O)\C=C/C Amb27604137 [0,1,1,0,0,0|0,0,1]=3 3232 B7R0.7 C=CCC(=O)\C=C\C Amb24584475 [0,1,1,0,0,0|0,0,1]=3 3233 B7R0.7 C=CCC(C)CCC Amb26958532 [0,1,1,0,0,0|1,0,1]=4 3234 B7R0.7 C=CCC(O)CCC Amb4019981 [0,1,1,0,0,0|0,0,2]=4 3235 B7R0.7 C=CC[C@@H](O)CCC Amb28315693 [0,1,1,0,0,0|0,0,2]=4 3236 B7R0.7 C=CC[C@H](O)CCC Amb27221895 [0,1,1,0,0,0|0,0,2]=4 3237 B7R0.7 C=CC\C(C)=C\CC Amb26515782 [0,1,1,0,0,0|1,0,1]=4 3238 B7R0.7 C=CNC(=O)NCC Amb27982432 [0,1,1,0,0,0|1,0,0]=3 3239 B7R0.7 C=COC(=O)CCCl Amb28347432 [0,1,1,0,0,0|1,0,0]=3 3240 B7R0.7 C=COC(=O)CCI Amb17934195 [0,1,1,0,0,0|1,0,0]=3 3241 B7R0.7 C=COC(=O)\C=C\C Amb8514531 [0,1,1,0,0,0|0,0,2]=4 3242 B7R0.7 C=COC(O)CCC Amb27222270 [0,1,1,0,0,0|0,0,2]=4 3243 B7R0.7 C=C\C=C(/C)CCC Amb24577361 [0,1,1,0,0,0|1,0,0]=3 3244 B7R0.7 CC#CC(=O)CCC Amb17593135 [0,1,1,0,0,0|0,0,2]=4 3245 B7R0.7 CC#CC(=O)OCC Amb10069006 [0,1,1,0,0,0|0,0,2]=4 3246 B7R0.7 CCCC(=O)C=[N+]=[N-] Amb28048975 [0,1,1,0,0,0|1,0,0]=3 3247 B7R0.7 CCCC(=O)CC#N Amb7768264 [0,1,1,0,0,0|0,0,2]=4 3248 B7R0.7 CCCC(=O)CC=N Amb28049020 [0,1,1,0,0,0|0,0,1]=3 3249 B7R0.7 CCCC(=O)CCBr Amb27845324 [0,1,1,0,0,0|0,0,2]=4 3250 B7R0.7 CCCC(=O)CCC Amb6608653 [0,1,1,0,0,0|0,0,2]=4 3251 B7R0.7 CCCC(=O)CCCl Amb17593421 [0,1,1,0,0,0|0,0,2]=4 3252 B7R0.7 CCCC(=O)CCN Amb25104618 [0,1,1,0,0,0|0,0,2]=4 3253 B7R0.7 CCCC(=O)CNC Amb27251893 [0,1,1,0,0,0|0,0,2]=4 3254 B7R0.7 CCCC(=O)N=C=O Amb17231812 [0,1,1,0,0,0|1,0,1]=4 3255 B7R0.7 CCCC(=O)N=[N+]=[N-] Amb28250912 [0,1,1,0,0,0|2,0,0]=4 3256 B7R0.7 CCCC(=O)OCBr Amb27659135 [0,1,1,0,0,0|1,0,1]=4 3257 B7R0.7 CCCC(=O)OCC Amb3940136 [0,1,1,0,0,0|0,0,2]=4 3258 B7R0.7 CCCC(=O)OCCl Amb8384806 [0,1,1,0,0,0|1,0,1]=4 3259 B7R0.7 CCCC(=O)\C=C\Cl Amb17593395 [0,1,1,0,0,0|0,0,0]=2 3260 B7R0.7 CCCC(=O)\C=C\N Amb17593176 [0,1,1,0,0,0|0,0,0]=2 3261 B7R0.7 CCCC(Br)\C=C\O Amb28458444 [0,1,1,0,0,0|1,0,1]=4 3262 B7R0.7 CCCC(O)\C=C\F Amb27981709 [0,1,1,0,0,0|0,0,2]=4 3263 B7R0.7 CCC\C(Br)=C/C=O Amb28252419 [0,1,1,0,0,0|1,0,0]=3 3264 B7R0.7 CCC\C(C)=C\C#N Amb28120820 [0,1,1,0,0,0|1,0,1]=4 3265 B7R0.7 CCC\C(C)=C\C=O Amb27237056 [0,1,1,0,0,0|1,0,0]=3 3266 B7R0.7 CCC\C(C)=C\CCl Amb27252320 [0,1,1,0,0,0|1,0,1]=4 3267 B7R0.7 CCC\C(C)=C\CN Amb28256367 [0,1,1,0,0,0|1,0,1]=4 3268 B7R0.7 CCC\C(C)=C\CO Amb28287554 [0,1,1,0,0,0|1,0,1]=4 3269 B7R0.7 CCC\C([O-])=C\C#N Amb33483436 [0,1,1,0,0,0|0,0,2]=4 3270 B7R0.7 CCNC(=O)CCBr Amb17324658 [0,1,1,0,0,0|1,0,1]=4 3271 B7R0.7 CCNC(=O)CCCl Amb1138928 [0,1,1,0,0,0|1,0,1]=4 3272 B7R0.7 CCNC(=O)CCN Amb1131291 [0,1,1,0,0,0|1,0,1]=4 3273 B7R0.7 CCNC(=O)CCN Amb21956669 [0,1,1,0,0,0|1,0,1]=4 3274 B7R0.7 CCNC(=O)CCO Amb17334068 [0,1,1,0,0,0|1,0,1]=4 3275 B7R0.7 CCNC(=O)CNC Amb1971537 [0,1,1,0,0,0|1,0,1]=4 3276 B7R0.7 CCNC(=O)CNC Amb33548995 [0,1,1,0,0,0|1,0,1]=4 3277 B7R0.7 CCNC(=O)CSC Amb27873687 [0,1,1,0,0,0|1,0,1]=4 3278 B7R0.7 CCNC(=O)NCC Amb8484443 [0,1,1,0,0,0|1,0,1]=4 3279 B7R0.7 CCNC(=O)NOC Amb27838398 [0,1,1,0,0,0|2,0,0]=4 3280 B7R0.7 CCNC(=O)OCC Amb8517332 [0,1,1,0,0,0|1,0,1]=4 3281 B7R0.7 CCNC(=O)SCC Amb24271089 [0,1,1,0,0,0|1,0,1]=4 3282 B7R0.7 CCNC(=O)\C=C/Cl Amb28398559 [0,1,1,0,0,0|1,0,0]=3 3283 B7R0.7 CCOC(=O)C=[N+]=[N-] Amb10070568 [0,1,1,0,0,0|2,0,0]=4 3284 B7R0.7 CCOC(=O)CC=O Amb8394868 [0,1,1,0,0,0|1,0,1]=4 3285 B7R0.7 CCOC(=O)CCBr Amb3940217 [0,1,1,0,0,0|1,0,1]=4 3286 B7R0.7 CCOC(=O)CCCl Amb3940265 [0,1,1,0,0,0|1,0,1]=4 3287 B7R0.7 CCOC(=O)CCF Amb22492835 [0,1,1,0,0,0|1,0,1]=4 3288 B7R0.7 CCOC(=O)CCI Amb19957952 [0,1,1,0,0,0|1,0,1]=4 3289 B7R0.7 CCOC(=O)CCN Amb2684293 [0,1,1,0,0,0|1,0,1]=4 3290 B7R0.7 CCOC(=O)CCN Amb2697378 [0,1,1,0,0,0|1,0,1]=4 3291 B7R0.7 CCOC(=O)CCO Amb8867845 [0,1,1,0,0,0|1,0,1]=4 3292 B7R0.7 CCOC(=O)CCS Amb20620159 [0,1,1,0,0,0|1,0,1]=4 3293 B7R0.7 CCOC(=O)CC[NH3+] Amb24113699 [0,1,1,0,0,0|1,0,1]=4 3294 B7R0.7 CCOC(=O)CNC Amb33531143 [0,1,1,0,0,0|1,0,1]=4 3295 B7R0.7 CCOC(=O)CNC Amb3941374 [0,1,1,0,0,0|1,0,1]=4 3296 B7R0.7 CCOC(=O)COC Amb2726240 [0,1,1,0,0,0|1,0,1]=4 3297 B7R0.7 CCOC(=O)CSC Amb8514150 [0,1,1,0,0,0|1,0,1]=4 3298 B7R0.7 CCOC(=O)NC=O Amb28349177 [0,1,1,0,0,0|2,0,0]=4 3299 B7R0.7 CCOC(=O)NNC Amb25322288 [0,1,1,0,0,0|2,0,0]=4 3300 B7R0.7 CCOC(=O)NOC Amb6384032 [0,1,1,0,0,0|2,0,0]=4 3301 B7R0.7 CCOC(=O)OCC Amb6608863 [0,1,1,0,0,0|1,0,1]=4 3302 B7R0.7 CCOC(=O)[CH-]C=O Amb26035798 [0,1,1,0,0,0|1,0,1]=4 3303 B7R0.7 CCOC(=O)\C=C/Br Amb8515599 [0,1,1,0,0,0|1,0,0]=3 3304 B7R0.7 CCOC(=O)\C=C/Cl Amb27791777 [0,1,1,0,0,0|1,0,0]=3 3305 B7R0.7 CCOC(=O)\C=C/I Amb9825994 [0,1,1,0,0,0|1,0,0]=3 3306 B7R0.7 CCOC(=O)\C=C/N Amb25275600 [0,1,1,0,0,0|1,0,0]=3 3307 B7R0.7 CCOC(=O)\C=C\Br Amb33135678 [0,1,1,0,0,0|1,0,0]=3 3308 B7R0.7 CCOC(=O)\C=C\Cl Amb27205247 [0,1,1,0,0,0|1,0,0]=3 3309 B7R0.7 CCOC(=O)\C=C\F Amb32644746 [0,1,1,0,0,0|1,0,0]=3 3310 B7R0.7 CCOC(=O)\C=C\I Amb10604155 [0,1,1,0,0,0|1,0,0]=3 3311 B7R0.7 CCOC(=O)\C=C\N Amb20247563 [0,1,1,0,0,0|1,0,0]=3 3312 B7R0.7 CCOC(=O)\C=C\S Amb30008387 [0,1,1,0,0,0|1,0,0]=3 3313 B7R0.7 CCOC(=O)\C=C\[O-] Amb10552505 [0,1,1,0,0,0|1,0,0]=3 3314 B7R0.7 CCOC(=O)\C=N\O Amb27470791 [0,1,1,0,0,0|2,0,0]=4 3315 B7R0.7 CCOC(=O)\C=[NH+]\[NH-] Amb28315766 [0,1,1,0,0,0|2,0,0]=4 3316 B7R0.7 CCSC(=O)CCN Amb28043103 [0,1,1,0,0,0|1,0,1]=4 3317 B7R0.7 CCSC(=O)CCO Amb28044792 [0,1,1,0,0,0|1,0,1]=4 3318 B7R0.7 CCSC(=O)SCC Amb3986705 [0,1,1,0,0,0|1,0,1]=4 3319 B7R0.7 CCS\C(C)=C/C=O Amb18642814 [0,1,1,0,0,0|2,0,0]=4 3320 B7R0.7 CCS\C(C)=C\C=O Amb27482152 [0,1,1,0,0,0|2,0,0]=4 3321 B7R0.7 CC\C=C(/C)CCC Amb28140596 [0,1,1,0,0,0|1,0,1]=4 3322 B7R0.7 CC\C=C(/C)CCO Amb27640229 [0,1,1,0,0,0|1,0,1]=4 3323 B7R0.7 CC\C=C(\C)CCO Amb27441640 [0,1,1,0,0,0|1,0,1]=4 3324 B7R0.7 CNCC(=O)CCF Amb33196460 [0,1,1,0,0,0|1,0,1]=4 3325 B7R0.7 CNCC(=O)COC Amb28313964 [0,1,1,0,0,0|1,0,1]=4 3326 B7R0.7 CNCC(=O)CSC Amb33272051 [0,1,1,0,0,0|1,0,1]=4 3327 B7R0.7 COCC(=O)CCN Amb26326903 [0,1,1,0,0,0|1,0,1]=4 3328 B7R0.7 COCC(=O)COC Amb2694754 [0,1,1,0,0,0|1,0,1]=4 3329 B7R0.7 COC\C(C)=C\C=O Amb28287378 [0,1,1,0,0,0|2,0,0]=4 3330 B7R0.7 CONC(=O)CCBr Amb28048928 [0,1,1,0,0,0|2,0,0]=4 3331 B7R0.7 CONC(=O)CCCl Amb27792516 [0,1,1,0,0,0|2,0,0]=4 3332 B7R0.7 CSCC(=O)CCN Amb33272060 [0,1,1,0,0,0|1,0,1]=4 3333 B7R0.7 CSCC(=O)\C=C\Cl Amb35609142 [0,1,1,0,0,0|1,0,0]=3 3334 B7R0.7 CSCC(=O)\C=N\O Amb27487829 [0,1,1,0,0,0|2,0,0]=4 3335 B7R0.7 C\C=C/[C@@H](C)CCBr Amb27433882 [0,1,1,0,0,0|1,0,1]=4 3336 B7R0.7 C\C=C\C(=O)CCC Amb25717214 [0,1,1,0,0,0|0,0,0]=2 3337 B7R0.7 C\C=C\C(=O)CCCl Amb27803642 [0,1,1,0,0,0|0,0,0]=2 3338 B7R0.7 C\C=C\C(=O)COC Amb28315679 [0,1,1,0,0,0|0,0,0]=2 3339 B7R0.7 C\C=C\C(=O)N=C=O Amb24483044 [0,1,1,0,0,0|1,0,1]=4 3340 B7R0.7 C\C=C\C(=O)N=C=S Amb2686561 [0,1,1,0,0,0|1,0,1]=4 3341 B7R0.7 C\C=C\C(=O)N=[N+]=[N-] Amb26552906 [0,1,1,0,0,0|2,0,0]=4 3342 B7R0.7 C\C=C\C(=O)NOC Amb28423185 [0,1,1,0,0,0|1,0,0]=3 3343 B7R0.7 C\C=C\C(=O)OCBr Amb24475318 [0,1,1,0,0,0|1,0,0]=3 3344 B7R0.7 C\C=C\C(=O)OCC Amb8513578 [0,1,1,0,0,0|0,0,0]=2 3345 B7R0.7 C\C=C\C(=O)\C=C/Cl Amb28316111 [0,1,1,0,0,0|0,0,2]=4 3346 B7R0.7 C\C=C\C(=O)\C=C\Br Amb28422704 [0,1,1,0,0,0|0,0,2]=4 3347 B7R0.7 C\C=C\C(=O)\C=C\Cl Amb27657841 [0,1,1,0,0,0|0,0,2]=4 3348 B7R0.7 C\C=C\C(=O)\C=C\N Amb27422017 [0,1,1,0,0,0|0,0,2]=4 3349 B7R0.7 C\C=C\C(=O)\C=C\O Amb28054394 [0,1,1,0,0,0|0,0,2]=4 3350 B7R0.7 C\C=C\C(Br)CCC Amb17672603 [0,1,1,0,0,0|1,0,1]=4 3351 B7R0.7 C\C=C\C(C)CCC Amb26633016 [0,1,1,0,0,0|1,0,1]=4 3352 B7R0.7 C\C=C\C(C)CCO Amb27437234 [0,1,1,0,0,0|1,0,1]=4 3353 B7R0.7 C\C=C\C(Cl)=C\CCl Amb27435614 [0,1,1,0,0,0|1,0,1]=4 3354 B7R0.7 C\C=C\C(Cl)CSC Amb27657144 [0,1,1,0,0,0|1,0,1]=4 3355 B7R0.7 C\C=C\C(O)CCO Amb3354799 [0,1,1,0,0,0|0,0,2]=4 3356 B7R0.7 C\C=C\[C@@H](C)CCO Amb27651868 [0,1,1,0,0,0|1,0,1]=4 3357 B7R0.7 C\C=C\[C@H](O)CCO Amb27164439 [0,1,1,0,0,0|0,0,2]=4 3358 B7R0.7 C\C=N\S(=O)CCC Amb35732315 [0,1,1,0,0,0|1,0,1]=4 3359 B7R0.7 O=C(\C=C\Cl)CCBr Amb35585518 [0,1,1,0,0,0|1,0,0]=3 3360 B7R0.7 O=CCC(=O)CCO Amb28255739 [0,1,1,0,0,0|1,0,1]=4 3361 B7R0.10 C#CC(=O)C(N)CC Amb28422982 [0,1,1,0,0,0|0,0,2]=4 3362 B7R0.10 C#CC(=O)[C@@H](N)CC Amb35601233 [0,1,1,0,0,0|0,0,2]=4 3363 B7R0.10 C#CC(=O)[C@H](N)CC Amb35594876 [0,1,1,0,0,0|0,0,2]=4 3364 B7R0.10 C#CC(=O)\C(C)=C\C Amb28349031 [0,1,1,0,0,0|0,0,2]=4 3365 B7R0.10 C=C(C=O)[C@@H](C)CC Amb27390187 [0,1,1,0,0,0|2,0,0]=4 3366 B7R0.10 C=C(CC)C(=O)CC Amb17593165 [0,1,1,0,0,0|0,0,1]=3 3367 B7R0.10 C=C(CC)C(=O)CO Amb27486129 [0,1,1,0,0,0|1,0,1]=4 3368 B7R0.10 C=C(CC)C(=O)OC Amb24469857 [0,1,1,0,0,0|1,0,1]=4 3369 B7R0.10 C=C(CO)\C(C)=C/C Amb28065375 [0,1,1,0,0,0|2,0,0]=4 3370 B7R0.10 C=C(OC)C(=O)OC Amb28399073 [0,1,1,0,0,0|2,0,0]=4 3371 B7R0.10 C=C(SC)C(=O)OC Amb27656814 [0,1,1,0,0,0|2,0,0]=4 3372 B7R0.10 C=C=C(C)C(O)CC Amb28400385 [0,1,1,0,0,0|1,0,1]=4 3373 B7R0.10 C=CC(=C)C(O)CC Amb27397155 [0,1,1,0,0,0|1,0,0]=3 3374 B7R0.10 C=CC(=O)C(C)CC Amb26350444 [0,1,1,0,0,0|0,0,0]=2 3375 B7R0.10 C=CC(=O)C(C)CN Amb27251892 [0,1,1,0,0,0|1,0,0]=3 3376 B7R0.10 C=CC(=O)C(N)CC Amb27593564 [0,1,1,0,0,0|0,0,0]=2 3377 B7R0.10 C=CC(=O)N(C)CC Amb9480867 [0,1,1,0,0,0|1,0,0]=3 3378 B7R0.10 C=CC(=O)N(C)OC Amb9492353 [0,1,1,0,0,0|2,0,0]=4 3379 B7R0.10 C=CC(=O)[C@@H](N)CC Amb35601235 [0,1,1,0,0,0|0,0,0]=2 3380 B7R0.10 C=CC(=O)[C@H](C)NC Amb30039175 [0,1,1,0,0,0|1,0,0]=3 3381 B7R0.10 C=CC(=O)[C@H](N)CC Amb35594877 [0,1,1,0,0,0|0,0,0]=2 3382 B7R0.10 C=CC(=O)\C(C)=C/C Amb27434163 [0,1,1,0,0,0|0,0,2]=4 3383 B7R0.10 C=CC(C)C(C)CC Amb22229051 [0,1,1,0,0,0|1,0,1]=4 3384 B7R0.10 C=CC(C)C(N)CC Amb30029363 [0,1,1,0,0,0|1,0,1]=4 3385 B7R0.10 C=CC(Cl)C(O)CC Amb27482691 [0,1,1,0,0,0|1,0,1]=4 3386 B7R0.10 C=CC(N)C(C)CC Amb28132556 [0,1,1,0,0,0|1,0,1]=4 3387 B7R0.10 C=CC(O)C(C)CC Amb25139404 [0,1,1,0,0,0|0,0,2]=4 3388 B7R0.10 C=CC(O)[C@@H](N)CC Amb35601262 [0,1,1,0,0,0|0,0,2]=4 3389 B7R0.10 C=CC(O)[C@H](N)CC Amb35659376 [0,1,1,0,0,0|0,0,2]=4 3390 B7R0.10 C=C[C@@H](C)[C@H](O)CC Amb28280923 [0,1,1,0,0,0|1,0,1]=4 3391 B7R0.10 C=C[C@@H](O)[C@H](O)CC Amb28429693 [0,1,1,0,0,0|0,0,2]=4 3392 B7R0.10 C=C[C@H](O)[C@H](N)CC Amb27430452 [0,1,1,0,0,0|0,0,2]=4 3393 B7R0.10 CCC(=O)C(=O)CC Amb6608779 [0,1,1,0,0,0|0,0,1]=3 3394 B7R0.10 CCC(=O)C(=O)CO Amb28316184 [0,1,1,0,0,0|1,0,1]=4 3395 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [0,1,1,0,0,0|1,0,0]=3 3396 B7R0.10 CCC(=O)C(Br)C=O Amb27407783 [0,1,1,0,0,0|1,0,1]=4 3397 B7R0.10 CCC(=O)C(C)CC Amb22229845 [0,1,1,0,0,0|0,0,2]=4 3398 B7R0.10 CCC(=O)C(C)NC Amb25738187 [0,1,1,0,0,0|1,0,1]=4 3399 B7R0.10 CCC(=O)C(Cl)CC Amb17593422 [0,1,1,0,0,0|0,0,2]=4 3400 B7R0.10 CCC(=O)C(F)CC Amb28048919 [0,1,1,0,0,0|0,0,2]=4 3401 B7R0.10 CCC(=O)C(O)CC Amb2721046 [0,1,1,0,0,0|0,0,2]=4 3402 B7R0.10 CCC(=O)N(C)OC Amb8394947 [0,1,1,0,0,0|2,0,0]=4 3403 B7R0.10 CCC(=O)N(N)CC Amb33191316 [0,1,1,0,0,0|1,0,1]=4 3404 B7R0.10 CCC(=O)[C@@H](N)CC Amb35601236 [0,1,1,0,0,0|0,0,2]=4 3405 B7R0.10 CCC(=O)[C@H](C)CC Amb27835595 [0,1,1,0,0,0|0,0,2]=4 3406 B7R0.10 CCC(=O)[C@H](C)NC Amb30039186 [0,1,1,0,0,0|1,0,1]=4 3407 B7R0.10 CCC(=O)[C@H](N)CC Amb35594878 [0,1,1,0,0,0|0,0,2]=4 3408 B7R0.10 CCC(=O)\C(Br)=C\O Amb28316206 [0,1,1,0,0,0|1,0,0]=3 3409 B7R0.10 CCC(=O)\C(C)=C/N Amb17778143 [0,1,1,0,0,0|1,0,0]=3 3410 B7R0.10 CCC(=O)\C(C)=C\Br Amb26477160 [0,1,1,0,0,0|1,0,0]=3 3411 B7R0.10 CCC(=O)\C(C)=C\Cl Amb28291599 [0,1,1,0,0,0|1,0,0]=3 3412 B7R0.10 CCC(=O)\C(C)=C\N Amb27798686 [0,1,1,0,0,0|1,0,0]=3 3413 B7R0.10 CCC(=O)\C(C)=N/N Amb28126724 [0,1,1,0,0,0|2,0,0]=4 3414 B7R0.10 CCC(=O)\C(C)=N/O Amb10552519 [0,1,1,0,0,0|2,0,0]=4 3415 B7R0.10 CCC(=O)\C(C)=N\C Amb27260482 [0,1,1,0,0,0|1,0,0]=3 3416 B7R0.10 CCC(=O)\C(C)=N\O Amb27460236 [0,1,1,0,0,0|2,0,0]=4 3417 B7R0.10 CCC(Br)C(=O)NC Amb18181033 [0,1,1,0,0,0|1,0,1]=4 3418 B7R0.10 CCC(Br)C(=O)OC Amb1157544 [0,1,1,0,0,0|1,0,1]=4 3419 B7R0.10 CCC(C)C(=O)CBr Amb24483169 [0,1,1,0,0,0|1,0,1]=4 3420 B7R0.10 CCC(C)C(=O)CCl Amb20667851 [0,1,1,0,0,0|1,0,1]=4 3421 B7R0.10 CCC(C)C(=O)CN Amb26871505 [0,1,1,0,0,0|1,0,1]=4 3422 B7R0.10 CCC(C)C(=O)CO Amb24680373 [0,1,1,0,0,0|1,0,1]=4 3423 B7R0.10 CCC(C)C(=O)NN Amb9706124 [0,1,1,0,0,0|2,0,0]=4 3424 B7R0.10 CCC(C)C(=O)NO Amb6275767 [0,1,1,0,0,0|2,0,0]=4 3425 B7R0.10 CCC(C)\C(Cl)=C\Cl Amb27865557 [0,1,1,0,0,0|2,0,0]=4 3426 B7R0.10 CCC(Cl)C(=O)OC Amb21618748 [0,1,1,0,0,0|1,0,1]=4 3427 B7R0.10 CCC(N)C(=O)NC Amb33552054 [0,1,1,0,0,0|1,0,1]=4 3428 B7R0.10 CCC(N)C(=O)NC Amb9514096 [0,1,1,0,0,0|1,0,1]=4 3429 B7R0.10 CCC(N)C(=O)NN Amb18061942 [0,1,1,0,0,0|2,0,0]=4 3430 B7R0.10 CCC(N)C(=O)NO Amb21922881 [0,1,1,0,0,0|2,0,0]=4 3431 B7R0.10 CCC(N)C(=O)OC Amb17601372 [0,1,1,0,0,0|1,0,1]=4 3432 B7R0.10 CCC(N)C(=O)OC Amb9271765 [0,1,1,0,0,0|1,0,1]=4 3433 B7R0.10 CCC(O)C(=O)C=O Amb24722957 [0,1,1,0,0,0|1,0,0]=3 3434 B7R0.10 CCC(O)C(=O)CO Amb28316154 [0,1,1,0,0,0|1,0,1]=4 3435 B7R0.10 CCC(O)C(=O)NC Amb27403520 [0,1,1,0,0,0|1,0,1]=4 3436 B7R0.10 CCC(O)C(=O)OC Amb4019849 [0,1,1,0,0,0|1,0,1]=4 3437 B7R0.10 CCC(S)C(=O)OC Amb26860434 [0,1,1,0,0,0|1,0,1]=4 3438 B7R0.10 CC[C@@H](Br)C(=O)OC Amb27607617 [0,1,1,0,0,0|1,0,1]=4 3439 B7R0.10 CC[C@@H](N)C(=O)NC Amb27655585 [0,1,1,0,0,0|1,0,1]=4 3440 B7R0.10 CC[C@@H](N)C(=O)NO Amb27602079 [0,1,1,0,0,0|2,0,0]=4 3441 B7R0.10 CC[C@@H](N)C(=O)OC Amb19944650 [0,1,1,0,0,0|1,0,1]=4 3442 B7R0.10 CC[C@@H](N)C(=O)OC Amb22057548 [0,1,1,0,0,0|1,0,1]=4 3443 B7R0.10 CC[C@H](C)C(=O)NC Amb27403795 [0,1,1,0,0,0|1,0,1]=4 3444 B7R0.10 CC[C@H](C)C(=O)OC Amb28145887 [0,1,1,0,0,0|1,0,1]=4 3445 B7R0.10 CC[C@H](N)C(=O)NN Amb27186616 [0,1,1,0,0,0|2,0,0]=4 3446 B7R0.10 CC[C@H](N)C(=O)NO Amb27869261 [0,1,1,0,0,0|2,0,0]=4 3447 B7R0.10 CC[C@H](N)C(=O)OC Amb22167154 [0,1,1,0,0,0|1,0,1]=4 3448 B7R0.10 CC[C@H](N)C(=O)OC Amb27391053 [0,1,1,0,0,0|1,0,1]=4 3449 B7R0.10 CC[C@H](O)C(=O)CO Amb27433137 [0,1,1,0,0,0|1,0,1]=4 3450 B7R0.10 CC[C@H](O)C(=O)OC Amb26318042 [0,1,1,0,0,0|1,0,1]=4 3451 B7R0.10 CC\C(C)=C(/C)C=O Amb27622928 [0,1,1,0,0,0|2,0,0]=4 3452 B7R0.10 CC\C(C)=C(/F)C=O Amb27948535 [0,1,1,0,0,0|2,0,0]=4 3453 B7R0.10 CC\C(C)=C(\C)CC Amb24099381 [0,1,1,0,0,0|1,0,1]=4 3454 B7R0.10 CC\C(Cl)=C(/C)C=O Amb27761558 [0,1,1,0,0,0|2,0,0]=4 3455 B7R0.10 CC\C(O)=C(/Br)C=O Amb28133175 [0,1,1,0,0,0|1,0,1]=4 3456 B7R0.10 CNC(=N)C(=O)NC Amb27879455 [0,1,1,0,0,0|2,0,0]=4 3457 B7R0.10 CNC(=O)C(=O)NC Amb534268 [0,1,1,0,0,0|2,0,0]=4 3458 B7R0.10 CNC(=O)C(=O)OC Amb26858133 [0,1,1,0,0,0|2,0,0]=4 3459 B7R0.10 CNC(=O)C(=S)SC Amb27461333 [0,1,1,0,0,0|2,0,0]=4 3460 B7R0.10 COC(=O)C(=O)CBr Amb2455971 [0,1,1,0,0,0|2,0,0]=4 3461 B7R0.10 COC(=O)C(=O)CCl Amb25929741 [0,1,1,0,0,0|2,0,0]=4 3462 B7R0.10 COC(=O)C(=O)CF Amb27464331 [0,1,1,0,0,0|2,0,0]=4 3463 B7R0.10 COC(=O)C(=O)C[S-] Amb27397384 [0,1,1,0,0,0|2,0,0]=4 3464 B7R0.10 COC(=O)C(=O)OC Amb2793071 [0,1,1,0,0,0|2,0,0]=4 3465 B7R0.10 COC(=O)\C(Br)=C/Cl Amb27955826 [0,1,1,0,0,0|2,0,0]=4 3466 B7R0.10 COC(=O)\C(Br)=C\Br Amb16234173 [0,1,1,0,0,0|2,0,0]=4 3467 B7R0.10 COC(=O)\C(Br)=C\Cl Amb27818193 [0,1,1,0,0,0|2,0,0]=4 3468 B7R0.10 COC(=O)\C(C)=C/Br Amb33249840 [0,1,1,0,0,0|2,0,0]=4 3469 B7R0.10 COC(=O)\C(C)=C\Br Amb26330519 [0,1,1,0,0,0|2,0,0]=4 3470 B7R0.10 COC(=O)\C(Cl)=C/Br Amb28325703 [0,1,1,0,0,0|2,0,0]=4 3471 B7R0.10 COC(=O)\C(Cl)=C\Cl Amb28193482 [0,1,1,0,0,0|2,0,0]=4 3472 B7R0.10 COC(=O)\C(F)=C\Cl Amb27881870 [0,1,1,0,0,0|2,0,0]=4 3473 B7R0.10 COC(C)C(=O)C=O Amb27622168 [0,1,1,0,0,0|2,0,0]=4 3474 B7R0.10 CSC(=O)C(=O)CF Amb27861416 [0,1,1,0,0,0|2,0,0]=4 3475 B7R0.10 C\C=C(/Br)C(=O)OC Amb24618775 [0,1,1,0,0,0|1,0,0]=3 3476 B7R0.10 C\C=C(/C)C(=O)C#N Amb27768636 [0,1,1,0,0,0|1,0,1]=4 3477 B7R0.10 C\C=C(/C)C(=O)CBr Amb28458579 [0,1,1,0,0,0|1,0,0]=3 3478 B7R0.10 C\C=C(/C)C(=O)CC Amb28066002 [0,1,1,0,0,0|0,0,0]=2 3479 B7R0.10 C\C=C(/C)C(=O)NC Amb27838362 [0,1,1,0,0,0|1,0,0]=3 3480 B7R0.10 C\C=C(/C)C(=O)OC Amb6296120 [0,1,1,0,0,0|1,0,0]=3 3481 B7R0.10 C\C=C(/C)C(=S)NC Amb28345690 [0,1,1,0,0,0|1,1,0]=4 3482 B7R0.10 C\C=C(/C)C(C)CC Amb25989296 [0,1,1,0,0,0|1,0,1]=4 3483 B7R0.10 C\C=C(/C)C(Cl)CC Amb28343053 [0,1,1,0,0,0|1,0,1]=4 3484 B7R0.10 C\C=C(/C)[C@H](O)CC Amb28350272 [0,1,1,0,0,0|0,0,2]=4 3485 B7R0.10 C\C=C(/N)C(=O)OC Amb27438851 [0,1,1,0,0,0|1,0,0]=3 3486 B7R0.10 C\C=C(\Br)C(=O)C#N Amb28199908 [0,1,1,0,0,0|1,0,1]=4 3487 B7R0.10 C\C=C(\C)C(=O)OC Amb19930194 [0,1,1,0,0,0|1,0,0]=3 3488 B7R0.10 O=C(CCl)\C(Cl)=C/Cl Amb27392322 [0,1,1,0,0,0|2,0,0]=4 3489 B7R0.10 O=CC(=O)[C@@H](O)CO Amb28247115 [0,1,1,0,0,0|2,0,0]=4 3490 B7R0.10 O=CC(=O)[C@H](O)CO Amb27210862 [0,1,1,0,0,0|2,0,0]=4 3491 B7R0.11 C=CC(C)(C)CCC Amb22229023 [0,1,1,0,0,0|1,0,1]=4 3492 B7R0.11 C=CP(=O)(Cl)CCCl Amb28325534 [0,1,1,0,0,0|2,0,0]=4 3493 B7R0.11 C=CP(C)(=O)CCCl Amb27872111 [0,1,1,0,0,0|2,0,0]=4 3494 B7R0.11 C=CS(=O)(=O)CCC Amb27424659 [0,1,1,0,0,0|1,0,0]=3 3495 B7R0.11 C=CS(=O)(=O)CCCl Amb20624007 [0,1,1,0,0,0|2,0,0]=4 3496 B7R0.11 C=CS(=O)(=O)CCO Amb24580830 [0,1,1,0,0,0|2,0,0]=4 3497 B7R0.11 C=CS(=O)(=O)NCC Amb35789262 [0,1,1,0,0,0|2,0,0]=4 3498 B7R0.12 C=CC(CC)CCC Amb26515787 [0,1,1,0,0,0|1,0,1]=4 3499 B7R0.12 C=CC(CCC)NN Amb28197763 [0,1,1,0,0,0|1,0,1]=4 3500 B7R0.12 C=CC(CO)CCC Amb27857843 [0,1,1,0,0,0|0,0,2]=4 3501 B7R0.12 C=CN(CCO)N=O Amb28319580 [0,1,1,0,0,0|2,0,0]=4 3502 B7R0.12 C=C\C=C(\CC)CBr Amb27984917 [0,1,1,0,0,0|1,0,1]=4 3503 B7R0.12 CCC=C(CC)CC Amb22229297 [0,1,1,0,0,0|1,0,1]=4 3504 B7R0.12 CCCC(C=O)C=O Amb26644051 [0,1,1,0,0,0|1,0,1]=4 3505 B7R0.12 CCCC(NC)=S=O Amb27246778 [0,1,1,0,0,0|1,0,1]=4 3506 B7R0.12 CCC\C(=C\Cl)CC Amb27788138 [0,1,1,0,0,0|2,0,0]=4 3507 B7R0.12 CCC\C(C=O)=C\Cl Amb28141986 [0,1,1,0,0,0|1,0,0]=3 3508 B7R0.12 CCC\C(C=O)=C\O Amb27268562 [0,1,1,0,0,0|1,0,0]=3 3509 B7R0.12 CC\C(=C/C=O)SC Amb27440443 [0,1,1,0,0,0|1,1,0]=4 3510 B7R0.12 CC\C(C#N)=C\OC Amb28315688 [0,1,1,0,0,0|2,0,0]=4 3511 B7R0.12 CC\C(C=O)=C\OC Amb27261656 [0,1,1,0,0,0|1,0,0]=3 3512 B7R0.12 CC\C=C(/C=O)CC Amb18641709 [0,1,1,0,0,0|0,0,1]=3 3513 B7R0.12 CC\C=C(/C=O)CCl Amb27433293 [0,1,1,0,0,0|1,0,1]=4 3514 B7R0.12 CO\C=C(/C=O)OC Amb26003663 [0,1,1,0,0,0|2,0,0]=4 3515 B7R0.12 C\C=C(\C=O)CCC Amb27435435 [0,1,1,0,0,0|0,0,1]=3 3516 B7R0.12 C\C=C(\C=O)CSC Amb27972922 [0,1,1,0,0,0|1,0,1]=4 3517 B7R0.12 C\C=C\C(CC)CC Amb22730434 [0,1,1,0,0,0|1,0,1]=4 3518 B7R0.12 C\C=C\C(CC)NC Amb27204826 [0,1,1,0,0,0|1,0,1]=4 3519 B7R0.4 C#CCCCC(=O)Cl Amb2688725 [0,1,1,0,0,0|1,0,1]=4 3520 B7R0.4 C#CCCCC(=O)O Amb2721705 [0,1,1,0,0,0|1,0,1]=4 3521 B7R0.4 C#CCCCC(C)=O Amb18115312 [0,1,1,0,0,0|0,0,2]=4 3522 B7R0.4 C#CCCCC(N)=O Amb27590599 [0,1,1,0,0,0|1,0,1]=4 3523 B7R0.4 C=C(Br)CCCC#N Amb6298900 [0,1,1,0,0,0|1,0,1]=4 3524 B7R0.4 C=C(Br)CCCCBr Amb4035450 [0,1,1,0,0,0|1,0,1]=4 3525 B7R0.4 C=C(Br)CNCCN Amb18180845 [0,1,1,0,0,0|2,0,0]=4 3526 B7R0.4 C=C(Br)COCCN Amb19020783 [0,1,1,0,0,0|2,0,0]=4 3527 B7R0.4 C=C(Br)COCCO Amb28453509 [0,1,1,0,0,0|2,0,0]=4 3528 B7R0.4 C=C(C)CCCC#N Amb6298905 [0,1,1,0,0,0|1,0,1]=4 3529 B7R0.4 C=C(C)CCCCC Amb6298938 [0,1,1,0,0,0|1,0,1]=4 3530 B7R0.4 C=C(C)CCCCO Amb26872404 [0,1,1,0,0,0|1,0,1]=4 3531 B7R0.4 C=C(C)CCCNN Amb28345747 [0,1,1,0,0,0|2,0,0]=4 3532 B7R0.4 C=C(C)CCNC=O Amb27228134 [0,1,1,0,0,0|2,0,0]=4 3533 B7R0.4 C=C(C)CCOCCl Amb28366369 [0,1,1,0,0,0|2,0,0]=4 3534 B7R0.4 C=C(C)CC\C=C\C Amb25746764 [0,1,1,0,0,0|1,0,1]=4 3535 B7R0.4 C=C(C)CNCCC Amb17308631 [0,1,1,0,0,0|1,0,1]=4 3536 B7R0.4 C=C(C)CNCCF Amb28316183 [0,1,1,0,0,0|2,0,0]=4 3537 B7R0.4 C=C(C)COCC=O Amb27949608 [0,1,1,0,0,0|2,0,0]=4 3538 B7R0.4 C=C(C)COCCN Amb19020764 [0,1,1,0,0,0|2,0,0]=4 3539 B7R0.4 C=C(C)COCCN Amb20631068 [0,1,1,0,0,0|2,0,0]=4 3540 B7R0.4 C=C(C)COCCO Amb27452088 [0,1,1,0,0,0|2,0,0]=4 3541 B7R0.4 C=C(C)CSCCC Amb27449649 [0,1,1,0,0,0|1,0,1]=4 3542 B7R0.4 C=C(C)CSCCN Amb6259178 [0,1,1,0,0,0|2,0,0]=4 3543 B7R0.4 C=C(C)C\C=C\CO Amb27181043 [0,1,1,0,0,0|2,0,0]=4 3544 B7R0.4 C=C(Cl)CCCC=O Amb27751311 [0,1,1,0,0,0|1,0,0]=3 3545 B7R0.4 C=C(Cl)CNCCC Amb19004838 [0,1,1,0,0,0|1,0,1]=4 3546 B7R0.4 C=C(Cl)CNCCN Amb27394577 [0,1,1,0,0,0|2,0,0]=4 3547 B7R0.4 C=C(Cl)COCCN Amb19020765 [0,1,1,0,0,0|2,0,0]=4 3548 B7R0.4 C=C(Cl)CSCCO Amb9273887 [0,1,1,0,0,0|2,0,0]=4 3549 B7R0.4 C=C(F)CCCCO Amb22641473 [0,1,1,0,0,0|1,0,1]=4 3550 B7R0.4 C=C=CCCC(C)=O Amb28315801 [0,1,1,0,0,0|0,0,2]=4 3551 B7R0.4 C=CCCCC(=O)Cl Amb8392411 [0,1,1,0,0,0|1,0,0]=3 3552 B7R0.4 C=CCCCC(=O)O Amb3941675 [0,1,1,0,0,0|1,0,0]=3 3553 B7R0.4 C=CCCCC(C)=O Amb17593171 [0,1,1,0,0,0|0,0,1]=3 3554 B7R0.4 C=CCCNC(N)=O Amb25789999 [0,1,1,0,0,0|1,0,1]=4 3555 B7R0.4 C=CCCOC(=O)Cl Amb10844792 [0,1,1,0,0,0|1,0,1]=4 3556 B7R0.4 C=CCCOC(C)=O Amb3940828 [0,1,1,0,0,0|0,0,2]=4 3557 B7R0.4 C=CCCSC(C)=O Amb24117956 [0,1,1,0,0,0|0,0,2]=4 3558 B7R0.4 C=CCNCC(=C)Br Amb10585861 [0,1,1,0,0,0|1,0,1]=4 3559 B7R0.4 C=CCNCC(=C)Br Amb22279683 [0,1,1,0,0,0|1,0,1]=4 3560 B7R0.4 C=CCNCC(=C)C Amb17308750 [0,1,1,0,0,0|1,0,1]=4 3561 B7R0.4 C=CCNCC(=O)O Amb7766404 [0,1,1,0,0,0|1,0,1]=4 3562 B7R0.4 C=CCNCC(=O)O Amb8631497 [0,1,1,0,0,0|1,0,1]=4 3563 B7R0.4 C=CCNCC(N)=O Amb6706481 [0,1,1,0,0,0|1,0,1]=4 3564 B7R0.4 C=CCOCC(=C)C Amb26398441 [0,1,1,0,0,0|1,0,1]=4 3565 B7R0.4 C=CCOCC(=O)O Amb9208694 [0,1,1,0,0,0|1,0,1]=4 3566 B7R0.4 C=CCOCC(C)=O Amb27829146 [0,1,1,0,0,0|0,0,2]=4 3567 B7R0.4 C=CCOCC(N)=O Amb26859258 [0,1,1,0,0,0|1,0,1]=4 3568 B7R0.4 C=CCSCC(=C)C Amb28127803 [0,1,1,0,0,0|1,0,1]=4 3569 B7R0.4 C=CCSCC(=C)Cl Amb28291799 [0,1,1,0,0,0|1,0,1]=4 3570 B7R0.4 C=CCSCC(=O)O Amb33526723 [0,1,1,0,0,0|1,0,1]=4 3571 B7R0.4 C=CNCCC(=O)O Amb27429817 [0,1,1,0,0,0|1,0,1]=4 3572 B7R0.4 C=COCCC(=O)O Amb28350126 [0,1,1,0,0,0|1,0,1]=4 3573 B7R0.4 CC(=O)C#CCCO Amb28316149 [0,1,1,0,0,0|0,0,2]=4 3574 B7R0.4 CC(=O)C=C=CCO Amb28284681 [0,1,1,0,0,0|1,0,0]=3 3575 B7R0.4 CC(=O)CCCC#N Amb17106756 [0,1,1,0,0,0|0,0,2]=4 3576 B7R0.4 CC(=O)CCCCBr Amb16234126 [0,1,1,0,0,0|0,0,2]=4 3577 B7R0.4 CC(=O)CCCCCl Amb3941549 [0,1,1,0,0,0|0,0,2]=4 3578 B7R0.4 CC(=O)CCCCF Amb27490855 [0,1,1,0,0,0|0,0,2]=4 3579 B7R0.4 CC(=O)CCCCN Amb27401218 [0,1,1,0,0,0|0,0,2]=4 3580 B7R0.4 CC(=O)CCCCO Amb10603864 [0,1,1,0,0,0|0,0,2]=4 3581 B7R0.4 CC(=O)COCCCl Amb25346574 [0,1,1,0,0,0|1,0,1]=4 3582 B7R0.4 CC(=O)COCCF Amb27463527 [0,1,1,0,0,0|1,0,1]=4 3583 B7R0.4 CC(=O)COCCO Amb28122841 [0,1,1,0,0,0|1,0,1]=4 3584 B7R0.4 CC(=O)CSCCF Amb24621173 [0,1,1,0,0,0|1,0,1]=4 3585 B7R0.4 CC(=O)CSCCN Amb17500454 [0,1,1,0,0,0|1,0,1]=4 3586 B7R0.4 CC(=O)CSCCO Amb4165952 [0,1,1,0,0,0|1,0,1]=4 3587 B7R0.4 CC(=O)C\C=C\C=O Amb27165276 [0,1,1,0,0,0|1,0,1]=4 3588 B7R0.4 CC(=O)NCCC=O Amb17102165 [0,1,1,0,0,0|1,0,1]=4 3589 B7R0.4 CC(=O)NCCCBr Amb8826231 [0,1,1,0,0,0|1,0,1]=4 3590 B7R0.4 CC(=O)NCCCCl Amb3886559 [0,1,1,0,0,0|1,0,1]=4 3591 B7R0.4 CC(=O)NCCCN Amb10610286 [0,1,1,0,0,0|1,0,1]=4 3592 B7R0.4 CC(=O)NCCCN Amb6664982 [0,1,1,0,0,0|1,0,1]=4 3593 B7R0.4 CC(=O)NCCCO Amb3429354 [0,1,1,0,0,0|1,0,1]=4 3594 B7R0.4 CC(=O)NOCCO Amb27484242 [0,1,1,0,0,0|2,0,0]=4 3595 B7R0.4 CC(=O)OCCCBr Amb26515737 [0,1,1,0,0,0|1,0,1]=4 3596 B7R0.4 CC(=O)OCCCCl Amb3940269 [0,1,1,0,0,0|1,0,1]=4 3597 B7R0.4 CC(=O)OCCCO Amb25854267 [0,1,1,0,0,0|1,0,1]=4 3598 B7R0.4 CC(=O)OCCCS Amb4018773 [0,1,1,0,0,0|1,0,1]=4 3599 B7R0.4 CC(=O)SCCC=O Amb25101351 [0,1,1,0,0,0|1,0,1]=4 3600 B7R0.4 CC(=O)SCCCBr Amb17610077 [0,1,1,0,0,0|1,0,1]=4 3601 B7R0.4 CC(=O)SCCCCl Amb3940270 [0,1,1,0,0,0|1,0,1]=4 3602 B7R0.4 CC(=O)\C=C/C=C\Br Amb27858614 [0,1,1,0,0,0|0,0,2]=4 3603 B7R0.4 CC(=O)\C=C\C=C\Cl Amb27233379 [0,1,1,0,0,0|0,0,2]=4 3604 B7R0.4 CC(=O)\C=C\CCF Amb33196081 [0,1,1,0,0,0|0,0,0]=2 3605 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [0,1,1,0,0,0|0,0,0]=2 3606 B7R0.4 CC(C)=C=CCCO Amb27265946 [0,1,1,0,0,0|1,0,1]=4 3607 B7R0.4 CC(C)=CCCCN Amb18641749 [0,1,1,0,0,0|1,0,1]=4 3608 B7R0.4 CC(C)=CCCCO Amb26478086 [0,1,1,0,0,0|1,0,1]=4 3609 B7R0.4 CC(C)=COCCO Amb27662198 [0,1,1,0,0,0|2,0,0]=4 3610 B7R0.4 CC(C)=C\C=C\CCl Amb27778733 [0,1,1,0,0,0|1,0,1]=4 3611 B7R0.4 CC(C)=C\C=C\CO Amb28400370 [0,1,1,0,0,0|1,0,1]=4 3612 B7R0.4 CC(C)\C=C\CCBr Amb17570209 [0,1,1,0,0,0|1,0,1]=4 3613 B7R0.4 CC(C)\C=C\CCN Amb17569896 [0,1,1,0,0,0|1,0,1]=4 3614 B7R0.4 CC(C)\C=C\CCO Amb25117403 [0,1,1,0,0,0|1,0,1]=4 3615 B7R0.4 CC(N)\C=C\CCF Amb33196065 [0,1,1,0,0,0|1,0,1]=4 3616 B7R0.4 CC(O)\C=C\CCBr Amb27228895 [0,1,1,0,0,0|0,0,2]=4 3617 B7R0.4 CC(O)\C=C\CCO Amb28138579 [0,1,1,0,0,0|0,0,2]=4 3618 B7R0.4 CCC#CCC(C)=O Amb28040888 [0,1,1,0,0,0|0,0,2]=4 3619 B7R0.4 CCC=C=CC(C)=O Amb25830543 [0,1,1,0,0,0|0,0,0]=2 3620 B7R0.4 CCC=C=CC(C)N Amb27838389 [0,1,1,0,0,0|1,0,1]=4 3621 B7R0.4 CCCC#CC(C)=O Amb26844271 [0,1,1,0,0,0|0,0,2]=4 3622 B7R0.4 CCCCC=C(C)C Amb22228888 [0,1,1,0,0,0|1,0,1]=4 3623 B7R0.4 CCCCCC(=O)F Amb26061517 [0,1,1,0,0,0|1,0,1]=4 3624 B7R0.4 CCCCCC(=O)O Amb3939846 [0,1,1,0,0,0|1,0,1]=4 3625 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [0,1,1,0,0,0|1,0,1]=4 3626 B7R0.4 CCCCCC(C)=O Amb6608885 [0,1,1,0,0,0|0,0,2]=4 3627 B7R0.4 CCCCNC(=O)Cl Amb24574309 [0,1,1,0,0,0|1,0,1]=4 3628 B7R0.4 CCCCNC(C)=O Amb5835711 [0,1,1,0,0,0|0,0,2]=4 3629 B7R0.4 CCCCNC(N)=O Amb6663202 [0,1,1,0,0,0|1,0,1]=4 3630 B7R0.4 CCCCOC(=O)Cl Amb6608833 [0,1,1,0,0,0|1,0,1]=4 3631 B7R0.4 CCCCOC(C)=O Amb6608782 [0,1,1,0,0,0|0,0,2]=4 3632 B7R0.4 CCCCOC(N)=O Amb4136361 [0,1,1,0,0,0|1,0,1]=4 3633 B7R0.4 CCCCSC(=O)Cl Amb22352826 [0,1,1,0,0,0|1,0,1]=4 3634 B7R0.4 CCCNCC(=O)O Amb10609640 [0,1,1,0,0,0|1,0,1]=4 3635 B7R0.4 CCCNCC(=O)O Amb1110628 [0,1,1,0,0,0|1,0,1]=4 3636 B7R0.4 CCCNCC(C)=O Amb26954588 [0,1,1,0,0,0|0,0,2]=4 3637 B7R0.4 CCCNCC(N)=O Amb1124632 [0,1,1,0,0,0|1,0,1]=4 3638 B7R0.4 CCCNCC(N)=O Amb28934788 [0,1,1,0,0,0|1,0,1]=4 3639 B7R0.4 CCCOCC(=O)Cl Amb27260778 [0,1,1,0,0,0|1,0,1]=4 3640 B7R0.4 CCCOCC(=O)O Amb8874504 [0,1,1,0,0,0|1,0,1]=4 3641 B7R0.4 CCCOCC(N)=O Amb27844884 [0,1,1,0,0,0|1,0,1]=4 3642 B7R0.4 CCCONC(C)=O Amb27764366 [0,1,1,0,0,0|1,0,1]=4 3643 B7R0.4 CCCSCC(=O)O Amb1137113 [0,1,1,0,0,0|1,0,1]=4 3644 B7R0.4 CCCSCC(C)=O Amb9668676 [0,1,1,0,0,0|0,0,2]=4 3645 B7R0.4 CCCSCC(N)=O Amb27424658 [0,1,1,0,0,0|1,0,1]=4 3646 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [0,1,1,0,0,0|0,0,0]=2 3647 B7R0.4 CCC\C=C\C(=N)N Amb33358507 [0,1,1,0,0,0|2,0,0]=4 3648 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [0,1,1,0,0,0|1,0,0]=3 3649 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [0,1,1,0,0,0|1,0,0]=3 3650 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [0,1,1,0,0,0|0,0,0]=2 3651 B7R0.4 CCC\C=C\C(C)C Amb4019553 [0,1,1,0,0,0|1,0,1]=4 3652 B7R0.4 CCC\C=C\C(C)N Amb33374704 [0,1,1,0,0,0|1,0,1]=4 3653 B7R0.4 CCC\C=C\C(C)O Amb25083446 [0,1,1,0,0,0|0,0,2]=4 3654 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [0,1,1,0,0,0|1,0,0]=3 3655 B7R0.4 CCC\C=C\[C@@H](C)N Amb33327161 [0,1,1,0,0,0|1,0,1]=4 3656 B7R0.4 CCC\C=C\[C@@H](C)O Amb33429966 [0,1,1,0,0,0|0,0,2]=4 3657 B7R0.4 CCC\C=C\[C@H](C)N Amb33327160 [0,1,1,0,0,0|1,0,1]=4 3658 B7R0.4 CCC\C=C\[C@H](C)O Amb27857282 [0,1,1,0,0,0|0,0,2]=4 3659 B7R0.4 CCC\C=C\[N+](=O)[O-] Amb24558342 [0,1,1,0,0,0|2,0,0]=4 3660 B7R0.4 CCC\C=N\S(C)=O Amb29858759 [0,1,1,0,0,0|1,0,1]=4 3661 B7R0.4 CCN=C=CC(C)=O Amb24481402 [0,1,1,0,0,0|0,0,1]=3 3662 B7R0.4 CCNCCC(=O)O Amb28934794 [0,1,1,0,0,0|1,0,1]=4 3663 B7R0.4 CCNCCC(=O)O Amb7766402 [0,1,1,0,0,0|1,0,1]=4 3664 B7R0.4 CCNCCC(C)=O Amb18641851 [0,1,1,0,0,0|0,0,2]=4 3665 B7R0.4 CCNCCC(N)=O Amb33533384 [0,1,1,0,0,0|1,0,1]=4 3666 B7R0.4 CCNCCC(N)=O Amb35749820 [0,1,1,0,0,0|1,0,1]=4 3667 B7R0.4 CCOCCC(=O)Cl Amb20672027 [0,1,1,0,0,0|1,0,1]=4 3668 B7R0.4 CCOCCC(=O)O Amb3939859 [0,1,1,0,0,0|1,0,1]=4 3669 B7R0.4 CCOCCC(C)=O Amb7764636 [0,1,1,0,0,0|0,0,2]=4 3670 B7R0.4 CCO\C=C\C(=O)Cl Amb33943049 [0,1,1,0,0,0|1,0,0]=3 3671 B7R0.4 CCO\C=C\C(=O)O Amb2725260 [0,1,1,0,0,0|1,0,0]=3 3672 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [0,1,1,0,0,0|0,0,0]=2 3673 B7R0.4 CCO\C=C\C(C)C Amb22261439 [0,1,1,0,0,0|1,0,1]=4 3674 B7R0.4 CCO\N=C\C(=O)O Amb27468748 [0,1,1,0,0,0|2,0,0]=4 3675 B7R0.4 CCO\N=C\C(N)=O Amb27949484 [0,1,1,0,0,0|2,0,0]=4 3676 B7R0.4 CCSCCC(=O)O Amb6273140 [0,1,1,0,0,0|1,0,1]=4 3677 B7R0.4 CCSCCC(C)=O Amb9655821 [0,1,1,0,0,0|0,0,2]=4 3678 B7R0.4 CCSCCC(N)=O Amb27258252 [0,1,1,0,0,0|1,0,1]=4 3679 B7R0.4 CCSSCC(C)=O Amb28316151 [0,1,1,0,0,0|1,0,1]=4 3680 B7R0.4 CCS\C=C/C(C)=O Amb28122375 [0,1,1,0,0,0|0,0,0]=2 3681 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [0,1,1,0,0,0|1,0,0]=3 3682 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [0,1,1,0,0,0|0,0,0]=2 3683 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [0,1,1,0,0,0|1,0,0]=3 3684 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [0,1,1,0,0,0|1,0,0]=3 3685 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [0,1,1,0,0,0|0,0,0]=2 3686 B7R0.4 CC\C=C\CC(C)Br Amb33009075 [0,1,1,0,0,0|1,0,1]=4 3687 B7R0.4 CC\C=C\CC(C)C Amb4016285 [0,1,1,0,0,0|1,0,1]=4 3688 B7R0.4 CC\C=C\CC(C)N Amb25357984 [0,1,1,0,0,0|1,0,1]=4 3689 B7R0.4 CC\C=C\CC(C)O Amb33079090 [0,1,1,0,0,0|0,0,2]=4 3690 B7R0.4 CC\C=C\CC(N)=S Amb33225501 [0,1,1,0,0,0|1,1,0]=4 3691 B7R0.4 CC\C=C\CN(C)O Amb33268704 [0,1,1,0,0,0|1,0,1]=4 3692 B7R0.4 CC\C=C\C[C@@H](C)N Amb33225016 [0,1,1,0,0,0|1,0,1]=4 3693 B7R0.4 CC\C=C\C[C@@H](C)O Amb33359513 [0,1,1,0,0,0|0,0,2]=4 3694 B7R0.4 CC\C=C\C[C@H](C)N Amb33267988 [0,1,1,0,0,0|1,0,1]=4 3695 B7R0.4 CC\C=C\C[C@H](C)O Amb33474377 [0,1,1,0,0,0|0,0,2]=4 3696 B7R0.4 CC\C=C\C[N+](=O)[O-] Amb33267962 [0,1,1,0,0,0|2,0,0]=4 3697 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [0,1,1,0,0,0|2,0,0]=4 3698 B7R0.4 CC\C=N\NC(N)=O Amb26899579 [0,1,1,0,0,0|2,0,0]=4 3699 B7R0.4 CNCCCC(=O)O Amb1153115 [0,1,1,0,0,0|1,0,1]=4 3700 B7R0.4 CNCCCC(=O)O Amb4521435 [0,1,1,0,0,0|1,0,1]=4 3701 B7R0.4 CNCCCC(C)=O Amb27838406 [0,1,1,0,0,0|0,0,2]=4 3702 B7R0.4 CNCCCC(N)=O Amb18303611 [0,1,1,0,0,0|1,0,1]=4 3703 B7R0.4 CNCCCC(N)=O Amb31307731 [0,1,1,0,0,0|1,0,1]=4 3704 B7R0.4 CNCCNC(C)=O Amb28934797 [0,1,1,0,0,0|1,0,1]=4 3705 B7R0.4 CNCCNC(C)=O Amb9256137 [0,1,1,0,0,0|1,0,1]=4 3706 B7R0.4 CNCCOC(C)=O Amb18124262 [0,1,1,0,0,0|1,0,1]=4 3707 B7R0.4 CNCCOC(C)=O Amb33621071 [0,1,1,0,0,0|1,0,1]=4 3708 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [0,1,1,0,0,0|1,0,0]=3 3709 B7R0.4 CNC\C=C\C(C)C Amb27828260 [0,1,1,0,0,0|1,0,1]=4 3710 B7R0.4 COCC#CC(C)=O Amb28053950 [0,1,1,0,0,0|0,0,2]=4 3711 B7R0.4 COCCCC(=O)O Amb6275629 [0,1,1,0,0,0|1,0,1]=4 3712 B7R0.4 COCCCC(C)=O Amb9031556 [0,1,1,0,0,0|0,0,2]=4 3713 B7R0.4 COCCNC(C)=O Amb3358082 [0,1,1,0,0,0|1,0,1]=4 3714 B7R0.4 COCCOC(C)=O Amb4037074 [0,1,1,0,0,0|1,0,1]=4 3715 B7R0.4 COC\C=C\C(=O)O Amb33986212 [0,1,1,0,0,0|1,0,0]=3 3716 B7R0.4 COC\C=C\C(C)=O Amb33359822 [0,1,1,0,0,0|0,0,0]=2 3717 B7R0.4 COC\C=C\C(C)Cl Amb27791751 [0,1,1,0,0,0|1,0,1]=4 3718 B7R0.4 COC\C=C\C(C)N Amb33429413 [0,1,1,0,0,0|1,0,1]=4 3719 B7R0.4 COC\C=C\[N+](=O)[O-] Amb33428677 [0,1,1,0,0,0|2,0,0]=4 3720 B7R0.4 CO\C=C/NC(C)=O Amb27391649 [0,1,1,0,0,0|1,0,0]=3 3721 B7R0.4 CO\C=C\NC(C)=O Amb28198239 [0,1,1,0,0,0|1,0,0]=3 3722 B7R0.4 CSCCCC(=O)O Amb17503622 [0,1,1,0,0,0|1,0,1]=4 3723 B7R0.4 CSCCCC(C)=O Amb25122381 [0,1,1,0,0,0|0,0,2]=4 3724 B7R0.4 CSCCNC(C)=O Amb8504699 [0,1,1,0,0,0|1,0,1]=4 3725 B7R0.4 CSCCSC(C)=O Amb27635033 [0,1,1,0,0,0|1,0,1]=4 3726 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [0,1,1,0,0,0|0,0,0]=2 3727 B7R0.4 CSC\C=C\C(C)=O Amb33359530 [0,1,1,0,0,0|0,0,0]=2 3728 B7R0.4 CSC\C=C\C(C)Cl Amb27267373 [0,1,1,0,0,0|1,0,1]=4 3729 B7R0.4 CSC\C=C\C(C)N Amb33269663 [0,1,1,0,0,0|1,0,1]=4 3730 B7R0.4 CSC\C=C\[N+](=O)[O-] Amb33271736 [0,1,1,0,0,0|2,0,0]=4 3731 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [0,1,1,0,0,0|2,0,0]=4 3732 B7R0.4 C\C(Br)=C\CCCBr Amb22347606 [0,1,1,0,0,0|1,0,1]=4 3733 B7R0.4 C\C(Cl)=C\C=C\CCl Amb27849935 [0,1,1,0,0,0|1,0,1]=4 3734 B7R0.4 C\C(Cl)=C\CCCO Amb27211291 [0,1,1,0,0,0|1,0,1]=4 3735 B7R0.4 C\C=C/C=C/C(C)=O Amb28129038 [0,1,1,0,0,0|0,0,1]=3 3736 B7R0.4 C\C=C\C=C\C(=O)Cl Amb32664141 [0,1,1,0,0,0|1,0,1]=4 3737 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [0,1,1,0,0,0|1,0,1]=4 3738 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33512746 [0,1,1,0,0,0|1,0,1]=4 3739 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33723188 [0,1,1,0,0,0|1,0,1]=4 3740 B7R0.4 C\C=C\C=C\C(C)=O Amb17593137 [0,1,1,0,0,0|0,0,1]=3 3741 B7R0.4 C\C=C\C=C\C(N)=O Amb28400805 [0,1,1,0,0,0|1,0,1]=4 3742 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [0,1,1,0,0,0|1,0,1]=4 3743 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [0,1,1,0,0,0|0,0,2]=4 3744 B7R0.4 C\C=C\COC(C)=O Amb6366590 [0,1,1,0,0,0|0,0,2]=4 3745 B7R0.4 N#CCCCC(=O)O Amb33542831 [0,1,1,0,0,0|1,0,1]=4 3746 B7R0.4 NC(=O)CCCCBr Amb27875083 [0,1,1,0,0,0|1,0,1]=4 3747 B7R0.4 NC(=O)CCCCCl Amb7782532 [0,1,1,0,0,0|1,0,1]=4 3748 B7R0.4 NC(=O)CCCCO Amb3939470 [0,1,1,0,0,0|1,0,1]=4 3749 B7R0.4 NC(=O)CCCCS Amb27839239 [0,1,1,0,0,0|1,0,1]=4 3750 B7R0.4 NC(=O)CCSCCl Amb27430706 [0,1,1,0,0,0|2,0,0]=4 3751 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [0,1,1,0,0,0|1,0,1]=4 3752 B7R0.4 NC(=O)CNCCO Amb6714605 [0,1,1,0,0,0|2,0,0]=4 3753 B7R0.4 NC(=O)COCCBr Amb25133475 [0,1,1,0,0,0|2,0,0]=4 3754 B7R0.4 NC(=O)COCCCl Amb5722397 [0,1,1,0,0,0|2,0,0]=4 3755 B7R0.4 NC(=O)CSCCBr Amb28193514 [0,1,1,0,0,0|2,0,0]=4 3756 B7R0.4 NC(=O)CSCCO Amb6754148 [0,1,1,0,0,0|2,0,0]=4 3757 B7R0.4 NC(=O)CSCCS Amb27651871 [0,1,1,0,0,0|2,0,0]=4 3758 B7R0.4 NC(=O)NCCCF Amb27396406 [0,1,1,0,0,0|2,0,0]=4 3759 B7R0.4 NC(=O)NCCCO Amb9248133 [0,1,1,0,0,0|2,0,0]=4 3760 B7R0.4 NC(=O)OCCCBr Amb28316236 [0,1,1,0,0,0|2,0,0]=4 3761 B7R0.4 NCCCCC(=O)Cl Amb26599615 [0,1,1,0,0,0|1,0,1]=4 3762 B7R0.4 NCCCCC(=O)O Amb2780021 [0,1,1,0,0,0|1,0,1]=4 3763 B7R0.4 NCCCCC(=O)O Amb3941646 [0,1,1,0,0,0|1,0,1]=4 3764 B7R0.4 NCCCCC(=O)O Amb9825855 [0,1,1,0,0,0|1,0,1]=4 3765 B7R0.4 NCCCCC(N)=O Amb18641897 [0,1,1,0,0,0|1,0,1]=4 3766 B7R0.4 NCCCCC(N)=O Amb33552086 [0,1,1,0,0,0|1,0,1]=4 3767 B7R0.4 NCCCNC(=O)O Amb24093884 [0,1,1,0,0,0|2,0,0]=4 3768 B7R0.4 NCCCNC(=O)S Amb27839485 [0,1,1,0,0,0|2,0,0]=4 3769 B7R0.4 NCCCNC(N)=O Amb18296186 [0,1,1,0,0,0|2,0,0]=4 3770 B7R0.4 NCCCNC(N)=O Amb20622408 [0,1,1,0,0,0|2,0,0]=4 3771 B7R0.4 NCCCOC(N)=O Amb26334419 [0,1,1,0,0,0|2,0,0]=4 3772 B7R0.4 NCCCOC(N)=O Amb33299259 [0,1,1,0,0,0|2,0,0]=4 3773 B7R0.4 NCCNCC(=O)O Amb17608063 [0,1,1,0,0,0|2,0,0]=4 3774 B7R0.4 NCCNCC(=O)O Amb33339058 [0,1,1,0,0,0|2,0,0]=4 3775 B7R0.4 NCCNCC(N)=O Amb28388338 [0,1,1,0,0,0|2,0,0]=4 3776 B7R0.4 NCCOCC(=O)O Amb18630146 [0,1,1,0,0,0|2,0,0]=4 3777 B7R0.4 NCCOCC(=O)O Amb33550947 [0,1,1,0,0,0|2,0,0]=4 3778 B7R0.4 NCCOCC(N)=O Amb18523830 [0,1,1,0,0,0|2,0,0]=4 3779 B7R0.4 NCCOCC(N)=O Amb33549549 [0,1,1,0,0,0|2,0,0]=4 3780 B7R0.4 NCCSCC(=O)O Amb17500446 [0,1,1,0,0,0|2,0,0]=4 3781 B7R0.4 NCCSCC(=O)O Amb20622325 [0,1,1,0,0,0|2,0,0]=4 3782 B7R0.4 NCCSCC(N)=O Amb6266329 [0,1,1,0,0,0|2,0,0]=4 3783 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [0,1,1,0,0,0|1,0,0]=3 3784 B7R0.4 NOCCCC(=O)O Amb10975956 [0,1,1,0,0,0|2,0,0]=4 3785 B7R0.4 NOCCCC(=O)O Amb22011795 [0,1,1,0,0,0|2,0,0]=4 3786 B7R0.4 NOCCCC(=O)O Amb31283653 [0,1,1,0,0,0|2,0,0]=4 3787 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [0,1,1,0,0,0|1,0,1]=4 3788 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [0,1,1,0,0,0|1,0,1]=4 3789 B7R0.4 O=C(Cl)COCCCl Amb17610887 [0,1,1,0,0,0|2,0,0]=4 3790 B7R0.4 O=C(Cl)NCCCCl Amb27856097 [0,1,1,0,0,0|2,0,0]=4 3791 B7R0.4 O=C(Cl)NCCCF Amb35633310 [0,1,1,0,0,0|2,0,0]=4 3792 B7R0.4 O=C(Cl)OCCCCl Amb10844795 [0,1,1,0,0,0|2,0,0]=4 3793 B7R0.4 O=C(Cl)OCCCF Amb26994902 [0,1,1,0,0,0|2,0,0]=4 3794 B7R0.4 O=C(Cl)\C=C\CCCl Amb27413542 [0,1,1,0,0,0|1,0,0]=3 3795 B7R0.4 O=C(O)CCCCBr Amb6608763 [0,1,1,0,0,0|1,0,1]=4 3796 B7R0.4 O=C(O)CCCCCl Amb3940369 [0,1,1,0,0,0|1,0,1]=4 3797 B7R0.4 O=C(O)CCCCF Amb26639920 [0,1,1,0,0,0|1,0,1]=4 3798 B7R0.4 O=C(O)CCCCO Amb9214971 [0,1,1,0,0,0|1,0,1]=4 3799 B7R0.4 O=C(O)CCCCS Amb17503767 [0,1,1,0,0,0|1,0,1]=4 3800 B7R0.4 O=C(O)CCCNCl Amb27173950 [0,1,1,0,0,0|2,0,0]=4 3801 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [0,1,1,0,0,0|1,0,1]=4 3802 B7R0.4 O=C(O)CNCCF Amb28076282 [0,1,1,0,0,0|2,0,0]=4 3803 B7R0.4 O=C(O)CNCCO Amb9325653 [0,1,1,0,0,0|2,0,0]=4 3804 B7R0.4 O=C(O)COCCCl Amb21857870 [0,1,1,0,0,0|2,0,0]=4 3805 B7R0.4 O=C(O)COCCF Amb27866609 [0,1,1,0,0,0|2,0,0]=4 3806 B7R0.4 O=C(O)COCCO Amb6680914 [0,1,1,0,0,0|2,0,0]=4 3807 B7R0.4 O=C(O)CSCCCl Amb18644703 [0,1,1,0,0,0|2,0,0]=4 3808 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [0,1,1,0,0,0|2,0,0]=4 3809 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [0,1,1,0,0,0|2,0,0]=4 3810 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [0,1,1,0,0,0|2,0,0]=4 3811 B7R0.4 O=C(O)\C=C\CCBr Amb25702661 [0,1,1,0,0,0|1,0,0]=3 3812 B7R0.4 O=C(O)\C=C\CCF Amb33196445 [0,1,1,0,0,0|1,0,0]=3 3813 B7R0.4 O=C([O-])CCCCF Amb33527827 [0,1,1,0,0,0|1,0,1]=4 3814 B7R0.4 O=C([O-])CCCCO Amb13952763 [0,1,1,0,0,0|1,0,1]=4 3815 B7R0.4 O=C([O-])CCCCO Amb22749314 [0,1,1,0,0,0|1,0,1]=4 3816 B7R0.4 O=C([O-])COCCO Amb33553026 [0,1,1,0,0,0|2,0,0]=4 3817 B7R0.4 O=CCCCC(=O)O Amb17593198 [0,1,1,0,0,0|1,0,0]=3 3818 B7R0.4 O=CNCCC(=O)O Amb18290434 [0,1,1,0,0,0|2,0,0]=4 3819 B7R0.4 O=[N+]([O-])\C=C\CCF Amb33196117 [0,1,1,0,0,0|2,0,0]=4 3820 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [0,1,1,0,0,0|1,0,1]=4 3821 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [0,1,1,0,0,0|1,0,1]=4 3822 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [0,1,1,0,0,0|0,0,2]=4 3823 B7R0.6 C=C(C)CCC(C)Br Amb27878705 [0,1,1,0,0,0|1,0,1]=4 3824 B7R0.6 C=C(C)CCC(C)N Amb18641752 [0,1,1,0,0,0|1,0,1]=4 3825 B7R0.6 C=C(C)CCC(C)O Amb24062974 [0,1,1,0,0,0|1,0,1]=4 3826 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [0,1,1,0,0,0|1,0,1]=4 3827 B7R0.6 C=C(C)CC[C@@H](C)N Amb33199549 [0,1,1,0,0,0|1,0,1]=4 3828 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [0,1,1,0,0,0|1,0,1]=4 3829 B7R0.6 C=C(C)CC[C@H](C)N Amb33199548 [0,1,1,0,0,0|1,0,1]=4 3830 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [0,1,1,0,0,0|1,0,1]=4 3831 B7R0.6 C=C(C)\C=C/C(C)=O Amb28061353 [0,1,1,0,0,0|0,0,1]=3 3832 B7R0.6 C=C(C)\C=C\C(=C)C Amb27229870 [0,1,1,0,0,0|1,0,1]=4 3833 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [0,1,1,0,0,0|1,0,1]=4 3834 B7R0.6 C=C(C)\C=C\C(C)=O Amb33172526 [0,1,1,0,0,0|0,0,1]=3 3835 B7R0.6 C=C(C)\C=C\C(C)N Amb33199201 [0,1,1,0,0,0|1,0,0]=3 3836 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [0,1,1,0,0,0|1,0,1]=4 3837 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [0,1,1,0,0,0|0,0,2]=4 3838 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [0,1,1,0,0,0|1,0,1]=4 3839 B7R0.6 CC(=O)C#C[C@@H](C)O Amb27854924 [0,1,1,0,0,0|0,0,2]=4 3840 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [0,1,1,0,0,0|0,0,2]=4 3841 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [0,1,1,0,0,0|0,0,2]=4 3842 B7R0.6 CC(=O)CCC(C)C Amb4605991 [0,1,1,0,0,0|0,0,2]=4 3843 B7R0.6 CC(=O)CCC(C)O Amb25829594 [0,1,1,0,0,0|0,0,2]=4 3844 B7R0.6 CC(=O)CCC(F)F Amb27413848 [0,1,1,0,0,0|1,0,1]=4 3845 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [0,1,1,0,0,0|0,0,2]=4 3846 B7R0.6 CC(=O)CNC(C)C Amb28126943 [0,1,1,0,0,0|1,0,1]=4 3847 B7R0.6 CC(=O)CNC(C)C Amb32661638 [0,1,1,0,0,0|1,0,1]=4 3848 B7R0.6 CC(=O)COC(C)C Amb9665256 [0,1,1,0,0,0|1,0,1]=4 3849 B7R0.6 CC(=O)CSC(C)C Amb22549127 [0,1,1,0,0,0|1,0,1]=4 3850 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [0,1,1,0,0,0|0,0,2]=4 3851 B7R0.6 CC(=O)NCC(C)C Amb3364211 [0,1,1,0,0,0|1,0,1]=4 3852 B7R0.6 CC(=O)NCC(C)N Amb18631377 [0,1,1,0,0,0|1,0,1]=4 3853 B7R0.6 CC(=O)NCC(C)O Amb9276316 [0,1,1,0,0,0|1,0,1]=4 3854 B7R0.6 CC(=O)NNC(C)C Amb22233621 [0,1,1,0,0,0|2,0,0]=4 3855 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [0,1,1,0,0,0|1,0,1]=4 3856 B7R0.6 CC(=O)OCC(C)O Amb24056158 [0,1,1,0,0,0|1,0,1]=4 3857 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [0,1,1,0,0,0|1,0,1]=4 3858 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [0,1,1,0,0,0|1,0,1]=4 3859 B7R0.6 CC(=O)SCC(C)O Amb27801534 [0,1,1,0,0,0|1,0,1]=4 3860 B7R0.6 CC(=O)\C=C/C(O)O Amb27834325 [0,1,1,0,0,0|1,0,0]=3 3861 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [0,1,1,0,0,0|1,0,1]=4 3862 B7R0.6 CC(=O)\C=C\C(C)=O Amb22346013 [0,1,1,0,0,0|0,0,1]=3 3863 B7R0.6 CC(=O)\C=C\C(C)C Amb28524833 [0,1,1,0,0,0|0,0,0]=2 3864 B7R0.6 CC(=O)\C=C\C(C)Cl Amb25782801 [0,1,1,0,0,0|0,0,0]=2 3865 B7R0.6 CC(=O)\C=C\C(F)F Amb32811499 [0,1,1,0,0,0|1,0,0]=3 3866 B7R0.6 CC(=O)\C=C\C(N)=O Amb24516266 [0,1,1,0,0,0|1,0,1]=4 3867 B7R0.6 CC(=O)\C=C\N(C)C Amb4019563 [0,1,1,0,0,0|1,0,0]=3 3868 B7R0.6 CC(=O)\C=N\N(C)C Amb28316186 [0,1,1,0,0,0|2,0,0]=4 3869 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [0,1,1,0,0,0|1,0,0]=3 3870 B7R0.6 CC(=O)\N=C\N(C)C Amb27950201 [0,1,1,0,0,0|2,0,0]=4 3871 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [0,1,1,0,0,0|1,0,1]=4 3872 B7R0.6 CC(C)=C=CC(C)O Amb17593160 [0,1,1,0,0,0|1,0,1]=4 3873 B7R0.6 CC(C)=CC=C(C)C Amb2721453 [0,1,1,0,0,0|1,0,1]=4 3874 B7R0.6 CC(C)=CCC(C)C Amb22731329 [0,1,1,0,0,0|1,0,1]=4 3875 B7R0.6 CC(C)=CCC(C)Cl Amb27590455 [0,1,1,0,0,0|1,0,1]=4 3876 B7R0.6 CC(C)=CCC(C)N Amb27391176 [0,1,1,0,0,0|1,0,1]=4 3877 B7R0.6 CC(C)=CC[C@@H](C)O Amb28315798 [0,1,1,0,0,0|1,0,1]=4 3878 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [0,1,1,0,0,0|1,0,1]=4 3879 B7R0.6 CC(C)CCC(=O)O Amb1153016 [0,1,1,0,0,0|1,0,1]=4 3880 B7R0.6 CC(C)CCC(N)=O Amb8997711 [0,1,1,0,0,0|1,0,1]=4 3881 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [0,1,1,0,0,0|1,0,0]=3 3882 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [0,1,1,0,0,0|1,0,0]=3 3883 B7R0.6 CC(C)\C=C\C(C)Br Amb27397074 [0,1,1,0,0,0|1,0,1]=4 3884 B7R0.6 CC(C)\C=C\C(C)C Amb4019551 [0,1,1,0,0,0|1,0,1]=4 3885 B7R0.6 CC(C)\C=C\C(C)Cl Amb24483228 [0,1,1,0,0,0|1,0,1]=4 3886 B7R0.6 CC(C)\C=C\C(C)N Amb32953515 [0,1,1,0,0,0|1,0,1]=4 3887 B7R0.6 CC(C)\C=C\C(C)O Amb25746608 [0,1,1,0,0,0|0,0,2]=4 3888 B7R0.6 CC(C)\C=C\[C@H](C)O Amb28189174 [0,1,1,0,0,0|0,0,2]=4 3889 B7R0.6 CC(C)\C=C\[N+](=O)[O-] Amb32644472 [0,1,1,0,0,0|2,0,0]=4 3890 B7R0.6 CC(C)\C=N\S(C)=O Amb35681708 [0,1,1,0,0,0|2,0,0]=4 3891 B7R0.6 CC(C)\N=C\C(N)=O Amb28388359 [0,1,1,0,0,0|2,0,0]=4 3892 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,1,1,0,0,0|1,0,1]=4 3893 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [0,1,1,0,0,0|1,0,0]=3 3894 B7R0.6 CC(I)CCC(=O)O Amb25938596 [0,1,1,0,0,0|1,0,1]=4 3895 B7R0.6 CC(N)CCC(=O)O Amb17593212 [0,1,1,0,0,0|1,0,1]=4 3896 B7R0.6 CC(N)CCC(=O)O Amb19515603 [0,1,1,0,0,0|1,0,1]=4 3897 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [0,1,1,0,0,0|1,0,0]=3 3898 B7R0.6 CC(O)CCC(=O)O Amb18294804 [0,1,1,0,0,0|1,0,1]=4 3899 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [0,1,1,0,0,0|1,0,1]=4 3900 B7R0.6 CC(O)\C=C\C(C)O Amb22346175 [0,1,1,0,0,0|0,0,2]=4 3901 B7R0.6 CC(S)CCC(=O)O Amb8471198 [0,1,1,0,0,0|1,0,1]=4 3902 B7R0.6 CC(S)CCC(N)=O Amb28399630 [0,1,1,0,0,0|1,0,1]=4 3903 B7R0.6 CN(C)\C=C\C(=O)O Amb25273624 [0,1,1,0,0,0|2,0,0]=4 3904 B7R0.6 CN(O)\C=C\C(=O)O Amb27788003 [0,1,1,0,0,0|2,0,0]=4 3905 B7R0.6 CS(=O)\C=C/C(N)=O Amb27815054 [0,1,1,0,0,0|2,0,0]=4 3906 B7R0.6 CS(=O)\C=C\C(=O)O Amb18642965 [0,1,1,0,0,0|2,0,0]=4 3907 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [0,1,1,0,0,0|1,0,1]=4 3908 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [0,1,1,0,0,0|1,0,1]=4 3909 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [0,1,1,0,0,0|1,0,1]=4 3910 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [0,1,1,0,0,0|1,0,1]=4 3911 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [0,1,1,0,0,0|1,0,1]=4 3912 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [0,1,1,0,0,0|1,0,1]=4 3913 B7R0.6 NC(=O)CCC(Cl)Cl Amb32671996 [0,1,1,0,0,0|2,0,0]=4 3914 B7R0.6 NC(=O)CCC(O)O Amb27254204 [0,1,1,0,0,0|2,0,0]=4 3915 B7R0.6 O=C(Cl)\C=C\C(F)F Amb32415914 [0,1,1,0,0,0|2,0,0]=4 3916 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [0,1,1,0,0,0|2,0,0]=4 3917 B7R0.6 O=C(O)CCC(F)F Amb20623135 [0,1,1,0,0,0|2,0,0]=4 3918 B7R0.6 O=C(O)\C=C\C(Cl)Cl Amb26464246 [0,1,1,0,0,0|2,0,0]=4 3919 B7R0.6 O=C(O)\C=C\C(F)F Amb24340205 [0,1,1,0,0,0|2,0,0]=4 3920 B7R0.8 CC\C=C/C(C)(C)C Amb4036316 [0,1,1,0,0,0|1,0,1]=4 3921 B7R0.8 CC\C=C\C(C)(C)C Amb4020583 [0,1,1,0,0,0|1,0,1]=4 3922 B7R0.8 CC\C=C\C(C)(C)N Amb33473924 [0,1,1,0,0,0|1,0,1]=4 3923 B7R0.8 CC\C=C\C(C)(C)O Amb33268272 [0,1,1,0,0,0|0,0,2]=4 3924 B7R0.8 CC\C=C\P(=O)(O)O Amb22388769 [0,1,1,0,0,0|2,0,0]=4 3925 B7R0.8 CN\C=C\S(C)(=O)=O Amb27254159 [0,1,1,0,0,0|2,0,0]=4 3926 B7R0.8 CS(=O)(=O)\C=C/CBr Amb28280463 [0,1,1,0,0,0|2,0,0]=4 3927 B7R0.8 CS(=O)(=O)\C=C/CN Amb29083415 [0,1,1,0,0,0|2,0,0]=4 3928 B7R0.8 CS(=O)(=O)\C=C\CBr Amb28195723 [0,1,1,0,0,0|2,0,0]=4 3929 B7R0.8 CS(=O)(=O)\C=C\CN Amb27430001 [0,1,1,0,0,0|2,0,0]=4 3930 B7R0.8 CS(=O)(=O)\C=C\CN Amb29083403 [0,1,1,0,0,0|2,0,0]=4 3931 B7R0.1 C#CCCCCC=C Amb22367006 [0,1,1,0,0,0|1,0,1]=4 3932 B7R0.1 C#CCCCNC=O Amb27838352 [0,1,1,0,0,0|0,0,2]=4 3933 B7R0.1 C#CCCNCC=C Amb28249670 [0,1,1,0,0,0|1,0,1]=4 3934 B7R0.1 C#CCCOCC=C Amb28247850 [0,1,1,0,0,0|1,0,1]=4 3935 B7R0.1 C#CCNCCC=C Amb27856078 [0,1,1,0,0,0|1,0,1]=4 3936 B7R0.1 C#CCOCCC=O Amb27877538 [0,1,1,0,0,0|0,0,2]=4 3937 B7R0.1 C#CC\C=C\CCC Amb33424838 [0,1,1,0,0,0|1,0,1]=4 3938 B7R0.1 C#C\C=C\CCCO Amb10605296 [0,1,1,0,0,0|1,0,1]=4 3939 B7R0.1 C#C\C=C\CNCC Amb25175071 [0,1,1,0,0,0|1,0,1]=4 3940 B7R0.1 C=C=CCCCC=O Amb28144035 [0,1,1,0,0,0|0,0,0]=2 3941 B7R0.1 C=C=CCCCCCl Amb27986085 [0,1,1,0,0,0|1,0,1]=4 3942 B7R0.1 C=C=CCCCCO Amb17593159 [0,1,1,0,0,0|0,0,2]=4 3943 B7R0.1 C=C=CCOCC=O Amb28321808 [0,1,1,0,0,0|1,0,0]=3 3944 B7R0.1 C=CCCC#CC=O Amb27224253 [0,1,1,0,0,0|0,0,1]=3 3945 B7R0.1 C=CCCCC#CC Amb28048990 [0,1,1,0,0,0|1,0,1]=4 3946 B7R0.1 C=CCCCCC=O Amb9785164 [0,1,1,0,0,0|0,0,0]=2 3947 B7R0.1 C=CCCCCCBr Amb16234121 [0,1,1,0,0,0|1,0,1]=4 3948 B7R0.1 C=CCCCCCC Amb3940500 [0,1,1,0,0,0|1,0,1]=4 3949 B7R0.1 C=CCCCCCCl Amb6298878 [0,1,1,0,0,0|1,0,1]=4 3950 B7R0.1 C=CCCCCCI Amb24483139 [0,1,1,0,0,0|1,0,1]=4 3951 B7R0.1 C=CCCCCCN Amb18641754 [0,1,1,0,0,0|1,0,1]=4 3952 B7R0.1 C=CCCCCCO Amb4017321 [0,1,1,0,0,0|0,0,2]=4 3953 B7R0.1 C=CCCCCNC Amb19886674 [0,1,1,0,0,0|1,0,1]=4 3954 B7R0.1 C=CCCCCNC Amb22495849 [0,1,1,0,0,0|1,0,1]=4 3955 B7R0.1 C=CCCCN=C=O Amb26567370 [0,1,1,0,0,0|0,0,1]=3 3956 B7R0.1 C=CCCCN=C=S Amb10601691 [0,1,1,0,0,0|0,1,1]=4 3957 B7R0.1 C=CCCCNC#N Amb28072825 [0,1,1,0,0,0|1,0,1]=4 3958 B7R0.1 C=CCCCNCC Amb28461005 [0,1,1,0,0,0|1,0,1]=4 3959 B7R0.1 C=CCCCNCC Amb32988644 [0,1,1,0,0,0|1,0,1]=4 3960 B7R0.1 C=CCCCOCBr Amb2696014 [0,1,1,0,0,0|1,0,1]=4 3961 B7R0.1 C=CCCCOCCl Amb2694973 [0,1,1,0,0,0|1,0,1]=4 3962 B7R0.1 C=CCCCSC#N Amb26948505 [0,1,1,0,0,0|1,0,1]=4 3963 B7R0.1 C=CCCCSCC Amb27600986 [0,1,1,0,0,0|1,0,1]=4 3964 B7R0.1 C=CCCC\C=C\C Amb24700388 [0,1,1,0,0,0|1,0,0]=3 3965 B7R0.1 C=CCCNCC=C Amb18641672 [0,1,1,0,0,0|1,0,0]=3 3966 B7R0.1 C=CCCNCCC Amb27796644 [0,1,1,0,0,0|1,0,1]=4 3967 B7R0.1 C=CCCOCCBr Amb9208733 [0,1,1,0,0,0|1,0,1]=4 3968 B7R0.1 C=CCCOCCN Amb22059113 [0,1,1,0,0,0|1,0,1]=4 3969 B7R0.1 C=CCCOCCO Amb26613595 [0,1,1,0,0,0|0,0,2]=4 3970 B7R0.1 C=CCCOCOC Amb27664092 [0,1,1,0,0,0|2,0,0]=4 3971 B7R0.1 C=CCCSCCC Amb27806215 [0,1,1,0,0,0|1,0,1]=4 3972 B7R0.1 C=CCCSCCN Amb25889820 [0,1,1,0,0,0|1,0,1]=4 3973 B7R0.1 C=CCCSCCO Amb28283935 [0,1,1,0,0,0|0,0,2]=4 3974 B7R0.1 C=CCC\C=C\CO Amb27406831 [0,1,1,0,0,0|0,0,2]=4 3975 B7R0.1 C=CCNCCC#N Amb19960051 [0,1,1,0,0,0|1,0,1]=4 3976 B7R0.1 C=CCNCCC#N Amb8827851 [0,1,1,0,0,0|1,0,1]=4 3977 B7R0.1 C=CCNCCCCl Amb27655586 [0,1,1,0,0,0|1,0,1]=4 3978 B7R0.1 C=CCNCCCI Amb28256753 [0,1,1,0,0,0|1,0,1]=4 3979 B7R0.1 C=CCNCCCN Amb17315274 [0,1,1,0,0,0|1,0,1]=4 3980 B7R0.1 C=CCNCCCO Amb17308751 [0,1,1,0,0,0|0,0,2]=4 3981 B7R0.1 C=CCNCCOC Amb6706505 [0,1,1,0,0,0|2,0,0]=4 3982 B7R0.1 C=CCNC\C=C\C Amb18124233 [0,1,1,0,0,0|1,0,1]=4 3983 B7R0.1 C=CCNNCC=C Amb27787288 [0,1,1,0,0,0|2,0,0]=4 3984 B7R0.1 C=CCNOCC=C Amb27249771 [0,1,1,0,0,0|2,0,0]=4 3985 B7R0.1 C=CCOCCC#N Amb9208769 [0,1,1,0,0,0|1,0,1]=4 3986 B7R0.1 C=CCOCCC=O Amb26516382 [0,1,1,0,0,0|0,0,0]=2 3987 B7R0.1 C=CCOCCCBr Amb8828250 [0,1,1,0,0,0|1,0,1]=4 3988 B7R0.1 C=CCOCCCC Amb3940494 [0,1,1,0,0,0|1,0,1]=4 3989 B7R0.1 C=CCOCCCCl Amb9208730 [0,1,1,0,0,0|1,0,1]=4 3990 B7R0.1 C=CCOCCCN Amb25190295 [0,1,1,0,0,0|1,0,1]=4 3991 B7R0.1 C=CCOCCCO Amb25097051 [0,1,1,0,0,0|0,0,2]=4 3992 B7R0.1 C=CCOCCSC Amb27983164 [0,1,1,0,0,0|2,0,0]=4 3993 B7R0.1 C=CCSCCCBr Amb27228626 [0,1,1,0,0,0|1,0,1]=4 3994 B7R0.1 C=CCSCCCN Amb17500693 [0,1,1,0,0,0|1,0,1]=4 3995 B7R0.1 C=CCSCCCS Amb28293414 [0,1,1,0,0,0|0,1,1]=4 3996 B7R0.1 C=CCSCCNC Amb27594788 [0,1,1,0,0,0|2,0,0]=4 3997 B7R0.1 C=CCSCCOC Amb17799422 [0,1,1,0,0,0|2,0,0]=4 3998 B7R0.1 C=CCSCCSC Amb27594231 [0,1,1,0,0,0|2,0,0]=4 3999 B7R0.1 C=CCSCN=C=O Amb28193492 [0,1,1,0,0,0|1,0,1]=4 4000 B7R0.1 C=CCSSCC=C Amb8393146 [0,1,1,0,0,0|2,0,0]=4 4001 B7R0.1 C=CC\C=C\CCBr Amb27235562 [0,1,1,0,0,0|2,0,0]=4 4002 B7R0.1 C=CC\C=C\CCC Amb4035888 [0,1,1,0,0,0|1,0,0]=3 4003 B7R0.1 C=CNCCOC=C Amb27844762 [0,1,1,0,0,0|2,0,0]=4 4004 B7R0.1 C=COCCCCO Amb8517109 [0,1,1,0,0,0|0,0,2]=4 4005 B7R0.1 C=COCCCOC Amb28063047 [0,1,1,0,0,0|2,0,0]=4 4006 B7R0.1 C=CSCCCCC Amb27666051 [0,1,1,0,0,0|1,0,1]=4 4007 B7R0.1 C=C\C=C\CCC=C Amb26026784 [0,1,1,0,0,0|1,0,1]=4 4008 B7R0.1 C=C\C=C\CCCC Amb22729011 [0,1,1,0,0,0|1,0,0]=3 4009 B7R0.1 C=C\C=C\CCCCl Amb28132447 [0,1,1,0,0,0|1,0,0]=3 4010 B7R0.1 C=C\C=C\CCNC Amb18641669 [0,1,1,0,0,0|1,0,0]=3 4011 B7R0.1 CC#CCCCC=O Amb17593142 [0,1,1,0,0,0|0,0,2]=4 4012 B7R0.1 CC=C=CCCCC Amb28284500 [0,1,1,0,0,0|1,0,1]=4 4013 B7R0.1 CCCC=C=CCN Amb27838307 [0,1,1,0,0,0|1,0,1]=4 4014 B7R0.1 CCCCC#CC=O Amb17593134 [0,1,1,0,0,0|0,0,2]=4 4015 B7R0.1 CCCCCCC=O Amb3939948 [0,1,1,0,0,0|0,0,2]=4 4016 B7R0.1 CCCCC\C=C\Br Amb27985859 [0,1,1,0,0,0|1,0,1]=4 4017 B7R0.1 CCCCC\C=C\Cl Amb28384465 [0,1,1,0,0,0|1,0,1]=4 4018 B7R0.1 CCCCC\C=C\I Amb22641605 [0,1,1,0,0,0|1,0,1]=4 4019 B7R0.1 CCCCOCC=O Amb26515709 [0,1,1,0,0,0|0,0,2]=4 4020 B7R0.1 CCCCO\C=C/Cl Amb27777227 [0,1,1,0,0,0|1,0,1]=4 4021 B7R0.1 CCCCO\C=C\Br Amb27858551 [0,1,1,0,0,0|1,0,1]=4 4022 B7R0.1 CCCCSCC=O Amb28189740 [0,1,1,0,0,0|0,0,2]=4 4023 B7R0.1 CCCCS\C=C/Cl Amb28048891 [0,1,1,0,0,0|1,0,1]=4 4024 B7R0.1 CCCC\C=C\C#N Amb18641342 [0,1,1,0,0,0|1,0,1]=4 4025 B7R0.1 CCCC\C=C\C=O Amb2720528 [0,1,1,0,0,0|0,0,0]=2 4026 B7R0.1 CCCC\C=C\CN Amb25175053 [0,1,1,0,0,0|1,0,1]=4 4027 B7R0.1 CCCC\C=C\CO Amb8514979 [0,1,1,0,0,0|0,0,2]=4 4028 B7R0.1 CCCNCCC=O Amb27838403 [0,1,1,0,0,0|0,0,2]=4 4029 B7R0.1 CCCNC\C=C\Cl Amb25340126 [0,1,1,0,0,0|1,0,1]=4 4030 B7R0.1 CCCN\C=C\C#N Amb27424747 [0,1,1,0,0,0|1,0,1]=4 4031 B7R0.1 CCCOC\C=C/Cl Amb27839016 [0,1,1,0,0,0|1,0,1]=4 4032 B7R0.1 CCC\C=C/CCC Amb27838401 [0,1,1,0,0,0|1,0,1]=4 4033 B7R0.1 CCC\C=C/CCO Amb22052625 [0,1,1,0,0,0|0,0,2]=4 4034 B7R0.1 CCC\C=C\C=C\Cl Amb27657659 [0,1,1,0,0,0|1,0,0]=3 4035 B7R0.1 CCC\C=C\CC#N Amb33172503 [0,1,1,0,0,0|1,0,1]=4 4036 B7R0.1 CCC\C=C\CC=O Amb32954538 [0,1,1,0,0,0|0,0,0]=2 4037 B7R0.1 CCC\C=C\CCBr Amb33242599 [0,1,1,0,0,0|1,0,1]=4 4038 B7R0.1 CCC\C=C\CCC Amb9134769 [0,1,1,0,0,0|1,0,1]=4 4039 B7R0.1 CCC\C=C\CCCl Amb32686957 [0,1,1,0,0,0|1,0,1]=4 4040 B7R0.1 CCC\C=C\CCN Amb25221747 [0,1,1,0,0,0|1,0,1]=4 4041 B7R0.1 CCC\C=C\CCO Amb22730273 [0,1,1,0,0,0|0,0,2]=4 4042 B7R0.1 CCC\C=C\CCS Amb33373718 [0,1,1,0,0,0|0,1,1]=4 4043 B7R0.1 CCC\C=C\CNC Amb33172653 [0,1,1,0,0,0|1,0,1]=4 4044 B7R0.1 CCC\C=C\CNN Amb33425693 [0,1,1,0,0,0|1,0,1]=4 4045 B7R0.1 CCC\C=C\CNO Amb33327497 [0,1,1,0,0,0|0,0,2]=4 4046 B7R0.1 CCC\C=C\CON Amb33424912 [0,1,1,0,0,0|0,0,2]=4 4047 B7R0.1 CCC\C=C\N=C=O Amb25260726 [0,1,1,0,0,0|0,0,1]=3 4048 B7R0.1 CCC\C=C\N=[N+]=[N-] Amb25232268 [0,1,1,0,0,0|2,0,0]=4 4049 B7R0.1 CCC\C=C\OCC Amb25074036 [0,1,1,0,0,0|1,0,1]=4 4050 B7R0.1 CCNCC\C=C\Cl Amb27400178 [0,1,1,0,0,0|1,0,1]=4 4051 B7R0.1 CCNC\C=C/CO Amb28072875 [0,1,1,0,0,0|0,0,2]=4 4052 B7R0.1 CCNC\C=C\CN Amb27972499 [0,1,1,0,0,0|1,0,1]=4 4053 B7R0.1 CCOCCCC=O Amb27236777 [0,1,1,0,0,0|0,0,2]=4 4054 B7R0.1 CCOC\C=C\CO Amb25221278 [0,1,1,0,0,0|0,0,2]=4 4055 B7R0.1 CCOC\C=C\CS Amb28254606 [0,1,1,0,0,0|0,1,1]=4 4056 B7R0.1 CCO\C=C\C=C/Br Amb27858991 [0,1,1,0,0,0|1,0,1]=4 4057 B7R0.1 CCO\C=C\C=C\Br Amb28138073 [0,1,1,0,0,0|1,0,1]=4 4058 B7R0.1 CCSCCCC=O Amb33323662 [0,1,1,0,0,0|0,0,2]=4 4059 B7R0.1 CCSCCNC=O Amb27752341 [0,1,1,0,0,0|1,0,1]=4 4060 B7R0.1 CCSC\C=C\C=O Amb33323727 [0,1,1,0,0,0|0,0,0]=2 4061 B7R0.1 CCSC\C=C\CN Amb33474425 [0,1,1,0,0,0|1,0,1]=4 4062 B7R0.1 CCSC\C=C\CO Amb33475304 [0,1,1,0,0,0|0,0,2]=4 4063 B7R0.1 CC\C=C/CCCO Amb22053865 [0,1,1,0,0,0|1,0,1]=4 4064 B7R0.1 CC\C=C\C=C\C=O Amb8392847 [0,1,1,0,0,0|0,0,1]=3 4065 B7R0.1 CC\C=C\C=C\CN Amb33267973 [0,1,1,0,0,0|1,0,1]=4 4066 B7R0.1 CC\C=C\C=C\CO Amb32953372 [0,1,1,0,0,0|0,0,2]=4 4067 B7R0.1 CC\C=C\CCC=O Amb27390797 [0,1,1,0,0,0|0,0,2]=4 4068 B7R0.1 CC\C=C\CCCBr Amb27232700 [0,1,1,0,0,0|1,0,1]=4 4069 B7R0.1 CC\C=C\CCCC Amb19930202 [0,1,1,0,0,0|1,0,1]=4 4070 B7R0.1 CC\C=C\CCCCl Amb28410595 [0,1,1,0,0,0|1,0,1]=4 4071 B7R0.1 CC\C=C\CCCN Amb33474692 [0,1,1,0,0,0|1,0,1]=4 4072 B7R0.1 CC\C=C\CCCO Amb33172698 [0,1,1,0,0,0|1,0,1]=4 4073 B7R0.1 CC\C=C\CCCS Amb32882557 [0,1,1,0,0,0|1,0,1]=4 4074 B7R0.1 CC\C=C\CCNC Amb32953435 [0,1,1,0,0,0|1,0,1]=4 4075 B7R0.1 CC\C=C\CCSC Amb27397344 [0,1,1,0,0,0|1,0,1]=4 4076 B7R0.1 COCCCCC=O Amb27410175 [0,1,1,0,0,0|0,0,2]=4 4077 B7R0.1 COCCOCC=O Amb26051823 [0,1,1,0,0,0|1,0,1]=4 4078 B7R0.1 COCCONC=O Amb28049001 [0,1,1,0,0,0|2,0,0]=4 4079 B7R0.1 COCC\C=C\C=O Amb33377482 [0,1,1,0,0,0|0,0,0]=2 4080 B7R0.1 COCC\C=C\CCl Amb10844762 [0,1,1,0,0,0|1,0,1]=4 4081 B7R0.1 COCC\C=C\CN Amb33474375 [0,1,1,0,0,0|1,0,1]=4 4082 B7R0.1 COCC\C=C\CO Amb32954125 [0,1,1,0,0,0|0,0,2]=4 4083 B7R0.1 COCOCCC=O Amb25804170 [0,1,1,0,0,0|1,0,1]=4 4084 B7R0.1 CO\C=C\CCC=O Amb18641790 [0,1,1,0,0,0|0,0,2]=4 4085 B7R0.1 CSCCCCC=O Amb25760866 [0,1,1,0,0,0|0,0,2]=4 4086 B7R0.1 CSCC\C=C\C=O Amb32953448 [0,1,1,0,0,0|0,0,0]=2 4087 B7R0.1 CSCC\C=C\CN Amb33198278 [0,1,1,0,0,0|1,0,1]=4 4088 B7R0.1 CSCC\C=C\CO Amb33198279 [0,1,1,0,0,0|0,0,2]=4 4089 B7R0.1 C\C=C/CCCCC Amb4035902 [0,1,1,0,0,0|1,0,1]=4 4090 B7R0.1 C\C=C/CCCCO Amb4019856 [0,1,1,0,0,0|0,0,2]=4 4091 B7R0.1 C\C=C\C=C\CCBr Amb28201639 [0,1,1,0,0,0|1,0,1]=4 4092 B7R0.1 C\C=C\C=C\CCC Amb27493119 [0,1,1,0,0,0|1,0,0]=3 4093 B7R0.1 C\C=C\C=C\CCN Amb28245294 [0,1,1,0,0,0|1,0,1]=4 4094 B7R0.1 C\C=C\C=C\CCO Amb27459750 [0,1,1,0,0,0|1,0,1]=4 4095 B7R0.1 C\C=C\CCCCC Amb8513437 [0,1,1,0,0,0|1,0,1]=4 4096 B7R0.1 C\C=C\CCCCN Amb27209196 [0,1,1,0,0,0|1,0,1]=4 4097 B7R0.1 C\C=C\CCNC=O Amb27874072 [0,1,1,0,0,0|1,0,0]=3 4098 B7R0.1 C\C=C\CC\C=C\C Amb21520377 [0,1,1,0,0,0|1,0,1]=4 4099 B7R0.1 C\C=C\CC\C=C\Cl Amb27433939 [0,1,1,0,0,0|1,0,1]=4 4100 B7R0.1 C\C=C\CNCCC Amb28127654 [0,1,1,0,0,0|1,0,1]=4 4101 B7R0.1 C\C=C\C\C=C\C=O Amb27202097 [0,1,1,0,0,0|0,0,1]=3 4102 B7R0.1 C\C=C\SSCCC Amb25865705 [0,1,1,0,0,0|2,0,0]=4 4103 B7R0.1 ClC\C=C\CCCCl Amb27421977 [0,1,1,0,0,0|1,0,1]=4 4104 B7R0.1 N#CCCCCC=O Amb17593149 [0,1,1,0,0,0|0,0,2]=4 4105 B7R0.1 N#CCCOCC=O Amb27613546 [0,1,1,0,0,0|1,0,1]=4 4106 B7R0.1 NCCCCNC=O Amb18641902 [0,1,1,0,0,0|1,0,1]=4 4107 B7R0.1 NCCC\C=C/CO Amb27838308 [0,1,1,0,0,0|0,0,2]=4 4108 B7R0.1 NCCC\C=C\CO Amb24117506 [0,1,1,0,0,0|0,0,2]=4 4109 B7R0.1 NCCC\C=C\CO Amb33734220 [0,1,1,0,0,0|0,0,2]=4 4110 B7R0.1 NCCC\C=C\CO Amb33743765 [0,1,1,0,0,0|0,0,2]=4 4111 B7R0.1 O=CC#CCCCCl Amb27759532 [0,1,1,0,0,0|0,0,2]=4 4112 B7R0.1 O=CCCCCC=O Amb17593185 [0,1,1,0,0,0|0,0,1]=3 4113 B7R0.1 O=CCCCCCBr Amb18127461 [0,1,1,0,0,0|0,0,2]=4 4114 B7R0.1 O=CCCCCCCl Amb16185781 [0,1,1,0,0,0|0,0,2]=4 4115 B7R0.1 O=CCCCCCF Amb24533888 [0,1,1,0,0,0|0,0,2]=4 4116 B7R0.1 O=CCCCCCO Amb18641885 [0,1,1,0,0,0|0,0,2]=4 4117 B7R0.1 O=CCCOCCO Amb18641946 [0,1,1,0,0,0|1,0,1]=4 4118 B7R0.1 O=CCSCCCO Amb27871143 [0,1,1,0,0,0|1,0,1]=4 4119 B7R0.1 O=CCSSCC=O Amb27169089 [0,1,1,0,0,0|2,0,0]=4 4120 B7R0.1 O=CC\C=C\C=C\Br Amb27222551 [0,1,1,0,0,0|0,0,2]=4 4121 B7R0.1 O=CC\C=C\CC=O Amb26402388 [0,1,1,0,0,0|1,0,1]=4 4122 B7R0.1 O=CNCCCCF Amb27168251 [0,1,1,0,0,0|1,0,1]=4 4123 B7R0.1 O=CNCCCCO Amb28187191 [0,1,1,0,0,0|1,0,1]=4 4124 B7R0.1 O=CNCCNC=O Amb1043861 [0,1,1,0,0,0|2,0,0]=4 4125 B7R0.1 O=COCCOC=O Amb2721136 [0,1,1,0,0,0|2,0,0]=4 4126 B7R0.1 O=C\C=C\C=C\CCl Amb28292786 [0,1,1,0,0,0|0,0,2]=4 4127 B7R0.1 O=C\C=C\C=C\CO Amb27424442 [0,1,1,0,0,0|0,0,2]=4 4128 B7R0.1 O=C\C=C\CCC=O Amb18124241 [0,1,1,0,0,0|0,0,1]=3 4129 B7R0.1 OC\C=C/CCCCl Amb27862350 [0,1,1,0,0,0|0,0,2]=4 4130 B7R0.1 OC\C=C\CCCO Amb27205649 [0,1,1,0,0,0|0,0,2]=4 4131 B7R0.1 O\C=C\C=C\CCO Amb27605420 [0,1,1,0,0,0|0,0,2]=4 4132 B7R0.1 [C-]#[N+]C\C=C\CCC Amb33327126 [0,1,1,0,0,0|1,0,1]=4 4133 B7R0.1 [N-]=[N+]=NCCCC=O Amb26993491 [0,1,1,0,0,0|2,0,0]=4 4134 B7R1.1 BrC=C1CCCC1 Amb27592183 [0,1,0,0,1,0|1,0,1]=4 4135 B7R1.1 BrCC1=CCCC1 Amb23439168 [0,1,0,0,1,0|1,0,0]=3 4136 B7R1.1 BrCC1C=CCC1 Amb28385457 [0,1,0,0,1,0|1,0,1]=4 4137 B7R1.1 BrC[C@@H]1C=CCC1 Amb27233396 [0,1,0,0,1,0|1,0,1]=4 4138 B7R1.1 C#CC1=CCCC1 Amb17689255 [0,1,0,0,1,0|1,0,0]=3 4139 B7R1.1 CC=C1CCCC1 Amb4035880 [0,1,0,0,1,0|1,0,1]=4 4140 B7R1.1 CCC1=CCCC1 Amb4035875 [0,1,0,0,1,0|1,0,0]=3 4141 B7R1.1 CCC1=NCCC1 Amb22055207 [0,1,0,0,1,0|2,0,0]=4 4142 B7R1.1 CCC1C=CCC1 Amb4020582 [0,1,0,0,1,0|1,0,1]=4 4143 B7R1.1 CNC1=NCCC1 Amb33249673 [0,1,0,0,1,0|2,0,0]=4 4144 B7R1.1 CNC1=NCCC1 Amb4136373 [0,1,0,0,1,0|2,0,0]=4 4145 B7R1.1 COC1=CCCN1 Amb19883801 [0,1,0,0,1,0|1,0,1]=4 4146 B7R1.1 COC1=NCC=C1 Amb27877548 [0,1,0,0,1,0|1,0,1]=4 4147 B7R1.1 COC1=NCCC1 Amb1694184 [0,1,0,0,1,0|1,0,1]=4 4148 B7R1.1 COC1C=CCC1 Amb4016570 [0,1,0,0,1,0|0,0,2]=4 4149 B7R1.1 ClC=C1CCCC1 Amb28118913 [0,1,0,0,1,0|1,0,1]=4 4150 B7R1.1 ICC1=CCCC1 Amb27838217 [0,1,0,0,1,0|1,0,0]=3 4151 B7R1.1 N#CC1=CCCC1 Amb2720765 [0,1,0,0,1,0|1,0,0]=3 4152 B7R1.1 N#CC1=CCCO1 Amb19149010 [0,1,0,0,1,0|2,0,0]=4 4153 B7R1.1 N#CC1=CCSC1 Amb25949534 [0,1,0,0,1,0|2,0,0]=4 4154 B7R1.1 N#CC1=NCC=C1 Amb27438641 [0,1,0,0,1,0|2,0,0]=4 4155 B7R1.1 NCC1=CCCC1 Amb18120760 [0,1,0,0,1,0|1,0,0]=3 4156 B7R1.1 NCC1=CCNC1 Amb24714742 [0,1,0,0,1,0|2,0,0]=4 4157 B7R1.1 NCC1=CCSC1 Amb35743801 [0,1,0,0,1,0|2,0,0]=4 4158 B7R1.1 NCC1C=CCC1 Amb18119742 [0,1,0,0,1,0|1,0,1]=4 4159 B7R1.1 NCC1C=CCC1 Amb30584689 [0,1,0,0,1,0|1,0,1]=4 4160 B7R1.1 NNC1=CCCO1 Amb27461530 [0,1,0,0,1,0|2,0,0]=4 4161 B7R1.1 NNC1=NCCC1 Amb24119297 [0,1,0,0,1,0|2,0,0]=4 4162 B7R1.1 NNC1=NCCC1 Amb33621235 [0,1,0,0,1,0|2,0,0]=4 4163 B7R1.1 O=C=C1CC=CN1 Amb27851531 [0,1,0,0,1,0|1,0,1]=4 4164 B7R1.1 O=C=C1CCCC1 Amb17673796 [0,1,0,0,1,0|0,0,1]=3 4165 B7R1.1 O=CC1=CC=CC1 Amb25799627 [0,1,0,0,1,0|0,0,1]=3 4166 B7R1.1 O=CC1=CCCC1 Amb17138358 [0,1,0,0,1,0|0,0,0]=2 4167 B7R1.1 O=CC1=CCCO1 Amb18120782 [0,1,0,0,1,0|1,0,0]=3 4168 B7R1.1 O=CC1=CCSC1 Amb423472 [0,1,0,0,1,0|1,0,0]=3 4169 B7R1.1 O=CC1=COCC1 Amb18120774 [0,1,0,0,1,0|1,0,0]=3 4170 B7R1.1 O=CC1=NCCS1 Amb27799744 [0,1,0,0,1,0|2,0,0]=4 4171 B7R1.1 O=CC1=NOCC1 Amb35788708 [0,1,0,0,1,0|2,0,0]=4 4172 B7R1.1 O=CC1C=CCC1 Amb27229924 [0,1,0,0,1,0|0,0,1]=3 4173 B7R1.1 O=CC1CCCC1 Amb31292855 [0,1,0,0,1,0|0,0,2]=4 4174 B7R1.1 O=CC1CCCC1 Amb4605847 [0,1,0,0,1,0|0,0,2]=4 4175 B7R1.1 O=CC1CCCC1 Amb6297186 [0,1,0,0,1,0|0,0,2]=4 4176 B7R1.1 O=CC1CCCO1 Amb3939388 [0,1,0,0,1,0|1,0,1]=4 4177 B7R1.1 O=CC1CCCS1 Amb27214645 [0,1,0,0,1,0|1,0,1]=4 4178 B7R1.1 O=CN1CCCC1 Amb2720947 [0,1,0,0,1,0|1,0,1]=4 4179 B7R1.1 O=C[C@@H]1CCCN1 Amb27261498 [0,1,0,0,1,0|1,0,1]=4 4180 B7R1.1 O=C[C@@H]1CCCS1 Amb28130403 [0,1,0,0,1,0|1,0,1]=4 4181 B7R1.1 O=Cc1ccco1 Amb2720358 [0,1,0,0,1,0|1,0,1]=4 4182 B7R1.1 O=Cc1cccs1 Amb2690601 [0,1,0,0,1,0|1,0,1]=4 4183 B7R1.1 O=Cc1ccno1 Amb33546951 [0,1,0,0,1,0|2,0,0]=4 4184 B7R1.1 O=Cc1ccns1 Amb8010934 [0,1,0,0,1,0|2,0,0]=4 4185 B7R1.1 O=Cc1ccoc1 Amb2720357 [0,1,0,0,1,0|1,0,1]=4 4186 B7R1.1 O=Cc1ccon1 Amb8009575 [0,1,0,0,1,0|2,0,0]=4 4187 B7R1.1 O=Cc1ccsc1 Amb2720343 [0,1,0,0,1,0|1,0,1]=4 4188 B7R1.1 O=Cc1ccsn1 Amb8010932 [0,1,0,0,1,0|2,0,0]=4 4189 B7R1.1 O=NC1CCCN1 Amb27488681 [0,1,0,0,1,0|1,0,1]=4 4190 B7R1.1 O=NN1C=CCC1 Amb27845186 [0,1,0,0,1,0|1,0,0]=3 4191 B7R1.1 O=NN1CCCC1 Amb9787681 [0,1,0,0,1,0|1,0,1]=4 4192 B7R1.1 O=S=C1NCCO1 Amb28350550 [0,1,0,0,1,0|2,0,0]=4 4193 B7R1.1 OCC1=CC=CC1 Amb27457780 [0,1,0,0,1,0|0,0,2]=4 4194 B7R1.1 OCC1=CCCC1 Amb24479891 [0,1,0,0,1,0|0,0,1]=3 4195 B7R1.1 OCC1=CCSC1 Amb35606324 [0,1,0,0,1,0|1,0,1]=4 4196 B7R1.1 OCC1=COCC1 Amb27827039 [0,1,0,0,1,0|1,0,1]=4 4197 B7R1.1 OCC1=CSCC1 Amb28345026 [0,1,0,0,1,0|1,0,1]=4 4198 B7R1.1 OCC1C=CCC1 Amb23455253 [0,1,0,0,1,0|0,0,2]=4 4199 B7R1.1 ON=C1CCCC1 Amb6538721 [0,1,0,0,1,0|0,0,2]=4 4200 B7R1.1 O\N=C1/C=CCC1 Amb27838262 [0,1,0,0,1,0|0,0,1]=3 4201 B7R1.1 O\N=C1/CCCN1 Amb19769769 [0,1,0,0,1,0|1,0,1]=4 4202 B7R1.1 O\N=C1/CCCN1 Amb33309985 [0,1,0,0,1,0|1,0,1]=4 4203 B7R1.1 SCC1=CCSC1 Amb32788040 [0,1,0,0,1,0|1,1,0]=4 4204 B7R1.2 BrC1C=CC(Br)C1 Amb26393963 [0,1,0,0,1,0|1,0,1]=4 4205 B7R1.2 Br[C@@H]1C=C[C@H](Br)C1 Amb27794599 [0,1,0,0,1,0|1,0,1]=4 4206 B7R1.2 C=C1CCC(Br)C1 Amb25135798 [0,1,0,0,1,0|1,0,1]=4 4207 B7R1.2 C=C1COC(=O)C1 Amb24589821 [0,1,0,0,1,0|1,0,1]=4 4208 B7R1.2 C=C1NC(=O)CO1 Amb27847146 [0,1,0,0,1,0|2,0,0]=4 4209 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [0,1,0,0,1,0|0,0,0]=2 4210 B7R1.2 CC1=CC(=O)CN1 Amb27390872 [0,1,0,0,1,0|1,0,0]=3 4211 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [0,1,0,0,1,0|1,0,0]=3 4212 B7R1.2 CC1=CC(=O)NC1 Amb24479892 [0,1,0,0,1,0|1,0,0]=3 4213 B7R1.2 CC1=CC(=O)NN1 Amb19770794 [0,1,0,0,1,0|2,0,0]=4 4214 B7R1.2 CC1=CC(=O)NO1 Amb19338707 [0,1,0,0,1,0|2,0,0]=4 4215 B7R1.2 CC1=CC(=O)OC1 Amb22002703 [0,1,0,0,1,0|1,0,0]=3 4216 B7R1.2 CC1=CC(C)CC1 Amb24479860 [0,1,0,0,1,0|1,0,0]=3 4217 B7R1.2 CC1=CC(C)NC1 Amb17593062 [0,1,0,0,1,0|2,0,0]=4 4218 B7R1.2 CC1=CC(N)CC1 Amb28186103 [0,1,0,0,1,0|1,0,0]=3 4219 B7R1.2 CC1=CCC(O)O1 Amb27241898 [0,1,0,0,1,0|2,0,0]=4 4220 B7R1.2 CC1=CCP(Cl)C1 Amb27261470 [0,1,0,0,1,0|2,0,0]=4 4221 B7R1.2 CC1=COC(=O)C1 Amb27624758 [0,1,0,0,1,0|1,0,1]=4 4222 B7R1.2 CC1=NC(=O)CS1 Amb27838191 [0,1,0,0,1,0|2,0,0]=4 4223 B7R1.2 CC1=NC(C)C=C1 Amb27442121 [0,1,0,0,1,0|2,0,0]=4 4224 B7R1.2 CC1=NCC(=O)N1 Amb27827848 [0,1,0,0,1,0|2,0,0]=4 4225 B7R1.2 CC1=NCC(=O)O1 Amb27783804 [0,1,0,0,1,0|2,0,0]=4 4226 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [0,1,0,0,1,0|0,0,0]=2 4227 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [0,1,0,0,1,0|1,0,0]=3 4228 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [0,1,0,0,1,0|1,0,0]=3 4229 B7R1.2 CC1C=CC(C)C1 Amb28365868 [0,1,0,0,1,0|1,0,1]=4 4230 B7R1.2 CC1CC(=O)CN1 Amb28349308 [0,1,0,0,1,0|1,0,1]=4 4231 B7R1.2 CC1CC(=O)CO1 Amb25888380 [0,1,0,0,1,0|1,0,1]=4 4232 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,1,0,0,1,0|1,0,1]=4 4233 B7R1.2 CC1CC(=O)NN1 Amb493880 [0,1,0,0,1,0|2,0,0]=4 4234 B7R1.2 CC1CCC(=O)C1 Amb8513672 [0,1,0,0,1,0|0,0,1]=3 4235 B7R1.2 CC1CCC(=O)N1 Amb19267101 [0,1,0,0,1,0|1,0,0]=3 4236 B7R1.2 CC1CCC(=O)O1 Amb6298321 [0,1,0,0,1,0|1,0,0]=3 4237 B7R1.2 CC1CCC(=O)S1 Amb27252897 [0,1,0,0,1,0|1,0,0]=3 4238 B7R1.2 CC1CCC(=S)N1 Amb27849283 [0,1,0,0,1,0|1,1,0]=4 4239 B7R1.2 CC1CNC(=O)C1 Amb10608004 [0,1,0,0,1,0|1,0,0]=3 4240 B7R1.2 CC1CNC(=O)N1 Amb17506853 [0,1,0,0,1,0|2,0,0]=4 4241 B7R1.2 CC1CNC(=O)O1 Amb19651732 [0,1,0,0,1,0|2,0,0]=4 4242 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,1,0,0,1,0|1,0,0]=3 4243 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,1,0,0,1,0|2,0,0]=4 4244 B7R1.2 CC1COC(=O)O1 Amb8513300 [0,1,0,0,1,0|2,0,0]=4 4245 B7R1.2 CC1CSC(=O)N1 Amb28320497 [0,1,0,0,1,0|2,0,0]=4 4246 B7R1.2 CC1NC(=O)CS1 Amb27806202 [0,1,0,0,1,0|2,0,0]=4 4247 B7R1.2 CC1NCC(=O)N1 Amb28456791 [0,1,0,0,1,0|2,0,0]=4 4248 B7R1.2 CC1OC(=O)CS1 Amb25314322 [0,1,0,0,1,0|2,0,0]=4 4249 B7R1.2 CN1C=CC(=O)C1 Amb28201569 [0,1,0,0,1,0|1,0,0]=3 4250 B7R1.2 CN1CCC(=O)C1 Amb22236123 [0,1,0,0,1,0|1,0,1]=4 4251 B7R1.2 CN1CCC(=O)C1 Amb8947873 [0,1,0,0,1,0|1,0,1]=4 4252 B7R1.2 CN1CCC(=O)N1 Amb24064860 [0,1,0,0,1,0|2,0,0]=4 4253 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [0,1,0,0,1,0|0,0,0]=2 4254 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,1,0,0,1,0|0,0,1]=3 4255 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [0,1,0,0,1,0|1,0,0]=3 4256 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [0,1,0,0,1,0|1,0,0]=3 4257 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,1,0,0,1,0|1,0,0]=3 4258 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [0,1,0,0,1,0|2,0,0]=4 4259 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,1,0,0,1,0|1,0,0]=3 4260 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,1,0,0,1,0|2,0,0]=4 4261 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [0,1,0,0,1,0|2,0,0]=4 4262 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [0,1,0,0,1,0|0,0,0]=2 4263 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [0,1,0,0,1,0|1,0,0]=3 4264 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [0,1,0,0,1,0|1,0,0]=3 4265 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [0,1,0,0,1,0|2,0,0]=4 4266 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,1,0,0,1,0|1,0,0]=3 4267 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [0,1,0,0,1,0|2,0,0]=4 4268 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [0,1,0,0,1,0|2,0,0]=4 4269 B7R1.2 ClC1=CC(Br)CC1 Amb27232977 [0,1,0,0,1,0|1,0,0]=3 4270 B7R1.2 ClC1C=CC(Cl)C1 Amb28076677 [0,1,0,0,1,0|1,0,1]=4 4271 B7R1.2 Cl[C@@H]1C=C[C@H](Cl)C1 Amb27969911 [0,1,0,0,1,0|1,0,1]=4 4272 B7R1.2 N=C1C=C(N)CO1 Amb27631497 [0,1,0,0,1,0|2,0,0]=4 4273 B7R1.2 N=C1C=C(O)CO1 Amb27445689 [0,1,0,0,1,0|1,0,1]=4 4274 B7R1.2 N=C1C=C(O)CS1 Amb27438020 [0,1,0,0,1,0|1,0,1]=4 4275 B7R1.2 N=C1CC(=O)CS1 Amb27227202 [0,1,0,0,1,0|1,0,1]=4 4276 B7R1.2 N=C1CSC(=O)N1 Amb2537154 [0,1,0,0,1,0|2,0,0]=4 4277 B7R1.2 N=C1NC(=O)CS1 Amb8468365 [0,1,0,0,1,0|2,0,0]=4 4278 B7R1.2 NC1=CC(=O)CC1 Amb9753541 [0,1,0,0,1,0|0,0,0]=2 4279 B7R1.2 NC1=CC(=O)CS1 Amb22229937 [0,1,0,0,1,0|1,0,0]=3 4280 B7R1.2 NC1=CC(=O)N=N1 Amb4005026 [0,1,0,0,1,0|2,0,0]=4 4281 B7R1.2 NC1=CC(=O)NC1 Amb27454229 [0,1,0,0,1,0|1,0,0]=3 4282 B7R1.2 NC1=CC(=O)NN1 Amb18941269 [0,1,0,0,1,0|2,0,0]=4 4283 B7R1.2 NC1=CC(=O)NO1 Amb20103209 [0,1,0,0,1,0|2,0,0]=4 4284 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [0,1,0,0,1,0|1,0,1]=4 4285 B7R1.2 NC1=NC(=O)CN1 Amb18639307 [0,1,0,0,1,0|2,0,0]=4 4286 B7R1.2 NC1=NC(=O)CO1 Amb9797441 [0,1,0,0,1,0|2,0,0]=4 4287 B7R1.2 NC1=NC(=O)CS1 Amb6364701 [0,1,0,0,1,0|2,0,0]=4 4288 B7R1.2 NC1=NC(=O)NC1 Amb22059492 [0,1,0,0,1,0|2,0,0]=4 4289 B7R1.2 NC1=NCC(=O)N1 Amb21964674 [0,1,0,0,1,0|2,0,0]=4 4290 B7R1.2 NC1=NCC(=O)N1 Amb475286 [0,1,0,0,1,0|2,0,0]=4 4291 B7R1.2 NC1=NCC(=O)S1 Amb25810910 [0,1,0,0,1,0|2,0,0]=4 4292 B7R1.2 NC1C=CC(=O)C1 Amb27445487 [0,1,0,0,1,0|0,0,0]=2 4293 B7R1.2 NC1C=CC(O)C1 Amb27948080 [0,1,0,0,1,0|0,0,2]=4 4294 B7R1.2 NC1CCC(=O)C1 Amb22494268 [0,1,0,0,1,0|0,0,1]=3 4295 B7R1.2 NC1CCC(=O)N1 Amb24480433 [0,1,0,0,1,0|1,0,0]=3 4296 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,1,0,0,1,0|1,0,0]=3 4297 B7R1.2 NC1CCS(=O)C1 Amb19149072 [0,1,0,0,1,0|1,0,1]=4 4298 B7R1.2 NC1CCS(=O)C1 Amb25133789 [0,1,0,0,1,0|1,0,1]=4 4299 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,1,0,0,1,0|1,0,0]=3 4300 B7R1.2 NC1CNC(=O)C1 Amb33544169 [0,1,0,0,1,0|1,0,0]=3 4301 B7R1.2 NC1COC(=O)C1 Amb30594428 [0,1,0,0,1,0|1,0,0]=3 4302 B7R1.2 NC1COC(=O)C1 Amb9782136 [0,1,0,0,1,0|1,0,0]=3 4303 B7R1.2 NC1CSC(=O)N1 Amb27596093 [0,1,0,0,1,0|2,0,0]=4 4304 B7R1.2 NC1N=CC(=O)S1 Amb27589031 [0,1,0,0,1,0|2,0,0]=4 4305 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,1,0,0,1,0|1,0,0]=3 4306 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,1,0,0,1,0|1,0,0]=3 4307 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [0,1,0,0,1,0|1,0,0]=3 4308 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [0,1,0,0,1,0|1,0,0]=3 4309 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [0,1,0,0,1,0|1,0,0]=3 4310 B7R1.2 N[C@H]1CCC(=O)N1 Amb27482175 [0,1,0,0,1,0|1,0,0]=3 4311 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,1,0,0,1,0|1,0,0]=3 4312 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [0,1,0,0,1,0|1,0,0]=3 4313 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,1,0,0,1,0|1,0,0]=3 4314 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,1,0,0,1,0|1,0,0]=3 4315 B7R1.2 O=C1C=C(Br)CC1 Amb23399816 [0,1,0,0,1,0|0,0,0]=2 4316 B7R1.2 O=C1C=C(Br)CN1 Amb23402184 [0,1,0,0,1,0|1,0,0]=3 4317 B7R1.2 O=C1C=C(Br)CO1 Amb10067500 [0,1,0,0,1,0|1,0,0]=3 4318 B7R1.2 O=C1C=C(Cl)CC1 Amb9753542 [0,1,0,0,1,0|0,0,0]=2 4319 B7R1.2 O=C1C=C(I)CO1 Amb2455617 [0,1,0,0,1,0|1,0,0]=3 4320 B7R1.2 O=C1C=C(O)CC1 Amb9901808 [0,1,0,0,1,0|0,0,0]=2 4321 B7R1.2 O=C1C=C(O)CN1 Amb20623530 [0,1,0,0,1,0|1,0,0]=3 4322 B7R1.2 O=C1C=C(O)CO1 Amb628324 [0,1,0,0,1,0|1,0,0]=3 4323 B7R1.2 O=C1C=C(S)CO1 Amb28323506 [0,1,0,0,1,0|1,0,0]=3 4324 B7R1.2 O=C1C=C(S)CS1 Amb27877546 [0,1,0,0,1,0|1,0,0]=3 4325 B7R1.2 O=C1C=CC(=O)C1 Amb22338203 [0,1,0,0,1,0|0,0,1]=3 4326 B7R1.2 O=C1C=CC(=O)N1 Amb1235242 [0,1,0,0,1,0|1,0,1]=4 4327 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [0,1,0,0,1,0|1,0,1]=4 4328 B7R1.2 O=C1C=CC(=O)O1 Amb6297783 [0,1,0,0,1,0|1,0,1]=4 4329 B7R1.2 O=C1C=CC(Br)C1 Amb27809803 [0,1,0,0,1,0|0,0,0]=2 4330 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [0,1,0,0,1,0|1,0,0]=3 4331 B7R1.2 O=C1C=CC(Br)S1 Amb26530759 [0,1,0,0,1,0|1,0,0]=3 4332 B7R1.2 O=C1C=CC(Cl)O1 Amb27760027 [0,1,0,0,1,0|1,0,0]=3 4333 B7R1.2 O=C1C=CC(Cl)S1 Amb28428650 [0,1,0,0,1,0|1,0,0]=3 4334 B7R1.2 O=C1C=CC(F)O1 Amb27778280 [0,1,0,0,1,0|1,0,0]=3 4335 B7R1.2 O=C1C=CC(O)=N1 Amb22552540 [0,1,0,0,1,0|1,0,1]=4 4336 B7R1.2 O=C1C=CC(O)C1 Amb9782767 [0,1,0,0,1,0|0,0,0]=2 4337 B7R1.2 O=C1C=CC(O)N1 Amb27978638 [0,1,0,0,1,0|1,0,0]=3 4338 B7R1.2 O=C1C=CC(O)O1 Amb24544763 [0,1,0,0,1,0|1,0,0]=3 4339 B7R1.2 O=C1C=C[C@@H](O)C1 Amb27256512 [0,1,0,0,1,0|0,0,0]=2 4340 B7R1.2 O=C1C=C[C@H](Cl)C1 Amb27984687 [0,1,0,0,1,0|0,0,0]=2 4341 B7R1.2 O=C1C=C[C@H](O)C1 Amb2694980 [0,1,0,0,1,0|0,0,0]=2 4342 B7R1.2 O=C1C=NC(S)S1 Amb22734244 [0,1,0,0,1,0|2,0,0]=4 4343 B7R1.2 O=C1CC(Br)=CO1 Amb27263920 [0,1,0,0,1,0|1,0,1]=4 4344 B7R1.2 O=C1CC(Cl)=CS1 Amb27239976 [0,1,0,0,1,0|1,0,1]=4 4345 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,1,0,0,1,0|1,0,0]=3 4346 B7R1.2 O=C1CC(I)CO1 Amb27401189 [0,1,0,0,1,0|1,0,0]=3 4347 B7R1.2 O=C1CC(O)CN1 Amb19958404 [0,1,0,0,1,0|1,0,0]=3 4348 B7R1.2 O=C1CC(O)CO1 Amb4006296 [0,1,0,0,1,0|1,0,0]=3 4349 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,1,0,0,1,0|1,0,0]=3 4350 B7R1.2 O=C1CC=C(Br)S1 Amb25961289 [0,1,0,0,1,0|1,0,1]=4 4351 B7R1.2 O=C1CC=C(S)S1 Amb27621600 [0,1,0,0,1,0|1,0,1]=4 4352 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [0,1,0,0,1,0|0,0,1]=3 4353 B7R1.2 O=C1CCC(=O)N1 Amb2793049 [0,1,0,0,1,0|1,0,0]=3 4354 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [0,1,0,0,1,0|1,0,0]=3 4355 B7R1.2 O=C1CCC(=O)S1 Amb2691584 [0,1,0,0,1,0|1,0,0]=3 4356 B7R1.2 O=C1CCC(=S)N1 Amb28122939 [0,1,0,0,1,0|1,0,0]=3 4357 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [0,1,0,0,1,0|0,0,1]=3 4358 B7R1.2 O=C1CCC(Br)N1 Amb27592181 [0,1,0,0,1,0|1,0,0]=3 4359 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,1,0,0,1,0|1,0,0]=3 4360 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [0,1,0,0,1,0|0,0,1]=3 4361 B7R1.2 O=C1CCC(Cl)O1 Amb27477474 [0,1,0,0,1,0|1,0,0]=3 4362 B7R1.2 O=C1CCC(F)C1 Amb21963553 [0,1,0,0,1,0|0,0,1]=3 4363 B7R1.2 O=C1CCC(O)C1 Amb22057378 [0,1,0,0,1,0|0,0,1]=3 4364 B7R1.2 O=C1CCC(O)O1 Amb22740957 [0,1,0,0,1,0|1,0,0]=3 4365 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [0,1,0,0,1,0|1,0,1]=4 4366 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [0,1,0,0,1,0|0,0,1]=3 4367 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [0,1,0,0,1,0|1,0,0]=3 4368 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [0,1,0,0,1,0|0,0,1]=3 4369 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [0,1,0,0,1,0|1,0,0]=3 4370 B7R1.2 O=C1CN(Cl)CN1 Amb27795741 [0,1,0,0,1,0|2,0,0]=4 4371 B7R1.2 O=C1CN=C(S)N1 Amb22058713 [0,1,0,0,1,0|2,0,0]=4 4372 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [0,1,0,0,1,0|1,0,1]=4 4373 B7R1.2 O=C1CNC(=O)N1 Amb3598086 [0,1,0,0,1,0|2,0,0]=4 4374 B7R1.2 O=C1CNC(=O)O1 Amb2695392 [0,1,0,0,1,0|2,0,0]=4 4375 B7R1.2 O=C1CNC(=O)S1 Amb22372196 [0,1,0,0,1,0|2,0,0]=4 4376 B7R1.2 O=C1CNC(=S)N1 Amb1151361 [0,1,0,0,1,0|2,0,0]=4 4377 B7R1.2 O=C1CNC(=S)O1 Amb27393154 [0,1,0,0,1,0|2,0,0]=4 4378 B7R1.2 O=C1CNC(=S)S1 Amb621648 [0,1,0,0,1,0|2,0,0]=4 4379 B7R1.2 O=C1CNC(S)S1 Amb24460897 [0,1,0,0,1,0|2,0,0]=4 4380 B7R1.2 O=C1COC(=O)C1 Amb2721303 [0,1,0,0,1,0|1,0,1]=4 4381 B7R1.2 O=C1COC(=O)N1 Amb1625991 [0,1,0,0,1,0|2,0,0]=4 4382 B7R1.2 O=C1COC(=O)O1 Amb27837383 [0,1,0,0,1,0|2,0,0]=4 4383 B7R1.2 O=C1COC(=O)[N-]1 Amb32656005 [0,1,0,0,1,0|2,0,0]=4 4384 B7R1.2 O=C1COC(Br)=N1 Amb29849631 [0,1,0,0,1,0|2,0,0]=4 4385 B7R1.2 O=C1COC(I)=N1 Amb29849639 [0,1,0,0,1,0|2,0,0]=4 4386 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [0,1,0,0,1,0|1,0,1]=4 4387 B7R1.2 O=C1CSC(=O)N1 Amb1853667 [0,1,0,0,1,0|2,0,0]=4 4388 B7R1.2 O=C1CSC(=O)[N-]1 Amb435911 [0,1,0,0,1,0|2,0,0]=4 4389 B7R1.2 O=C1CSC(=S)N1 Amb1008361 [0,1,0,0,1,0|2,0,0]=4 4390 B7R1.2 O=C1CSC(Br)=N1 Amb29850234 [0,1,0,0,1,0|2,0,0]=4 4391 B7R1.2 O=C1CSC(Cl)=N1 Amb29850164 [0,1,0,0,1,0|2,0,0]=4 4392 B7R1.2 O=C1CSC(S)=N1 Amb837069 [0,1,0,0,1,0|2,0,0]=4 4393 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [0,1,0,0,1,0|1,0,0]=3 4394 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [0,1,0,0,1,0|1,0,0]=3 4395 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,1,0,0,1,0|1,0,0]=3 4396 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [0,1,0,0,1,0|1,0,0]=3 4397 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [0,1,0,0,1,0|1,0,0]=3 4398 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,1,0,0,1,0|1,0,0]=3 4399 B7R1.2 O=C1NC(=S)CO1 Amb28384997 [0,1,0,0,1,0|2,0,0]=4 4400 B7R1.2 O=C1NC(=S)CS1 Amb2469502 [0,1,0,0,1,0|2,0,0]=4 4401 B7R1.2 O=C1NCC(=S)N1 Amb2794498 [0,1,0,0,1,0|2,0,0]=4 4402 B7R1.2 O=C1NCC(=S)S1 Amb27785367 [0,1,0,0,1,0|2,0,0]=4 4403 B7R1.2 O=C1OC(O)CS1 Amb28066979 [0,1,0,0,1,0|2,0,0]=4 4404 B7R1.2 O=C1OCC(Cl)O1 Amb10842117 [0,1,0,0,1,0|2,0,0]=4 4405 B7R1.2 O=C1OCC(F)O1 Amb10841016 [0,1,0,0,1,0|2,0,0]=4 4406 B7R1.2 O=S1CCC(Br)C1 Amb27872345 [0,1,0,0,1,0|1,0,1]=4 4407 B7R1.2 O=S1CCC(O)C1 Amb26600157 [0,1,0,0,1,0|1,0,1]=4 4408 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [0,1,0,0,1,0|1,0,1]=4 4409 B7R1.2 OC1C=C(Br)CC1 Amb8391790 [0,1,0,0,1,0|1,0,0]=3 4410 B7R1.2 OC1C=C(I)CC1 Amb26903566 [0,1,0,0,1,0|1,0,0]=3 4411 B7R1.2 OC1C=CC(F)C1 Amb27859641 [0,1,0,0,1,0|0,0,2]=4 4412 B7R1.2 OC1C=CC(O)C1 Amb4034755 [0,1,0,0,1,0|0,0,2]=4 4413 B7R1.2 OC1CC=C(Br)C1 Amb25662365 [0,1,0,0,1,0|1,0,0]=3 4414 B7R1.2 O[C@@H]1C=C(Br)CC1 Amb24479014 [0,1,0,0,1,0|1,0,0]=3 4415 B7R1.2 O[C@@H]1C=C[C@H](O)C1 Amb8395199 [0,1,0,0,1,0|0,0,2]=4 4416 B7R1.2 O[C@H]1C=C(Br)CC1 Amb27213930 [0,1,0,0,1,0|1,0,0]=3 4417 B7R1.2 O[C@H]1C=CC(Cl)C1 Amb28291629 [0,1,0,0,1,0|0,0,2]=4 4418 B7R1.2 S=C1CCC(=S)N1 Amb24479225 [0,1,0,0,1,0|1,1,0]=4 4419 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,1,0,0,1,0|1,0,0]=3 4420 B7R1.4 BrC1=C(Br)CCC1 Amb8389430 [0,1,0,0,1,0|1,0,0]=3 4421 B7R1.4 C=C1CCCC1=O Amb17593061 [0,1,0,0,1,0|0,0,0]=2 4422 B7R1.4 C=C1CCNC1=O Amb26415156 [0,1,0,0,1,0|1,0,0]=3 4423 B7R1.4 C=C1CCOC1=O Amb3941636 [0,1,0,0,1,0|1,0,0]=3 4424 B7R1.4 C=C1CNCC1=C Amb17593055 [0,1,0,0,1,0|2,0,0]=4 4425 B7R1.4 C=C1COCC1=C Amb27838190 [0,1,0,0,1,0|2,0,0]=4 4426 B7R1.4 CC1=C(Br)CCC1 Amb24479762 [0,1,0,0,1,0|1,0,0]=3 4427 B7R1.4 CC1=C(C)CCC1 Amb22227705 [0,1,0,0,1,0|1,0,0]=3 4428 B7R1.4 CC1=C(C)CNC1 Amb28326117 [0,1,0,0,1,0|2,0,0]=4 4429 B7R1.4 CC1=C(S)CCO1 Amb16232456 [0,1,0,0,1,0|1,1,0]=4 4430 B7R1.4 CC1=CCCC1=O Amb8514958 [0,1,0,0,1,0|0,0,0]=2 4431 B7R1.4 CC1=CCCC1C Amb24479857 [0,1,0,0,1,0|1,0,0]=3 4432 B7R1.4 CC1=CCCC1O Amb25220686 [0,1,0,0,1,0|1,0,0]=3 4433 B7R1.4 CC1=CCCN1C Amb17938859 [0,1,0,0,1,0|2,0,0]=4 4434 B7R1.4 CC1=CCN=C1C Amb27463558 [0,1,0,0,1,0|2,0,0]=4 4435 B7R1.4 CC1=CCNC1C Amb27975662 [0,1,0,0,1,0|2,0,0]=4 4436 B7R1.4 CC1=CCOC1=O Amb16231256 [0,1,0,0,1,0|1,0,0]=3 4437 B7R1.4 CC1=CCSC1=S Amb27633752 [0,1,0,0,1,0|1,1,0]=4 4438 B7R1.4 CC1C=CCC1C Amb27454828 [0,1,0,0,1,0|1,0,1]=4 4439 B7R1.4 CC1C=CCC1O Amb28324626 [0,1,0,0,1,0|1,0,1]=4 4440 B7R1.4 CC1C=COC1=O Amb27862334 [0,1,0,0,1,0|1,0,1]=4 4441 B7R1.4 CC1CCCC1=O Amb8514830 [0,1,0,0,1,0|0,0,1]=3 4442 B7R1.4 CC1CCCC1=S Amb27483022 [0,1,0,0,1,0|0,1,1]=4 4443 B7R1.4 CC1CCNC1=O Amb10603701 [0,1,0,0,1,0|1,0,0]=3 4444 B7R1.4 CC1CCOC1=O Amb16185414 [0,1,0,0,1,0|1,0,0]=3 4445 B7R1.4 CC1CNNC1=O Amb27228083 [0,1,0,0,1,0|2,0,0]=4 4446 B7R1.4 CC1COCC1=O Amb24333426 [0,1,0,0,1,0|1,0,1]=4 4447 B7R1.4 CC1CONC1=O Amb33714888 [0,1,0,0,1,0|2,0,0]=4 4448 B7R1.4 CC1CSCC1=O Amb21964769 [0,1,0,0,1,0|1,0,1]=4 4449 B7R1.4 CC1NC=CC1=O Amb28201187 [0,1,0,0,1,0|1,0,0]=3 4450 B7R1.4 CC1NCCC1=O Amb26950680 [0,1,0,0,1,0|1,0,1]=4 4451 B7R1.4 CC1NCCC1=O Amb32410228 [0,1,0,0,1,0|1,0,1]=4 4452 B7R1.4 CC1OC=CC1=O Amb28053998 [0,1,0,0,1,0|1,0,0]=3 4453 B7R1.4 CC1OCCC1=O Amb2725497 [0,1,0,0,1,0|1,0,1]=4 4454 B7R1.4 CC1OCNC1=O Amb28046854 [0,1,0,0,1,0|2,0,0]=4 4455 B7R1.4 CC1SCCC1=O Amb8392845 [0,1,0,0,1,0|1,0,1]=4 4456 B7R1.4 CC1SCNC1=O Amb27211661 [0,1,0,0,1,0|2,0,0]=4 4457 B7R1.4 CN1CC=CC1=N Amb27850064 [0,1,0,0,1,0|2,0,0]=4 4458 B7R1.4 CN1CC=CC1=O Amb22372248 [0,1,0,0,1,0|1,0,0]=3 4459 B7R1.4 CN1CCCC1=N Amb20669437 [0,1,0,0,1,0|2,0,0]=4 4460 B7R1.4 CN1CCCC1=O Amb22493780 [0,1,0,0,1,0|1,0,0]=3 4461 B7R1.4 CN1CCCC1=O Amb6608842 [0,1,0,0,1,0|1,0,0]=3 4462 B7R1.4 CN1CCCC1=S Amb10562641 [0,1,0,0,1,0|1,1,0]=4 4463 B7R1.4 CN1CCNC1=O Amb5718647 [0,1,0,0,1,0|2,0,0]=4 4464 B7R1.4 CN1CCOC1=O Amb22347786 [0,1,0,0,1,0|2,0,0]=4 4465 B7R1.4 CN1CNCC1=O Amb26582942 [0,1,0,0,1,0|2,0,0]=4 4466 B7R1.4 CN1CNCC1=O Amb28827643 [0,1,0,0,1,0|2,0,0]=4 4467 B7R1.4 CN1NC=CC1=O Amb22002214 [0,1,0,0,1,0|2,0,0]=4 4468 B7R1.4 CN1NCCC1=O Amb18559311 [0,1,0,0,1,0|2,0,0]=4 4469 B7R1.4 CN1SC=CC1=O Amb19133167 [0,1,0,0,1,0|2,0,0]=4 4470 B7R1.4 CN1SC=CC1=O Amb20239425 [0,1,0,0,1,0|2,0,0]=4 4471 B7R1.4 CN1SC=CC1=O Amb31289633 [0,1,0,0,1,0|2,0,0]=4 4472 B7R1.4 C[C@@H]1C=CC[C@H]1C Amb25957944 [0,1,0,0,1,0|1,0,1]=4 4473 B7R1.4 C[C@@H]1C=CC[C@H]1O Amb27486253 [0,1,0,0,1,0|1,0,1]=4 4474 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,1,0,0,1,0|1,0,0]=3 4475 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [0,1,0,0,1,0|1,0,1]=4 4476 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [0,1,0,0,1,0|0,0,1]=3 4477 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [0,1,0,0,1,0|1,0,0]=3 4478 B7R1.4 ClC1=CCCC1Cl Amb27262105 [0,1,0,0,1,0|1,0,0]=3 4479 B7R1.4 Cl[C@@H]1C=CC[C@H]1Br Amb28195658 [0,1,0,0,1,0|1,0,1]=4 4480 B7R1.4 Cl[C@H]1C=CC[C@H]1Cl Amb27202572 [0,1,0,0,1,0|1,0,1]=4 4481 B7R1.4 Cl[C@H]1CC=C[C@H]1Cl Amb28247222 [0,1,0,0,1,0|1,0,1]=4 4482 B7R1.4 NC1=CCOC1=O Amb22234102 [0,1,0,0,1,0|1,0,0]=3 4483 B7R1.4 NC1=CNNC1=O Amb24120355 [0,1,0,0,1,0|2,0,0]=4 4484 B7R1.4 NC1=CNNC1=O Amb28827627 [0,1,0,0,1,0|2,0,0]=4 4485 B7R1.4 NC1=CONC1=O Amb18203033 [0,1,0,0,1,0|2,0,0]=4 4486 B7R1.4 NC1C=CCC1O Amb18639380 [0,1,0,0,1,0|1,0,1]=4 4487 B7R1.4 NC1CCC=C1Br Amb33295394 [0,1,0,0,1,0|1,0,0]=3 4488 B7R1.4 NC1CCC=C1Br Amb33484034 [0,1,0,0,1,0|1,0,0]=3 4489 B7R1.4 NC1CCCC1=O Amb17939050 [0,1,0,0,1,0|0,0,1]=3 4490 B7R1.4 NC1CCCC1=O Amb28994832 [0,1,0,0,1,0|0,0,1]=3 4491 B7R1.4 NC1CCNC1=O Amb21955321 [0,1,0,0,1,0|1,0,0]=3 4492 B7R1.4 NC1CCNC1=O Amb6739903 [0,1,0,0,1,0|1,0,0]=3 4493 B7R1.4 NC1CCOC1=O Amb17614991 [0,1,0,0,1,0|1,0,0]=3 4494 B7R1.4 NC1CCOC1=O Amb6609049 [0,1,0,0,1,0|1,0,0]=3 4495 B7R1.4 NC1CCOC1=O Amb9761351 [0,1,0,0,1,0|1,0,0]=3 4496 B7R1.4 NC1CCSC1=O Amb1151877 [0,1,0,0,1,0|1,0,0]=3 4497 B7R1.4 NC1CCSC1=O Amb2720274 [0,1,0,0,1,0|1,0,0]=3 4498 B7R1.4 NC1COCC1=O Amb18202885 [0,1,0,0,1,0|1,0,1]=4 4499 B7R1.4 NC1COCC1=O Amb33328736 [0,1,0,0,1,0|1,0,1]=4 4500 B7R1.4 NC1CONC1=O Amb1865548 [0,1,0,0,1,0|2,0,0]=4 4501 B7R1.4 NC1CSCC1=O Amb18202693 [0,1,0,0,1,0|1,0,1]=4 4502 B7R1.4 NC1CSNC1=O Amb27435893 [0,1,0,0,1,0|2,0,0]=4 4503 B7R1.4 NN1CCCC1=O Amb8496496 [0,1,0,0,1,0|1,0,0]=3 4504 B7R1.4 NN1CCCC1=O Amb9174227 [0,1,0,0,1,0|1,0,0]=3 4505 B7R1.4 NN1CCNC1=O Amb5722000 [0,1,0,0,1,0|2,0,0]=4 4506 B7R1.4 NN1CCOC1=O Amb10068971 [0,1,0,0,1,0|2,0,0]=4 4507 B7R1.4 NN1CCOC1=O Amb33532698 [0,1,0,0,1,0|2,0,0]=4 4508 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [0,1,0,0,1,0|1,0,0]=3 4509 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [0,1,0,0,1,0|1,0,0]=3 4510 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [0,1,0,0,1,0|1,0,0]=3 4511 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,1,0,0,1,0|1,0,0]=3 4512 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [0,1,0,0,1,0|1,0,0]=3 4513 B7R1.4 N[C@@H]1CONC1=O Amb533888 [0,1,0,0,1,0|2,0,0]=4 4514 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [0,1,0,0,1,0|1,0,0]=3 4515 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [0,1,0,0,1,0|1,0,0]=3 4516 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [0,1,0,0,1,0|1,0,0]=3 4517 B7R1.4 N[C@H]1CCOC1=O Amb541960 [0,1,0,0,1,0|1,0,0]=3 4518 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [0,1,0,0,1,0|1,0,0]=3 4519 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [0,1,0,0,1,0|1,0,0]=3 4520 B7R1.4 N[C@H]1CCSC1=O Amb33758042 [0,1,0,0,1,0|1,0,0]=3 4521 B7R1.4 N[C@H]1CCSC1=O Amb8628572 [0,1,0,0,1,0|1,0,0]=3 4522 B7R1.4 N[C@H]1CNOC1=O Amb27778477 [0,1,0,0,1,0|2,0,0]=4 4523 B7R1.4 N[C@H]1CONC1=O Amb2719694 [0,1,0,0,1,0|2,0,0]=4 4524 B7R1.4 O=C1C=CC=C1Br Amb28435335 [0,1,0,0,1,0|0,0,2]=4 4525 B7R1.4 O=C1C=CC=C1O Amb27835626 [0,1,0,0,1,0|0,0,2]=4 4526 B7R1.4 O=C1C=CCC1Cl Amb27482393 [0,1,0,0,1,0|0,0,0]=2 4527 B7R1.4 O=C1C=CCN1O Amb28255915 [0,1,0,0,1,0|1,0,0]=3 4528 B7R1.4 O=C1C=CNC1=O Amb26887753 [0,1,0,0,1,0|1,0,1]=4 4529 B7R1.4 O=C1C=COC1O Amb27638452 [0,1,0,0,1,0|1,0,0]=3 4530 B7R1.4 O=C1CCC=C1Br Amb10067494 [0,1,0,0,1,0|0,0,0]=2 4531 B7R1.4 O=C1CCC=C1I Amb26585706 [0,1,0,0,1,0|0,0,0]=2 4532 B7R1.4 O=C1CCC=C1O Amb17593067 [0,1,0,0,1,0|0,0,0]=2 4533 B7R1.4 O=C1CCCC1=O Amb24053064 [0,1,0,0,1,0|0,0,0]=2 4534 B7R1.4 O=C1CCCC1Br Amb16234114 [0,1,0,0,1,0|0,0,1]=3 4535 B7R1.4 O=C1CCCC1Cl Amb3939970 [0,1,0,0,1,0|0,0,1]=3 4536 B7R1.4 O=C1CCCC1F Amb28050533 [0,1,0,0,1,0|0,0,1]=3 4537 B7R1.4 O=C1CCCC1I Amb25756212 [0,1,0,0,1,0|0,0,1]=3 4538 B7R1.4 O=C1CCCC1O Amb17593081 [0,1,0,0,1,0|0,0,1]=3 4539 B7R1.4 O=C1CCCC1S Amb27838260 [0,1,0,0,1,0|0,0,1]=3 4540 B7R1.4 O=C1CCCN1O Amb33484242 [0,1,0,0,1,0|1,0,0]=3 4541 B7R1.4 O=C1CCC[C@@H]1F Amb35788466 [0,1,0,0,1,0|0,0,1]=3 4542 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [0,1,0,0,1,0|0,0,1]=3 4543 B7R1.4 O=C1CCNC1=O Amb21858086 [0,1,0,0,1,0|1,0,0]=3 4544 B7R1.4 O=C1CCOC1=O Amb27849805 [0,1,0,0,1,0|1,0,0]=3 4545 B7R1.4 O=C1CNC=C1O Amb27962752 [0,1,0,0,1,0|1,0,0]=3 4546 B7R1.4 O=C1COC=C1O Amb27838226 [0,1,0,0,1,0|1,0,0]=3 4547 B7R1.4 O=C1N=NC=C1Cl Amb25836875 [0,1,0,0,1,0|2,0,0]=4 4548 B7R1.4 O=C1NCCC1Br Amb20623055 [0,1,0,0,1,0|1,0,0]=3 4549 B7R1.4 O=C1NCCC1Cl Amb28050511 [0,1,0,0,1,0|1,0,0]=3 4550 B7R1.4 O=C1NCCC1F Amb25838145 [0,1,0,0,1,0|1,0,0]=3 4551 B7R1.4 O=C1NCCC1O Amb10603089 [0,1,0,0,1,0|1,0,0]=3 4552 B7R1.4 O=C1NCCC1S Amb18202686 [0,1,0,0,1,0|1,0,0]=3 4553 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [0,1,0,0,1,0|1,0,0]=3 4554 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [0,1,0,0,1,0|1,0,0]=3 4555 B7R1.4 O=C1NOC=C1Br Amb24641631 [0,1,0,0,1,0|2,0,0]=4 4556 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,1,0,0,1,0|1,0,1]=4 4557 B7R1.4 O=C1OC=CC1S Amb27624883 [0,1,0,0,1,0|1,0,1]=4 4558 B7R1.4 O=C1OC=C[C@@H]1O Amb27472742 [0,1,0,0,1,0|1,0,1]=4 4559 B7R1.4 O=C1OCC=C1Br Amb10067498 [0,1,0,0,1,0|1,0,0]=3 4560 B7R1.4 O=C1OCC=C1Cl Amb23571857 [0,1,0,0,1,0|1,0,0]=3 4561 B7R1.4 O=C1OCC=C1F Amb28144969 [0,1,0,0,1,0|1,0,0]=3 4562 B7R1.4 O=C1OCCC1Br Amb3940058 [0,1,0,0,1,0|1,0,0]=3 4563 B7R1.4 O=C1OCCC1F Amb27642041 [0,1,0,0,1,0|1,0,0]=3 4564 B7R1.4 O=C1OCCC1I Amb24418518 [0,1,0,0,1,0|1,0,0]=3 4565 B7R1.4 O=C1OCCC1O Amb5718058 [0,1,0,0,1,0|1,0,0]=3 4566 B7R1.4 O=C1OCCC1S Amb25146639 [0,1,0,0,1,0|1,0,0]=3 4567 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [0,1,0,0,1,0|1,0,0]=3 4568 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [0,1,0,0,1,0|1,0,0]=3 4569 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [0,1,0,0,1,0|1,0,0]=3 4570 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [0,1,0,0,1,0|1,0,0]=3 4571 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [0,1,0,0,1,0|1,0,0]=3 4572 B7R1.4 O=C1OCNC1Br Amb25299209 [0,1,0,0,1,0|2,0,0]=4 4573 B7R1.4 O=C1SCC=C1Br Amb27462381 [0,1,0,0,1,0|1,0,0]=3 4574 B7R1.4 O=C1SCC[C@@H]1Br Amb27482200 [0,1,0,0,1,0|1,0,0]=3 4575 B7R1.4 O=S1CCCC1Br Amb28046103 [0,1,0,0,1,0|1,0,1]=4 4576 B7R1.4 O=S1CCCC1Cl Amb27796334 [0,1,0,0,1,0|1,0,1]=4 4577 B7R1.4 OC1C=CCC1O Amb17593080 [0,1,0,0,1,0|0,0,2]=4 4578 B7R1.4 OC1CCC=C1Br Amb24429462 [0,1,0,0,1,0|1,0,0]=3 4579 B7R1.4 OC1CCC=C1Cl Amb25202022 [0,1,0,0,1,0|1,0,0]=3 4580 B7R1.4 O[C@@H]1C=CC[C@H]1O Amb28139433 [0,1,0,0,1,0|0,0,2]=4 4581 B7R1.4 O[C@@H]1CCC=C1Cl Amb28340922 [0,1,0,0,1,0|1,0,0]=3 4582 B7R1.4 O[C@H]1C=CC[C@H]1O Amb24622453 [0,1,0,0,1,0|0,0,2]=4 4583 B7R1.4 S=C1SCC=C1Br Amb27438682 [0,1,0,0,1,0|1,1,0]=4 4584 B7R1.4 S=C1SCC=C1Cl Amb28323649 [0,1,0,0,1,0|1,1,0]=4 4585 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [0,1,0,0,1,0|1,0,0]=3 4586 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [0,1,0,0,1,0|1,0,0]=3 4587 B7R1.14 CC1(C)C=CCC1 Amb27471019 [0,1,0,0,1,0|1,0,1]=4 4588 B7R1.14 CP1(=O)C=CCC1 Amb27833507 [0,1,0,0,1,0|1,0,0]=3 4589 B7R1.14 CP1(=O)C=CCO1 Amb25345454 [0,1,0,0,1,0|2,0,0]=4 4590 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [0,1,0,0,1,0|1,0,1]=4 4591 B7R1.14 O=P1(F)C=CCC1 Amb35789660 [0,1,0,0,1,0|1,0,0]=3 4592 B7R1.14 O=S1(=O)C=CCC1 Amb1099221 [0,1,0,0,1,0|1,0,0]=3 4593 B7R1.14 O=S1(=O)C=CCN1 Amb25982784 [0,1,0,0,1,0|2,0,0]=4 4594 B7R1.14 O=S1(=O)C=CCO1 Amb19957378 [0,1,0,0,1,0|2,0,0]=4 4595 B7R1.14 O=S1(=O)CCC=N1 Amb21964374 [0,1,0,0,1,0|2,0,0]=4 4596 B7R1.14 O=S1(=O)CCCC1 Amb2973382 [0,1,0,0,1,0|1,0,1]=4 4597 B7R1.14 O=S1(=O)CCCN1 Amb6893202 [0,1,0,0,1,0|2,0,0]=4 4598 B7R1.14 O=S1(=O)CCCO1 Amb6608684 [0,1,0,0,1,0|2,0,0]=4 4599 B9R1.5 CC1=CC=CCCC1=O Amb27803075 [0,1,0,0,0,1|0,0,1]=3 4600 B9R1.5 CC1=CCC=CCC1O Amb27653215 [0,1,0,0,0,1|1,0,1]=4 4601 B9R1.5 CC1=CCCCCC1O Amb27184844 [0,1,0,0,0,1|0,0,2]=4 4602 B9R1.5 CC1C=CC=CCC1=O Amb27206986 [0,1,0,0,0,1|0,0,2]=4 4603 B9R1.5 CC1C=CCCCC1=O Amb27600759 [0,1,0,0,0,1|0,0,0]=2 4604 B9R1.5 CC1CCCC=CC1=O Amb27838624 [0,1,0,0,0,1|0,0,0]=2 4605 B9R1.5 CC1CCCCCC1=O Amb26348270 [0,1,0,0,0,1|0,0,2]=4 4606 B9R1.5 CC1CCNCCC1=O Amb22886271 [0,1,0,0,0,1|0,0,2]=4 4607 B9R1.5 CC1CNCCNC1=O Amb27228560 [0,1,0,0,0,1|1,0,1]=4 4608 B9R1.5 CC1CSC=CNC1=O Amb28183043 [0,1,0,0,0,1|1,0,0]=3 4609 B9R1.5 CC1NCCCNC1=O Amb33545017 [0,1,0,0,0,1|1,0,1]=4 4610 B9R1.5 CC1SCCCCC1=O Amb28048147 [0,1,0,0,0,1|0,0,2]=4 4611 B9R1.5 CN1CCCCCC1=O Amb2779825 [0,1,0,0,0,1|0,0,2]=4 4612 B9R1.5 CN1CCCNCC1=O Amb15690772 [0,1,0,0,0,1|1,0,1]=4 4613 B9R1.5 CN1CCCNCC1=O Amb21960817 [0,1,0,0,0,1|1,0,1]=4 4614 B9R1.5 CN1CCNCCC1=O Amb16231373 [0,1,0,0,0,1|1,0,1]=4 4615 B9R1.5 CN1CCNCCC1=O Amb21959037 [0,1,0,0,0,1|1,0,1]=4 4616 B9R1.5 CN1CCNCCC1=O Amb28934999 [0,1,0,0,0,1|1,0,1]=4 4617 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [0,1,0,0,0,1|0,0,2]=4 4618 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [0,1,0,0,0,1|1,0,1]=4 4619 B9R1.5 C[C@H]1C=CCCC[C@@H]1O Amb27852529 [0,1,0,0,0,1|0,0,2]=4 4620 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [0,1,0,0,0,1|1,0,1]=4 4621 B9R1.5 ClC1=COCCOC1Cl Amb28366955 [0,1,0,0,0,1|2,0,0]=4 4622 B9R1.5 NC1CCCC=CC1O Amb27209173 [0,1,0,0,0,1|0,0,2]=4 4623 B9R1.5 NC1CCCCC=C1Br Amb27747172 [0,1,0,0,0,1|1,0,1]=4 4624 B9R1.5 NC1CCCCCC1=O Amb18276126 [0,1,0,0,0,1|0,0,2]=4 4625 B9R1.5 NC1CCCCCC1=O Amb28934932 [0,1,0,0,0,1|0,0,2]=4 4626 B9R1.5 NC1CCCCNC1=O Amb19958477 [0,1,0,0,0,1|0,0,2]=4 4627 B9R1.5 NC1CCCCNC1=O Amb9721937 [0,1,0,0,0,1|0,0,2]=4 4628 B9R1.5 NC1CSCCNC1=O Amb25336468 [0,1,0,0,0,1|1,0,1]=4 4629 B9R1.5 NC1CSCCNC1=O Amb32412582 [0,1,0,0,0,1|1,0,1]=4 4630 B9R1.5 NN1CCCCCC1=O Amb22495331 [0,1,0,0,0,1|0,0,2]=4 4631 B9R1.5 N[C@@H]1CCCCNC1=O Amb10608775 [0,1,0,0,0,1|0,0,2]=4 4632 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [0,1,0,0,0,1|0,0,2]=4 4633 B9R1.5 N[C@@H]1CSCCNC1=O Amb19374458 [0,1,0,0,0,1|1,0,1]=4 4634 B9R1.5 N[C@@H]1CSCCNC1=O Amb32414615 [0,1,0,0,0,1|1,0,1]=4 4635 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [0,1,0,0,0,1|0,0,2]=4 4636 B9R1.5 N[C@H]1CCCCNC1=O Amb532926 [0,1,0,0,0,1|0,0,2]=4 4637 B9R1.5 N[C@H]1COCCNC1=O Amb27234381 [0,1,0,0,0,1|1,0,1]=4 4638 B9R1.5 N[C@H]1CSCCNC1=O Amb10067826 [0,1,0,0,0,1|1,0,1]=4 4639 B9R1.5 O=C1C=CC=CCC1=O Amb25319856 [0,1,0,0,0,1|0,0,2]=4 4640 B9R1.5 O=C1C=CCCCC1O Amb27838742 [0,1,0,0,0,1|0,0,0]=2 4641 B9R1.5 O=C1CCCCC=C1Br Amb27482990 [0,1,0,0,0,1|0,0,0]=2 4642 B9R1.5 O=C1CCCCC=C1F Amb27835100 [0,1,0,0,0,1|0,0,0]=2 4643 B9R1.5 O=C1CCCCCC1=O Amb17593310 [0,1,0,0,0,1|0,0,1]=3 4644 B9R1.5 O=C1CCCCCC1Br Amb18325296 [0,1,0,0,0,1|0,0,2]=4 4645 B9R1.5 O=C1CCCCCC1Cl Amb6892055 [0,1,0,0,0,1|0,0,2]=4 4646 B9R1.5 O=C1CCCCCC1F Amb21965071 [0,1,0,0,0,1|0,0,2]=4 4647 B9R1.5 O=C1CCCCCC1O Amb25284997 [0,1,0,0,0,1|0,0,2]=4 4648 B9R1.5 O=C1CCCCCC1S Amb28199868 [0,1,0,0,0,1|0,0,2]=4 4649 B9R1.5 O=C1CCCCCN1Br Amb9786551 [0,1,0,0,0,1|0,0,2]=4 4650 B9R1.5 O=C1CCCCCN1Cl Amb10572732 [0,1,0,0,0,1|0,0,2]=4 4651 B9R1.5 O=C1CCCCOC1=O Amb27227093 [0,1,0,0,0,1|0,0,1]=3 4652 B9R1.5 O=C1CCCNCC1F Amb22886244 [0,1,0,0,0,1|0,0,2]=4 4653 B9R1.5 O=C1CCNCCC1=O Amb32415899 [0,1,0,0,0,1|0,0,1]=3 4654 B9R1.5 O=C1CCNCCC1Br Amb27201712 [0,1,0,0,0,1|0,0,2]=4 4655 B9R1.5 O=C1CCNCCC1Br Amb33621267 [0,1,0,0,0,1|0,0,2]=4 4656 B9R1.5 O=C1CCNCCC1F Amb22886247 [0,1,0,0,0,1|0,0,2]=4 4657 B9R1.5 O=C1CCOCCC1=O Amb32642050 [0,1,0,0,0,1|0,0,1]=3 4658 B9R1.5 O=C1CCSCCC1=O Amb32642055 [0,1,0,0,0,1|0,0,1]=3 4659 B9R1.5 O=C1CNCCCC1F Amb22886238 [0,1,0,0,0,1|0,0,2]=4 4660 B9R1.5 O=C1NCCCCC1Br Amb9781677 [0,1,0,0,0,1|0,0,2]=4 4661 B9R1.5 O=C1NCCCCC1Cl Amb27815034 [0,1,0,0,0,1|0,0,2]=4 4662 B9R1.5 O=C1NCCCCC1I Amb35751097 [0,1,0,0,0,1|0,0,2]=4 4663 B9R1.5 O=C1NCCSC=C1Cl Amb28198770 [0,1,0,0,0,1|1,0,0]=3 4664 B9R1.5 OC1CCCCC=C1Br Amb27604372 [0,1,0,0,0,1|0,0,2]=4 4665 B9R1.5 OC1CCCCC=C1Cl Amb28185035 [0,1,0,0,0,1|0,0,2]=4 4666 B9R1.5 O[C@@H]1C=CCCC[C@H]1O Amb27184263 [0,1,0,0,0,1|0,0,2]=4 4667 B9R1.5 O[C@@H]1CC=CCC[C@H]1O Amb27873382 [0,1,0,0,0,1|0,0,2]=4 4668 B9R1.5 O[C@H]1C=CCCC[C@@H]1O Amb28428672 [0,1,0,0,0,1|0,0,2]=4 4669 B9R1.48 C=C1C=CCCC(O)C1 Amb28065207 [0,1,0,0,0,1|1,0,0]=3 4670 B9R1.48 CC1=CC(=O)CCCC1 Amb17593284 [0,1,0,0,0,1|0,0,0]=2 4671 B9R1.48 CC1=CC(=O)NCCO1 Amb24451309 [0,1,0,0,0,1|1,0,0]=3 4672 B9R1.48 CC1=CC(C)=NCCN1 Amb5559692 [0,1,0,0,0,1|2,0,0]=4 4673 B9R1.48 CC1=CC(Cl)CCCC1 Amb27469441 [0,1,0,0,0,1|1,0,1]=4 4674 B9R1.48 CC1=CC(N)CCCC1 Amb28040829 [0,1,0,0,0,1|1,0,1]=4 4675 B9R1.48 CC1=CCCCC(C)=C1 Amb22365190 [0,1,0,0,0,1|1,0,0]=3 4676 B9R1.48 CC1=NCCNC(=O)C1 Amb28187399 [0,1,0,0,0,1|1,0,1]=4 4677 B9R1.48 CC1CC(=O)NCCN1 Amb18832620 [0,1,0,0,0,1|1,0,1]=4 4678 B9R1.48 CC1CC(=O)NCCO1 Amb27244386 [0,1,0,0,0,1|1,0,1]=4 4679 B9R1.48 CC1CC(=O)NCCS1 Amb22642277 [0,1,0,0,0,1|1,0,1]=4 4680 B9R1.48 CC1CCC=CC(=O)C1 Amb28460736 [0,1,0,0,0,1|0,0,0]=2 4681 B9R1.48 CC1CCC=CC(O)C1 Amb28400665 [0,1,0,0,0,1|0,0,2]=4 4682 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,0,0,1|0,0,2]=4 4683 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [0,1,0,0,0,1|0,0,2]=4 4684 B9R1.48 CC1CCCCC(=O)O1 Amb27792220 [0,1,0,0,0,1|0,0,2]=4 4685 B9R1.48 CC1CCCNC(=O)C1 Amb28364919 [0,1,0,0,0,1|0,0,2]=4 4686 B9R1.48 CC1CNCCC(=O)N1 Amb27838526 [0,1,0,0,0,1|1,0,1]=4 4687 B9R1.48 CC1COCCC(=O)N1 Amb28123242 [0,1,0,0,0,1|1,0,1]=4 4688 B9R1.48 CC1CSCCC(=O)N1 Amb27253792 [0,1,0,0,0,1|1,0,1]=4 4689 B9R1.48 CN1CCCNC(=O)C1 Amb28282218 [0,1,0,0,0,1|1,0,1]=4 4690 B9R1.48 C[C@@H]1CC(=O)NCCN1 Amb26457829 [0,1,0,0,0,1|1,0,1]=4 4691 B9R1.48 C[C@@H]1CCCCC(=O)C1 Amb26030783 [0,1,0,0,0,1|0,0,2]=4 4692 B9R1.48 C[C@@H]1CCCNC(=O)C1 Amb28241573 [0,1,0,0,0,1|0,0,2]=4 4693 B9R1.48 C[C@H]1CCCNC(=O)C1 Amb27174761 [0,1,0,0,0,1|0,0,2]=4 4694 B9R1.48 NC1=NC(=O)NCC=C1 Amb27470905 [0,1,0,0,0,1|1,0,1]=4 4695 B9R1.48 O=C1C=CC=CC(O)C1 Amb28430523 [0,1,0,0,0,1|0,0,1]=3 4696 B9R1.48 O=C1C=CCC[C@H](O)C1 Amb27838758 [0,1,0,0,0,1|0,0,0]=2 4697 B9R1.48 O=C1CCCCC(=O)C1 Amb10603368 [0,1,0,0,0,1|0,0,1]=3 4698 B9R1.48 O=C1CCCCC(=O)N1 Amb8439258 [0,1,0,0,0,1|0,0,1]=3 4699 B9R1.48 O=C1CCCCC(=O)O1 Amb8487366 [0,1,0,0,0,1|0,0,1]=3 4700 B9R1.48 O=C1CCCCC(=S)N1 Amb24374795 [0,1,0,0,0,1|0,0,1]=3 4701 B9R1.48 O=C1CCCCC(O)C1 Amb27838745 [0,1,0,0,0,1|0,0,2]=4 4702 B9R1.48 O=C1CCCCC(O)O1 Amb27424648 [0,1,0,0,0,1|0,0,2]=4 4703 B9R1.48 O=C1CCCC[C@H](O)C1 Amb27618242 [0,1,0,0,0,1|0,0,2]=4 4704 B9R1.48 O=C1CCCNC(=O)C1 Amb18832700 [0,1,0,0,0,1|0,0,1]=3 4705 B9R1.48 O=C1CCCSC(=S)N1 Amb27202292 [0,1,0,0,0,1|1,0,0]=3 4706 B9R1.48 OC1C=C(Br)CCCC1 Amb28455049 [0,1,0,0,0,1|0,0,2]=4 4707 B9R1.49 C=C1CCCC(=O)NC1 Amb27252961 [0,1,0,0,0,1|0,0,1]=3 4708 B9R1.49 CC1=CCC(=O)CCC1 Amb27838790 [0,1,0,0,0,1|0,0,0]=2 4709 B9R1.49 CC1=CCC(O)CC=C1 Amb28123967 [0,1,0,0,0,1|1,0,0]=3 4710 B9R1.49 CC1=CCCC(=O)CC1 Amb27948552 [0,1,0,0,0,1|0,0,2]=4 4711 B9R1.49 CC1C=CC(Cl)CCC1 Amb27179881 [0,1,0,0,0,1|1,0,1]=4 4712 B9R1.49 CC1C=CC(O)CCC1 Amb27599988 [0,1,0,0,0,1|0,0,2]=4 4713 B9R1.49 CC1CC=CC(=O)CC1 Amb27838660 [0,1,0,0,0,1|0,0,0]=2 4714 B9R1.49 CC1CCCC(=O)CC1 Amb27265770 [0,1,0,0,0,1|0,0,2]=4 4715 B9R1.49 CC1CCNC(=O)CC1 Amb9316850 [0,1,0,0,0,1|0,0,2]=4 4716 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,1,0,0,0,1|0,0,2]=4 4717 B9R1.49 CC1CNC(=O)CCN1 Amb10607813 [0,1,0,0,0,1|1,0,1]=4 4718 B9R1.49 CC1CNC(=O)CCN1 Amb22587019 [0,1,0,0,0,1|1,0,1]=4 4719 B9R1.49 CN1CCCC(=O)CC1 Amb8383587 [0,1,0,0,0,1|0,0,2]=4 4720 B9R1.49 CN1CCCC(=O)CC1 Amb8394679 [0,1,0,0,0,1|0,0,2]=4 4721 B9R1.49 CN1CCNC(=O)CC1 Amb21857545 [0,1,0,0,0,1|1,0,1]=4 4722 B9R1.49 CN1CCNC(=O)CC1 Amb8393772 [0,1,0,0,0,1|1,0,1]=4 4723 B9R1.49 C[C@@H]1C=C[C@@H](O)CCC1 Amb27220561 [0,1,0,0,0,1|0,0,2]=4 4724 B9R1.49 C[C@@H]1CC=C[C@@H](Cl)CC1 Amb27472012 [0,1,0,0,0,1|1,0,1]=4 4725 B9R1.49 C[C@@H]1CC=C[C@H](Cl)CC1 Amb27232720 [0,1,0,0,0,1|1,0,1]=4 4726 B9R1.49 C[C@@H]1CCCC(=O)CC1 Amb26483475 [0,1,0,0,0,1|0,0,2]=4 4727 B9R1.49 C[C@@H]1CCCC(=O)NC1 Amb27814970 [0,1,0,0,0,1|0,0,2]=4 4728 B9R1.49 C[C@H]1C=C[C@H](Cl)CCC1 Amb27629772 [0,1,0,0,0,1|1,0,1]=4 4729 B9R1.49 C[C@H]1CCCC(=O)CC1 Amb28199901 [0,1,0,0,0,1|0,0,2]=4 4730 B9R1.49 NC1CCCC(=O)NC1 Amb22230053 [0,1,0,0,0,1|0,0,2]=4 4731 B9R1.49 NC1CCCC(=O)NC1 Amb27867752 [0,1,0,0,0,1|0,0,2]=4 4732 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,1,0,0,0,1|0,0,2]=4 4733 B9R1.49 NC1CCNC(=O)CC1 Amb32663578 [0,1,0,0,0,1|0,0,2]=4 4734 B9R1.49 NC1CCNC(=O)CC1 Amb32663872 [0,1,0,0,0,1|0,0,2]=4 4735 B9R1.49 O=C1C=CC(=O)CCC1 Amb28351041 [0,1,0,0,0,1|0,0,0]=2 4736 B9R1.49 O=C1CCC(=O)COC1 Amb2707216 [0,1,0,0,0,1|1,0,1]=4 4737 B9R1.49 O=C1CCC(Cl)CCN1 Amb27768772 [0,1,0,0,0,1|0,0,2]=4 4738 B9R1.49 O=C1CCC(O)CCN1 Amb26443713 [0,1,0,0,0,1|0,0,2]=4 4739 B9R1.49 O=C1CCC(O)CCO1 Amb23598292 [0,1,0,0,0,1|0,0,2]=4 4740 B9R1.49 O=C1CCCC(O)CN1 Amb22491274 [0,1,0,0,0,1|0,0,2]=4 4741 B9R1.49 O=C1CCCC(O)CO1 Amb28138759 [0,1,0,0,0,1|0,0,2]=4 4742 B9R1.49 O=C1CCCS(=O)CC1 Amb26476534 [0,1,0,0,0,1|0,0,2]=4 4743 B9R1.49 O=C1CCC[C@H](O)CC1 Amb27838657 [0,1,0,0,0,1|0,0,2]=4 4744 B9R1.49 O=C1CCNC(=O)CC1 Amb22490261 [0,1,0,0,0,1|1,0,1]=4 4745 B9R1.49 O=C1CCS(=O)CCN1 Amb26480169 [0,1,0,0,0,1|1,0,1]=4 4746 B9R1.49 O=C1CC[C@@H](Br)CCO1 Amb27447872 [0,1,0,0,0,1|0,0,2]=4 4747 B9R1.49 O=C1CC[C@H](Br)CCO1 Amb28458370 [0,1,0,0,0,1|0,0,2]=4 4748 B9R1.49 O=C1CNCC(O)CN1 Amb27838571 [0,1,0,0,0,1|1,0,1]=4 4749 B9R1.49 O=C1COC(=O)CCN1 Amb27168286 [0,1,0,0,0,1|1,0,1]=4 4750 B9R1.49 O=C1NC=CC(O)CN1 Amb27409827 [0,1,0,0,0,1|1,0,0]=3 4751 B9R1.89 BrCC1C=CCCCC1 Amb33329273 [0,1,0,0,0,1|1,0,1]=4 4752 B9R1.89 C#CC1=CCCCCC1 Amb17689256 [0,1,0,0,0,1|1,0,1]=4 4753 B9R1.89 C=CC1=CCCCCC1 Amb28245546 [0,1,0,0,0,1|1,0,1]=4 4754 B9R1.89 COC1=CCCCCC1 Amb26014503 [0,1,0,0,0,1|0,0,2]=4 4755 B9R1.89 CSC1=CCCCCN1 Amb27395313 [0,1,0,0,0,1|0,1,1]=4 4756 B9R1.89 N#CC1=CCCCCC1 Amb4016990 [0,1,0,0,0,1|1,0,1]=4 4757 B9R1.89 NCC1=CCCCCC1 Amb27403312 [0,1,0,0,0,1|1,0,1]=4 4758 B9R1.89 NCC1C=CCCCC1 Amb28184480 [0,1,0,0,0,1|1,0,1]=4 4759 B9R1.89 NCC1C=CCCCC1 Amb33744094 [0,1,0,0,0,1|1,0,1]=4 4760 B9R1.89 O=CC1=CC=CC=CC1 Amb17593229 [0,1,0,0,0,1|0,0,2]=4 4761 B9R1.89 O=CC1=CCC=CC=C1 Amb27955933 [0,1,0,0,0,1|0,0,2]=4 4762 B9R1.89 O=CC1=CCCCCC1 Amb9790320 [0,1,0,0,0,1|0,0,1]=3 4763 B9R1.89 O=CC1=CSCCCS1 Amb28197267 [0,1,0,0,0,1|1,0,0]=3 4764 B9R1.89 O=C[C@H]1C=CCC=CC1 Amb27876323 [0,1,0,0,0,1|0,0,2]=4 4765 B9R1.89 O=S=C1CCCCCN1 Amb28313706 [0,1,0,0,0,1|0,0,2]=4 4766 B9R1.89 OCC1=CCC=CCC1 Amb28315414 [0,1,0,0,0,1|0,0,2]=4 4767 B9R1.89 OCC1=CCCCCC1 Amb27424682 [0,1,0,0,0,1|0,0,2]=4 4768 B9R1.89 OCC1C=CCCCC1 Amb27662352 [0,1,0,0,0,1|0,0,2]=4 4769 B9R1.148 O=S1(=O)C=CCCC=C1 Amb22365010 [0,1,0,0,0,1|1,0,1]=4 4770 B9R1.1 C#CC1=CCC(=O)CC1 Amb28249288 [0,2,0,0,0,0|0,0,2]=4 4771 B9R1.1 C#CC1=CCC(N)CC1 Amb27873147 [0,2,0,0,0,0|1,0,1]=4 4772 B9R1.1 C#CC1=CCC(O)CC1 Amb27397129 [0,2,0,0,0,0|1,0,1]=4 4773 B9R1.1 C#CC1CCC(=O)CC1 Amb27807116 [0,2,0,0,0,0|0,0,2]=4 4774 B9R1.1 C=CC1=CCC(N)CC1 Amb28366097 [0,2,0,0,0,0|1,0,1]=4 4775 B9R1.1 C=CC1=CCC(O)CC1 Amb28350279 [0,2,0,0,0,0|1,0,1]=4 4776 B9R1.1 C=C[C@@H]1C=C[C@@H](O)CC1 Amb27431403 [0,2,0,0,0,0|0,0,2]=4 4777 B9R1.1 CC1=CCC(C=O)CC1 Amb614508 [0,2,0,0,0,0|1,0,1]=4 4778 B9R1.1 CC1=CCC(CO)CC1 Amb2699906 [0,2,0,0,0,0|1,0,1]=4 4779 B9R1.1 CC1CC=C(C#N)CC1 Amb18642016 [0,2,0,0,0,0|1,0,1]=4 4780 B9R1.1 CCC1=CCC(N)CC1 Amb27229710 [0,2,0,0,0,0|1,0,1]=4 4781 B9R1.1 CCC1=CCC(O)CC1 Amb27618200 [0,2,0,0,0,0|1,0,1]=4 4782 B9R1.1 CCC1C=CC(=O)CC1 Amb26870913 [0,2,0,0,0,0|0,0,0]=2 4783 B9R1.1 CCC1CCC(=O)CC1 Amb6296028 [0,2,0,0,0,0|0,0,2]=4 4784 B9R1.1 CC[C@@H]1C=C[C@H](O)CC1 Amb27443552 [0,2,0,0,0,0|0,0,2]=4 4785 B9R1.1 CNC1CCC(=O)CC1 Amb10602371 [0,2,0,0,0,0|0,0,2]=4 4786 B9R1.1 CNC1CCC(=O)CC1 Amb22170247 [0,2,0,0,0,0|0,0,2]=4 4787 B9R1.1 CNC1CCC(=O)NC1 Amb28047809 [0,2,0,0,0,0|1,0,1]=4 4788 B9R1.1 CN[C@@H]1CC=C(C)CC1 Amb28049919 [0,2,0,0,0,0|1,0,1]=4 4789 B9R1.1 COC1=CCC(O)CC1 Amb21858056 [0,2,0,0,0,0|0,0,2]=4 4790 B9R1.1 COC1C=CC(=O)CC1 Amb27256443 [0,2,0,0,0,0|0,0,0]=2 4791 B9R1.1 COC1C=CC(=O)CO1 Amb24713481 [0,2,0,0,0,0|1,0,0]=3 4792 B9R1.1 COC1C=CC(Cl)CC1 Amb28285275 [0,2,0,0,0,0|0,0,2]=4 4793 B9R1.1 COC1C=CC(O)CC1 Amb27790233 [0,2,0,0,0,0|0,0,2]=4 4794 B9R1.1 COC1CC=C(C)CC1 Amb25279365 [0,2,0,0,0,0|1,0,1]=4 4795 B9R1.1 COC1CCC(=O)CC1 Amb2385260 [0,2,0,0,0,0|0,0,2]=4 4796 B9R1.1 COC1CCC(=O)CO1 Amb27265592 [0,2,0,0,0,0|1,0,1]=4 4797 B9R1.1 CO[C@@H]1C=CC(=O)CO1 Amb27265732 [0,2,0,0,0,0|1,0,0]=3 4798 B9R1.1 CO[C@@H]1C=C[C@H](O)CC1 Amb28077905 [0,2,0,0,0,0|0,0,2]=4 4799 B9R1.1 CO[C@@H]1CCC(=O)CO1 Amb27659850 [0,2,0,0,0,0|1,0,1]=4 4800 B9R1.1 CSC1C=CC(=O)CC1 Amb27211800 [0,2,0,0,0,0|0,0,0]=2 4801 B9R1.1 CSC1C=CC(F)CC1 Amb25888675 [0,2,0,0,0,0|0,1,1]=4 4802 B9R1.1 CS[C@H]1C=C[C@@H](F)CC1 Amb28239990 [0,2,0,0,0,0|0,1,1]=4 4803 B9R1.1 N#CC1=CCC(=O)CC1 Amb27588804 [0,2,0,0,0,0|0,0,2]=4 4804 B9R1.1 N#CC1CC=C(F)CC1 Amb22753713 [0,2,0,0,0,0|1,0,1]=4 4805 B9R1.1 N#CC1CCC(=O)CC1 Amb16231535 [0,2,0,0,0,0|0,0,2]=4 4806 B9R1.1 N#CC1CCC(=O)CS1 Amb23596953 [0,2,0,0,0,0|1,0,1]=4 4807 B9R1.1 NCC1CCC(=O)CC1 Amb31307747 [0,2,0,0,0,0|0,0,2]=4 4808 B9R1.1 NCC1CCC(=O)NC1 Amb18832607 [0,2,0,0,0,0|1,0,1]=4 4809 B9R1.1 NCC1CCC(=O)NC1 Amb32653087 [0,2,0,0,0,0|1,0,1]=4 4810 B9R1.1 NCC1CCC(=O)NC1 Amb32653107 [0,2,0,0,0,0|1,0,1]=4 4811 B9R1.1 NCC1CCC(=O)NC1 Amb35748141 [0,2,0,0,0,0|1,0,1]=4 4812 B9R1.1 N[C@@H]1C=C[C@H](CO)CC1 Amb24649717 [0,2,0,0,0,0|0,0,2]=4 4813 B9R1.1 N[C@H]1C=C[C@@H](CO)CC1 Amb24443345 [0,2,0,0,0,0|0,0,2]=4 4814 B9R1.1 O=C1C=C[C@@H](CO)CC1 Amb27838659 [0,2,0,0,0,0|0,0,0]=2 4815 B9R1.1 O=C1CC=C(CO)CC1 Amb28253672 [0,2,0,0,0,0|0,0,2]=4 4816 B9R1.1 O=C1CCC(CBr)CC1 Amb26583100 [0,2,0,0,0,0|0,0,2]=4 4817 B9R1.1 O=C1CCC(CBr)CN1 Amb23597460 [0,2,0,0,0,0|1,0,1]=4 4818 B9R1.1 O=C1CCC(CCl)CC1 Amb27196238 [0,2,0,0,0,0|0,0,2]=4 4819 B9R1.1 O=C1CCC(CO)CC1 Amb10071596 [0,2,0,0,0,0|0,0,2]=4 4820 B9R1.1 O=C1CCC(CO)CN1 Amb19958990 [0,2,0,0,0,0|1,0,1]=4 4821 B9R1.1 O=CC1C=CC(=O)C=C1 Amb28126595 [0,2,0,0,0,0|0,0,2]=4 4822 B9R1.1 O=CC1CC=C(Cl)CC1 Amb18124712 [0,2,0,0,0,0|1,0,1]=4 4823 B9R1.1 O=CC1CCC(=O)CC1 Amb8385725 [0,2,0,0,0,0|0,0,2]=4 4824 B9R1.1 OCC1=CCC(O)CC1 Amb28206504 [0,2,0,0,0,0|0,0,2]=4 4825 B9R1.1 OCC1CC=C(O)CC1 Amb27465669 [0,2,0,0,0,0|0,0,2]=4 4826 B9R1.1 ONC1C=CC(O)CC1 Amb27229210 [0,2,0,0,0,0|0,0,2]=4 4827 B9R1.1 O\N=C1/C=CC(Cl)CC1 Amb27232636 [0,2,0,0,0,0|0,0,1]=3 4828 B9R1.2 C#CC1=CC(=O)CCC1 Amb27838728 [0,2,0,0,0,0|0,0,0]=2 4829 B9R1.2 C#CC1CCCC(=O)C1 Amb26842390 [0,2,0,0,0,0|0,0,2]=4 4830 B9R1.2 C#CC1CCCC(=O)N1 Amb27211198 [0,2,0,0,0,0|1,0,1]=4 4831 B9R1.2 C#C[C@H]1CCCC(=O)N1 Amb27863767 [0,2,0,0,0,0|1,0,1]=4 4832 B9R1.2 C=C1C=C(C=O)CCC1 Amb27955260 [0,2,0,0,0,0|0,0,0]=2 4833 B9R1.2 C=C1C=C(OC)CCC1 Amb27423877 [0,2,0,0,0,0|0,0,1]=3 4834 B9R1.2 C=C1CCCN(C=O)C1 Amb29883056 [0,2,0,0,0,0|1,0,1]=4 4835 B9R1.2 C=CC1=CC(=O)CCC1 Amb25134896 [0,2,0,0,0,0|0,0,0]=2 4836 B9R1.2 C=CC1=CCCC(=O)N1 Amb28067811 [0,2,0,0,0,0|1,0,1]=4 4837 B9R1.2 C=CC1=CCCC(O)C1 Amb28315534 [0,2,0,0,0,0|1,0,1]=4 4838 B9R1.2 C=CC1=C[C@H](O)CCC1 Amb28049203 [0,2,0,0,0,0|0,0,2]=4 4839 B9R1.2 C=CC1CC(=O)C=CO1 Amb22748833 [0,2,0,0,0,0|1,0,0]=3 4840 B9R1.2 C=CC1CC=CC(O)C1 Amb27956505 [0,2,0,0,0,0|0,0,2]=4 4841 B9R1.2 C=CC1CCCC(=O)C1 Amb28250679 [0,2,0,0,0,0|0,0,2]=4 4842 B9R1.2 C=CC1CCCC(=O)N1 Amb26036889 [0,2,0,0,0,0|1,0,1]=4 4843 B9R1.2 C=CN1CCCC(=O)C1 Amb25887409 [0,2,0,0,0,0|1,0,1]=4 4844 B9R1.2 C=C[C@@H]1CC=C[C@@H](O)C1 Amb27981632 [0,2,0,0,0,0|0,0,2]=4 4845 B9R1.2 CC1C=C(C=O)CCC1 Amb4035517 [0,2,0,0,0,0|0,0,1]=3 4846 B9R1.2 CCC1=CC(=O)CCC1 Amb27599813 [0,2,0,0,0,0|0,0,0]=2 4847 B9R1.2 CCC1=CC(=O)CCN1 Amb27595544 [0,2,0,0,0,0|1,0,0]=3 4848 B9R1.2 CCC1=CC(=O)CSC1 Amb27838665 [0,2,0,0,0,0|1,0,0]=3 4849 B9R1.2 CCC1=CC(N)CCC1 Amb27173637 [0,2,0,0,0,0|1,0,1]=4 4850 B9R1.2 CCC1=C[C@H](O)CCC1 Amb28064187 [0,2,0,0,0,0|0,0,2]=4 4851 B9R1.2 CCC1CC(=O)C=CN1 Amb28285113 [0,2,0,0,0,0|1,0,0]=3 4852 B9R1.2 CCC1CC(=O)C=CO1 Amb28076224 [0,2,0,0,0,0|1,0,0]=3 4853 B9R1.2 CCC1CC=CC(=O)O1 Amb27480728 [0,2,0,0,0,0|1,0,0]=3 4854 B9R1.2 CCC1CCCC(=O)C1 Amb19335038 [0,2,0,0,0,0|0,0,2]=4 4855 B9R1.2 CCC1CCCC(=O)N1 Amb13883424 [0,2,0,0,0,0|1,0,1]=4 4856 B9R1.2 CCC1CCCC(=O)O1 Amb27242548 [0,2,0,0,0,0|1,0,1]=4 4857 B9R1.2 CCC1CCNC(=O)C1 Amb25791122 [0,2,0,0,0,0|1,0,1]=4 4858 B9R1.2 CCN1CCCC(=O)C1 Amb23440927 [0,2,0,0,0,0|1,0,1]=4 4859 B9R1.2 CCN1CCCC(=O)C1 Amb9825829 [0,2,0,0,0,0|1,0,1]=4 4860 B9R1.2 CC[C@@H]1CC=CC(=O)C1 Amb27828949 [0,2,0,0,0,0|0,0,0]=2 4861 B9R1.2 CC[C@H]1CC=CC(=O)C1 Amb28461147 [0,2,0,0,0,0|0,0,0]=2 4862 B9R1.2 CC[C@H]1CCCC(=O)N1 Amb28049339 [0,2,0,0,0,0|1,0,1]=4 4863 B9R1.2 CN1CCC=C(C=O)C1 Amb17593300 [0,2,0,0,0,0|1,0,1]=4 4864 B9R1.2 CNC1=CC(=O)CCC1 Amb2386653 [0,2,0,0,0,0|0,0,0]=2 4865 B9R1.2 CNC1CCC=C(C)C1 Amb27752187 [0,2,0,0,0,0|1,0,1]=4 4866 B9R1.2 COC1=CC(=O)CCC1 Amb19930192 [0,2,0,0,0,0|0,0,0]=2 4867 B9R1.2 COC1=CC(=O)NCC1 Amb27174359 [0,2,0,0,0,0|1,0,0]=3 4868 B9R1.2 COC1=CC(=O)SCC1 Amb27438098 [0,2,0,0,0,0|1,0,0]=3 4869 B9R1.2 COC1=CC(O)CCC1 Amb28194168 [0,2,0,0,0,0|0,0,2]=4 4870 B9R1.2 COC1CCCC(=O)C1 Amb20671002 [0,2,0,0,0,0|0,0,2]=4 4871 B9R1.2 COC1CCCC(=O)N1 Amb27594844 [0,2,0,0,0,0|1,0,1]=4 4872 B9R1.2 CSC1=NC(=O)CCN1 Amb27778665 [0,2,0,0,0,0|2,0,0]=4 4873 B9R1.2 CSC1CCCC(=O)C1 Amb25328147 [0,2,0,0,0,0|0,0,2]=4 4874 B9R1.2 C\C=C1/CCOC(=O)N1 Amb27482030 [0,2,0,0,0,0|2,0,0]=4 4875 B9R1.2 N#CC1=CC(Cl)CCC1 Amb27806744 [0,2,0,0,0,0|1,0,1]=4 4876 B9R1.2 N#CC1=CCCC(O)C1 Amb24682186 [0,2,0,0,0,0|1,0,1]=4 4877 B9R1.2 N#CC1=CCC[C@@H](O)C1 Amb28321626 [0,2,0,0,0,0|1,0,1]=4 4878 B9R1.2 N#CC1C=C(F)CCC1 Amb27478498 [0,2,0,0,0,0|1,0,1]=4 4879 B9R1.2 N#CC1CCCC(=O)C1 Amb18642100 [0,2,0,0,0,0|0,0,2]=4 4880 B9R1.2 N#CC1CCNC(=O)C1 Amb26984825 [0,2,0,0,0,0|1,0,1]=4 4881 B9R1.2 N#C[C@H]1CCCC(=O)C1 Amb27838628 [0,2,0,0,0,0|0,0,2]=4 4882 B9R1.2 NCC1CCCC(=O)N1 Amb18832610 [0,2,0,0,0,0|1,0,1]=4 4883 B9R1.2 NCC1CCCC(=O)N1 Amb22754591 [0,2,0,0,0,0|1,0,1]=4 4884 B9R1.2 NCC1CCCC(=O)N1 Amb33313533 [0,2,0,0,0,0|1,0,1]=4 4885 B9R1.2 NCC1CCNC(=O)C1 Amb18832611 [0,2,0,0,0,0|1,0,1]=4 4886 B9R1.2 NCC1CCNC(=O)C1 Amb22405878 [0,2,0,0,0,0|1,0,1]=4 4887 B9R1.2 NCC1CCNC(=O)C1 Amb35747931 [0,2,0,0,0,0|1,0,1]=4 4888 B9R1.2 NC[C@H]1CCCC(=O)N1 Amb32687113 [0,2,0,0,0,0|1,0,1]=4 4889 B9R1.2 NC[C@H]1CCCC(=O)N1 Amb32687289 [0,2,0,0,0,0|1,0,1]=4 4890 B9R1.2 N[C@H]1C=CC[C@@H](CO)C1 Amb25290992 [0,2,0,0,0,0|1,0,1]=4 4891 B9R1.2 N\N=C1/CCSC(=O)N1 Amb27168996 [0,2,0,0,0,0|2,0,0]=4 4892 B9R1.2 O=C1C=C(CCl)CCC1 Amb27882739 [0,2,0,0,0,0|0,0,0]=2 4893 B9R1.2 O=C1C=C(CO)CCC1 Amb27843949 [0,2,0,0,0,0|0,0,0]=2 4894 B9R1.2 O=C1C=CCC(CCl)O1 Amb24432531 [0,2,0,0,0,0|1,0,0]=3 4895 B9R1.2 O=C1C=CCC(CO)O1 Amb28049087 [0,2,0,0,0,0|1,0,0]=3 4896 B9R1.2 O=C1C=CC[C@@H](CCl)O1 Amb22226720 [0,2,0,0,0,0|1,0,0]=3 4897 B9R1.2 O=C1C=CNC(CO)C1 Amb27875190 [0,2,0,0,0,0|1,0,0]=3 4898 B9R1.2 O=C1C=COC(CCl)C1 Amb28050973 [0,2,0,0,0,0|1,0,0]=3 4899 B9R1.2 O=C1CC(CBr)CCN1 Amb27980511 [0,2,0,0,0,0|1,0,1]=4 4900 B9R1.2 O=C1CC(CCl)CCO1 Amb27482669 [0,2,0,0,0,0|1,0,1]=4 4901 B9R1.2 O=C1CC(CO)CCN1 Amb21960758 [0,2,0,0,0,0|1,0,1]=4 4902 B9R1.2 O=C1CCCC(CBr)C1 Amb28396522 [0,2,0,0,0,0|0,0,2]=4 4903 B9R1.2 O=C1CCCC(CBr)O1 Amb28325542 [0,2,0,0,0,0|1,0,1]=4 4904 B9R1.2 O=C1CCCC(CCl)C1 Amb17593666 [0,2,0,0,0,0|0,0,2]=4 4905 B9R1.2 O=C1CCCC(CCl)N1 Amb19374373 [0,2,0,0,0,0|1,0,1]=4 4906 B9R1.2 O=C1CCCC(CI)N1 Amb28044882 [0,2,0,0,0,0|1,0,1]=4 4907 B9R1.2 O=C1CCCC(CO)C1 Amb16231079 [0,2,0,0,0,0|0,0,2]=4 4908 B9R1.2 O=C1CCCC(CO)N1 Amb13886257 [0,2,0,0,0,0|1,0,1]=4 4909 B9R1.2 O=C1CCCC(CO)O1 Amb27980552 [0,2,0,0,0,0|1,0,1]=4 4910 B9R1.2 O=C1CCC[C@@H](CO)C1 Amb26479307 [0,2,0,0,0,0|0,0,2]=4 4911 B9R1.2 O=C1CCC[C@H](CO)N1 Amb25187085 [0,2,0,0,0,0|1,0,1]=4 4912 B9R1.2 O=C1CCC\C(=N/O)C1 Amb27756076 [0,2,0,0,0,0|0,0,1]=3 4913 B9R1.2 O=C1CCC\C(=N/O)N1 Amb26654206 [0,2,0,0,0,0|1,0,0]=3 4914 B9R1.2 O=C1CNCC(CO)C1 Amb27621654 [0,2,0,0,0,0|1,0,1]=4 4915 B9R1.2 O=C1CSC\C(=N/O)C1 Amb27222200 [0,2,0,0,0,0|1,0,1]=4 4916 B9R1.2 O=C1C[C@H](CCl)CCO1 Amb27656328 [0,2,0,0,0,0|1,0,1]=4 4917 B9R1.2 O=C1C\C(=N/O)CCN1 Amb22741023 [0,2,0,0,0,0|1,0,1]=4 4918 B9R1.2 O=C1C\C(=N\O)CCN1 Amb24696069 [0,2,0,0,0,0|1,0,1]=4 4919 B9R1.2 O=C1N=C(NO)CCN1 Amb27960301 [0,2,0,0,0,0|2,0,0]=4 4920 B9R1.2 O=CC1CC=CC(=O)C1 Amb27849044 [0,2,0,0,0,0|0,0,0]=2 4921 B9R1.2 O=CC1CC=CC(=O)O1 Amb18642367 [0,2,0,0,0,0|1,0,0]=3 4922 B9R1.2 O=CN1CCCC(=O)C1 Amb27595139 [0,2,0,0,0,0|1,0,1]=4 4923 B9R1.2 O=C[C@@H]1CC=C[C@@H](O)C1 Amb28143998 [0,2,0,0,0,0|0,0,2]=4 4924 B9R1.2 O=C[C@@H]1CC=C[C@H](O)C1 Amb28130446 [0,2,0,0,0,0|0,0,2]=4 4925 B9R1.2 O=S1C=C(CO)SCC1 Amb27428304 [0,2,0,0,0,0|2,0,0]=4 4926 B9R1.2 OCC1=CC(O)CCC1 Amb28315569 [0,2,0,0,0,0|0,0,2]=4 4927 B9R1.2 OC[C@@H]1CC=CC(=S)N1 Amb27468983 [0,2,0,0,0,0|1,1,0]=4 4928 B9R1.2 OC[C@@H]1CC=C[C@H](O)C1 Amb22756427 [0,2,0,0,0,0|0,0,2]=4 4929 B9R1.2 OC[C@H]1CC=C[C@@H](O)C1 Amb28248697 [0,2,0,0,0,0|0,0,2]=4 4930 B9R1.2 [N-]=[N+]=C1CCCC(=O)C1 Amb17593275 [0,2,0,0,0,0|0,0,1]=3 4931 B9R1.6 CC(=O)C1=CCCCC1 Amb8513050 [0,2,0,0,0,0|0,0,1]=3 4932 B9R1.6 CC(=O)C1=CCCCN1 Amb27234616 [0,2,0,0,0,0|1,0,1]=4 4933 B9R1.6 CC(=O)C1=CCNCC1 Amb28188537 [0,2,0,0,0,0|1,0,1]=4 4934 B9R1.6 CC(=O)C1=CCOCC1 Amb26054193 [0,2,0,0,0,0|1,0,1]=4 4935 B9R1.6 CC(=O)C1=CNCCC1 Amb1162825 [0,2,0,0,0,0|1,0,0]=3 4936 B9R1.6 CC(=O)C1=CNCCS1 Amb25691015 [0,2,0,0,0,0|2,0,0]=4 4937 B9R1.6 CC(=O)C1=COCCC1 Amb26337589 [0,2,0,0,0,0|1,0,0]=3 4938 B9R1.6 CC(=O)C1=COCCO1 Amb20669275 [0,2,0,0,0,0|2,0,0]=4 4939 B9R1.6 CC(=O)C1=CSCCC1 Amb27803691 [0,2,0,0,0,0|1,0,0]=3 4940 B9R1.6 CC(=O)C1C=CCCC1 Amb17593287 [0,2,0,0,0,0|0,0,1]=3 4941 B9R1.6 CC(=O)[C@@H]1C=CCCC1 Amb25683968 [0,2,0,0,0,0|0,0,1]=3 4942 B9R1.6 CC(C)C1=CCCCC1 Amb22227968 [0,2,0,0,0,0|1,0,1]=4 4943 B9R1.6 CC(N)C1=CCCCC1 Amb10607848 [0,2,0,0,0,0|1,0,1]=4 4944 B9R1.6 CC(N)C1=CCCCC1 Amb22587030 [0,2,0,0,0,0|1,0,1]=4 4945 B9R1.6 CC(N)C1=COCCC1 Amb27412503 [0,2,0,0,0,0|2,0,0]=4 4946 B9R1.6 CC(O)C1=CCCCC1 Amb25747240 [0,2,0,0,0,0|0,0,2]=4 4947 B9R1.6 CC(O)C1C=CCCC1 Amb22365214 [0,2,0,0,0,0|0,0,2]=4 4948 B9R1.6 C[C@@H](N)C1=COCCC1 Amb33415715 [0,2,0,0,0,0|2,0,0]=4 4949 B9R1.6 C[C@@H](O)C1=COCCC1 Amb33415677 [0,2,0,0,0,0|1,0,1]=4 4950 B9R1.6 C[C@H](N)C1=COCCC1 Amb33415688 [0,2,0,0,0,0|2,0,0]=4 4951 B9R1.6 C[C@H](O)C1=COCCC1 Amb33415714 [0,2,0,0,0,0|1,0,1]=4 4952 B9R1.6 N=C(N)C1=COCCC1 Amb33319608 [0,2,0,0,0,0|2,0,0]=4 4953 B9R1.6 NC(=O)C1=CC=CNC1 Amb28397885 [0,2,0,0,0,0|1,0,1]=4 4954 B9R1.6 NC(=O)C1=CCCCC1 Amb27878423 [0,2,0,0,0,0|0,0,1]=3 4955 B9R1.6 NC(=O)C1=CCCSC1 Amb27980042 [0,2,0,0,0,0|1,0,1]=4 4956 B9R1.6 NC(=O)C1=CNCCC1 Amb2779121 [0,2,0,0,0,0|1,0,0]=3 4957 B9R1.6 NC(=O)C1=COCCC1 Amb20665861 [0,2,0,0,0,0|1,0,0]=3 4958 B9R1.6 NC(=O)C1=COCCO1 Amb24560922 [0,2,0,0,0,0|2,0,0]=4 4959 B9R1.6 NC(=O)C1C=CCCN1 Amb31030951 [0,2,0,0,0,0|1,0,1]=4 4960 B9R1.6 NC(=S)C1=COCCC1 Amb33319613 [0,2,0,0,0,0|1,1,0]=4 4961 B9R1.6 O=C(Cl)C1=CCCCC1 Amb21961756 [0,2,0,0,0,0|0,0,1]=3 4962 B9R1.6 O=C(Cl)C1=CCCOC1 Amb26843141 [0,2,0,0,0,0|1,0,1]=4 4963 B9R1.6 O=C(Cl)C1=CCOCC1 Amb25714177 [0,2,0,0,0,0|1,0,1]=4 4964 B9R1.6 O=C(Cl)C1=COCCC1 Amb27855704 [0,2,0,0,0,0|1,0,0]=3 4965 B9R1.6 O=C(Cl)C1=COCCO1 Amb10879700 [0,2,0,0,0,0|2,0,0]=4 4966 B9R1.6 O=C(Cl)C1C=COCC1 Amb28144327 [0,2,0,0,0,0|1,0,1]=4 4967 B9R1.6 O=C(O)C1=CCCCC1 Amb2720517 [0,2,0,0,0,0|0,0,1]=3 4968 B9R1.6 O=C(O)C1=CCCCN1 Amb23585365 [0,2,0,0,0,0|1,0,1]=4 4969 B9R1.6 O=C(O)C1=CCCCO1 Amb2700341 [0,2,0,0,0,0|1,0,1]=4 4970 B9R1.6 O=C(O)C1=CCCNC1 Amb10608557 [0,2,0,0,0,0|1,0,1]=4 4971 B9R1.6 O=C(O)C1=CCCNC1 Amb8503496 [0,2,0,0,0,0|1,0,1]=4 4972 B9R1.6 O=C(O)C1=CCCOC1 Amb19958529 [0,2,0,0,0,0|1,0,1]=4 4973 B9R1.6 O=C(O)C1=CCCSC1 Amb19515066 [0,2,0,0,0,0|1,0,1]=4 4974 B9R1.6 O=C(O)C1=CCNCC1 Amb10843904 [0,2,0,0,0,0|1,0,1]=4 4975 B9R1.6 O=C(O)C1=CCNCC1 Amb2698151 [0,2,0,0,0,0|1,0,1]=4 4976 B9R1.6 O=C(O)C1=CCOC=C1 Amb27860440 [0,2,0,0,0,0|1,0,1]=4 4977 B9R1.6 O=C(O)C1=CCOCC1 Amb18642574 [0,2,0,0,0,0|1,0,1]=4 4978 B9R1.6 O=C(O)C1=COCCC1 Amb18642576 [0,2,0,0,0,0|1,0,0]=3 4979 B9R1.6 O=C(O)C1=COCCO1 Amb1106470 [0,2,0,0,0,0|2,0,0]=4 4980 B9R1.6 O=C(O)C1=CSCCO1 Amb20455323 [0,2,0,0,0,0|2,0,0]=4 4981 B9R1.6 O=C(O)C1=NC=CCC1 Amb26865460 [0,2,0,0,0,0|1,0,1]=4 4982 B9R1.6 O=C(O)C1=NCCCC1 Amb24597785 [0,2,0,0,0,0|1,0,1]=4 4983 B9R1.6 O=C(O)C1=NNCCC1 Amb18642590 [0,2,0,0,0,0|2,0,0]=4 4984 B9R1.6 O=C(O)C1C=CCCC1 Amb18642396 [0,2,0,0,0,0|0,0,1]=3 4985 B9R1.6 O=C(O)C1C=CCCN1 Amb25145978 [0,2,0,0,0,0|1,0,1]=4 4986 B9R1.6 O=C(O)C1C=CCCN1 Amb35750834 [0,2,0,0,0,0|1,0,1]=4 4987 B9R1.6 O=C(O)C1C=CCNC1 Amb18642497 [0,2,0,0,0,0|1,0,1]=4 4988 B9R1.6 O=C(O)C1C=CCNC1 Amb35747468 [0,2,0,0,0,0|1,0,1]=4 4989 B9R1.6 O=C([O-])C1=CCCCN1 Amb32675115 [0,2,0,0,0,0|1,0,1]=4 4990 B9R1.6 O=[N+]([O-])C1=CCCCC1 Amb22347895 [0,2,0,0,0,0|0,0,1]=3 4991 B9R1.6 O=[N+]([O-])C1=CCSCC1 Amb27469153 [0,2,0,0,0,0|1,0,1]=4 4992 B9R1.6 O=[N+]([O-])C1=NNCC=C1 Amb27856354 [0,2,0,0,0,0|2,0,0]=4 4993 B9R1.6 O=[PH](O)C1=CCNCC1 Amb27469692 [0,2,0,0,0,0|1,0,1]=4 4994 B9R1.6 OB(O)C1=CCCCC1 Amb2455978 [0,2,0,0,0,0|0,0,2]=4 4995 B9R1.6 OB(O)C1C=CCCC1 Amb27180568 [0,2,0,0,0,0|0,0,2]=4 4996 B9R1.8 BrCCC1=CCCCC1 Amb26032382 [0,2,0,0,0,0|1,0,1]=4 4997 B9R1.8 BrCCC1=COCCC1 Amb33335769 [0,2,0,0,0,0|2,0,0]=4 4998 B9R1.8 C#CCC1=COCCC1 Amb33414888 [0,2,0,0,0,0|2,0,0]=4 4999 B9R1.8 C=CCC1=CCCCC1 Amb26318373 [0,2,0,0,0,0|1,0,1]=4 5000 B9R1.8 CCCC1C=CCCC1 Amb27644637 [0,2,0,0,0,0|1,0,1]=4 5001 B9R1.8 CCOC1=CCCCC1 Amb8471211 [0,2,0,0,0,0|0,0,2]=4 5002 B9R1.8 CNCC1=CCCCC1 Amb28246319 [0,2,0,0,0,0|1,0,1]=4 5003 B9R1.8 CNCC1=COCCC1 Amb26568553 [0,2,0,0,0,0|2,0,0]=4 5004 B9R1.8 ClCCC1C=CCCC1 Amb17672831 [0,2,0,0,0,0|1,0,1]=4 5005 B9R1.8 N#CCC1=CCCCC1 Amb2686628 [0,2,0,0,0,0|1,0,1]=4 5006 B9R1.8 N#CCC1=COCCC1 Amb33415725 [0,2,0,0,0,0|2,0,0]=4 5007 B9R1.8 N#CCC1C=CCCC1 Amb18642023 [0,2,0,0,0,0|1,0,1]=4 5008 B9R1.8 NCCC1=CCCCC1 Amb3939984 [0,2,0,0,0,0|1,0,1]=4 5009 B9R1.8 NCCC1=COCCC1 Amb26588888 [0,2,0,0,0,0|2,0,0]=4 5010 B9R1.8 NCCC1C=CCCC1 Amb25707655 [0,2,0,0,0,0|1,0,1]=4 5011 B9R1.8 NNCC1=COCCC1 Amb25785604 [0,2,0,0,0,0|2,0,0]=4 5012 B9R1.8 NOCC1=COCCC1 Amb33414913 [0,2,0,0,0,0|1,0,1]=4 5013 B9R1.8 O=C=NC1=CCCCC1 Amb27792501 [0,2,0,0,0,0|0,0,1]=3 5014 B9R1.8 O=C=NC1=COCCC1 Amb27409166 [0,2,0,0,0,0|1,0,0]=3 5015 B9R1.8 O=CC=C1CCCCC1 Amb17593282 [0,2,0,0,0,0|0,0,2]=4 5016 B9R1.8 O=CCC1=CCCCC1 Amb17593283 [0,2,0,0,0,0|0,0,1]=3 5017 B9R1.8 O=CCC1=COCCC1 Amb33414885 [0,2,0,0,0,0|1,0,0]=3 5018 B9R1.8 O=CNC1=CCCCC1 Amb16192555 [0,2,0,0,0,0|0,0,1]=3 5019 B9R1.8 OCCC1=CCCCC1 Amb17593322 [0,2,0,0,0,0|0,0,2]=4 5020 B9R1.8 OCCC1=COCCC1 Amb32944531 [0,2,0,0,0,0|1,0,1]=4 5021 B9R1.8 OCCC1C=CCCC1 Amb17593314 [0,2,0,0,0,0|0,0,2]=4 5022 B9R1.8 ONCC1=COCCC1 Amb33416036 [0,2,0,0,0,0|1,0,1]=4 5023 B9R1.8 SCCC1=COCCC1 Amb33319968 [0,2,0,0,0,0|1,1,0]=4 5024 B9R1.8 [C-]#[N+]CC1=COCCC1 Amb33415626 [0,2,0,0,0,0|2,0,0]=4 5025 B9R1.8 [N-]=[N+]=NC1=CCCCC1 Amb27882370 [0,2,0,0,0,0|1,0,1]=4 5026 B9R1.8 [N-]=[N+]=NC1C=CCCC1 Amb25139500 [0,2,0,0,0,0|1,0,1]=4 5027 B9R1.15 C=CC1=CCCCC1=O Amb27434250 [0,2,0,0,0,0|0,0,0]=2 5028 B9R1.15 C=CN1CCCCC1=O Amb3568877 [0,2,0,0,0,0|1,0,1]=4 5029 B9R1.15 C=C[C@@H]1CCC=C[C@@H]1O Amb28053736 [0,2,0,0,0,0|0,0,2]=4 5030 B9R1.15 CC1=C(C#N)CCCN1 Amb28076896 [0,2,0,0,0,0|2,0,0]=4 5031 B9R1.15 CC1=C(C=O)SCCS1 Amb26427222 [0,2,0,0,0,0|2,0,0]=4 5032 B9R1.15 CC1=C(CO)CCCC1 Amb27969811 [0,2,0,0,0,0|0,0,2]=4 5033 B9R1.15 CC1=CCCC\C1=N/O Amb27208139 [0,2,0,0,0,0|0,0,1]=3 5034 B9R1.15 CC1C=CCCC1CCl Amb27805564 [0,2,0,0,0,0|1,0,1]=4 5035 B9R1.15 CC1C=CCCC1CN Amb28046907 [0,2,0,0,0,0|1,0,1]=4 5036 B9R1.15 CCC1=CCCCC1=O Amb27838623 [0,2,0,0,0,0|0,0,0]=2 5037 B9R1.15 CCC1=CCCCC1O Amb27808543 [0,2,0,0,0,0|0,0,2]=4 5038 B9R1.15 CCC1C=NC=CC1=O Amb27838782 [0,2,0,0,0,0|1,0,1]=4 5039 B9R1.15 CCC1CCCCC1=O Amb22002104 [0,2,0,0,0,0|0,0,2]=4 5040 B9R1.15 CCC1CCCNC1=O Amb22276357 [0,2,0,0,0,0|1,0,1]=4 5041 B9R1.15 CCC1CCOCC1=O Amb33295409 [0,2,0,0,0,0|1,0,1]=4 5042 B9R1.15 CCC1NCCCC1=O Amb19888368 [0,2,0,0,0,0|1,0,1]=4 5043 B9R1.15 CCC1NCCCC1=O Amb28055859 [0,2,0,0,0,0|1,0,1]=4 5044 B9R1.15 CC[C@@H]1C=CCC[C@H]1O Amb27632001 [0,2,0,0,0,0|1,0,1]=4 5045 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [0,2,0,0,0,0|0,0,2]=4 5046 B9R1.15 CC[C@@H]1CCCNC1=O Amb28436118 [0,2,0,0,0,0|1,0,1]=4 5047 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [0,2,0,0,0,0|1,0,1]=4 5048 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [0,2,0,0,0,0|1,0,1]=4 5049 B9R1.15 CNC1=CCCCC1=O Amb25743372 [0,2,0,0,0,0|0,0,0]=2 5050 B9R1.15 CNC1C=CCCC1O Amb27954422 [0,2,0,0,0,0|1,0,1]=4 5051 B9R1.15 CNC1CCCC=C1C Amb27663676 [0,2,0,0,0,0|1,0,1]=4 5052 B9R1.15 CNC1CCCCC1=O Amb28984230 [0,2,0,0,0,0|0,0,2]=4 5053 B9R1.15 CNC1CCCCC1=O Amb3644506 [0,2,0,0,0,0|0,0,2]=4 5054 B9R1.15 CNC1CCCNC1=O Amb28934961 [0,2,0,0,0,0|1,0,1]=4 5055 B9R1.15 COC1=CCCCC1=O Amb22755964 [0,2,0,0,0,0|0,0,0]=2 5056 B9R1.15 COC1=CCCCC1O Amb26050792 [0,2,0,0,0,0|0,0,2]=4 5057 B9R1.15 COC1C=CCCC1O Amb27632601 [0,2,0,0,0,0|0,0,2]=4 5058 B9R1.15 COC1CC=CCC1=O Amb27256455 [0,2,0,0,0,0|0,0,2]=4 5059 B9R1.15 COC1CCC=CC1N Amb27491501 [0,2,0,0,0,0|1,0,1]=4 5060 B9R1.15 COC1CCCC=C1Br Amb26495485 [0,2,0,0,0,0|0,0,2]=4 5061 B9R1.15 COC1CCCCC1=O Amb4606000 [0,2,0,0,0,0|0,0,2]=4 5062 B9R1.15 COC1CCCNC1=O Amb16231349 [0,2,0,0,0,0|1,0,1]=4 5063 B9R1.15 COC1OCCCC1=O Amb27838671 [0,2,0,0,0,0|1,0,1]=4 5064 B9R1.15 CON1CCCCC1=O Amb27669022 [0,2,0,0,0,0|1,0,1]=4 5065 B9R1.15 CO[C@@H]1CCCCC1=O Amb22799901 [0,2,0,0,0,0|0,0,2]=4 5066 B9R1.15 CO[C@H]1CCCCC1=O Amb8386937 [0,2,0,0,0,0|0,0,2]=4 5067 B9R1.15 CSC1=CCCCC1=O Amb27255244 [0,2,0,0,0,0|0,0,0]=2 5068 B9R1.15 CSC1=CCCCN1C Amb28285265 [0,2,0,0,0,0|2,0,0]=4 5069 B9R1.15 CSC1CCC=CC1=O Amb28074788 [0,2,0,0,0,0|0,0,0]=2 5070 B9R1.15 CSC1CCC=CC1F Amb27864051 [0,2,0,0,0,0|1,0,1]=4 5071 B9R1.15 CSC1CCCCC1=O Amb19267090 [0,2,0,0,0,0|0,0,2]=4 5072 B9R1.15 CS[C@@H]1CCC=C[C@H]1F Amb25093019 [0,2,0,0,0,0|1,0,1]=4 5073 B9R1.15 C[C@@H]1C=CCC[C@H]1C=O Amb28246398 [0,2,0,0,0,0|1,0,1]=4 5074 B9R1.15 C[C@H]1C=CCC[C@H]1CN Amb27420782 [0,2,0,0,0,0|1,0,1]=4 5075 B9R1.15 C\C=C1/CCCCC1=O Amb10558348 [0,2,0,0,0,0|0,0,1]=3 5076 B9R1.15 C\C=C1\CCCCC1=O Amb24571944 [0,2,0,0,0,0|0,0,1]=3 5077 B9R1.15 C\C=C1\CNCCC1=O Amb32649111 [0,2,0,0,0,0|1,0,1]=4 5078 B9R1.15 C\C=C1\COCCC1=O Amb27750956 [0,2,0,0,0,0|1,0,1]=4 5079 B9R1.15 C\C=C1\CSCCC1=O Amb32649112 [0,2,0,0,0,0|1,0,1]=4 5080 B9R1.15 ClCC1=C(Cl)CCCC1 Amb27595204 [0,2,0,0,0,0|1,0,1]=4 5081 B9R1.15 ClCC1=CCCCC1Cl Amb27493133 [0,2,0,0,0,0|1,0,1]=4 5082 B9R1.15 Cl\C=C1\CCCC=C1Cl Amb27614358 [0,2,0,0,0,0|1,0,0]=3 5083 B9R1.15 N#CC1=C(Br)CCCC1 Amb27985365 [0,2,0,0,0,0|1,0,1]=4 5084 B9R1.15 N#CC1=C(Cl)CCCC1 Amb19337274 [0,2,0,0,0,0|1,0,1]=4 5085 B9R1.15 N#CC1=C(N)CCCC1 Amb18278062 [0,2,0,0,0,0|1,0,1]=4 5086 B9R1.15 N#CC1=C(N)OCCC1 Amb4061611 [0,2,0,0,0,0|2,0,0]=4 5087 B9R1.15 N#CC1=C(O)CCCC1 Amb22057806 [0,2,0,0,0,0|0,0,2]=4 5088 B9R1.15 N#CC1=CCCCC1=O Amb27847881 [0,2,0,0,0,0|0,0,0]=2 5089 B9R1.15 N#CC1=CCCCC1O Amb18642103 [0,2,0,0,0,0|0,0,2]=4 5090 B9R1.15 N#CC1CCC=CC1O Amb27204585 [0,2,0,0,0,0|0,0,2]=4 5091 B9R1.15 N#CC1CCCCC1=O Amb2691377 [0,2,0,0,0,0|0,0,2]=4 5092 B9R1.15 N#CC1CCNCC1=O Amb27966755 [0,2,0,0,0,0|1,0,1]=4 5093 B9R1.15 N#CC1CCOCC1=O Amb18832849 [0,2,0,0,0,0|1,0,1]=4 5094 B9R1.15 N#CC1OCCCC1=O Amb18832848 [0,2,0,0,0,0|1,0,1]=4 5095 B9R1.15 N#C[C@H]1CCC=C[C@H]1N Amb27785481 [0,2,0,0,0,0|1,0,1]=4 5096 B9R1.15 N#C[C@H]1CCC=C[C@H]1O Amb27978517 [0,2,0,0,0,0|0,0,2]=4 5097 B9R1.15 NC1C=CCCC1CO Amb27841059 [0,2,0,0,0,0|1,0,1]=4 5098 B9R1.15 NCC1=C(Cl)CCCC1 Amb18251295 [0,2,0,0,0,0|1,0,1]=4 5099 B9R1.15 NCC1=C(Cl)CCCO1 Amb27817875 [0,2,0,0,0,0|2,0,0]=4 5100 B9R1.15 NCC1CCCCC1=O Amb18203259 [0,2,0,0,0,0|0,0,2]=4 5101 B9R1.15 NCC1CCCNC1=O Amb19514595 [0,2,0,0,0,0|1,0,1]=4 5102 B9R1.15 NCC1CCCNC1=O Amb23586199 [0,2,0,0,0,0|1,0,1]=4 5103 B9R1.15 N[C@@H]1C=CCC[C@H]1CO Amb26464134 [0,2,0,0,0,0|1,0,1]=4 5104 B9R1.15 N[C@H]1C=CCC[C@H]1CO Amb25231204 [0,2,0,0,0,0|1,0,1]=4 5105 B9R1.15 N\C=C1/CCCCC1=O Amb28054309 [0,2,0,0,0,0|0,0,1]=3 5106 B9R1.15 N\C=C1\CCCCC1=O Amb25146068 [0,2,0,0,0,0|0,0,1]=3 5107 B9R1.15 O=C1CCC=C\C1=C\O Amb25298436 [0,2,0,0,0,0|0,0,1]=3 5108 B9R1.15 O=C1CCCC=C1CBr Amb27180223 [0,2,0,0,0,0|0,0,0]=2 5109 B9R1.15 O=C1CCCC=C1CCl Amb27424688 [0,2,0,0,0,0|0,0,0]=2 5110 B9R1.15 O=C1CCCC=C1CO Amb24453147 [0,2,0,0,0,0|0,0,0]=2 5111 B9R1.15 O=C1CCCCC1CO Amb16231080 [0,2,0,0,0,0|0,0,2]=4 5112 B9R1.15 O=C1CCCCC1CS Amb27838753 [0,2,0,0,0,0|0,0,2]=4 5113 B9R1.15 O=C1CCCCN1CCl Amb2798048 [0,2,0,0,0,0|1,0,1]=4 5114 B9R1.15 O=C1CCCC[C@@H]1CO Amb27750239 [0,2,0,0,0,0|0,0,2]=4 5115 B9R1.15 O=C1CCCC[C@H]1CO Amb27956173 [0,2,0,0,0,0|0,0,2]=4 5116 B9R1.15 O=C1CCCC\C1=C/O Amb33109815 [0,2,0,0,0,0|0,0,1]=3 5117 B9R1.15 O=C1CCCC\C1=C/[O-] Amb33541795 [0,2,0,0,0,0|0,0,1]=3 5118 B9R1.15 O=C1CCCC\C1=C\Br Amb27492896 [0,2,0,0,0,0|0,0,1]=3 5119 B9R1.15 O=C1CCCC\C1=C\Cl Amb27200151 [0,2,0,0,0,0|0,0,1]=3 5120 B9R1.15 O=C1CCCC\C1=C\O Amb20001480 [0,2,0,0,0,0|0,0,1]=3 5121 B9R1.15 O=C1CCCC\C1=C\[O-] Amb27247843 [0,2,0,0,0,0|0,0,1]=3 5122 B9R1.15 O=C1CCCC\C1=N\O Amb27780978 [0,2,0,0,0,0|0,0,1]=3 5123 B9R1.15 O=C1CCSC\C1=C\O Amb24736136 [0,2,0,0,0,0|1,0,1]=4 5124 B9R1.15 O=C1NCCCC1CO Amb27814971 [0,2,0,0,0,0|1,0,1]=4 5125 B9R1.15 O=C1NCCCC1CS Amb27473272 [0,2,0,0,0,0|1,0,1]=4 5126 B9R1.15 O=C1NCCC\C1=N/O Amb27493028 [0,2,0,0,0,0|1,0,1]=4 5127 B9R1.15 O=C1NCCO\C1=N\O Amb24117137 [0,2,0,0,0,0|2,0,0]=4 5128 B9R1.15 O=C1OCCC\C1=C\O Amb27465766 [0,2,0,0,0,0|1,0,1]=4 5129 B9R1.15 O=C1SCCC\C1=C\O Amb27652949 [0,2,0,0,0,0|1,0,1]=4 5130 B9R1.15 O=CC1=C(Br)CCCC1 Amb18522186 [0,2,0,0,0,0|0,0,1]=3 5131 B9R1.15 O=CC1=C(Br)CCOC1 Amb27184819 [0,2,0,0,0,0|1,0,1]=4 5132 B9R1.15 O=CC1=C(Cl)CCCC1 Amb2797788 [0,2,0,0,0,0|0,0,1]=3 5133 B9R1.15 O=CC1=C(Cl)CCSC1 Amb27451184 [0,2,0,0,0,0|1,0,1]=4 5134 B9R1.15 O=CC1=C(S)CCCC1 Amb28074713 [0,2,0,0,0,0|0,0,1]=3 5135 B9R1.15 O=CC1=CCCOC1Br Amb27879745 [0,2,0,0,0,0|1,0,1]=4 5136 B9R1.15 O=CC1CCCCC1=O Amb19651323 [0,2,0,0,0,0|0,0,2]=4 5137 B9R1.15 O=CN1CCCCC1=O Amb27861937 [0,2,0,0,0,0|1,0,1]=4 5138 B9R1.15 O=C[C@H]1CCC=C[C@H]1O Amb27854577 [0,2,0,0,0,0|0,0,2]=4 5139 B9R1.15 O=NN1CCCNC1=O Amb25861805 [0,2,0,0,0,0|2,0,0]=4 5140 B9R1.15 OC1CCCC=C1CCl Amb28060583 [0,2,0,0,0,0|0,0,2]=4 5141 B9R1.15 OCC1=C(Cl)CCCC1 Amb28061885 [0,2,0,0,0,0|0,0,2]=4 5142 B9R1.15 OC[C@@H]1CCC=C[C@@H]1O Amb27215271 [0,2,0,0,0,0|0,0,2]=4 5143 B9R1.15 OC[C@H]1CCC=C[C@H]1O Amb27218905 [0,2,0,0,0,0|0,0,2]=4 5144 B9R1.15 [N-]=[N+]=C1CCCCC1=O Amb25074525 [0,2,0,0,0,0|0,0,1]=3 5145 B9R1.15 [N-]=[N+]=C1CCCNC1=O Amb15693097 [0,2,0,0,0,0|1,0,1]=4 5146 B9R1.118 C#CC1(O)C=CCCC1 Amb27757637 [0,2,0,0,0,0|0,0,2]=4 5147 B9R1.118 C=CC1(O)C=CCCC1 Amb27594611 [0,2,0,0,0,0|0,0,2]=4 5148 B9R1.118 CC1(C#N)C=CCCC1 Amb33189271 [0,2,0,0,0,0|1,0,1]=4 5149 B9R1.118 CC1(CN)C=CCCC1 Amb31157065 [0,2,0,0,0,0|1,0,1]=4 5150 B9R1.118 CC1(CN)C=CCCC1 Amb33309478 [0,2,0,0,0,0|1,0,1]=4 5151 B9R1.118 CC1(CO)C=CCCC1 Amb28049165 [0,2,0,0,0,0|0,0,2]=4 5152 B9R1.118 CCC1(O)C=CCCC1 Amb27652373 [0,2,0,0,0,0|0,0,2]=4 5153 B9R1.118 NCC1(O)C=CCCC1 Amb27851870 [0,2,0,0,0,0|0,0,2]=4 5154 B9R1.10 CC1(C)C=CC(=O)CC1 Amb8515573 [0,2,0,0,0,0|0,0,0]=2 5155 B9R1.10 CC1(C)C=CC(=O)CS1 Amb28144116 [0,2,0,0,0,0|1,0,0]=3 5156 B9R1.10 CC1(C)C=CC(N)CC1 Amb24426817 [0,2,0,0,0,0|1,0,1]=4 5157 B9R1.10 CC1(C)C=CC(O)CC1 Amb27827311 [0,2,0,0,0,0|0,0,2]=4 5158 B9R1.10 CC1(C)CC=C(Br)CC1 Amb22227865 [0,2,0,0,0,0|1,0,1]=4 5159 B9R1.10 CC1(C)CC=C(Cl)CC1 Amb27473762 [0,2,0,0,0,0|1,0,1]=4 5160 B9R1.10 CC1(C)CC=C(O)CC1 Amb27641416 [0,2,0,0,0,0|0,0,2]=4 5161 B9R1.10 CC1(C)CCC(=O)CC1 Amb15692607 [0,2,0,0,0,0|0,0,2]=4 5162 B9R1.10 CC1(C)CCC(=O)NC1 Amb33530532 [0,2,0,0,0,0|1,0,1]=4 5163 B9R1.10 CC1(C)CCC(=O)OC1 Amb28120623 [0,2,0,0,0,0|1,0,1]=4 5164 B9R1.10 CC1(Cl)C=CC(=O)C=C1 Amb28285172 [0,2,0,0,0,0|0,0,2]=4 5165 B9R1.10 CC1(F)CCC(=O)CC1 Amb28062001 [0,2,0,0,0,0|0,0,2]=4 5166 B9R1.10 CC1(N)C=CC(=O)C=C1 Amb27971345 [0,2,0,0,0,0|0,0,2]=4 5167 B9R1.10 CC1(N)CCC(=O)CC1 Amb23589791 [0,2,0,0,0,0|0,0,2]=4 5168 B9R1.10 CC1(O)CCC(=O)CC1 Amb22235468 [0,2,0,0,0,0|0,0,2]=4 5169 B9R1.10 CC1C=CC(C)(O)CC1 Amb32864483 [0,2,0,0,0,0|0,0,2]=4 5170 B9R1.10 FC1(F)CC=C(Br)CC1 Amb26579176 [0,2,0,0,0,0|1,0,1]=4 5171 B9R1.10 NC1(N)CCC(=O)CC1 Amb25695419 [0,2,0,0,0,0|0,0,2]=4 5172 B9R1.10 O=C1C=CC(F)(F)CC1 Amb25217348 [0,2,0,0,0,0|0,0,0]=2 5173 B9R1.10 O=C1C=CS(=O)(=O)CC1 Amb25684660 [0,2,0,0,0,0|1,0,0]=3 5174 B9R1.10 O=C1CCC(F)(F)CC1 Amb10982553 [0,2,0,0,0,0|0,0,2]=4 5175 B9R1.10 O=C1CCC(F)(F)CN1 Amb23439794 [0,2,0,0,0,0|1,0,1]=4 5176 B9R1.10 OC1=CCC(F)(F)CC1 Amb27855284 [0,2,0,0,0,0|0,0,2]=4 5177 B9R1.69 C=C1CC(C)CNC1=O Amb27640032 [0,2,0,0,0,0|1,0,1]=4 5178 B9R1.69 C=C1CCC(=O)NC1=O Amb26600967 [0,2,0,0,0,0|1,0,1]=4 5179 B9R1.69 C=C1CN(C)CCC1=O Amb27881222 [0,2,0,0,0,0|1,0,1]=4 5180 B9R1.69 CC1=C(C)CC(C)CC1 Amb26603643 [0,2,0,0,0,0|1,0,1]=4 5181 B9R1.69 CC1=C(C)CC(Cl)CC1 Amb27233566 [0,2,0,0,0,0|1,0,1]=4 5182 B9R1.69 CC1=C(C)NC(=O)CC1 Amb8394546 [0,2,0,0,0,0|1,0,1]=4 5183 B9R1.69 CC1=C(N)CCC(=O)N1 Amb27169262 [0,2,0,0,0,0|1,0,1]=4 5184 B9R1.69 CC1=CC(=O)C(C)CC1 Amb28323862 [0,2,0,0,0,0|0,0,0]=2 5185 B9R1.69 CC1=CC(=O)C(C)SC1 Amb28351436 [0,2,0,0,0,0|1,0,0]=3 5186 B9R1.69 CC1=CC(=O)C(O)CC1 Amb27838713 [0,2,0,0,0,0|0,0,0]=2 5187 B9R1.69 CC1=CC(=O)C=CC1O Amb27750285 [0,2,0,0,0,0|0,0,2]=4 5188 B9R1.69 CC1=CC(=O)CCC1=O Amb28455194 [0,2,0,0,0,0|0,0,1]=3 5189 B9R1.69 CC1=CC(=O)CC[C@H]1C Amb27838729 [0,2,0,0,0,0|0,0,0]=2 5190 B9R1.69 CC1=CC(=O)OCC1O Amb28457807 [0,2,0,0,0,0|1,0,0]=3 5191 B9R1.69 CC1=CC(=O)[C@H](C)CC1 Amb27598775 [0,2,0,0,0,0|0,0,0]=2 5192 B9R1.69 CC1=CC(C)C(C)CC1 Amb25048711 [0,2,0,0,0,0|1,0,1]=4 5193 B9R1.69 CC1=CC(C)C(O)CC1 Amb27664856 [0,2,0,0,0,0|1,0,1]=4 5194 B9R1.69 CC1=CC(C)CNC1=O Amb27435183 [0,2,0,0,0,0|1,0,0]=3 5195 B9R1.69 CC1=CC(Cl)C(C)CC1 Amb27483834 [0,2,0,0,0,0|1,0,1]=4 5196 B9R1.69 CC1=CC(O)C=CC1=O Amb27954124 [0,2,0,0,0,0|0,0,2]=4 5197 B9R1.69 CC1=CC(O)CCC1=O Amb27838743 [0,2,0,0,0,0|0,0,0]=2 5198 B9R1.69 CC1=CC(O)CCC1C Amb27218950 [0,2,0,0,0,0|0,0,2]=4 5199 B9R1.69 CC1=CC(O)CCC1Cl Amb27233700 [0,2,0,0,0,0|0,0,2]=4 5200 B9R1.69 CC1=CC(O)CC[C@H]1C Amb28350322 [0,2,0,0,0,0|0,0,2]=4 5201 B9R1.69 CC1=CC(O)[C@H](C)CC1 Amb28049248 [0,2,0,0,0,0|0,0,2]=4 5202 B9R1.69 CC1=CCC(=O)C[C@@H]1C Amb27434226 [0,2,0,0,0,0|0,0,2]=4 5203 B9R1.69 CC1=CCC(C)C(=O)O1 Amb6600560 [0,2,0,0,0,0|1,0,1]=4 5204 B9R1.69 CC1=CCC(C)CC1O Amb27842013 [0,2,0,0,0,0|0,0,2]=4 5205 B9R1.69 CC1=CCC(O)C(C)C1 Amb27977995 [0,2,0,0,0,0|1,0,1]=4 5206 B9R1.69 CC1=CCC(O)C(O)C1 Amb28208568 [0,2,0,0,0,0|1,0,1]=4 5207 B9R1.69 CC1=CC[C@@H](C)C[C@H]1O Amb28401379 [0,2,0,0,0,0|0,0,2]=4 5208 B9R1.69 CC1=CC[C@@H](O)C(C)C1 Amb27956617 [0,2,0,0,0,0|1,0,1]=4 5209 B9R1.69 CC1=CC[C@@H](O)C[C@H]1C Amb27970535 [0,2,0,0,0,0|1,0,1]=4 5210 B9R1.69 CC1=CC[C@@H](O)[C@H](O)C1 Amb27422441 [0,2,0,0,0,0|1,0,1]=4 5211 B9R1.69 CC1=CC[C@H](O)C[C@@H]1C Amb27446679 [0,2,0,0,0,0|1,0,1]=4 5212 B9R1.69 CC1=CC[C@H](O)[C@H](O)C1 Amb27882767 [0,2,0,0,0,0|1,0,1]=4 5213 B9R1.69 CC1=CNC(=O)CC1=O Amb27246493 [0,2,0,0,0,0|1,0,1]=4 5214 B9R1.69 CC1=C[C@@H](O)CC[C@H]1Cl Amb27985909 [0,2,0,0,0,0|0,0,2]=4 5215 B9R1.69 CC1=C[C@@H](O)CC[C@H]1O Amb27970996 [0,2,0,0,0,0|0,0,2]=4 5216 B9R1.69 CC1=C[C@@H](O)[C@H](O)CC1 Amb27255140 [0,2,0,0,0,0|0,0,2]=4 5217 B9R1.69 CC1=C[C@H](O)[C@H](O)CC1 Amb28321435 [0,2,0,0,0,0|0,0,2]=4 5218 B9R1.69 CC1C=C(I)C(=O)CC1 Amb32867829 [0,2,0,0,0,0|0,0,0]=2 5219 B9R1.69 CC1C=CC(=O)C(C)C1 Amb27433057 [0,2,0,0,0,0|0,0,0]=2 5220 B9R1.69 CC1C=CC(Br)CC1C Amb27401853 [0,2,0,0,0,0|1,0,1]=4 5221 B9R1.69 CC1C=CC(C)C(O)C1 Amb27395845 [0,2,0,0,0,0|1,0,1]=4 5222 B9R1.69 CC1C=CC(O)C(O)C1 Amb27394816 [0,2,0,0,0,0|0,0,2]=4 5223 B9R1.69 CC1C=CC(O)CC1C Amb27808814 [0,2,0,0,0,0|0,0,2]=4 5224 B9R1.69 CC1CC(=O)C(O)=CO1 Amb28351460 [0,2,0,0,0,0|1,0,0]=3 5225 B9R1.69 CC1CC(=O)C=CC1=O Amb27750328 [0,2,0,0,0,0|0,0,1]=3 5226 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,2,0,0,0,0|0,0,2]=4 5227 B9R1.69 CC1CC(=O)CC[C@H]1C Amb28141697 [0,2,0,0,0,0|0,0,2]=4 5228 B9R1.69 CC1CC(=O)NCC1O Amb27257393 [0,2,0,0,0,0|1,0,1]=4 5229 B9R1.69 CC1CC(=O)NNC1Cl Amb27796166 [0,2,0,0,0,0|2,0,0]=4 5230 B9R1.69 CC1CC(=O)OCC1O Amb27956456 [0,2,0,0,0,0|1,0,1]=4 5231 B9R1.69 CC1CC(Br)CCC1=O Amb28396505 [0,2,0,0,0,0|0,0,2]=4 5232 B9R1.69 CC1CC(O)C=CC1O Amb27978689 [0,2,0,0,0,0|0,0,2]=4 5233 B9R1.69 CC1CC=C(Br)C(=O)N1 Amb27494118 [0,2,0,0,0,0|1,0,0]=3 5234 B9R1.69 CC1CC=C(Br)C(O)C1 Amb27662803 [0,2,0,0,0,0|0,0,2]=4 5235 B9R1.69 CC1CC=C(Cl)C(=O)C1 Amb27199164 [0,2,0,0,0,0|0,0,0]=2 5236 B9R1.69 CC1CCC(=O)C(Br)C1 Amb18325312 [0,2,0,0,0,0|0,0,2]=4 5237 B9R1.69 CC1CCC(=O)C(C)C1 Amb27945615 [0,2,0,0,0,0|0,0,2]=4 5238 B9R1.69 CC1CCC(=O)C(F)C1 Amb27947951 [0,2,0,0,0,0|0,0,2]=4 5239 B9R1.69 CC1CCC(=O)C(O)C1 Amb25333970 [0,2,0,0,0,0|0,0,2]=4 5240 B9R1.69 CC1CCC(=O)C=C1O Amb26053264 [0,2,0,0,0,0|0,0,0]=2 5241 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,2,0,0,0,0|0,0,1]=3 5242 B9R1.69 CC1CCC(=O)CC1C Amb22732216 [0,2,0,0,0,0|0,0,2]=4 5243 B9R1.69 CC1CCC(=O)CC1Cl Amb27872191 [0,2,0,0,0,0|0,0,2]=4 5244 B9R1.69 CC1CCC(=O)CC1I Amb32867595 [0,2,0,0,0,0|0,0,2]=4 5245 B9R1.69 CC1CCC(=O)CC1N Amb32866958 [0,2,0,0,0,0|0,0,2]=4 5246 B9R1.69 CC1CCC(=O)CC1O Amb27180113 [0,2,0,0,0,0|0,0,2]=4 5247 B9R1.69 CC1CCC(=O)NC1=O Amb21963732 [0,2,0,0,0,0|1,0,0]=3 5248 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,2,0,0,0,0|1,0,0]=3 5249 B9R1.69 CC1CCC(Br)C(=O)C1 Amb27666885 [0,2,0,0,0,0|0,0,2]=4 5250 B9R1.69 CC1CCC(C)C(=O)C1 Amb22228357 [0,2,0,0,0,0|0,0,2]=4 5251 B9R1.69 CC1CCC(C)C(=O)N1 Amb25692572 [0,2,0,0,0,0|1,0,1]=4 5252 B9R1.69 CC1CCC(Cl)C(=O)C1 Amb28195532 [0,2,0,0,0,0|0,0,2]=4 5253 B9R1.69 CC1CCC(F)C(=O)C1 Amb27836782 [0,2,0,0,0,0|0,0,2]=4 5254 B9R1.69 CC1CCC(N)C(=O)N1 Amb26015847 [0,2,0,0,0,0|1,0,1]=4 5255 B9R1.69 CC1CCC(O)=CC1=O Amb24532888 [0,2,0,0,0,0|0,0,0]=2 5256 B9R1.69 CC1CCC(O)C(=O)O1 Amb28285159 [0,2,0,0,0,0|1,0,1]=4 5257 B9R1.69 CC1CCN(C)CC1=O Amb27861305 [0,2,0,0,0,0|1,0,1]=4 5258 B9R1.69 CC1CNC(=O)C(=O)O1 Amb27961492 [0,2,0,0,0,0|2,0,0]=4 5259 B9R1.69 CC1CNC(=O)C(C)C1 Amb20670731 [0,2,0,0,0,0|1,0,1]=4 5260 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,2,0,0,0,0|1,0,1]=4 5261 B9R1.69 CC1CNC(=O)CC1O Amb27816242 [0,2,0,0,0,0|1,0,1]=4 5262 B9R1.69 CC1CNC(=O)NC1=O Amb1152691 [0,2,0,0,0,0|2,0,0]=4 5263 B9R1.69 CC1CNC(O)=NC1=O Amb4256704 [0,2,0,0,0,0|2,0,0]=4 5264 B9R1.69 CC1NC(=O)CCC1Cl Amb27397322 [0,2,0,0,0,0|1,0,1]=4 5265 B9R1.69 CC1NC(=O)CCC1N Amb25276175 [0,2,0,0,0,0|1,0,1]=4 5266 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,2,0,0,0,0|1,0,1]=4 5267 B9R1.69 CC1NCC(=O)NC1=O Amb26514613 [0,2,0,0,0,0|2,0,0]=4 5268 B9R1.69 CC1OC(=O)C=CC1=O Amb27948593 [0,2,0,0,0,0|1,0,1]=4 5269 B9R1.69 CC1OC(=O)CCC1Br Amb27875143 [0,2,0,0,0,0|1,0,1]=4 5270 B9R1.69 CC1OCC(=O)C=C1N Amb27799172 [0,2,0,0,0,0|1,0,0]=3 5271 B9R1.69 CC1OCC(=O)CC1=O Amb27838792 [0,2,0,0,0,0|1,0,1]=4 5272 B9R1.69 CC1OCC(=O)NC1=O Amb27866285 [0,2,0,0,0,0|2,0,0]=4 5273 B9R1.69 CC1SCC(=O)CC1=O Amb27838733 [0,2,0,0,0,0|1,0,1]=4 5274 B9R1.69 CC1SCC(=O)NC1=O Amb32670772 [0,2,0,0,0,0|2,0,0]=4 5275 B9R1.69 CC1SCC(=O)OC1=O Amb2431035 [0,2,0,0,0,0|2,0,0]=4 5276 B9R1.69 CN1CC(N)CCC1=O Amb15701238 [0,2,0,0,0,0|1,0,1]=4 5277 B9R1.69 CN1CC(N)CCC1=O Amb22405964 [0,2,0,0,0,0|1,0,1]=4 5278 B9R1.69 CN1CC(N)CCC1=O Amb22586977 [0,2,0,0,0,0|1,0,1]=4 5279 B9R1.69 CN1CC(O)CCC1=O Amb22304825 [0,2,0,0,0,0|1,0,1]=4 5280 B9R1.69 CN1CCC(=O)CC1=O Amb27154977 [0,2,0,0,0,0|1,0,1]=4 5281 B9R1.69 CN1CCC(=O)N=C1N Amb18642514 [0,2,0,0,0,0|2,0,0]=4 5282 B9R1.69 CN1CCC(=O)NC1=O Amb2389875 [0,2,0,0,0,0|2,0,0]=4 5283 B9R1.69 CN1CCC(=O)NC1=S Amb4012104 [0,2,0,0,0,0|2,0,0]=4 5284 B9R1.69 CN1CCC(N)=NC1=O Amb5501940 [0,2,0,0,0,0|2,0,0]=4 5285 B9R1.69 CN1CCC(N)CC1=O Amb21857737 [0,2,0,0,0,0|1,0,1]=4 5286 B9R1.69 CN1CCC(N)CC1=O Amb28895935 [0,2,0,0,0,0|1,0,1]=4 5287 B9R1.69 CN1CCC(N)CC1=O Amb8010833 [0,2,0,0,0,0|1,0,1]=4 5288 B9R1.69 CN1C[C@@H](N)CCC1=O Amb27473199 [0,2,0,0,0,0|1,0,1]=4 5289 B9R1.69 C[C@@H]1C=CC(=O)[C@@H](C)O1 Amb27267068 [0,2,0,0,0,0|1,0,0]=3 5290 B9R1.69 C[C@@H]1CC(=O)C(O)=CO1 Amb28350976 [0,2,0,0,0,0|1,0,0]=3 5291 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1O Amb34913315 [0,2,0,0,0,0|0,0,2]=4 5292 B9R1.69 C[C@@H]1CCC(=O)C(O)C1 Amb27838716 [0,2,0,0,0,0|0,0,2]=4 5293 B9R1.69 C[C@@H]1CCC(=O)[C@@H](Cl)C1 Amb28457297 [0,2,0,0,0,0|0,0,2]=4 5294 B9R1.69 C[C@@H]1CCC(=O)[C@H](O)C1 Amb27434293 [0,2,0,0,0,0|0,0,2]=4 5295 B9R1.69 C[C@@H]1CC[C@H](F)C(=O)C1 Amb28246572 [0,2,0,0,0,0|0,0,2]=4 5296 B9R1.69 C[C@@H]1OC(O)C=CC1=O Amb27261619 [0,2,0,0,0,0|1,0,0]=3 5297 B9R1.69 C[C@@H]1OC(O)CCC1=O Amb28351368 [0,2,0,0,0,0|1,0,1]=4 5298 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,2,0,0,0,0|0,0,2]=4 5299 B9R1.69 C[C@H]1CC(=O)NC[C@H]1O Amb28365998 [0,2,0,0,0,0|1,0,1]=4 5300 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1C Amb26440377 [0,2,0,0,0,0|0,0,2]=4 5301 B9R1.69 C[C@H]1CCC(=O)C[C@H]1C Amb26910681 [0,2,0,0,0,0|0,0,2]=4 5302 B9R1.69 C[C@H]1CCC(=O)[C@H](Cl)C1 Amb27778268 [0,2,0,0,0,0|0,0,2]=4 5303 B9R1.69 C[C@H]1CC[C@@H](O)CC1=O Amb27427823 [0,2,0,0,0,0|0,0,2]=4 5304 B9R1.69 C[C@H]1CC[C@H](Br)C(=O)C1 Amb23592295 [0,2,0,0,0,0|0,0,2]=4 5305 B9R1.69 C[C@H]1CC[C@H](Cl)C(=O)C1 Amb28245372 [0,2,0,0,0,0|0,0,2]=4 5306 B9R1.69 C[C@H]1CNC(=O)NC1=O Amb27655087 [0,2,0,0,0,0|2,0,0]=4 5307 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,2,0,0,0,0|1,0,1]=4 5308 B9R1.69 C[C@H]1C[C@@H](C)COC1=O Amb27251551 [0,2,0,0,0,0|1,0,1]=4 5309 B9R1.69 C[C@H]1C[C@@H](O)CCC1=O Amb28253634 [0,2,0,0,0,0|0,0,2]=4 5310 B9R1.69 C[C@H]1C[C@H](O)C=CC1=O Amb27434201 [0,2,0,0,0,0|0,0,0]=2 5311 B9R1.69 C[C@H]1NC(=O)CC[C@@H]1O Amb28128446 [0,2,0,0,0,0|1,0,1]=4 5312 B9R1.69 C[C@H]1OC(=O)C=CC1=O Amb28351021 [0,2,0,0,0,0|1,0,1]=4 5313 B9R1.69 NC1=CC(=O)C(N)CN1 Amb27405218 [0,2,0,0,0,0|1,0,0]=3 5314 B9R1.69 NC1=CCC(N)C(=O)N1 Amb27655649 [0,2,0,0,0,0|1,0,1]=4 5315 B9R1.69 NC1=NC(=O)C(N)CN1 Amb28246176 [0,2,0,0,0,0|2,0,0]=4 5316 B9R1.69 NC1=NC(=O)NCC1Cl Amb27166738 [0,2,0,0,0,0|2,0,0]=4 5317 B9R1.69 NC1CC(O)CCC1=O Amb28430066 [0,2,0,0,0,0|0,0,2]=4 5318 B9R1.69 NC1CC(O)CNC1=O Amb25076949 [0,2,0,0,0,0|1,0,1]=4 5319 B9R1.69 NC1CCC(=O)N(P)C1 Amb25303528 [0,2,0,0,0,0|1,0,1]=4 5320 B9R1.69 NC1CCC(=O)NC1=O Amb16233835 [0,2,0,0,0,0|1,0,0]=3 5321 B9R1.69 NC1CCC(=O)NC1=O Amb20620338 [0,2,0,0,0,0|1,0,0]=3 5322 B9R1.69 NC1CCC(=O)NC1=O Amb22640986 [0,2,0,0,0,0|1,0,0]=3 5323 B9R1.69 NC1CCC(=O)NC1=O Amb30982658 [0,2,0,0,0,0|1,0,0]=3 5324 B9R1.69 NC1CCC(=O)OC1=O Amb27838431 [0,2,0,0,0,0|1,0,0]=3 5325 B9R1.69 NC1CNC(=O)NC1=O Amb28429840 [0,2,0,0,0,0|2,0,0]=4 5326 B9R1.69 N[C@@H]1CCC(=O)NC1=O Amb18536900 [0,2,0,0,0,0|1,0,0]=3 5327 B9R1.69 N[C@@H]1CCC(=O)NC1=O Amb31291118 [0,2,0,0,0,0|1,0,0]=3 5328 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22745558 [0,2,0,0,0,0|1,0,1]=4 5329 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22755435 [0,2,0,0,0,0|1,0,1]=4 5330 B9R1.69 N[C@H]1CCC(O)NC1=O Amb26317903 [0,2,0,0,0,0|1,0,1]=4 5331 B9R1.69 N[C@H]1C[C@@H](O)CNC1=O Amb25277394 [0,2,0,0,0,0|1,0,1]=4 5332 B9R1.69 O=C1C=C(Br)C(O)CC1 Amb28049179 [0,2,0,0,0,0|0,0,0]=2 5333 B9R1.69 O=C1C=CC(=O)C(O)C1 Amb27191875 [0,2,0,0,0,0|0,0,1]=3 5334 B9R1.69 O=C1C=CC(=O)N(O)C1 Amb27227026 [0,2,0,0,0,0|1,0,1]=4 5335 B9R1.69 O=C1C=CC(O)C(O)C1 Amb27984020 [0,2,0,0,0,0|0,0,0]=2 5336 B9R1.69 O=C1C=CC(O)[C@H](O)C1 Amb27836776 [0,2,0,0,0,0|0,0,0]=2 5337 B9R1.69 O=C1C=CC([Na])C(=O)N1 Amb28289811 [0,2,0,0,0,0|1,0,1]=4 5338 B9R1.69 O=C1CCC(Br)C(=O)N1 Amb22735973 [0,2,0,0,0,0|1,0,0]=3 5339 B9R1.69 O=C1CCC(Br)C(=O)O1 Amb25680134 [0,2,0,0,0,0|1,0,0]=3 5340 B9R1.69 O=C1CCC(Cl)CC1Cl Amb27237551 [0,2,0,0,0,0|0,0,2]=4 5341 B9R1.69 O=C1CCC(O)C(=O)C1 Amb27409551 [0,2,0,0,0,0|0,0,1]=3 5342 B9R1.69 O=C1CCC(O)C=C1Br Amb27768825 [0,2,0,0,0,0|0,0,0]=2 5343 B9R1.69 O=C1CCC(O)CC1O Amb27494789 [0,2,0,0,0,0|0,0,2]=4 5344 B9R1.69 O=C1CC[C@H](Br)C[C@H]1Cl Amb27622141 [0,2,0,0,0,0|0,0,2]=4 5345 B9R1.69 O=C1CC[C@H](Cl)C[C@@H]1Cl Amb27799562 [0,2,0,0,0,0|0,0,2]=4 5346 B9R1.69 O=C1CC[C@H](Cl)C[C@H]1Br Amb27229463 [0,2,0,0,0,0|0,0,2]=4 5347 B9R1.69 O=C1CC[C@H](Cl)C[C@H]1Cl Amb27789880 [0,2,0,0,0,0|0,0,2]=4 5348 B9R1.69 O=C1CC[C@H](O)C(=O)N1 Amb27954578 [0,2,0,0,0,0|1,0,0]=3 5349 B9R1.69 O=C1C[C@H](O)[C@H](O)CN1 Amb24517387 [0,2,0,0,0,0|1,0,1]=4 5350 B9R1.69 O=C1NCC(Br)C(=O)N1 Amb1156185 [0,2,0,0,0,0|2,0,0]=4 5351 B9R1.69 O=C1NCC(Cl)C(=O)N1 Amb2099523 [0,2,0,0,0,0|2,0,0]=4 5352 B9R1.69 O=C1NCC(F)C(=O)N1 Amb17614408 [0,2,0,0,0,0|2,0,0]=4 5353 B9R1.69 O=C1NCC(O)CC1O Amb28247470 [0,2,0,0,0,0|1,0,1]=4 5354 B9R1.69 O=C1NC[C@@H](F)C(=O)N1 Amb26889424 [0,2,0,0,0,0|2,0,0]=4 5355 B9R1.69 O=C1NC[C@H](O)C[C@H]1O Amb27460866 [0,2,0,0,0,0|1,0,1]=4 5356 B9R1.69 O=C1OCC(Br)C=C1Br Amb25727424 [0,2,0,0,0,0|1,0,0]=3 5357 B9R1.69 O[C@H]1C=C[C@@H](O)[C@H](O)C1 Amb27812560 [0,2,0,0,0,0|0,0,2]=4 5358 B9R1.69 O[C@H]1C=C[C@H](O)C[C@H]1O Amb27261720 [0,2,0,0,0,0|0,0,2]=4 5359 B9R1.69 O[C@H]1CCC(Br)=C[C@H]1O Amb27981973 [0,2,0,0,0,0|0,0,2]=4 5360 B9R1.69 O[C@H]1C[C@@H](O)C=C[C@H]1O Amb28350425 [0,2,0,0,0,0|0,0,2]=4 5361 B9R1.3 C=C1C(=O)CCC[C@@H]1C Amb27838735 [0,2,0,0,0,0|0,0,1]=3 5362 B9R1.3 C=C1C=CC[C@@H](O)[C@@H]1O Amb28248512 [0,2,0,0,0,0|1,0,0]=3 5363 B9R1.3 C=C1CCCC(O)C1=C Amb28206856 [0,2,0,0,0,0|0,0,2]=4 5364 B9R1.3 C=C1CCCN(C)C1=O Amb522206 [0,2,0,0,0,0|1,0,1]=4 5365 B9R1.3 CC1=C(Br)C(O)CCC1 Amb25811521 [0,2,0,0,0,0|0,0,2]=4 5366 B9R1.3 CC1=C(Br)CCNC1=O Amb28128472 [0,2,0,0,0,0|1,0,0]=3 5367 B9R1.3 CC1=C(Br)[C@H](O)CCC1 Amb27772139 [0,2,0,0,0,0|0,0,2]=4 5368 B9R1.3 CC1=C(C)C(=N)NCC1 Amb27468705 [0,2,0,0,0,0|2,0,0]=4 5369 B9R1.3 CC1=C(C)C(=O)CCC1 Amb17593288 [0,2,0,0,0,0|0,0,0]=2 5370 B9R1.3 CC1=C(C)C(=O)NCC1 Amb26025701 [0,2,0,0,0,0|1,0,0]=3 5371 B9R1.3 CC1=C(C)C(Br)CCC1 Amb27862157 [0,2,0,0,0,0|1,0,1]=4 5372 B9R1.3 CC1=C(C)C(O)CCC1 Amb27450753 [0,2,0,0,0,0|0,0,2]=4 5373 B9R1.3 CC1=C(C)[C@H](O)CCC1 Amb27399340 [0,2,0,0,0,0|0,0,2]=4 5374 B9R1.3 CC1=C(Cl)CCCC1=O Amb4036614 [0,2,0,0,0,0|0,0,0]=2 5375 B9R1.3 CC1=C(Cl)CCCC1O Amb10552852 [0,2,0,0,0,0|0,0,2]=4 5376 B9R1.3 CC1=C(N)CCCC1=O Amb27798039 [0,2,0,0,0,0|0,0,0]=2 5377 B9R1.3 CC1=C(O)C(=O)CCO1 Amb24736224 [0,2,0,0,0,0|1,0,0]=3 5378 B9R1.3 CC1=C(O)CCCC1=O Amb25147218 [0,2,0,0,0,0|0,0,0]=2 5379 B9R1.3 CC1=CCCC(C)C1=O Amb17593286 [0,2,0,0,0,0|0,0,0]=2 5380 B9R1.3 CC1=CCC[C@@H](C)C1Br Amb27407012 [0,2,0,0,0,0|1,0,1]=4 5381 B9R1.3 CC1=CCC[C@@H](O)[C@@H]1O Amb27422504 [0,2,0,0,0,0|0,0,2]=4 5382 B9R1.3 CC1=COCC(C)C1=O Amb24545605 [0,2,0,0,0,0|1,0,0]=3 5383 B9R1.3 CC1=NC=CC(=O)C1O Amb22015135 [0,2,0,0,0,0|1,0,1]=4 5384 B9R1.3 CC1C(=O)CCCC1=O Amb3993683 [0,2,0,0,0,0|0,0,1]=3 5385 B9R1.3 CC1C(=O)CCCN1C Amb28253362 [0,2,0,0,0,0|1,0,1]=4 5386 B9R1.3 CC1C(=O)CCC[C@H]1C Amb27951545 [0,2,0,0,0,0|0,0,2]=4 5387 B9R1.3 CC1C(=O)CCNC1=O Amb25220145 [0,2,0,0,0,0|1,0,1]=4 5388 B9R1.3 CC1C(=O)CSCC1=O Amb27199104 [0,2,0,0,0,0|1,0,1]=4 5389 B9R1.3 CC1C(=O)NCCC1O Amb27836723 [0,2,0,0,0,0|1,0,1]=4 5390 B9R1.3 CC1C=CCC(=O)C1C Amb28245024 [0,2,0,0,0,0|0,0,2]=4 5391 B9R1.3 CC1C=CCC(C)C1C Amb26068926 [0,2,0,0,0,0|1,0,1]=4 5392 B9R1.3 CC1C=CCC(O)C1O Amb27756031 [0,2,0,0,0,0|1,0,1]=4 5393 B9R1.3 CC1CC=CC(=O)C1C Amb27838646 [0,2,0,0,0,0|0,0,0]=2 5394 B9R1.3 CC1CC=CC(O)C1O Amb27466712 [0,2,0,0,0,0|0,0,2]=4 5395 B9R1.3 CC1CCCC(=O)C1Br Amb24355950 [0,2,0,0,0,0|0,0,2]=4 5396 B9R1.3 CC1CCCC(=O)C1C Amb27593439 [0,2,0,0,0,0|0,0,2]=4 5397 B9R1.3 CC1CCCC(=O)C1F Amb28381160 [0,2,0,0,0,0|0,0,2]=4 5398 B9R1.3 CC1CCCC(=O)C1O Amb27838796 [0,2,0,0,0,0|0,0,2]=4 5399 B9R1.3 CC1CCCC(C)C1=O Amb9702826 [0,2,0,0,0,0|0,0,2]=4 5400 B9R1.3 CC1CCCC(F)C1=O Amb24400707 [0,2,0,0,0,0|0,0,2]=4 5401 B9R1.3 CC1CCC[C@@H](C)C1=O Amb27262957 [0,2,0,0,0,0|0,0,2]=4 5402 B9R1.3 CC1CCC[C@H](Cl)C1=O Amb28388615 [0,2,0,0,0,0|0,0,2]=4 5403 B9R1.3 CC1CCNC(=O)C1Br Amb27658951 [0,2,0,0,0,0|1,0,1]=4 5404 B9R1.3 CC1CCNC(=O)C1N Amb22229171 [0,2,0,0,0,0|1,0,1]=4 5405 B9R1.3 CC1OC=CC(=O)C1=O Amb26429858 [0,2,0,0,0,0|1,0,1]=4 5406 B9R1.3 CN1C(=O)C=CCC1=O Amb27485739 [0,2,0,0,0,0|1,0,1]=4 5407 B9R1.3 CN1C(=O)CCCC1=O Amb22757472 [0,2,0,0,0,0|1,0,0]=3 5408 B9R1.3 CN1C(=O)CCCC1N Amb28285249 [0,2,0,0,0,0|1,0,1]=4 5409 B9R1.3 CN1C(=O)CCNC1=O Amb26628800 [0,2,0,0,0,0|2,0,0]=4 5410 B9R1.3 CN1C(=O)CCNC1=S Amb27478284 [0,2,0,0,0,0|2,0,0]=4 5411 B9R1.3 CN1C(=O)CNCC1=O Amb17334097 [0,2,0,0,0,0|2,0,0]=4 5412 B9R1.3 CN1C(=O)CNCC1=O Amb32412577 [0,2,0,0,0,0|2,0,0]=4 5413 B9R1.3 CN1C(=O)CNCC1=O Amb33249619 [0,2,0,0,0,0|2,0,0]=4 5414 B9R1.3 CN1C(=O)NCCC1=S Amb27458995 [0,2,0,0,0,0|2,0,0]=4 5415 B9R1.3 CN1CCCC(=O)C1=O Amb33547367 [0,2,0,0,0,0|1,0,0]=3 5416 B9R1.3 CN1CCCC(Br)C1=O Amb25924539 [0,2,0,0,0,0|1,0,1]=4 5417 B9R1.3 CN1CCCC(N)C1=O Amb23440176 [0,2,0,0,0,0|1,0,1]=4 5418 B9R1.3 CN1CCCC(N)C1=O Amb33536522 [0,2,0,0,0,0|1,0,1]=4 5419 B9R1.3 CN1CCCC(O)C1=O Amb17593360 [0,2,0,0,0,0|1,0,1]=4 5420 B9R1.3 CN1CCC[C@@H](N)C1=O Amb22745485 [0,2,0,0,0,0|1,0,1]=4 5421 B9R1.3 CN1CCC[C@@H](N)C1=O Amb25709654 [0,2,0,0,0,0|1,0,1]=4 5422 B9R1.3 CN1CCC[C@@H](O)C1=O Amb27250591 [0,2,0,0,0,0|1,0,1]=4 5423 B9R1.3 CN1CCC[C@H](N)C1=O Amb26503808 [0,2,0,0,0,0|1,0,1]=4 5424 B9R1.3 CN1CCC[C@H](N)C1=O Amb33801269 [0,2,0,0,0,0|1,0,1]=4 5425 B9R1.3 CN1CCNC(=O)C1=O Amb16544042 [0,2,0,0,0,0|2,0,0]=4 5426 B9R1.3 CN1OCCC(Br)C1=O Amb28458375 [0,2,0,0,0,0|2,0,0]=4 5427 B9R1.3 C[C@@H]1C(=O)C=CC[C@H]1C Amb28054028 [0,2,0,0,0,0|0,0,0]=2 5428 B9R1.3 C[C@@H]1C(=O)CCC[C@@H]1N Amb27818101 [0,2,0,0,0,0|0,0,2]=4 5429 B9R1.3 C[C@@H]1C=CC[C@@H](O)[C@@H]1O Amb28127362 [0,2,0,0,0,0|1,0,1]=4 5430 B9R1.3 C[C@@H]1CCCC(=O)C1F Amb27802756 [0,2,0,0,0,0|0,0,2]=4 5431 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1F Amb28324355 [0,2,0,0,0,0|0,0,2]=4 5432 B9R1.3 C[C@@H]1CCOC(=O)[C@H]1O Amb27197166 [0,2,0,0,0,0|1,0,1]=4 5433 B9R1.3 C[C@H]1C=CCC(=O)[C@H]1C Amb27441703 [0,2,0,0,0,0|0,0,2]=4 5434 B9R1.3 C[C@H]1C=CC[C@@H](O)[C@@H]1O Amb27197562 [0,2,0,0,0,0|1,0,1]=4 5435 B9R1.3 C[C@H]1CC=CC(=O)[C@H]1C Amb27441720 [0,2,0,0,0,0|0,0,0]=2 5436 B9R1.3 C[C@H]1CCCC(=O)[C@@H]1C Amb27432624 [0,2,0,0,0,0|0,0,2]=4 5437 B9R1.3 C[C@H]1CCC[C@@H](Br)C1=O Amb28132271 [0,2,0,0,0,0|0,0,2]=4 5438 B9R1.3 C[C@H]1CCC[C@H](F)C1=O Amb28202070 [0,2,0,0,0,0|0,0,2]=4 5439 B9R1.3 C[C@H]1CCOC(=O)[C@@H]1O Amb27196773 [0,2,0,0,0,0|1,0,1]=4 5440 B9R1.3 Cl[C@H]1CC=C[C@@H](Cl)[C@@H]1Cl Amb27776693 [0,2,0,0,0,0|1,0,1]=4 5441 B9R1.3 NC1CCCC(=O)C1=O Amb28042602 [0,2,0,0,0,0|0,0,1]=3 5442 B9R1.3 NC1CCCN(O)C1=O Amb25062670 [0,2,0,0,0,0|1,0,1]=4 5443 B9R1.3 NC1CCNC(N)C1=O Amb27644630 [0,2,0,0,0,0|1,0,1]=4 5444 B9R1.3 NC1CNNC(=O)C1Cl Amb27437980 [0,2,0,0,0,0|2,0,0]=4 5445 B9R1.3 N[C@@H]1CCCN(O)C1=O Amb28254924 [0,2,0,0,0,0|1,0,1]=4 5446 B9R1.3 N[C@H]1CCCN(O)C1=O Amb27759969 [0,2,0,0,0,0|1,0,1]=4 5447 B9R1.3 O=C1C(Cl)=CN=CC1Cl Amb22001411 [0,2,0,0,0,0|1,0,1]=4 5448 B9R1.3 O=C1C(Cl)CCCC1Cl Amb24480185 [0,2,0,0,0,0|0,0,2]=4 5449 B9R1.3 O=C1C(F)CCCC1Cl Amb28285276 [0,2,0,0,0,0|0,0,2]=4 5450 B9R1.3 O=C1C(I)=CN=CC1I Amb27805910 [0,2,0,0,0,0|1,0,1]=4 5451 B9R1.3 O=C1C(O)=CCOC1O Amb27164545 [0,2,0,0,0,0|1,0,0]=3 5452 B9R1.3 O=C1C(O)CCCC1Br Amb27483787 [0,2,0,0,0,0|0,0,2]=4 5453 B9R1.3 O=C1C=CCC(Cl)=C1Cl Amb27948594 [0,2,0,0,0,0|0,0,2]=4 5454 B9R1.3 O=C1CCCC(=O)C1=O Amb27838803 [0,2,0,0,0,0|0,0,0]=2 5455 B9R1.3 O=C1CCCC(=O)C1Br Amb33527290 [0,2,0,0,0,0|0,0,1]=3 5456 B9R1.3 O=C1CCCC(=O)C1Cl Amb25726716 [0,2,0,0,0,0|0,0,1]=3 5457 B9R1.3 O=C1CCCC(=O)N1Br Amb4015558 [0,2,0,0,0,0|1,0,0]=3 5458 B9R1.3 O=C1CCCC(Br)C1=O Amb27866033 [0,2,0,0,0,0|0,0,1]=3 5459 B9R1.3 O=C1CCCC(Br)C1O Amb27858762 [0,2,0,0,0,0|0,0,2]=4 5460 B9R1.3 O=C1CCCC(Cl)=C1Cl Amb24736273 [0,2,0,0,0,0|0,0,0]=2 5461 B9R1.3 O=C1CCCC(Cl)C1Br Amb26624735 [0,2,0,0,0,0|0,0,2]=4 5462 B9R1.3 O=C1CCCC(F)C1Br Amb25840986 [0,2,0,0,0,0|0,0,2]=4 5463 B9R1.3 O=C1CCCC(O)=C1Cl Amb2724553 [0,2,0,0,0,0|0,0,0]=2 5464 B9R1.3 O=C1CCCC(O)=C1F Amb27599391 [0,2,0,0,0,0|0,0,0]=2 5465 B9R1.3 O=C1CCCC(O)=C1I Amb31291506 [0,2,0,0,0,0|0,0,0]=2 5466 B9R1.3 O=C1CCC[C@H](Br)[C@@H]1O Amb27974655 [0,2,0,0,0,0|0,0,2]=4 5467 B9R1.3 O=C1NCC[C@@H](O)[C@@H]1O Amb28057700 [0,2,0,0,0,0|1,0,1]=4 5468 B9R1.3 O=C1NCC[C@H](O)[C@@H]1O Amb27202725 [0,2,0,0,0,0|1,0,1]=4 5469 B9R1.3 O=C1NNCC(Br)C1Br Amb26065676 [0,2,0,0,0,0|2,0,0]=4 5470 B9R1.3 O=C1NNCC(Cl)C1Cl Amb27612893 [0,2,0,0,0,0|2,0,0]=4 5471 B9R1.3 O=C1[C@@H](Cl)CCC[C@H]1Cl Amb27771094 [0,2,0,0,0,0|0,0,2]=4 5472 B9R1.3 O=C1[C@@H](F)CCC[C@H]1Br Amb27253622 [0,2,0,0,0,0|0,0,2]=4 5473 B9R1.3 O=C1[C@@H](F)CCC[C@H]1F Amb27836851 [0,2,0,0,0,0|0,0,2]=4 5474 B9R1.3 O=C1[C@H](Cl)CCC[C@H]1Br Amb27630665 [0,2,0,0,0,0|0,0,2]=4 5475 B9R1.3 O=C1[C@H](F)CCC[C@H]1F Amb27489318 [0,2,0,0,0,0|0,0,2]=4 5476 B9R1.3 O=C1[C@H](O)CCC[C@H]1O Amb28052305 [0,2,0,0,0,0|0,0,2]=4 5477 B9R1.3 OC1CCC=C(Br)C1O Amb27758755 [0,2,0,0,0,0|0,0,2]=4 5478 B9R1.3 OC1CCC=C(Cl)C1Cl Amb27665376 [0,2,0,0,0,0|1,0,1]=4 5479 B9R1.3 OC1CCC=C(F)C1O Amb27604467 [0,2,0,0,0,0|0,0,2]=4 5480 B9R1.3 O[C@H]1C=CC[C@H](O)[C@@H]1O Amb27207844 [0,2,0,0,0,0|0,0,2]=4 5481 B9R1.3 O[C@H]1CCC=C(Cl)[C@@H]1Cl Amb27440459 [0,2,0,0,0,0|1,0,1]=4 5482 B9R1.34 C=C1CC(=O)NC(=O)C1 Amb27437919 [0,2,0,0,0,0|1,0,1]=4 5483 B9R1.34 CC1=CC(=N)NC(C)C1 Amb27179678 [0,2,0,0,0,0|2,0,0]=4 5484 B9R1.34 CC1=CC(=O)CC(=O)O1 Amb17778431 [0,2,0,0,0,0|1,0,1]=4 5485 B9R1.34 CC1=CC(=O)CC(C)C1 Amb4605909 [0,2,0,0,0,0|0,0,0]=2 5486 B9R1.34 CC1=CC(=O)CC(C)O1 Amb25267464 [0,2,0,0,0,0|1,0,0]=3 5487 B9R1.34 CC1=CC(=O)NC(C)C1 Amb27852830 [0,2,0,0,0,0|1,0,0]=3 5488 B9R1.34 CC1=CC(=O)OC(=O)C1 Amb17673901 [0,2,0,0,0,0|1,0,1]=4 5489 B9R1.34 CC1=CC(C)CC(=O)C1 Amb26515881 [0,2,0,0,0,0|0,0,2]=4 5490 B9R1.34 CC1=CC(C)CC(=O)O1 Amb27812237 [0,2,0,0,0,0|1,0,1]=4 5491 B9R1.34 CC1=CC(C)CC(C)C1 Amb27448286 [0,2,0,0,0,0|1,0,1]=4 5492 B9R1.34 CC1=CC(O)CC(=O)O1 Amb16231305 [0,2,0,0,0,0|1,0,1]=4 5493 B9R1.34 CC1=CC(O)CC(C)C1 Amb27255196 [0,2,0,0,0,0|0,0,2]=4 5494 B9R1.34 CC1=C[C@@H](O)C[C@@H](C)C1 Amb27184430 [0,2,0,0,0,0|0,0,2]=4 5495 B9R1.34 CC1=C[C@@H](O)C[C@H](C)C1 Amb28131011 [0,2,0,0,0,0|0,0,2]=4 5496 B9R1.34 CC1=C[C@H](Cl)C[C@H](C)C1 Amb27233565 [0,2,0,0,0,0|1,0,1]=4 5497 B9R1.34 CC1CC(=O)C=C(Cl)C1 Amb7094066 [0,2,0,0,0,0|0,0,0]=2 5498 B9R1.34 CC1CC(=O)C=C(N)C1 Amb7094072 [0,2,0,0,0,0|0,0,0]=2 5499 B9R1.34 CC1CC(=O)CC(=O)C1 Amb772649 [0,2,0,0,0,0|0,0,1]=3 5500 B9R1.34 CC1CC(=O)CC(=O)N1 Amb22750293 [0,2,0,0,0,0|1,0,1]=4 5501 B9R1.34 CC1CC(=O)CC(=O)O1 Amb24422515 [0,2,0,0,0,0|1,0,1]=4 5502 B9R1.34 CC1CC(=O)CC(C)C1 Amb4035859 [0,2,0,0,0,0|0,0,2]=4 5503 B9R1.34 CC1CC(=O)CN(C)C1 Amb2369958 [0,2,0,0,0,0|1,0,1]=4 5504 B9R1.34 CC1CC(=O)C[C@@H](C)C1 Amb28201262 [0,2,0,0,0,0|0,0,2]=4 5505 B9R1.34 CC1CC(=O)NC(=O)C1 Amb17940391 [0,2,0,0,0,0|1,0,0]=3 5506 B9R1.34 CC1CC(=O)NC(=O)N1 Amb2196506 [0,2,0,0,0,0|2,0,0]=4 5507 B9R1.34 CC1CC(=O)NC(=O)S1 Amb27636402 [0,2,0,0,0,0|2,0,0]=4 5508 B9R1.34 CC1CC(=O)NC(=S)S1 Amb27622206 [0,2,0,0,0,0|2,0,0]=4 5509 B9R1.34 CC1CC(=O)NC(C)C1 Amb27760003 [0,2,0,0,0,0|1,0,1]=4 5510 B9R1.34 CC1CC(=O)NC(S)=N1 Amb5716287 [0,2,0,0,0,0|2,0,0]=4 5511 B9R1.34 CC1CC(=O)OC(=O)C1 Amb534202 [0,2,0,0,0,0|1,0,0]=3 5512 B9R1.34 CC1CC(=O)OC(=O)N1 Amb28285254 [0,2,0,0,0,0|2,0,0]=4 5513 B9R1.34 CC1CC(O)=CC(=O)O1 Amb22347797 [0,2,0,0,0,0|1,0,0]=3 5514 B9R1.34 CC1CC(O)CC(=O)N1 Amb27257554 [0,2,0,0,0,0|1,0,1]=4 5515 B9R1.34 CC1CC(O)CC(=O)O1 Amb23455145 [0,2,0,0,0,0|1,0,1]=4 5516 B9R1.34 CN1CC(=O)C=C(O)C1 Amb27604418 [0,2,0,0,0,0|1,0,0]=3 5517 B9R1.34 CN1CC(=O)CC(=O)C1 Amb22802168 [0,2,0,0,0,0|1,0,1]=4 5518 B9R1.34 CN1CC(=O)NC(=O)C1 Amb449715 [0,2,0,0,0,0|2,0,0]=4 5519 B9R1.34 CN1CC(=O)OC(=O)C1 Amb24673917 [0,2,0,0,0,0|2,0,0]=4 5520 B9R1.34 C[C@@H]1CC(=O)C[C@@H](C)C1 Amb27855014 [0,2,0,0,0,0|0,0,2]=4 5521 B9R1.34 C[C@@H]1CC(=O)C[C@H](C)C1 Amb24568269 [0,2,0,0,0,0|0,0,2]=4 5522 B9R1.34 C[C@@H]1C[C@H](N)CC(=O)N1 Amb28134031 [0,2,0,0,0,0|1,0,1]=4 5523 B9R1.34 C[C@H]1CC(=O)CC(=O)N1 Amb27168280 [0,2,0,0,0,0|1,0,1]=4 5524 B9R1.34 C[C@H]1C[C@@H](C)CC(=O)N1 Amb33484017 [0,2,0,0,0,0|1,0,1]=4 5525 B9R1.34 NC1=CC(=O)CC(=O)N1 Amb25146729 [0,2,0,0,0,0|1,0,1]=4 5526 B9R1.34 NC1=CC(=O)NC(=O)C1 Amb24560228 [0,2,0,0,0,0|1,0,1]=4 5527 B9R1.34 NC1CC(=O)NC(=O)C1 Amb30869723 [0,2,0,0,0,0|1,0,0]=3 5528 B9R1.34 NC1CC(=O)NC(=O)C1 Amb6261880 [0,2,0,0,0,0|1,0,0]=3 5529 B9R1.34 N[C@@H]1CC(=O)C[C@H](N)C1 Amb28326235 [0,2,0,0,0,0|0,0,2]=4 5530 B9R1.34 O=C1C=C(O)CC(=O)N1 Amb27410873 [0,2,0,0,0,0|1,0,1]=4 5531 B9R1.34 O=C1C=C(O)CC(=O)O1 Amb25689610 [0,2,0,0,0,0|1,0,1]=4 5532 B9R1.34 O=C1CC(=O)CC(O)C1 Amb27838801 [0,2,0,0,0,0|0,0,1]=3 5533 B9R1.34 O=C1CC(=O)CS(=O)C1 Amb27599003 [0,2,0,0,0,0|1,0,1]=4 5534 B9R1.34 O=C1CC(=O)NC(=O)C1 Amb18832704 [0,2,0,0,0,0|1,0,1]=4 5535 B9R1.34 O=C1CC(I)CC(O)N1 Amb27451041 [0,2,0,0,0,0|1,0,1]=4 5536 B9R1.34 O=C1C[C@@H](O)C[C@@H](O)C1 Amb27838772 [0,2,0,0,0,0|0,0,2]=4 5537 B9R1.34 O=C1C[C@H](O)C[C@@H](O)C1 Amb28074737 [0,2,0,0,0,0|0,0,2]=4 5538 B9R1.66 CC1(C)C=CCC(O)C1 Amb28049242 [0,2,0,0,0,0|1,0,1]=4 5539 B9R1.66 CC1(C)C=COC(=O)C1 Amb26551706 [0,2,0,0,0,0|1,0,1]=4 5540 B9R1.66 CC1(C)CC(=O)C=CO1 Amb27791423 [0,2,0,0,0,0|1,0,0]=3 5541 B9R1.66 CC1(C)CC=CC(=O)C1 Amb9782605 [0,2,0,0,0,0|0,0,0]=2 5542 B9R1.66 CC1(C)CC=CC(Br)C1 Amb27232963 [0,2,0,0,0,0|1,0,1]=4 5543 B9R1.66 CC1(C)CC=CC(O)C1 Amb27431061 [0,2,0,0,0,0|0,0,2]=4 5544 B9R1.66 CC1(C)CC=C[C@@H](O)C1 Amb28281908 [0,2,0,0,0,0|0,0,2]=4 5545 B9R1.66 CC1(C)CCCC(=O)C1 Amb13883565 [0,2,0,0,0,0|0,0,2]=4 5546 B9R1.66 CC1(C)CCCC(=O)N1 Amb26079134 [0,2,0,0,0,0|1,0,1]=4 5547 B9R1.66 CC1(C)CCCC(=O)O1 Amb25863489 [0,2,0,0,0,0|1,0,1]=4 5548 B9R1.66 CC1(C)CCNC(=O)C1 Amb24451332 [0,2,0,0,0,0|1,0,1]=4 5549 B9R1.66 CC1(C)CCOC(=O)C1 Amb27826965 [0,2,0,0,0,0|1,0,1]=4 5550 B9R1.66 CC1(C)COCC(=O)C1 Amb26515851 [0,2,0,0,0,0|1,0,1]=4 5551 B9R1.66 CC1(C)OC=CC(=O)O1 Amb27635269 [0,2,0,0,0,0|2,0,0]=4 5552 B9R1.66 CC1(N)C=C(N)C=CC1 Amb27832320 [0,2,0,0,0,0|1,0,1]=4 5553 B9R1.66 CC1(O)CC=CC(O)C1 Amb28071460 [0,2,0,0,0,0|0,0,2]=4 5554 B9R1.66 CC1(O)CCCC(=O)C1 Amb28202235 [0,2,0,0,0,0|0,0,2]=4 5555 B9R1.66 CC1(O)CCOC(=O)C1 Amb2695275 [0,2,0,0,0,0|1,0,1]=4 5556 B9R1.66 CC1C=CCC(C)(C)C1 Amb24415577 [0,2,0,0,0,0|1,0,1]=4 5557 B9R1.66 CC1CC=CC(C)(C)C1 Amb22229014 [0,2,0,0,0,0|1,0,1]=4 5558 B9R1.66 C[C@@]1(O)CCOC(=O)C1 Amb22388612 [0,2,0,0,0,0|1,0,1]=4 5559 B9R1.66 C[Si]1(C)CCCC(=O)O1 Amb27845166 [0,2,0,0,0,0|1,1,0]=4 5560 B9R1.66 NC1=NS(=O)(=O)CCC1 Amb27223679 [0,2,0,0,0,0|2,0,0]=4 5561 B9R1.66 O=C1CC(F)(F)CCN1 Amb24567328 [0,2,0,0,0,0|1,0,1]=4 5562 B9R1.66 O=C1CCCC(F)(F)C1 Amb24543971 [0,2,0,0,0,0|0,0,2]=4 5563 B9R1.66 O=C1CCCS(=O)(=O)C1 Amb13953230 [0,2,0,0,0,0|1,0,1]=4 5564 B9R1.66 O=C1CCCS(=O)(=O)N1 Amb10070303 [0,2,0,0,0,0|2,0,0]=4 5565 B9R1.66 O=C1CNCC(F)(F)C1 Amb27656873 [0,2,0,0,0,0|1,0,1]=4 5566 B9R1.40 CC1(Br)CCCCC1=O Amb17594983 [0,2,0,0,0,0|0,0,2]=4 5567 B9R1.40 CC1(C)C=CCCC1=O Amb27838775 [0,2,0,0,0,0|0,0,2]=4 5568 B9R1.40 CC1(C)C=CCCC1O Amb27485684 [0,2,0,0,0,0|1,0,1]=4 5569 B9R1.40 CC1(C)CCC=CC1=O Amb22356996 [0,2,0,0,0,0|0,0,0]=2 5570 B9R1.40 CC1(C)CCC=C[C@@H]1O Amb28454457 [0,2,0,0,0,0|0,0,2]=4 5571 B9R1.40 CC1(C)CCCCC1=O Amb17673753 [0,2,0,0,0,0|0,0,2]=4 5572 B9R1.40 CC1(C)CCCNC1=O Amb15701290 [0,2,0,0,0,0|1,0,1]=4 5573 B9R1.40 CC1(C)CCCOC1=O Amb19888333 [0,2,0,0,0,0|1,0,1]=4 5574 B9R1.40 CC1(C)CCOCC1=O Amb28386611 [0,2,0,0,0,0|1,0,1]=4 5575 B9R1.40 CC1(C)CCSCC1=O Amb27256830 [0,2,0,0,0,0|1,0,1]=4 5576 B9R1.40 CC1(C)COC=CC1=O Amb24360651 [0,2,0,0,0,0|1,0,0]=3 5577 B9R1.40 CC1(C)OCCCC1=O Amb28253367 [0,2,0,0,0,0|1,0,1]=4 5578 B9R1.40 CC1(Cl)CCCC=C1Cl Amb27638119 [0,2,0,0,0,0|1,0,1]=4 5579 B9R1.40 CC1(Cl)CCCCC1=O Amb15693404 [0,2,0,0,0,0|0,0,2]=4 5580 B9R1.40 CC1(F)CCCCC1=O Amb27838805 [0,2,0,0,0,0|0,0,2]=4 5581 B9R1.40 CC1(N)CCCNC1=O Amb32410904 [0,2,0,0,0,0|1,0,1]=4 5582 B9R1.40 CC1(O)COC=CC1=O Amb27267146 [0,2,0,0,0,0|1,0,0]=3 5583 B9R1.40 CC1=CCCCC1(C)C Amb25705834 [0,2,0,0,0,0|1,0,1]=4 5584 B9R1.40 CC1C=CCCC1(C)C Amb27837567 [0,2,0,0,0,0|1,0,1]=4 5585 B9R1.40 C[C@@]1(N)CCONC1=O Amb27449489 [0,2,0,0,0,0|2,0,0]=4 5586 B9R1.40 C[C@]1(N)CCCNC1=O Amb28285706 [0,2,0,0,0,0|1,0,1]=4 5587 B9R1.40 O=C1C=CC=CC1(Cl)Cl Amb27862884 [0,2,0,0,0,0|0,0,2]=4 5588 B9R1.40 O=C1CCCCC1(Cl)Cl Amb26936585 [0,2,0,0,0,0|0,0,2]=4 5589 B9R1.40 O=C1CCCCC1(F)Cl Amb27838680 [0,2,0,0,0,0|0,0,2]=4 5590 B9R1.40 O=C1CCCCC1(F)F Amb24117922 [0,2,0,0,0,0|0,0,2]=4 5591 B9R1.40 O=C1NCCCC1(Br)Br Amb22434360 [0,2,0,0,0,0|1,0,1]=4 5592 B9R1.40 O=C1NCCCC1(F)F Amb22899413 [0,2,0,0,0,0|1,0,1]=4 5593 B7R1.6 CCC=C1CCC1 Amb28120199 [0,0,1,1,0,0|1,0,1]=4 5594 B7R1.6 O=CC=C1CCC1 Amb27827363 [0,0,1,1,0,0|2,0,0]=4 5595 B7R1.8 CCC1CCC1=O Amb28137082 [0,0,1,1,0,0|0,0,2]=4 5596 B7R1.8 CCC1OCC1=O Amb23456089 [0,0,1,1,0,0|1,0,1]=4 5597 B7R1.8 COC1CCC1=O Amb22896543 [0,0,1,1,0,0|1,0,1]=4 5598 B7R1.8 CSC1CCC1=O Amb26054103 [0,0,1,1,0,0|1,0,1]=4 5599 B7R1.8 C\C=C1\CCC1=O Amb24512730 [0,0,1,1,0,0|0,0,0]=2 5600 B7R1.8 C\C=C1\CCC1O Amb27595035 [0,0,1,1,0,0|0,0,2]=4 5601 B7R1.8 O=CC1=C(Cl)CC1 Amb28050115 [0,0,1,1,0,0|2,0,0]=4 5602 B7R1.8 O=CC1=CCC1=O Amb27256480 [0,0,1,1,0,0|1,0,1]=4 5603 B7R1.15 C=C1C(=O)C=C1C Amb27802553 [0,0,1,1,0,0|0,0,2]=4 5604 B7R1.15 C=C1C(=O)NC1C Amb28350835 [0,0,1,1,0,0|1,0,0]=3 5605 B7R1.15 CC1=C(C)C(=O)C1 Amb27226738 [0,0,1,1,0,0|0,0,2]=4 5606 B7R1.15 CC1C(=O)CC1=O Amb24364046 [0,0,1,1,0,0|1,0,1]=4 5607 B7R1.15 CC1CC(=O)C1C Amb33551302 [0,0,1,1,0,0|0,0,2]=4 5608 B7R1.15 CC1NC(=O)C1C Amb22364651 [0,0,1,1,0,0|1,0,1]=4 5609 B7R1.15 C[C@@H]1C(=O)C[C@H]1C Amb27865634 [0,0,1,1,0,0|0,0,2]=4 5610 B7R1.15 C[C@H]1CC(=O)[C@@H]1C Amb27433516 [0,0,1,1,0,0|0,0,2]=4 5611 B7R1.15 C[C@H]1CC(=O)[C@H]1C Amb27788507 [0,0,1,1,0,0|0,0,2]=4 5612 B7R1.21 C\C=C\C1(N)CC1 Amb25835815 [0,0,1,1,0,0|1,0,1]=4 5613 B7R1.22 C=C(C=O)C1CC1 Amb28050249 [0,0,1,1,0,0|2,0,0]=4 5614 B7R1.22 C=CC(=O)C1CC1 Amb22059056 [0,0,1,1,0,0|0,0,0]=2 5615 B7R1.22 C=CC(=O)[C@@H]1CO1 Amb27859349 [0,0,1,1,0,0|1,0,0]=3 5616 B7R1.22 C=CC(N)C1CC1 Amb25296753 [0,0,1,1,0,0|1,0,1]=4 5617 B7R1.22 C=CC(N)C1CC1 Amb33527190 [0,0,1,1,0,0|1,0,1]=4 5618 B7R1.22 C=CC(O)C1CC1 Amb26635453 [0,0,1,1,0,0|0,0,2]=4 5619 B7R1.22 C=C[C@H](N)C1CC1 Amb27175395 [0,0,1,1,0,0|1,0,1]=4 5620 B7R1.22 CCC(=O)C1CC1 Amb17138359 [0,0,1,1,0,0|0,0,2]=4 5621 B7R1.22 CNC(=O)C1CC1 Amb33530537 [0,0,1,1,0,0|1,0,1]=4 5622 B7R1.22 COC(=O)C1CC1 Amb2689409 [0,0,1,1,0,0|1,0,1]=4 5623 B7R1.22 C\C(=C/Br)C1CC1 Amb27591985 [0,0,1,1,0,0|2,0,0]=4 5624 B7R1.22 N#CC(=O)C1CC1 Amb17231801 [0,0,1,1,0,0|1,0,1]=4 5625 B7R1.22 N=NC(=O)C1CC1 Amb28241431 [0,0,1,1,0,0|2,0,0]=4 5626 B7R1.22 NCC(=O)C1CC1 Amb18197870 [0,0,1,1,0,0|1,0,1]=4 5627 B7R1.22 NCC(=O)C1CC1 Amb33528322 [0,0,1,1,0,0|1,0,1]=4 5628 B7R1.22 NNC(=O)C1CC1 Amb6373977 [0,0,1,1,0,0|2,0,0]=4 5629 B7R1.22 O=C(CBr)C1CC1 Amb10879887 [0,0,1,1,0,0|1,0,1]=4 5630 B7R1.22 O=C(CCl)C1CC1 Amb24120625 [0,0,1,1,0,0|1,0,1]=4 5631 B7R1.22 O=C(CF)C1CC1 Amb23454824 [0,0,1,1,0,0|1,0,1]=4 5632 B7R1.22 O=C(CO)C1CC1 Amb18061832 [0,0,1,1,0,0|1,0,1]=4 5633 B7R1.22 O=C(NO)C1CC1 Amb6266675 [0,0,1,1,0,0|2,0,0]=4 5634 B7R1.22 O=CC(=O)C1CC1 Amb22900251 [0,0,1,1,0,0|1,0,0]=3 5635 B7R1.25 C=CC1(O)CCC1 Amb26654916 [0,0,1,1,0,0|0,0,2]=4 5636 B7R1.27 C=CC1(N)CC1C Amb27965807 [0,0,1,1,0,0|1,0,1]=4 5637 B7R1.7 CC\C=C\C1CO1 Amb33449783 [0,0,1,1,0,0|0,0,2]=4 5638 B7R1.7 CC\C=C\[C@@H]1CO1 Amb33272599 [0,0,1,1,0,0|0,0,2]=4 5639 B7R1.7 CC\C=C\[C@H]1CO1 Amb33272601 [0,0,1,1,0,0|0,0,2]=4 5640 B7R1.12 C=C(C)C1CC1N Amb33199895 [0,0,1,1,0,0|2,0,0]=4 5641 B7R1.12 C=C(C)[C@@H]1C[C@H]1N Amb33199897 [0,0,1,1,0,0|2,0,0]=4 5642 B7R1.12 C=C1CC1C(=O)O Amb9774969 [0,0,1,1,0,0|1,0,1]=4 5643 B7R1.12 C=C1CC1C(N)=O Amb28191145 [0,0,1,1,0,0|1,0,1]=4 5644 B7R1.12 CC(=O)C1CC1C Amb25720437 [0,0,1,1,0,0|0,0,2]=4 5645 B7R1.12 CC(=O)C1OC1C Amb25920285 [0,0,1,1,0,0|1,0,1]=4 5646 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [0,0,1,1,0,0|0,0,2]=4 5647 B7R1.12 CC(=O)[C@@H]1OC1C Amb27165592 [0,0,1,1,0,0|1,0,1]=4 5648 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [0,0,1,1,0,0|0,0,2]=4 5649 B7R1.12 CC(=O)[C@H]1O[C@H]1C Amb28052513 [0,0,1,1,0,0|1,0,1]=4 5650 B7R1.12 CC(=O)[C@H]1S[C@@H]1C Amb27231676 [0,0,1,1,0,0|1,0,1]=4 5651 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [0,0,1,1,0,0|1,0,1]=4 5652 B7R1.12 CC1CC1C(=O)O Amb9703126 [0,0,1,1,0,0|1,0,1]=4 5653 B7R1.12 CC1CC1C(N)=O Amb8858378 [0,0,1,1,0,0|1,0,1]=4 5654 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [0,0,1,1,0,0|1,0,1]=4 5655 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,1,1,0,0|1,0,1]=4 5656 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [0,0,1,1,0,0|1,0,1]=4 5657 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [0,0,1,1,0,0|1,0,1]=4 5658 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [0,0,1,1,0,0|1,0,1]=4 5659 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [0,0,1,1,0,0|1,0,1]=4 5660 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,1,1,0,0|1,0,1]=4 5661 B7R1.12 NC(=O)C1CC1Br Amb27838278 [0,0,1,1,0,0|2,0,0]=4 5662 B7R1.12 NC(=O)C1CC1F Amb26026786 [0,0,1,1,0,0|2,0,0]=4 5663 B7R1.12 NC(=O)C1CC1N Amb18279694 [0,0,1,1,0,0|2,0,0]=4 5664 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [0,0,1,1,0,0|2,0,0]=4 5665 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [0,0,1,1,0,0|2,0,0]=4 5666 B7R1.12 NC1CC1C(=O)O Amb7762823 [0,0,1,1,0,0|2,0,0]=4 5667 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [0,0,1,1,0,0|2,0,0]=4 5668 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [0,0,1,1,0,0|2,0,0]=4 5669 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [0,0,1,1,0,0|2,0,0]=4 5670 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [0,0,1,1,0,0|2,0,0]=4 5671 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [0,0,1,1,0,0|2,0,0]=4 5672 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,1,1,0,0|2,0,0]=4 5673 B7R1.12 O=C(O)C1CC1Br Amb27760446 [0,0,1,1,0,0|2,0,0]=4 5674 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [0,0,1,1,0,0|2,0,0]=4 5675 B7R1.12 O=C(O)C1CC1F Amb22490547 [0,0,1,1,0,0|2,0,0]=4 5676 B7R1.12 O=C(O)C1CC1I Amb26047069 [0,0,1,1,0,0|2,0,0]=4 5677 B7R1.12 O=C(O)C1CC1S Amb20246988 [0,0,1,1,0,0|2,0,0]=4 5678 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [0,0,1,1,0,0|2,0,0]=4 5679 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [0,0,1,1,0,0|2,0,0]=4 5680 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,1,1,0,0|2,0,0]=4 5681 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [0,0,1,1,0,0|2,0,0]=4 5682 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,1,1,0,0|2,0,0]=4 5683 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,1,1,0,0|2,0,0]=4 5684 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [0,0,1,1,0,0|2,0,0]=4 5685 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [0,0,1,1,0,0|2,0,0]=4 5686 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [0,0,1,1,0,0|2,0,0]=4 5687 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [0,0,1,1,0,0|2,0,0]=4 5688 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [0,0,1,1,0,0|2,0,0]=4 5689 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [0,0,1,1,0,0|2,0,0]=4 5690 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [0,0,1,1,0,0|2,0,0]=4 5691 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [0,0,1,1,0,0|2,0,0]=4 5692 B7R1.17 CC1C=CS1(=O)=O Amb22364955 [0,0,1,1,0,0|2,0,0]=4 5693 B7R1.18 C=C(C)C1CCC1 Amb25662691 [0,0,1,1,0,0|1,0,1]=4 5694 B7R1.18 C=C(C)C1CCN1 Amb33199611 [0,0,1,1,0,0|2,0,0]=4 5695 B7R1.18 C=C(F)C1CCC1 Amb27403200 [0,0,1,1,0,0|1,0,1]=4 5696 B7R1.18 CC(=O)C1=CCC1 Amb23453500 [0,0,1,1,0,0|0,0,0]=2 5697 B7R1.18 CC(=O)C1CCC1 Amb4037098 [0,0,1,1,0,0|0,0,2]=4 5698 B7R1.18 CC(=O)C1CCN1 Amb28142364 [0,0,1,1,0,0|1,0,1]=4 5699 B7R1.18 CC(=O)N1C=CC1 Amb22001815 [0,0,1,1,0,0|1,0,1]=4 5700 B7R1.18 CC(=O)N1CCC1 Amb22008358 [0,0,1,1,0,0|1,0,1]=4 5701 B7R1.18 NC(=O)C1CCC1 Amb33552668 [0,0,1,1,0,0|1,0,1]=4 5702 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,1,1,0,0|2,0,0]=4 5703 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,1,1,0,0|2,0,0]=4 5704 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [0,0,1,1,0,0|2,0,0]=4 5705 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [0,0,1,1,0,0|1,0,1]=4 5706 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [0,0,1,1,0,0|1,0,1]=4 5707 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [0,0,1,1,0,0|1,0,0]=3 5708 B7R1.18 O=C(O)C1CCC1 Amb2686619 [0,0,1,1,0,0|1,0,1]=4 5709 B7R1.18 O=C(O)C1CCN1 Amb2371568 [0,0,1,1,0,0|2,0,0]=4 5710 B7R1.18 O=C(O)C1CCN1 Amb8391098 [0,0,1,1,0,0|2,0,0]=4 5711 B7R1.18 O=C(O)C1CCO1 Amb2383526 [0,0,1,1,0,0|2,0,0]=4 5712 B7R1.18 O=C(O)C1CCS1 Amb27209836 [0,0,1,1,0,0|2,0,0]=4 5713 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [0,0,1,1,0,0|2,0,0]=4 5714 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [0,0,1,1,0,0|2,0,0]=4 5715 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [0,0,1,1,0,0|2,0,0]=4 5716 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [0,0,1,1,0,0|2,0,0]=4 5717 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [0,0,1,1,0,0|2,0,0]=4 5718 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [0,0,1,1,0,0|2,0,0]=4 5719 B7R1.18 O=C([O-])C1=CCC1 Amb34165365 [0,0,1,1,0,0|1,0,0]=3 5720 B7R1.20 C=C(C)CC1CC1 Amb27207160 [0,0,1,1,0,0|1,0,1]=4 5721 B7R1.20 C=C(C)CC1CO1 Amb33199536 [0,0,1,1,0,0|2,0,0]=4 5722 B7R1.20 CC(=O)C=C1CC1 Amb28201596 [0,0,1,1,0,0|0,0,0]=2 5723 B7R1.20 CC(=O)CC1CC1 Amb10603417 [0,0,1,1,0,0|0,0,2]=4 5724 B7R1.20 CC(=O)NC1CC1 Amb3366973 [0,0,1,1,0,0|1,0,1]=4 5725 B7R1.20 CC(O)C=C1CC1 Amb28189418 [0,0,1,1,0,0|0,0,2]=4 5726 B7R1.20 NC(=O)CC1CC1 Amb33552967 [0,0,1,1,0,0|1,0,1]=4 5727 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [0,0,1,1,0,0|1,0,1]=4 5728 B7R1.20 O=C(O)C=C1CC1 Amb8392543 [0,0,1,1,0,0|1,0,0]=3 5729 B7R1.20 O=C(O)CC1CC1 Amb2686657 [0,0,1,1,0,0|1,0,1]=4 5730 B7R1.20 O=C(O)CC1CO1 Amb25244347 [0,0,1,1,0,0|2,0,0]=4 5731 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [0,0,1,1,0,0|2,0,0]=4 5732 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [0,0,1,1,0,0|2,0,0]=4 5733 B7R1.20 O=S([O-])C=C1CC1 Amb32755418 [0,0,1,1,0,0|2,0,0]=4 5734 B7R1.24 C1=CCCC=CC1 Amb22365118 [0,0,1,1,0,0|1,0,1]=4 5735 B7R1.24 C1=CCCCC=C1 Amb22002708 [0,0,1,1,0,0|1,0,0]=3 5736 B7R1.24 C1=CCCCCC1 Amb8515344 [0,0,1,1,0,0|1,0,1]=4 5737 B7R1.24 C1=CCNCCC1 Amb25104535 [0,0,1,1,0,0|1,0,1]=4 5738 B7R1.24 C1=CCNCCC1 Amb33330391 [0,0,1,1,0,0|1,0,1]=4 5739 B7R1.24 C1=CNCCN=C1 Amb26896446 [0,0,1,1,0,0|2,0,0]=4 5740 B7R1.24 C1=COCCCC1 Amb28254269 [0,0,1,1,0,0|0,0,2]=4 5741 B7R2.12 C1=CC2NCC12 Amb24763738 [1,0,0,1,0,0|1,0,1]=4 5742 B7R2.13 C1=CC2OC2C1 Amb22002013 [1,0,0,1,0,0|1,0,1]=4 5743 B9R2.7 O=C1CC2C=CCC12 Amb8631505 [0,0,0,1,0,1|0,0,2]=4 5744 B9R2.7 O=C1CC2CC=CC12 Amb6608765 [0,0,0,1,0,1|0,0,0]=2 5745 B9R2.7 O=C1CC2CCOC12 Amb27593836 [0,0,0,1,0,1|0,0,2]=4 5746 B9R2.7 O=C1CC2CNCC12 Amb26370314 [0,0,0,1,0,1|0,0,2]=4 5747 B9R2.7 O=C1C[C@@H]2C=CC[C@H]12 Amb22735988 [0,0,0,1,0,1|0,0,2]=4 5748 B9R2.7 O=C1C[C@@H]2CCC[C@H]12 Amb27427660 [0,0,0,1,0,1|0,0,2]=4 5749 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [0,0,0,1,0,1|0,0,2]=4 5750 B9R2.7 O=C1C[C@@H]2COC[C@H]12 Amb26920071 [0,0,0,1,0,1|0,0,2]=4 5751 B9R2.7 O=C1C[C@H]2C=CC[C@H]12 Amb25962489 [0,0,0,1,0,1|0,0,2]=4 5752 B9R2.7 O=C1NC2C=CCC12 Amb27168204 [0,0,0,1,0,1|0,0,2]=4 5753 B9R2.7 O=C1NC2CCCC12 Amb2694983 [0,0,0,1,0,1|0,0,2]=4 5754 B9R2.7 O=C1NC2OCCC12 Amb24481565 [0,0,0,1,0,1|1,0,1]=4 5755 B9R2.7 O=C1N[C@@H]2CCC[C@H]12 Amb25278653 [0,0,0,1,0,1|0,0,2]=4 5756 B9R2.7 O=C1N[C@@H]2CCN[C@H]12 Amb27796913 [0,0,0,1,0,1|1,0,1]=4 5757 B9R2.7 O=C1N[C@@H]2OCC[C@H]12 Amb33192983 [0,0,0,1,0,1|1,0,1]=4 5758 B9R2.7 O=C1N[C@H]2CCC[C@@H]12 Amb6366178 [0,0,0,1,0,1|0,0,2]=4 5759 B9R2.7 O=C1N[C@H]2OCC[C@@H]12 Amb27785542 [0,0,0,1,0,1|1,0,1]=4 5760 B9R2.7 O[C@H]1C[C@H]2CC=C[C@@H]12 Amb27205200 [0,0,0,1,0,1|0,0,2]=4 5761 B9R2.7 SC1CC2CC=CC12 Amb32788167 [0,0,0,1,0,1|0,1,1]=4 5762 B9R2.20 ClC1C=CC2CCC12 Amb27267998 [0,0,0,1,0,1|1,0,1]=4 5763 B9R2.20 O=C1C=CC2CCC12 Amb22365116 [0,0,0,1,0,1|0,0,0]=2 5764 B9R2.20 O=C1CCC2CCC12 Amb26556513 [0,0,0,1,0,1|0,0,2]=4 5765 B9R2.20 O=C1CC[C@@H]2C=C[C@H]12 Amb27782001 [0,0,0,1,0,1|0,0,0]=2 5766 B9R2.20 O=C1CC[C@@H]2CC[C@H]12 Amb27214199 [0,0,0,1,0,1|0,0,2]=4 5767 B9R2.20 O=C1NCC2CCC12 Amb24121240 [0,0,0,1,0,1|0,0,2]=4 5768 B9R2.20 O=C1NC[C@@H]2CC[C@H]12 Amb28131123 [0,0,0,1,0,1|0,0,2]=4 5769 B9R2.20 O[C@@H]1C=C[C@@H]2CC[C@H]12 Amb25252536 [0,0,0,1,0,1|0,0,2]=4 5770 B9R2.20 O[C@@H]1CC[C@@H]2C=C[C@H]12 Amb28435644 [0,0,0,1,0,1|0,0,2]=4 5771 B9R2.20 O[C@H]1C=CC2CCC21 Amb26641999 [0,0,0,1,0,1|0,0,2]=4 5772 B9R2.20 O[C@H]1C=C[C@@H]2CC[C@@H]21 Amb24648863 [0,0,0,1,0,1|0,0,2]=4 5773 B9R2.21 O=C1C=CC2CC2C1 Amb28284686 [0,0,0,1,0,1|0,0,0]=2 5774 B9R2.21 O=C1CC2CC2CN1 Amb33716335 [0,0,0,1,0,1|0,0,2]=4 5775 B9R2.21 O=C1CCC2CC2C1 Amb28316224 [0,0,0,1,0,1|0,0,2]=4 5776 B9R2.21 O=C1CCC2CC2N1 Amb27636987 [0,0,0,1,0,1|0,0,2]=4 5777 B9R2.21 O=C1CCC2CC2O1 Amb27422131 [0,0,0,1,0,1|0,0,2]=4 5778 B9R2.21 O=C1NC2CC2CO1 Amb28247932 [0,0,0,1,0,1|1,0,1]=4 5779 B9R2.21 OC1C=C[C@@H]2C[C@@H]2C1 Amb27197544 [0,0,0,1,0,1|0,0,2]=4 5780 B9R2.21 O[C@@H]1C=C[C@H]2C[C@H]2C1 Amb28202543 [0,0,0,1,0,1|0,0,2]=4 5781 B9R2.33 O=C1CC2C=CC2C1 Amb28059971 [0,0,0,1,0,1|0,0,2]=4 5782 B9R2.33 O=C1CC2CCC2C1 Amb28316189 [0,0,0,1,0,1|0,0,2]=4 5783 B9R2.33 O=C1CC2CCC2N1 Amb28398052 [0,0,0,1,0,1|0,0,2]=4 5784 B9R2.33 O=C1CC2CC[C@H]2C1 Amb28048983 [0,0,0,1,0,1|0,0,2]=4 5785 B9R2.33 O=C1C[C@@H]2CC[C@@H]2C1 Amb26937805 [0,0,0,1,0,1|0,0,2]=4 5786 B9R2.33 O=C1C[C@@H]2CC[C@@H]2N1 Amb27420727 [0,0,0,1,0,1|0,0,2]=4 5787 B9R2.33 O=C1NC2CCC2N1 Amb27804174 [0,0,0,1,0,1|1,0,1]=4 5788 B9R2.33 O=C1NC2CCC2O1 Amb26067754 [0,0,0,1,0,1|1,0,1]=4 5789 B9R2.68 C1=CC2CC(C1)CN2 Amb35789168 [0,0,0,1,0,1|1,0,1]=4 5790 B9R2.68 C1=CC2CC(C1)CN2 Amb35789832 [0,0,0,1,0,1|1,0,1]=4 5791 B9R2.68 C1=CC2CCC(C1)N2 Amb18123991 [0,0,0,1,0,1|1,0,1]=4 5792 B9R2.68 C1=CC2CCC(C1)N2 Amb28934858 [0,0,0,1,0,1|1,0,1]=4 5793 B9R2.68 C1=CC2CCCC1N2 Amb27838404 [0,0,0,1,0,1|1,0,1]=4 5794 B9R2.68 C1=C[C@H]2CC[C@@H](C1)C2 Amb26925899 [0,0,0,1,0,1|1,0,1]=4 5795 B9R2.109 CC1=CCCC2OC12 Amb27875404 [0,0,0,1,0,1|1,0,1]=4 5796 B9R2.109 Cl[C@@H]1C=CC[C@H]2O[C@@H]12 Amb27232851 [0,0,0,1,0,1|1,0,1]=4 5797 B9R2.109 O=C1C=CCC2CC12 Amb27261956 [0,0,0,1,0,1|0,0,0]=2 5798 B9R2.109 O=C1C=CC[C@H]2C[C@@H]12 Amb27199136 [0,0,0,1,0,1|0,0,0]=2 5799 B9R2.109 O=C1CCCC2CC12 Amb17593139 [0,0,0,1,0,1|0,0,2]=4 5800 B9R2.109 O=C1CCCC2OC12 Amb20671097 [0,0,0,1,0,1|0,0,2]=4 5801 B9R2.109 O=C1CCC[C@@H]2C[C@@H]12 Amb24512517 [0,0,0,1,0,1|0,0,2]=4 5802 B9R2.109 O=C1CCC[C@@H]2C[C@H]12 Amb25934279 [0,0,0,1,0,1|0,0,2]=4 5803 B9R2.109 O=C1CCC[C@H]2C[C@@H]12 Amb24723004 [0,0,0,1,0,1|0,0,2]=4 5804 B9R2.109 O=C1CCC[C@H]2C[C@H]12 Amb27640590 [0,0,0,1,0,1|0,0,2]=4 5805 B9R2.109 O=C1CCNC2CC12 Amb27239180 [0,0,0,1,0,1|0,0,2]=4 5806 B9R2.109 O=C1NCC[C@@H]2O[C@H]12 Amb27446837 [0,0,0,1,0,1|1,0,1]=4 5807 B9R2.109 O=C1NNCC2CC12 Amb27797433 [0,0,0,1,0,1|1,0,1]=4 5808 B9R2.109 O[C@@H]1C=CC[C@H]2C[C@@H]12 Amb27790188 [0,0,0,1,0,1|0,0,2]=4 5809 B9R2.109 O[C@@H]1C=CC[C@H]2O[C@@H]12 Amb27422316 [0,0,0,1,0,1|0,0,2]=4 5810 B9R2.109 O[C@H]1C=CC[C@H]2C[C@H]21 Amb27219001 [0,0,0,1,0,1|0,0,2]=4 5811 B9R2.123 BrC1[C@H]2CCC=C[C@@H]12 Amb27488925 [0,0,0,1,0,1|1,0,1]=4 5812 B9R2.123 Cl[C@H]1[C@H]2CCC=C[C@@H]12 Amb27433961 [0,0,0,1,0,1|1,0,1]=4 5813 B9R2.24 BrC1C2C=CC1CC2 Amb8517215 [0,1,0,1,0,0|1,0,1]=4 5814 B9R2.24 Br[C@@H]1[C@@H]2C=C[C@H]1CC2 Amb16231049 [0,1,0,1,0,0|1,0,1]=4 5815 B9R2.24 Br[C@H]1[C@@H]2C=C[C@H]1CC2 Amb28458271 [0,1,0,1,0,0|1,0,1]=4 5816 B9R2.24 N[C@H]1[C@@H]2C=C[C@H]1CC2 Amb27473422 [0,1,0,1,0,0|1,0,1]=4 5817 B9R2.24 O=C1C2C=CC1CC2 Amb17593121 [0,1,0,1,0,0|0,0,1]=3 5818 B9R2.24 O=C1[C@@H]2C=C[C@H]1CC2 Amb24690194 [0,1,0,1,0,0|0,0,1]=3 5819 B9R2.24 O=C1[C@H]2C=C[C@H]1CC2 Amb27254614 [0,1,0,1,0,0|0,0,1]=3 5820 B9R2.24 OC1C2C=CC1CC2 Amb24745608 [0,1,0,1,0,0|0,0,2]=4 5821 B9R2.49 C1=CC2CCC1CN2 Amb18641334 [0,1,0,1,0,0|1,0,1]=4 5822 B9R2.49 C1=CC2CCC1NO2 Amb22263806 [0,1,0,1,0,0|0,0,2]=4 5823 B9R2.49 C1=CC2CCC1NO2 Amb24061312 [0,1,0,1,0,0|0,0,2]=4 5824 B9R2.49 C1=CC2CCC1NO2 Amb24309091 [0,1,0,1,0,0|0,0,2]=4 5825 B9R2.49 C1=C[C@H]2CC[C@@H]1NO2 Amb27879874 [0,1,0,1,0,0|0,0,2]=4 5826 B9R2.53 O=C1C2CCCC1C2 Amb28048997 [0,1,0,1,0,0|0,0,2]=4 5827 B9R2.70 O=CC1=CCC2CC12 Amb27949600 [0,1,0,1,0,0|0,0,1]=3 5828 B9R2.19 ClC1C=CC2CC1C2 Amb27657218 [0,1,0,1,0,0|1,0,1]=4 5829 B9R2.19 NC1C=CC2CC1C2 Amb28077632 [0,1,0,1,0,0|1,0,1]=4 5830 B9R2.19 O=C1CCC2CC1C2 Amb33547757 [0,1,0,1,0,0|0,0,2]=4 5831 B9R2.19 O=C1CCC2CC1O2 Amb22364973 [0,1,0,1,0,0|0,0,2]=4 5832 B9R2.19 O=C1NCC2CC1C2 Amb25221783 [0,1,0,1,0,0|1,0,1]=4 5833 B9R2.19 O=C1NCC2CC1N2 Amb27801865 [0,1,0,1,0,0|1,0,1]=4 5834 B9R2.19 O=C1NC[C@H]2C[C@@H]1O2 Amb27841075 [0,1,0,1,0,0|1,0,1]=4 5835 B9R2.19 OC1C=CC2CC1C2 Amb28207135 [0,1,0,1,0,0|0,0,2]=4 5836 B9R2.35 O=C1NC2C(O)CC12 Amb28368878 [0,1,0,1,0,0|1,0,1]=4 5837 B9R2.40 CC12CCC(=O)C1O2 Amb28048967 [0,1,0,1,0,0|1,0,1]=4 5838 B9R2.40 C[C@@]12CNC(=O)[C@@H]1C2 Amb27975818 [0,1,0,1,0,0|1,0,1]=4 5839 B9R2.110 NC12C=CC(CC1)C2 Amb26914616 [0,1,0,1,0,0|1,0,1]=4 5840 B9R2.110 N[C@@]12C=C[C@@H](CC1)C2 Amb27624003 [0,1,0,1,0,0|1,0,1]=4 5841 B9R2.8 O=C1CC2CC(C1)C2 Amb25706934 [0,1,0,1,0,0|0,0,2]=4 5842 B9R2.8 O=C1CC2CC(C1)O2 Amb27261957 [0,1,0,1,0,0|0,0,2]=4 5843 B9R2.18 C=C1C2CCC(=O)C12 Amb27749879 [0,1,0,1,0,0|0,0,1]=3 5844 B9R2.18 CC1C2CCC(=O)C12 Amb27803582 [0,1,0,1,0,0|0,0,2]=4 5845 B9R2.18 C[C@@H]1[C@@H]2CCC(=O)[C@@H]21 Amb27433144 [0,1,0,1,0,0|0,0,2]=4 5846 B9R2.18 C[C@H]1[C@@H]2CCC(=O)[C@H]12 Amb27433145 [0,1,0,1,0,0|0,0,2]=4 5847 B9R2.18 ClC1C2C=CC(Br)C12 Amb27873510 [0,1,0,1,0,0|1,0,1]=4 5848 B9R2.18 Cl[C@@H]1C=C[C@H]2[C@H](Br)[C@@H]12 Amb27791794 [0,1,0,1,0,0|1,0,1]=4 5849 B9R2.18 Cl[C@@H]1[C@H]2[C@H](Br)C=C[C@@H]12 Amb27793667 [0,1,0,1,0,0|1,0,1]=4 5850 B9R2.18 O=C1CC[C@H]2C(Br)[C@@H]12 Amb27630445 [0,1,0,1,0,0|0,0,2]=4 5851 B9R2.18 O=C1CC[C@H]2[C@@H](Br)[C@@H]12 Amb27644076 [0,1,0,1,0,0|0,0,2]=4 5852 B9R2.18 OC1C=CC2C(Br)C12 Amb28240461 [0,1,0,1,0,0|0,0,2]=4 5853 B9R2.25 CC1=CC(=O)C2OC12 Amb27409563 [0,1,0,1,0,0|1,0,0]=3 5854 B9R2.25 CC1=CC(=O)[C@@H]2C[C@H]12 Amb27797370 [0,1,0,1,0,0|0,0,0]=2 5855 B9R2.25 CC1CC(=O)C2CC12 Amb27598799 [0,1,0,1,0,0|0,0,2]=4 5856 B9R2.25 NC1=NC(=O)N2CC12 Amb22352757 [0,1,0,1,0,0|2,0,0]=4 5857 B9R2.25 O=C1CC(=O)[C@@H]2C[C@H]12 Amb28048943 [0,1,0,1,0,0|0,0,1]=3 5858 B9R2.25 O=C1NC(=O)C2CC12 Amb2446323 [0,1,0,1,0,0|1,0,0]=3 5859 B9R2.25 O=C1OC(=O)C2CC12 Amb2445133 [0,1,0,1,0,0|1,0,0]=3 5860 B9R2.25 O=C1OC(=O)[C@@H]2C[C@H]12 Amb27236139 [0,1,0,1,0,0|1,0,0]=3 5861 B9R2.29 O=C1CC2NC(=O)C12 Amb27801485 [0,1,0,1,0,0|1,0,1]=4 5862 B9R2.29 O=C1C[C@@H]2NC(=O)[C@H]12 Amb28388801 [0,1,0,1,0,0|1,0,1]=4 5863 B9R2.29 O=C1C[C@H]2NC(=O)[C@@H]12 Amb27458936 [0,1,0,1,0,0|1,0,1]=4 5864 B9R2.38 CC12CC(=O)CC1C2 Amb24357249 [0,1,0,1,0,0|0,0,2]=4 5865 B9R2.39 BrC1=C[C@H]2CC[C@@H]1C2 Amb28058988 [0,1,0,1,0,0|1,0,1]=4 5866 B9R2.39 BrC1CC2C=CC1C2 Amb27243334 [0,1,0,1,0,0|1,0,1]=4 5867 B9R2.39 CC1=CC2CCC1C2 Amb25246974 [0,1,0,1,0,0|1,0,1]=4 5868 B9R2.39 CC1=C[C@H]2CC[C@@H]1C2 Amb28320492 [0,1,0,1,0,0|1,0,1]=4 5869 B9R2.39 ClC1C[C@@H]2C=C[C@H]1C2 Amb27477159 [0,1,0,1,0,0|1,0,1]=4 5870 B9R2.39 Cl[C@H]1C[C@@H]2C=C[C@H]1C2 Amb28286185 [0,1,0,1,0,0|1,0,1]=4 5871 B9R2.39 Cl[C@H]1C[C@H]2C=C[C@H]1C2 Amb28073803 [0,1,0,1,0,0|1,0,1]=4 5872 B9R2.39 NC1CC2C=CC1C2 Amb22546323 [0,1,0,1,0,0|1,0,1]=4 5873 B9R2.39 NC1CC2C=CC1C2 Amb23592193 [0,1,0,1,0,0|1,0,1]=4 5874 B9R2.39 NC1CC2C=CC1O2 Amb28136333 [0,1,0,1,0,0|0,0,2]=4 5875 B9R2.39 NC1CC2C=CC1O2 Amb30585132 [0,1,0,1,0,0|0,0,2]=4 5876 B9R2.39 N[C@H]1C[C@@H]2C=C[C@H]1C2 Amb27799274 [0,1,0,1,0,0|1,0,1]=4 5877 B9R2.39 O=C1CC2C=CC1C2 Amb4477237 [0,1,0,1,0,0|0,0,2]=4 5878 B9R2.39 O=C1CC2C=CC1O2 Amb27151592 [0,1,0,1,0,0|0,0,2]=4 5879 B9R2.39 O=C1CC2CCC1C2 Amb6608983 [0,1,0,1,0,0|0,0,2]=4 5880 B9R2.39 O=C1CC2CCC1N2 Amb26502233 [0,1,0,1,0,0|0,0,2]=4 5881 B9R2.39 O=C1CC2CCC1O2 Amb25322815 [0,1,0,1,0,0|0,0,2]=4 5882 B9R2.39 O=C1CC2CNC1C2 Amb26860988 [0,1,0,1,0,0|1,0,1]=4 5883 B9R2.39 O=C1CC2COC1C2 Amb24734169 [0,1,0,1,0,0|1,0,1]=4 5884 B9R2.39 O=C1CC2CSC1C2 Amb28321970 [0,1,0,1,0,0|1,0,1]=4 5885 B9R2.39 O=C1CN2CCC1C2 Amb10067112 [0,1,0,1,0,0|1,0,1]=4 5886 B9R2.39 O=C1CN2CCC1C2 Amb20171539 [0,1,0,1,0,0|1,0,1]=4 5887 B9R2.39 O=C1CN2CC[C@@H]1C2 Amb26480461 [0,1,0,1,0,0|1,0,1]=4 5888 B9R2.39 O=C1C[C@@H]2C=C[C@H]1C2 Amb28385475 [0,1,0,1,0,0|0,0,2]=4 5889 B9R2.39 O=C1C[C@@H]2CC[C@@H]1C2 Amb27622753 [0,1,0,1,0,0|0,0,2]=4 5890 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 Amb4605941 [0,1,0,1,0,0|0,0,2]=4 5891 B9R2.39 O=C1C[C@H]2C=C[C@@H]1C2 Amb25061616 [0,1,0,1,0,0|0,0,2]=4 5892 B9R2.39 O=C1C[C@H]2CC[C@@H]1N2 Amb27421729 [0,1,0,1,0,0|0,0,2]=4 5893 B9R2.39 O=C1C[C@H]2CC[C@@H]1O2 Amb27195774 [0,1,0,1,0,0|0,0,2]=4 5894 B9R2.39 O=C1C[C@H]2CS[C@@H]1C2 Amb28428954 [0,1,0,1,0,0|1,0,1]=4 5895 B9R2.39 O=C1NC2CCC1C2 Amb20623082 [0,1,0,1,0,0|1,0,1]=4 5896 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 Amb25174368 [0,1,0,1,0,0|1,0,1]=4 5897 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 Amb8516352 [0,1,0,1,0,0|1,0,1]=4 5898 B9R2.39 O=C1OC2CCC1C2 Amb31379084 [0,1,0,1,0,0|1,0,1]=4 5899 B9R2.39 OC1CC2C=CC1C2 Amb19958337 [0,1,0,1,0,0|1,0,1]=4 5900 B9R2.39 OC1C[C@@H]2C=C[C@H]1C2 Amb26920676 [0,1,0,1,0,0|1,0,1]=4 5901 B9R2.39 OC1C[C@H]2C=C[C@@H]1C2 Amb33524064 [0,1,0,1,0,0|1,0,1]=4 5902 B9R2.39 OC1C[C@H]2C=C[C@H]1C2 Amb28428493 [0,1,0,1,0,0|1,0,1]=4 5903 B9R2.39 O[C@@H]1CC2C=C[C@@H]1C2 Amb28069705 [0,1,0,1,0,0|1,0,1]=4 5904 B9R2.39 O[C@@H]1C[C@H]2C=C[C@@H]1C2 Amb28369855 [0,1,0,1,0,0|1,0,1]=4 5905 B9R2.39 O[C@@H]1C[C@H]2C=C[C@@H]1O2 Amb28345331 [0,1,0,1,0,0|0,0,2]=4 5906 B9R2.39 O[C@@H]1C[C@H]2C=C[C@H]1C2 Amb28053800 [0,1,0,1,0,0|1,0,1]=4 5907 B9R2.39 O[C@H]1C[C@@H]2C=C[C@H]1C2 Amb27428377 [0,1,0,1,0,0|1,0,1]=4 5908 B9R2.39 O[C@H]1C[C@H]2C=C[C@@H]1C2 Amb27635724 [0,1,0,1,0,0|1,0,1]=4 5909 B9R2.39 SC1CC2C=CC1C2 Amb32788481 [0,1,0,1,0,0|1,0,1]=4 5910 B9R2.39 SC1C[C@H]2C=C[C@@H]1C2 Amb32788701 [0,1,0,1,0,0|1,0,1]=4 5911 B9R2.17 C[C@@]12C[C@@H]1CCC2=O Amb27972913 [0,1,0,1,0,0|0,0,2]=4 5912 B9R2.17 N[C@]12C[C@H]1COC2=O Amb27420696 [0,1,0,1,0,0|1,0,1]=4 5913 B9R2.17 O=C1CCC2CC12Br Amb28048970 [0,1,0,1,0,0|0,0,2]=4 5914 B9R2.17 O=C1CCC2CC12O Amb28285228 [0,1,0,1,0,0|0,0,2]=4 5915 B9R2.17 O=C1CC[C@@H]2C[C@]12Br Amb28285888 [0,1,0,1,0,0|0,0,2]=4 5916 B9R2.37 CC1CC2CC2C1=O Amb28048952 [0,1,0,1,0,0|0,0,2]=4 5917 B9R2.37 C[C@@H]1C(=O)C[C@@H]2C[C@@H]21 Amb28351384 [0,1,0,1,0,0|0,0,2]=4 5918 B9R2.37 O=C1[C@H](F)C[C@H]2C[C@@H]12 Amb33804306 [0,1,0,1,0,0|0,0,2]=4 5919 B9R2.90 O=C1[C@H](Cl)[C@H]2CC[C@@H]12 Amb27643745 [0,1,0,1,0,0|0,0,2]=4 5920 B9R3.55 O=C1C2CC3C1C23 Amb27602252 [0,0,0,2,0,0|0,0,2]=4 5921 B5R1.1 C1=CCCC1 Amb6608970 [1,0,0,0,1,0|0,0,0]=2 5922 B5R1.1 C1=CCNC1 Amb2695003 [1,0,0,0,1,0|1,0,0]=3 5923 B5R1.1 C1=CCNC1 Amb8630078 [1,0,0,0,1,0|1,0,0]=3 5924 B5R1.1 C1=CCOC1 Amb7809243 [1,0,0,0,1,0|1,0,0]=3 5925 B5R1.1 C1=CCSC1 Amb33544213 [1,0,0,0,1,0|1,0,0]=3 5926 B5R1.1 C1=CNCC1 Amb24476832 [1,0,0,0,1,0|1,0,0]=3 5927 B5R1.1 C1=COCC1 Amb6609005 [1,0,0,0,1,0|1,0,0]=3 5928 B5R1.1 C1=COCN1 Amb20242493 [1,0,0,0,1,0|2,0,0]=4 5929 B5R1.1 C1=CSCC1 Amb24065325 [1,0,0,0,1,0|1,0,0]=3 5930 B5R1.1 C1=CSSC1 Amb27437397 [1,0,0,0,1,0|2,0,0]=4 5931 B5R1.1 C1=C[CH-]C=C1 Amb8517522 [1,0,0,0,1,0|0,0,2]=4 5932 B5R1.1 C1=NCCC1 Amb28282781 [1,0,0,0,1,0|1,0,0]=3 5933 B5R1.1 C1=NCCN1 Amb25083166 [1,0,0,0,1,0|2,0,0]=4 5934 B5R1.1 C1=NCCO1 Amb16234259 [1,0,0,0,1,0|2,0,0]=4 5935 B5R1.1 C1=NCCS1 Amb4022861 [1,0,0,0,1,0|2,0,0]=4 5936 B5R1.1 C1=NCNC1 Amb27449121 [1,0,0,0,1,0|2,0,0]=4 5937 B5R1.1 C1=NNCC1 Amb21618957 [1,0,0,0,1,0|2,0,0]=4 5938 B5R1.1 C1CCNC1 Amb2792830 [1,0,0,0,1,0|1,0,1]=4 5939 B5R1.1 C1CCOC1 Amb2792997 [1,0,0,0,1,0|1,0,1]=4 5940 B5R1.1 C1CCSC1 Amb2690554 [1,0,0,0,1,0|1,0,1]=4 5941 B5R1.1 C1CC[SiH2]C1 Amb27494656 [1,0,0,0,1,0|0,1,1]=4 5942 B5R1.1 C1CNNC1 Amb18061973 [1,0,0,0,1,0|2,0,0]=4 5943 B5R1.1 C1CNNC1 Amb21964916 [1,0,0,0,1,0|2,0,0]=4 5944 B5R1.1 C1CNOC1 Amb6365588 [1,0,0,0,1,0|2,0,0]=4 5945 B5R1.1 C1CNOC1 Amb8503363 [1,0,0,0,1,0|2,0,0]=4 5946 B5R1.1 [C-]1=CC=CC1 Amb22231445 [1,0,0,0,1,0|0,0,1]=3 5947 B5R1.1 c1ccoc1 Amb6608834 [1,0,0,0,1,0|1,0,1]=4 5948 B5R1.1 c1ccsc1 Amb2694672 [1,0,0,0,1,0|1,0,1]=4 5949 B5R1.1 c1cnoc1 Amb2694985 [1,0,0,0,1,0|2,0,0]=4 5950 B5R1.1 c1cnsc1 Amb1090456 [1,0,0,0,1,0|2,0,0]=4 5951 B5R1.2 BrC1CCC1 Amb3941489 [0,0,0,0,2,0|1,0,1]=4 5952 B5R1.2 C=C1CCC1 Amb19374657 [0,0,0,0,2,0|1,0,0]=3 5953 B5R1.2 C=C1CCO1 Amb22736695 [0,0,0,0,2,0|2,0,0]=4 5954 B5R1.2 C=C1CNC1 Amb26026628 [0,0,0,0,2,0|2,0,0]=4 5955 B5R1.2 C=C1CNC1 Amb32666987 [0,0,0,0,2,0|2,0,0]=4 5956 B5R1.2 C=C1COC1 Amb27432949 [0,0,0,0,2,0|2,0,0]=4 5957 B5R1.2 ClC1CCC1 Amb3941524 [0,0,0,0,2,0|1,0,1]=4 5958 B5R1.2 IC1CCC1 Amb24476982 [0,0,0,0,2,0|1,0,1]=4 5959 B5R1.2 NC1C=CC1 Amb32658179 [0,0,0,0,2,0|1,0,1]=4 5960 B5R1.2 NC1CCC1 Amb3938963 [0,0,0,0,2,0|1,0,1]=4 5961 B5R1.2 NC1CCC1 Amb8631327 [0,0,0,0,2,0|1,0,1]=4 5962 B5R1.2 NN1CCC1 Amb24392919 [0,0,0,0,2,0|2,0,0]=4 5963 B5R1.2 NN1CCC1 Amb32656115 [0,0,0,0,2,0|2,0,0]=4 5964 B5R1.2 O=C1BCN1 Amb27403064 [0,0,0,0,2,0|2,0,0]=4 5965 B5R1.2 O=C1C=CC1 Amb24477666 [0,0,0,0,2,0|0,0,0]=2 5966 B5R1.2 O=C1CCC1 Amb4605970 [0,0,0,0,2,0|0,0,0]=2 5967 B5R1.2 O=C1CCN1 Amb2779956 [0,0,0,0,2,0|1,0,0]=3 5968 B5R1.2 O=C1CCO1 Amb8514945 [0,0,0,0,2,0|1,0,0]=3 5969 B5R1.2 O=C1CCS1 Amb28430252 [0,0,0,0,2,0|1,0,0]=3 5970 B5R1.2 O=C1CNC1 Amb10975976 [0,0,0,0,2,0|1,0,0]=3 5971 B5R1.2 O=C1COC1 Amb10067645 [0,0,0,0,2,0|1,0,0]=3 5972 B5R1.2 O=C1CSC1 Amb19516222 [0,0,0,0,2,0|1,0,0]=3 5973 B5R1.2 O=S1CCC1 Amb27653739 [0,0,0,0,2,0|1,0,0]=3 5974 B5R1.2 OC1CCC1 Amb4605821 [0,0,0,0,2,0|0,0,2]=4 5975 B5R1.2 SC1CCC1 Amb25339328 [0,0,0,0,2,0|0,1,1]=4 5976 B5R1.2 [Mg+]C1CCC1 Amb30591459 [0,0,0,0,2,0|1,0,1]=4 5977 B9R1.50 BrC1=CCCC=CCC1 Amb27171357 [0,0,0,0,0,2|1,0,1]=4 5978 B9R1.50 BrC1=CCCCCCC1 Amb23590920 [0,0,0,0,0,2|1,0,1]=4 5979 B9R1.50 BrC1C=CCC=CCC1 Amb25088467 [0,0,0,0,0,2|1,0,1]=4 5980 B9R1.50 BrC1C=CCCC=CC1 Amb26844237 [0,0,0,0,0,2|1,0,1]=4 5981 B9R1.50 BrC1C=CCCCC=C1 Amb27865465 [0,0,0,0,0,2|1,0,1]=4 5982 B9R1.50 BrC1C=CCCCCC1 Amb24480205 [0,0,0,0,0,2|1,0,1]=4 5983 B9R1.50 BrC1CCC=CCCC1 Amb24355370 [0,0,0,0,0,2|1,0,1]=4 5984 B9R1.50 CC1C=CCCC=CC1 Amb22347896 [0,0,0,0,0,2|1,0,1]=4 5985 B9R1.50 ClC1C=CCCCCC1 Amb27484094 [0,0,0,0,0,2|1,0,1]=4 5986 B9R1.50 ClC1CCC=CCCC1 Amb28118846 [0,0,0,0,0,2|1,0,1]=4 5987 B9R1.50 NC1C=CC=CCCC1 Amb27181161 [0,0,0,0,0,2|1,0,1]=4 5988 B9R1.50 NC1C=CCCCCC1 Amb22410845 [0,0,0,0,0,2|1,0,1]=4 5989 B9R1.50 NC1C=CCCCCC1 Amb32652668 [0,0,0,0,0,2|1,0,1]=4 5990 B9R1.50 NC1CCC=CCCC1 Amb27814669 [0,0,0,0,0,2|1,0,1]=4 5991 B9R1.50 NC1CCC=CCCC1 Amb33307000 [0,0,0,0,0,2|1,0,1]=4 5992 B9R1.50 N[C@@H]1C=CCCCCC1 Amb27423065 [0,0,0,0,0,2|1,0,1]=4 5993 B9R1.50 O=C1C=CC=CCC=C1 Amb27260505 [0,0,0,0,0,2|0,0,2]=4 5994 B9R1.50 O=C1C=CC=CCCC1 Amb27164621 [0,0,0,0,0,2|0,0,0]=2 5995 B9R1.50 O=C1C=CCC=CCC1 Amb28207621 [0,0,0,0,0,2|0,0,0]=2 5996 B9R1.50 O=C1C=CCCC=CC1 Amb22365234 [0,0,0,0,0,2|0,0,0]=2 5997 B9R1.50 O=C1C=CCCCC=C1 Amb22364780 [0,0,0,0,0,2|0,0,0]=2 5998 B9R1.50 O=C1C=CCCCCC1 Amb3987503 [0,0,0,0,0,2|0,0,0]=2 5999 B9R1.50 O=C1C=CCCCCN1 Amb24469221 [0,0,0,0,0,2|0,0,0]=2 6000 B9R1.50 O=C1C=CCCOCC1 Amb27838783 [0,0,0,0,0,2|0,0,0]=2 6001 B9R1.50 O=C1CC=CCC=CC1 Amb22365229 [0,0,0,0,0,2|0,0,1]=3 6002 B9R1.50 O=C1CC=CCCOC1 Amb22364797 [0,0,0,0,0,2|0,0,0]=2 6003 B9R1.50 O=C1CCCCCCC1 Amb2721546 [0,0,0,0,0,2|0,0,2]=4 6004 B9R1.50 O=C1CCCCCCN1 Amb2780498 [0,0,0,0,0,2|0,0,2]=4 6005 B9R1.50 O=C1CCCCCCO1 Amb27468239 [0,0,0,0,0,2|0,0,2]=4 6006 B9R1.50 O=C1CCCNCCN1 Amb27165283 [0,0,0,0,0,2|0,0,2]=4 6007 B9R1.50 O=C1CCCSCCC1 Amb17593637 [0,0,0,0,0,2|0,0,2]=4 6008 B9R1.50 O=C1CCNCCCN1 Amb22263665 [0,0,0,0,0,2|0,0,2]=4 6009 B9R1.50 O=C1CCNCCCN1 Amb23403551 [0,0,0,0,0,2|0,0,2]=4 6010 B9R1.50 O=C1CNCCCNC1 Amb30867936 [0,0,0,0,0,2|0,0,2]=4 6011 B9R1.50 O=C1NCCCCCN1 Amb25146134 [0,0,0,0,0,2|0,0,2]=4 6012 B9R1.50 OC1C=CC#CCCC1 Amb27618196 [0,0,0,0,0,2|0,0,2]=4 6013 B9R1.50 OC1C=CCC=CCC1 Amb27825906 [0,0,0,0,0,2|0,0,2]=4 6014 B9R1.50 OC1C=CCCCC=C1 Amb27958555 [0,0,0,0,0,2|0,0,2]=4 6015 B9R1.50 OC1C=CCCCCC1 Amb22364937 [0,0,0,0,0,2|0,0,2]=4 6016 B9R1.50 OC1C=CCCCOC1 Amb27452486 [0,0,0,0,0,2|0,0,2]=4 6017 B9R1.50 OC1CC=CCCOC1 Amb22364794 [0,0,0,0,0,2|0,0,2]=4 6018 B9R1.50 OC1CCC=CCCC1 Amb21858009 [0,0,0,0,0,2|0,0,2]=4 6019 B9R1.50 O[C@@H]1C=CC=CCCC1 Amb27841912 [0,0,0,0,0,2|0,0,2]=4 6020 B9R1.50 O[C@@H]1C=CCC=CCC1 Amb28315535 [0,0,0,0,0,2|0,0,2]=4 6021 B9R1.50 O[C@@H]1C=CCCCCC1 Amb27826413 [0,0,0,0,0,2|0,0,2]=4 6022 B9R1.50 O[C@@H]1CCC=CCCC1 Amb25781269 [0,0,0,0,0,2|0,0,2]=4 6023 B9R1.50 O[C@H]1C=CC=CCCC1 Amb28315480 [0,0,0,0,0,2|0,0,2]=4 6024 B9R1.50 O[C@H]1CCC=CCCC1 Amb24481888 [0,0,0,0,0,2|0,0,2]=4