0 B6R1.2 Bc1ccco1 Amb28286917 [0,0,0,0,0,0|1,0,3]=4 1 B6R1.2 BrC1=CCCC1 Amb10067271 [0,0,0,0,0,0|2,0,0]=2 2 B6R1.2 BrC1=CCCO1 Amb24322605 [0,0,0,0,0,0|1,0,1]=2 3 B6R1.2 BrC1=COCC1 Amb24322594 [0,0,0,0,0,0|3,0,0]=3 4 B6R1.2 BrC1=NCCN1 Amb28382662 [0,0,0,0,0,0|3,0,0]=3 5 B6R1.2 BrC1=NCCS1 Amb25987679 [0,0,0,0,0,0|2,1,0]=3 6 B6R1.2 BrC1CCCC1 Amb2686651 [0,0,0,0,0,0|2,0,1]=3 7 B6R1.2 BrC1CCCO1 Amb24322808 [0,0,0,0,0,0|1,0,1]=2 8 B6R1.2 BrC1CCNC1 Amb10608920 [0,0,0,0,0,0|3,0,1]=4 9 B6R1.2 BrC1CCNC1 Amb19958764 [0,0,0,0,0,0|3,0,1]=4 10 B6R1.2 BrC1CCNC1 Amb22229239 [0,0,0,0,0,0|3,0,1]=4 11 B6R1.2 BrC1CCOC1 Amb19957943 [0,0,0,0,0,0|3,0,1]=4 12 B6R1.2 BrC1CCSC1 Amb20413646 [0,0,0,0,0,0|3,0,1]=4 13 B6R1.2 BrC1OCCO1 Amb28315592 [0,0,0,0,0,0|2,0,1]=3 14 B6R1.2 Br[C@@H]1CCNC1 Amb22225312 [0,0,0,0,0,0|3,0,1]=4 15 B6R1.2 Br[C@@H]1CCNC1 Amb22225313 [0,0,0,0,0,0|3,0,1]=4 16 B6R1.2 Br[C@H]1CCNC1 Amb22226659 [0,0,0,0,0,0|3,0,1]=4 17 B6R1.2 Br[C@H]1CCNC1 Amb22226660 [0,0,0,0,0,0|3,0,1]=4 18 B6R1.2 Brc1ccco1 Amb2723041 [0,0,0,0,0,0|1,0,3]=4 19 B6R1.2 Brc1ccno1 Amb20242149 [0,0,0,0,0,0|2,0,2]=4 20 B6R1.2 Brc1cnco1 Amb24058248 [0,0,0,0,0,0|2,0,2]=4 21 B6R1.2 Brc1cnco1 Amb32667046 [0,0,0,0,0,0|2,0,2]=4 22 B6R1.2 Brc1ncco1 Amb10071482 [0,0,0,0,0,0|2,0,2]=4 23 B6R1.2 Brc1ncco1 Amb19514894 [0,0,0,0,0,0|2,0,2]=4 24 B6R1.2 Brc1nnco1 Amb28322838 [0,0,0,0,0,0|3,0,1]=4 25 B6R1.2 C=C1CCCC1 Amb22337671 [0,0,0,0,0,0|2,0,0]=2 26 B6R1.2 C=C1CCCS1 Amb28137153 [0,0,0,0,0,0|1,1,0]=2 27 B6R1.2 C=C1CCNC1 Amb22490848 [0,0,0,0,0,0|3,0,0]=3 28 B6R1.2 C=C1CCNC1 Amb27782898 [0,0,0,0,0,0|3,0,0]=3 29 B6R1.2 C=C1CCSC1 Amb26477950 [0,0,0,0,0,0|3,0,0]=3 30 B6R1.2 C=C1CNOC1 Amb31156059 [0,0,0,0,0,0|4,0,0]=4 31 B6R1.2 C=C1CNOC1 Amb33309622 [0,0,0,0,0,0|4,0,0]=4 32 B6R1.2 C=C1N=CCS1 Amb27796505 [0,0,0,0,0,0|2,1,1]=4 33 B6R1.2 C=C1OCCO1 Amb24477046 [0,0,0,0,0,0|2,0,0]=2 34 B6R1.2 CC1=CC=CC1 Amb26338978 [0,0,0,0,0,0|2,0,2]=4 35 B6R1.2 CC1=CCCC1 Amb8513250 [0,0,0,0,0,0|2,0,0]=2 36 B6R1.2 CC1=CCCO1 Amb20621083 [0,0,0,0,0,0|1,0,1]=2 37 B6R1.2 CC1=CSCC1 Amb26495749 [0,0,0,0,0,0|3,0,0]=3 38 B6R1.2 CC1=NCCC1 Amb8513341 [0,0,0,0,0,0|2,0,0]=2 39 B6R1.2 CC1=NCCN1 Amb1294344 [0,0,0,0,0,0|3,0,0]=3 40 B6R1.2 CC1=NCCO1 Amb8395082 [0,0,0,0,0,0|2,0,0]=2 41 B6R1.2 CC1=NCCS1 Amb6608778 [0,0,0,0,0,0|2,1,0]=3 42 B6R1.2 CC1=NNCC1 Amb8492492 [0,0,0,0,0,0|3,0,0]=3 43 B6R1.2 CC1=NOCN1 Amb27262288 [0,0,0,0,0,0|4,0,0]=4 44 B6R1.2 CC1C=CCC1 Amb17674168 [0,0,0,0,0,0|2,0,2]=4 45 B6R1.2 CC1CCCC1 Amb8516028 [0,0,0,0,0,0|2,0,1]=3 46 B6R1.2 CC1CCCN1 Amb8387002 [0,0,0,0,0,0|2,0,1]=3 47 B6R1.2 CC1CCCN1 Amb9713910 [0,0,0,0,0,0|2,0,1]=3 48 B6R1.2 CC1CCCO1 Amb8385612 [0,0,0,0,0,0|1,0,1]=2 49 B6R1.2 CC1CCCS1 Amb2689709 [0,0,0,0,0,0|1,1,1]=3 50 B6R1.2 CC1CCC[Cl+]1 Amb27233495 [0,0,0,0,0,0|2,0,1]=3 51 B6R1.2 CC1CCNC1 Amb15690616 [0,0,0,0,0,0|3,0,1]=4 52 B6R1.2 CC1CCNC1 Amb8630788 [0,0,0,0,0,0|3,0,1]=4 53 B6R1.2 CC1CCNO1 Amb27209819 [0,0,0,0,0,0|2,0,1]=3 54 B6R1.2 CC1CCOC1 Amb4418362 [0,0,0,0,0,0|3,0,1]=4 55 B6R1.2 CC1CCON1 Amb27793876 [0,0,0,0,0,0|3,0,1]=4 56 B6R1.2 CC1CCSC1 Amb20621725 [0,0,0,0,0,0|3,0,1]=4 57 B6R1.2 CC1CNCO1 Amb25934148 [0,0,0,0,0,0|2,0,1]=3 58 B6R1.2 CC1CNCS1 Amb27185493 [0,0,0,0,0,0|2,1,1]=4 59 B6R1.2 CC1CNCS1 Amb33330411 [0,0,0,0,0,0|2,1,1]=4 60 B6R1.2 CC1COCN1 Amb17506155 [0,0,0,0,0,0|3,0,1]=4 61 B6R1.2 CC1CSCN1 Amb24550471 [0,0,0,0,0,0|3,0,1]=4 62 B6R1.2 CC1CSCN1 Amb33330531 [0,0,0,0,0,0|3,0,1]=4 63 B6R1.2 CC1NCCN1 Amb28365170 [0,0,0,0,0,0|3,0,1]=4 64 B6R1.2 CC1NCCO1 Amb17506154 [0,0,0,0,0,0|2,0,1]=3 65 B6R1.2 CC1NCCS1 Amb10844849 [0,0,0,0,0,0|2,1,1]=4 66 B6R1.2 CC1SCCS1 Amb8517640 [0,0,0,0,0,0|2,1,1]=4 67 B6R1.2 CN1C=NCC1 Amb10565894 [0,0,0,0,0,0|4,0,0]=4 68 B6R1.2 CN1CCCC1 Amb8513261 [0,0,0,0,0,0|3,0,0]=3 69 B6R1.2 CN1CCCN1 Amb28058528 [0,0,0,0,0,0|3,0,0]=3 70 B6R1.2 CN1CCCN1 Amb35826246 [0,0,0,0,0,0|3,0,0]=3 71 B6R1.2 CN1CCNC1 Amb25663131 [0,0,0,0,0,0|4,0,0]=4 72 B6R1.2 CN1CCOC1 Amb25146749 [0,0,0,0,0,0|4,0,0]=4 73 B6R1.2 C[C@@H]1CCCN1 Amb10071006 [0,0,0,0,0,0|2,0,1]=3 74 B6R1.2 C[C@@H]1CCCN1 Amb8628964 [0,0,0,0,0,0|2,0,1]=3 75 B6R1.2 C[C@@H]1CCNC1 Amb19888329 [0,0,0,0,0,0|3,0,1]=4 76 B6R1.2 C[C@@H]1CCNC1 Amb27593574 [0,0,0,0,0,0|3,0,1]=4 77 B6R1.2 C[C@@H]1CNCO1 Amb35788486 [0,0,0,0,0,0|2,0,1]=3 78 B6R1.2 C[C@H]1CCCN1 Amb10071007 [0,0,0,0,0,0|2,0,1]=3 79 B6R1.2 C[C@H]1CCCN1 Amb8387004 [0,0,0,0,0,0|2,0,1]=3 80 B6R1.2 C[C@H]1CCNC1 Amb19887708 [0,0,0,0,0,0|3,0,1]=4 81 B6R1.2 C[C@H]1CNCO1 Amb35788704 [0,0,0,0,0,0|2,0,1]=3 82 B6R1.2 C[C@H]1COCN1 Amb28383154 [0,0,0,0,0,0|3,0,1]=4 83 B6R1.2 Cc1ccco1 Amb2447070 [0,0,0,0,0,0|1,0,3]=4 84 B6R1.2 Cc1ccno1 Amb33544333 [0,0,0,0,0,0|2,0,2]=4 85 B6R1.2 Cc1cnco1 Amb23403175 [0,0,0,0,0,0|2,0,2]=4 86 B6R1.2 Cc1ncco1 Amb17399783 [0,0,0,0,0,0|2,0,2]=4 87 B6R1.2 Cc1ncco1 Amb22757206 [0,0,0,0,0,0|2,0,2]=4 88 B6R1.2 Cc1nnco1 Amb20171395 [0,0,0,0,0,0|3,0,1]=4 89 B6R1.2 ClC1=CCC=C1 Amb22584067 [0,0,0,0,0,0|2,0,2]=4 90 B6R1.2 ClC1=NCCN1 Amb27624895 [0,0,0,0,0,0|3,0,0]=3 91 B6R1.2 ClC1=NCCO1 Amb8396614 [0,0,0,0,0,0|2,0,0]=2 92 B6R1.2 ClC1=NCCS1 Amb24621482 [0,0,0,0,0,0|2,1,0]=3 93 B6R1.2 ClC1C=CCC1 Amb17672585 [0,0,0,0,0,0|2,0,2]=4 94 B6R1.2 ClC1CCCC1 Amb3940287 [0,0,0,0,0,0|2,0,1]=3 95 B6R1.2 ClC1CCNC1 Amb18640558 [0,0,0,0,0,0|3,0,1]=4 96 B6R1.2 ClC1CCNC1 Amb22229273 [0,0,0,0,0,0|3,0,1]=4 97 B6R1.2 ClC1CCOC1 Amb20623054 [0,0,0,0,0,0|3,0,1]=4 98 B6R1.2 ClP1OCCO1 Amb4297344 [0,0,0,0,0,0|3,0,0]=3 99 B6R1.2 Cl[C@H]1CCNC1 Amb22226671 [0,0,0,0,0,0|3,0,1]=4 100 B6R1.2 Clc1ccco1 Amb27805575 [0,0,0,0,0,0|1,0,3]=4 101 B6R1.2 Clc1ncco1 Amb22054705 [0,0,0,0,0,0|2,0,2]=4 102 B6R1.2 Clc1ncco1 Amb32655821 [0,0,0,0,0,0|2,0,2]=4 103 B6R1.2 FC1=CCNC1 Amb35751388 [0,0,0,0,0,0|3,0,0]=3 104 B6R1.2 FC1=CCNC1 Amb35752602 [0,0,0,0,0,0|3,0,0]=3 105 B6R1.2 FC1=COCC1 Amb24322813 [0,0,0,0,0,0|3,0,0]=3 106 B6R1.2 FC1=NCCS1 Amb26341808 [0,0,0,0,0,0|2,1,0]=3 107 B6R1.2 FC1CCCC1 Amb10839457 [0,0,0,0,0,0|2,0,1]=3 108 B6R1.2 FC1CCCN1 Amb27590475 [0,0,0,0,0,0|2,0,1]=3 109 B6R1.2 FC1CCNC1 Amb19148522 [0,0,0,0,0,0|3,0,1]=4 110 B6R1.2 FC1CCNC1 Amb8010918 [0,0,0,0,0,0|3,0,1]=4 111 B6R1.2 F[C@@H]1CCNC1 Amb10603224 [0,0,0,0,0,0|3,0,1]=4 112 B6R1.2 F[C@@H]1CCNC1 Amb2688413 [0,0,0,0,0,0|3,0,1]=4 113 B6R1.2 F[C@H]1CCNC1 Amb10603273 [0,0,0,0,0,0|3,0,1]=4 114 B6R1.2 F[C@H]1CCNC1 Amb2688414 [0,0,0,0,0,0|3,0,1]=4 115 B6R1.2 Fc1ccco1 Amb27470402 [0,0,0,0,0,0|1,0,3]=4 116 B6R1.2 IC1=CCCC1 Amb24332192 [0,0,0,0,0,0|2,0,0]=2 117 B6R1.2 IC1=CCCO1 Amb24322816 [0,0,0,0,0,0|1,0,1]=2 118 B6R1.2 IC1=COCC1 Amb24322814 [0,0,0,0,0,0|3,0,0]=3 119 B6R1.2 IC1CCCC1 Amb3941530 [0,0,0,0,0,0|2,0,1]=3 120 B6R1.2 IC1CCNC1 Amb22229333 [0,0,0,0,0,0|3,0,1]=4 121 B6R1.2 IC1CCOC1 Amb9677596 [0,0,0,0,0,0|3,0,1]=4 122 B6R1.2 IC1CCSC1 Amb35704950 [0,0,0,0,0,0|3,0,1]=4 123 B6R1.2 IN1CCCC1 Amb27765883 [0,0,0,0,0,0|3,0,0]=3 124 B6R1.2 I[C@@H]1CCOC1 Amb25337461 [0,0,0,0,0,0|3,0,1]=4 125 B6R1.2 I[C@H]1CCOC1 Amb22405918 [0,0,0,0,0,0|3,0,1]=4 126 B6R1.2 Ic1ccco1 Amb17672748 [0,0,0,0,0,0|1,0,3]=4 127 B6R1.2 Ic1cnco1 Amb33250373 [0,0,0,0,0,0|2,0,2]=4 128 B6R1.2 Ic1ncco1 Amb33547666 [0,0,0,0,0,0|2,0,2]=4 129 B6R1.2 N=C1C=CNC1 Amb28135748 [0,0,0,0,0,0|3,0,1]=4 130 B6R1.2 N=C1CCC=N1 Amb28436317 [0,0,0,0,0,0|2,0,1]=3 131 B6R1.2 N=C1CCCN1 Amb2371632 [0,0,0,0,0,0|2,0,0]=2 132 B6R1.2 N=C1CCCN1 Amb501585 [0,0,0,0,0,0|2,0,0]=2 133 B6R1.2 N=C1CCCS1 Amb10072429 [0,0,0,0,0,0|1,1,0]=2 134 B6R1.2 N=C1CCCS1 Amb9825646 [0,0,0,0,0,0|1,1,0]=2 135 B6R1.2 N=C1NCCN1 Amb21859025 [0,0,0,0,0,0|3,0,0]=3 136 B6R1.2 N=C1NCCO1 Amb20623979 [0,0,0,0,0,0|2,0,0]=2 137 B6R1.2 N=C1NCCS1 Amb8470061 [0,0,0,0,0,0|2,1,0]=3 138 B6R1.2 N=C1SCCS1 Amb22168117 [0,0,0,0,0,0|2,1,0]=3 139 B6R1.2 NC1=CCNN1 Amb22346141 [0,0,0,0,0,0|3,0,1]=4 140 B6R1.2 NC1=CCNN1 Amb24053526 [0,0,0,0,0,0|3,0,1]=4 141 B6R1.2 NC1=CCNN1 Amb24080576 [0,0,0,0,0,0|3,0,1]=4 142 B6R1.2 NC1=CCNN1 Amb6889369 [0,0,0,0,0,0|3,0,1]=4 143 B6R1.2 NC1=NCC=C1 Amb25208790 [0,0,0,0,0,0|2,0,2]=4 144 B6R1.2 NC1=NCCC1 Amb10976565 [0,0,0,0,0,0|2,0,0]=2 145 B6R1.2 NC1=NCCC1 Amb8342250 [0,0,0,0,0,0|2,0,0]=2 146 B6R1.2 NC1=NCCN1 Amb10810372 [0,0,0,0,0,0|3,0,0]=3 147 B6R1.2 NC1=NCCO1 Amb24325166 [0,0,0,0,0,0|2,0,0]=2 148 B6R1.2 NC1=NCCS1 Amb1924859 [0,0,0,0,0,0|2,1,0]=3 149 B6R1.2 NC1=NCCS1 Amb2684532 [0,0,0,0,0,0|2,1,0]=3 150 B6R1.2 NC1=NCCS1 Amb6860805 [0,0,0,0,0,0|2,1,0]=3 151 B6R1.2 NC1=NNCC1 Amb22330617 [0,0,0,0,0,0|3,0,0]=3 152 B6R1.2 NC1=NNCC1 Amb28555323 [0,0,0,0,0,0|3,0,0]=3 153 B6R1.2 NC1=NOCC1 Amb27975619 [0,0,0,0,0,0|3,0,0]=3 154 B6R1.2 NC1C=CCC1 Amb23385329 [0,0,0,0,0,0|2,0,2]=4 155 B6R1.2 NC1C=CCC1 Amb26367288 [0,0,0,0,0,0|2,0,2]=4 156 B6R1.2 NC1CCCC1 Amb2792832 [0,0,0,0,0,0|2,0,1]=3 157 B6R1.2 NC1CCCO1 Amb16233703 [0,0,0,0,0,0|1,0,1]=2 158 B6R1.2 NC1CCNC1 Amb2720262 [0,0,0,0,0,0|3,0,1]=4 159 B6R1.2 NC1CCNC1 Amb2777850 [0,0,0,0,0,0|3,0,1]=4 160 B6R1.2 NC1CCOC1 Amb33536523 [0,0,0,0,0,0|3,0,1]=4 161 B6R1.2 NC1CCOC1 Amb3941188 [0,0,0,0,0,0|3,0,1]=4 162 B6R1.2 NC1CCSC1 Amb19149005 [0,0,0,0,0,0|3,0,1]=4 163 B6R1.2 NC1CCSC1 Amb9709380 [0,0,0,0,0,0|3,0,1]=4 164 B6R1.2 NN1CCCC1 Amb2720328 [0,0,0,0,0,0|3,0,0]=3 165 B6R1.2 NN1CCCC1 Amb32651939 [0,0,0,0,0,0|3,0,0]=3 166 B6R1.2 NN1CCCC1 Amb836837 [0,0,0,0,0,0|3,0,0]=3 167 B6R1.2 N[C@@H]1CCNC1 Amb2696338 [0,0,0,0,0,0|3,0,1]=4 168 B6R1.2 N[C@@H]1CCNC1 Amb8396670 [0,0,0,0,0,0|3,0,1]=4 169 B6R1.2 N[C@@H]1CCOC1 Amb19515768 [0,0,0,0,0,0|3,0,1]=4 170 B6R1.2 N[C@@H]1CCOC1 Amb8628967 [0,0,0,0,0,0|3,0,1]=4 171 B6R1.2 N[C@@H]1CCSC1 Amb28067533 [0,0,0,0,0,0|3,0,1]=4 172 B6R1.2 N[C@H]1CCNC1 Amb2696339 [0,0,0,0,0,0|3,0,1]=4 173 B6R1.2 N[C@H]1CCOC1 Amb10603285 [0,0,0,0,0,0|3,0,1]=4 174 B6R1.2 N[C@H]1CCOC1 Amb8389308 [0,0,0,0,0,0|3,0,1]=4 175 B6R1.2 N[C@H]1CCSC1 Amb24611361 [0,0,0,0,0,0|3,0,1]=4 176 B6R1.2 Nc1ccco1 Amb18203215 [0,0,0,0,0,0|1,0,3]=4 177 B6R1.2 Nc1ccno1 Amb33528297 [0,0,0,0,0,0|2,0,2]=4 178 B6R1.2 Nc1cnco1 Amb21962026 [0,0,0,0,0,0|2,0,2]=4 179 B6R1.2 Nc1cnco1 Amb21963496 [0,0,0,0,0,0|2,0,2]=4 180 B6R1.2 Nc1ncco1 Amb6751913 [0,0,0,0,0,0|2,0,2]=4 181 B6R1.2 Nc1ncno1 Amb18943952 [0,0,0,0,0,0|3,0,1]=4 182 B6R1.2 Nc1nnco1 Amb19516986 [0,0,0,0,0,0|3,0,1]=4 183 B6R1.2 O=C1C=CCC1 Amb4019519 [0,0,0,0,0,0|1,0,1]=2 184 B6R1.2 O=C1C=CCN1 Amb20241082 [0,0,0,0,0,0|1,0,2]=3 185 B6R1.2 O=C1C=CCO1 Amb2792769 [0,0,0,0,0,0|0,0,2]=2 186 B6R1.2 O=C1C=CCS1 Amb22336458 [0,0,0,0,0,0|0,1,2]=3 187 B6R1.2 O=C1C=CN=N1 Amb22230022 [0,0,0,0,0,0|2,0,2]=4 188 B6R1.2 O=C1C=CNN1 Amb19958916 [0,0,0,0,0,0|2,0,2]=4 189 B6R1.2 O=C1C=COC1 Amb24107591 [0,0,0,0,0,0|2,0,1]=3 190 B6R1.2 O=C1C=CSN1 Amb19895016 [0,0,0,0,0,0|2,0,2]=4 191 B6R1.2 O=C1C=CSS1 Amb27421370 [0,0,0,0,0,0|1,1,2]=4 192 B6R1.2 O=C1C=NCN1 Amb26572891 [0,0,0,0,0,0|2,0,1]=3 193 B6R1.2 O=C1C=NCO1 Amb25786221 [0,0,0,0,0,0|1,0,1]=2 194 B6R1.2 O=C1C=NN=C1 Amb28351406 [0,0,0,0,0,0|3,0,1]=4 195 B6R1.2 O=C1CC=CC1 Amb2686649 [0,0,0,0,0,0|1,0,2]=3 196 B6R1.2 O=C1CC=CN1 Amb22235167 [0,0,0,0,0,0|1,0,2]=3 197 B6R1.2 O=C1CC=NN1 Amb3428206 [0,0,0,0,0,0|2,0,1]=3 198 B6R1.2 O=C1CC=NO1 Amb27654112 [0,0,0,0,0,0|1,0,1]=2 199 B6R1.2 O=C1CCCC1 Amb2793024 [0,0,0,0,0,0|1,0,0]=1 200 B6R1.2 O=C1CCCN1 Amb22169686 [0,0,0,0,0,0|1,0,0]=1 201 B6R1.2 O=C1CCCN1 Amb6608645 [0,0,0,0,0,0|1,0,0]=1 202 B6R1.2 O=C1CCCO1 Amb3940401 [0,0,0,0,0,0|0,0,0]=0 203 B6R1.2 O=C1CCCS1 Amb22338102 [0,0,0,0,0,0|0,1,0]=1 204 B6R1.2 O=C1CCNC1 Amb2700623 [0,0,0,0,0,0|2,0,0]=2 205 B6R1.2 O=C1CCNC1 Amb8386645 [0,0,0,0,0,0|2,0,0]=2 206 B6R1.2 O=C1CCNN1 Amb33551041 [0,0,0,0,0,0|2,0,0]=2 207 B6R1.2 O=C1CCNN1 Amb3428540 [0,0,0,0,0,0|2,0,0]=2 208 B6R1.2 O=C1CCOC1 Amb7990143 [0,0,0,0,0,0|2,0,0]=2 209 B6R1.2 O=C1CCON1 Amb22235009 [0,0,0,0,0,0|2,0,0]=2 210 B6R1.2 O=C1CCSC1 Amb2720904 [0,0,0,0,0,0|2,0,0]=2 211 B6R1.2 O=C1CN=CS1 Amb27963219 [0,0,0,0,0,0|1,1,1]=3 212 B6R1.2 O=C1CNCN1 Amb19957368 [0,0,0,0,0,0|2,0,0]=2 213 B6R1.2 O=C1CNCS1 Amb27443758 [0,0,0,0,0,0|1,1,0]=2 214 B6R1.2 O=C1COCN1 Amb28132686 [0,0,0,0,0,0|2,0,0]=2 215 B6R1.2 O=C1CSCN1 Amb28187121 [0,0,0,0,0,0|2,0,0]=2 216 B6R1.2 O=C1CSSC1 Amb28351444 [0,0,0,0,0,0|3,0,0]=3 217 B6R1.2 O=C1N=CC=N1 Amb25138138 [0,0,0,0,0,0|2,0,2]=4 218 B6R1.2 O=C1N=CN=N1 Amb3614275 [0,0,0,0,0,0|3,0,1]=4 219 B6R1.2 O=C1NC=CN1 Amb19516737 [0,0,0,0,0,0|2,0,2]=4 220 B6R1.2 O=C1NC=CO1 Amb20671008 [0,0,0,0,0,0|1,0,2]=3 221 B6R1.2 O=C1NC=CS1 Amb19271596 [0,0,0,0,0,0|1,1,2]=4 222 B6R1.2 O=C1NC=NN1 Amb20243425 [0,0,0,0,0,0|3,0,1]=4 223 B6R1.2 O=C1NCCN1 Amb6357221 [0,0,0,0,0,0|2,0,0]=2 224 B6R1.2 O=C1NCCN1 Amb6608941 [0,0,0,0,0,0|2,0,0]=2 225 B6R1.2 O=C1NCCO1 Amb6608807 [0,0,0,0,0,0|1,0,0]=1 226 B6R1.2 O=C1NCCS1 Amb431322 [0,0,0,0,0,0|1,1,0]=2 227 B6R1.2 O=C1NN=CO1 Amb20667671 [0,0,0,0,0,0|2,0,1]=3 228 B6R1.2 O=C1NN=CS1 Amb22491285 [0,0,0,0,0,0|2,1,1]=4 229 B6R1.2 O=C1OC=CO1 Amb20239430 [0,0,0,0,0,0|1,0,2]=3 230 B6R1.2 O=C1OCCO1 Amb4057710 [0,0,0,0,0,0|1,0,0]=1 231 B6R1.2 O=C1OCCS1 Amb27398683 [0,0,0,0,0,0|1,0,0]=1 232 B6R1.2 O=S1CCCC1 Amb2690579 [0,0,0,0,0,0|2,0,0]=2 233 B6R1.2 O=S1CCNC1 Amb28075495 [0,0,0,0,0,0|3,0,0]=3 234 B6R1.2 O=S1OCCO1 Amb8383890 [0,0,0,0,0,0|2,0,0]=2 235 B6R1.2 O=[PH]1CC=CC1 Amb35747085 [0,0,0,0,0,0|2,0,2]=4 236 B6R1.2 O=[PH]1CCCC1 Amb33804724 [0,0,0,0,0,0|2,0,0]=2 237 B6R1.2 O=[PH]1OCCO1 Amb22346149 [0,0,0,0,0,0|2,0,0]=2 238 B6R1.2 OC1=NC=NC1 Amb26446352 [0,0,0,0,0,0|2,0,2]=4 239 B6R1.2 OC1=NNCC1 Amb2111955 [0,0,0,0,0,0|2,0,1]=3 240 B6R1.2 OC1=NNCC1 Amb844737 [0,0,0,0,0,0|2,0,1]=3 241 B6R1.2 OC1C=CCC1 Amb33546881 [0,0,0,0,0,0|1,0,3]=4 242 B6R1.2 OC1CCCC1 Amb3939016 [0,0,0,0,0,0|1,0,2]=3 243 B6R1.2 OC1CCCN1 Amb28120620 [0,0,0,0,0,0|1,0,2]=3 244 B6R1.2 OC1CCCO1 Amb17615892 [0,0,0,0,0,0|0,0,2]=2 245 B6R1.2 OC1CCCS1 Amb27864587 [0,0,0,0,0,0|0,1,2]=3 246 B6R1.2 OC1CCNC1 Amb22436788 [0,0,0,0,0,0|2,0,2]=4 247 B6R1.2 OC1CCNC1 Amb2688790 [0,0,0,0,0,0|2,0,2]=4 248 B6R1.2 OC1CCNC1 Amb2690449 [0,0,0,0,0,0|2,0,2]=4 249 B6R1.2 OC1CCOC1 Amb2688794 [0,0,0,0,0,0|2,0,2]=4 250 B6R1.2 OC1CCSC1 Amb9748224 [0,0,0,0,0,0|2,0,2]=4 251 B6R1.2 OC1NCCN1 Amb28455288 [0,0,0,0,0,0|2,0,2]=4 252 B6R1.2 ON1CCCC1 Amb30988006 [0,0,0,0,0,0|2,0,1]=3 253 B6R1.2 ON1CCCC1 Amb4035438 [0,0,0,0,0,0|2,0,1]=3 254 B6R1.2 OP1OCCO1 Amb24546968 [0,0,0,0,0,0|2,0,1]=3 255 B6R1.2 O[C@@H]1CCNC1 Amb2688791 [0,0,0,0,0,0|2,0,2]=4 256 B6R1.2 O[C@@H]1CCNC1 Amb3939360 [0,0,0,0,0,0|2,0,2]=4 257 B6R1.2 O[C@@H]1CCOC1 Amb8628960 [0,0,0,0,0,0|2,0,2]=4 258 B6R1.2 O[C@@H]1CCSC1 Amb27160810 [0,0,0,0,0,0|2,0,2]=4 259 B6R1.2 O[C@H]1C=CCC1 Amb28133982 [0,0,0,0,0,0|1,0,3]=4 260 B6R1.2 O[C@H]1CCNC1 Amb2688792 [0,0,0,0,0,0|2,0,2]=4 261 B6R1.2 O[C@H]1CCNC1 Amb33716680 [0,0,0,0,0,0|2,0,2]=4 262 B6R1.2 O[C@H]1CCNC1 Amb8384246 [0,0,0,0,0,0|2,0,2]=4 263 B6R1.2 O[C@H]1CCOC1 Amb32409449 [0,0,0,0,0,0|2,0,2]=4 264 B6R1.2 O[C@H]1CCOC1 Amb33718794 [0,0,0,0,0,0|2,0,2]=4 265 B6R1.2 O[C@H]1CCOC1 Amb3940165 [0,0,0,0,0,0|2,0,2]=4 266 B6R1.2 O[C@H]1CCSC1 Amb27211574 [0,0,0,0,0,0|2,0,2]=4 267 B6R1.2 Oc1ccco1 Amb25991417 [0,0,0,0,0,0|0,0,4]=4 268 B6R1.2 Oc1cnco1 Amb25301524 [0,0,0,0,0,0|1,0,3]=4 269 B6R1.2 Oc1ncno1 Amb26965847 [0,0,0,0,0,0|2,0,2]=4 270 B6R1.2 Oc1nnco1 Amb22586631 [0,0,0,0,0,0|2,0,2]=4 271 B6R1.2 PN1CCCC1 Amb27430446 [0,0,0,0,0,0|3,0,0]=3 272 B6R1.2 S=C1C=CCO1 Amb27971151 [0,0,0,0,0,0|0,1,2]=3 273 B6R1.2 S=C1CC=CN1 Amb27239207 [0,0,0,0,0,0|1,1,2]=4 274 B6R1.2 S=C1CCCC1 Amb28049287 [0,0,0,0,0,0|1,1,0]=2 275 B6R1.2 S=C1CCCN1 Amb2778514 [0,0,0,0,0,0|1,1,0]=2 276 B6R1.2 S=C1CCCO1 Amb27808589 [0,0,0,0,0,0|0,1,0]=1 277 B6R1.2 S=C1CN=CS1 Amb24093708 [0,0,0,0,0,0|1,2,1]=4 278 B6R1.2 S=C1COC=N1 Amb27636708 [0,0,0,0,0,0|2,1,1]=4 279 B6R1.2 S=C1NC=CO1 Amb21936248 [0,0,0,0,0,0|1,1,2]=4 280 B6R1.2 S=C1NCCN1 Amb2720352 [0,0,0,0,0,0|2,1,0]=3 281 B6R1.2 S=C1NCCO1 Amb2371644 [0,0,0,0,0,0|1,1,0]=2 282 B6R1.2 S=C1NCCS1 Amb4010551 [0,0,0,0,0,0|1,2,0]=3 283 B6R1.2 S=C1SCCS1 Amb8517514 [0,0,0,0,0,0|1,2,0]=3 284 B6R1.2 SC1=NCCN1 Amb3778841 [0,0,0,0,0,0|2,1,0]=3 285 B6R1.2 SC1=NCCS1 Amb2720331 [0,0,0,0,0,0|1,2,0]=3 286 B6R1.2 SC1C=CCC1 Amb32788808 [0,0,0,0,0,0|1,1,2]=4 287 B6R1.2 SC1CCCC1 Amb6608767 [0,0,0,0,0,0|1,1,1]=3 288 B6R1.2 SC1CCNC1 Amb10608919 [0,0,0,0,0,0|2,1,1]=4 289 B6R1.2 SC1CCOC1 Amb22298444 [0,0,0,0,0,0|2,1,1]=4 290 B6R1.2 SC1CCSC1 Amb7784766 [0,0,0,0,0,0|2,1,1]=4 291 B6R1.2 Sc1ccco1 Amb26641519 [0,0,0,0,0,0|0,1,3]=4 292 B6R1.2 Sc1nnco1 Amb8471779 [0,0,0,0,0,0|2,1,1]=4 293 B6R1.2 [NH3+]C1CC[NH2+]C1 Amb33513012 [0,0,0,0,0,0|3,0,1]=4 294 B6R1.2 [NH3+][C@@H]1CC[NH2+]C1 Amb8397249 [0,0,0,0,0,0|3,0,1]=4 295 B6R1.2 [NH3+][C@H]1CC[NH2+]C1 Amb8397248 [0,0,0,0,0,0|3,0,1]=4 296 B6R1.2 [O-][N+]1=CCCC1 Amb28066729 [0,0,0,0,0,0|2,0,1]=3 297 B6R1.2 [O-][N+]1=CCNC1 Amb27963190 [0,0,0,0,0,0|3,0,1]=4 298 B6R1.2 [SiH3]C1CCCC1 Amb22229567 [0,0,0,0,0,0|2,0,1]=3 299 B5R1.1 C1=CCCC1 Amb6608970 [1,0,0,0,0,0|1,0,0]=2 300 B5R1.1 C1=CCNC1 Amb2695003 [1,0,0,0,0,0|2,0,0]=3 301 B5R1.1 C1=CCNC1 Amb8630078 [1,0,0,0,0,0|2,0,0]=3 302 B5R1.1 C1=CCOC1 Amb7809243 [1,0,0,0,0,0|2,0,0]=3 303 B5R1.1 C1=CCSC1 Amb33544213 [1,0,0,0,0,0|2,0,0]=3 304 B5R1.1 C1=CNCC1 Amb24476832 [1,0,0,0,0,0|1,0,1]=3 305 B5R1.1 C1=COCC1 Amb6609005 [1,0,0,0,0,0|0,0,1]=2 306 B5R1.1 C1=COCN1 Amb20242493 [1,0,0,0,0,0|1,0,1]=3 307 B5R1.1 C1=CSCC1 Amb24065325 [1,0,0,0,0,0|0,1,1]=3 308 B5R1.1 C1=CSSC1 Amb27437397 [1,0,0,0,0,0|1,1,1]=4 309 B5R1.1 C1=NCCC1 Amb28282781 [1,0,0,0,0,0|1,0,0]=2 310 B5R1.1 C1=NCCN1 Amb25083166 [1,0,0,0,0,0|2,0,0]=3 311 B5R1.1 C1=NCCO1 Amb16234259 [1,0,0,0,0,0|1,0,0]=2 312 B5R1.1 C1=NCCS1 Amb4022861 [1,0,0,0,0,0|1,1,0]=3 313 B5R1.1 C1=NCNC1 Amb27449121 [1,0,0,0,0,0|2,0,0]=3 314 B5R1.1 C1=NNCC1 Amb21618957 [1,0,0,0,0,0|2,0,0]=3 315 B5R1.1 C1=NNCN1 Amb28186670 [1,0,0,0,0,0|3,0,0]=4 316 B5R1.1 C1=NOCN1 Amb24117046 [1,0,0,0,0,0|2,0,1]=4 317 B5R1.1 C1CCNC1 Amb2792830 [1,0,0,0,0,0|1,0,1]=3 318 B5R1.1 C1CCOC1 Amb2792997 [1,0,0,0,0,0|0,0,1]=2 319 B5R1.1 C1CCSC1 Amb2690554 [1,0,0,0,0,0|0,1,1]=3 320 B5R1.1 C1CC[SiH2]C1 Amb27494656 [1,0,0,0,0,0|1,0,1]=3 321 B5R1.1 C1CNCN1 Amb22497691 [1,0,0,0,0,0|2,0,1]=4 322 B5R1.1 C1CNNC1 Amb18061973 [1,0,0,0,0,0|2,0,0]=3 323 B5R1.1 C1CNNC1 Amb21964916 [1,0,0,0,0,0|2,0,0]=3 324 B5R1.1 C1CNOC1 Amb6365588 [1,0,0,0,0,0|1,0,0]=2 325 B5R1.1 C1CNOC1 Amb8503363 [1,0,0,0,0,0|1,0,0]=2 326 B5R1.1 C1COCN1 Amb17506153 [1,0,0,0,0,0|1,0,1]=3 327 B5R1.1 C1CSCN1 Amb30633758 [1,0,0,0,0,0|1,1,1]=4 328 B5R1.1 C1CSCN1 Amb3940118 [1,0,0,0,0,0|1,1,1]=4 329 B5R1.1 C1CSCS1 Amb10071964 [1,0,0,0,0,0|1,1,1]=4 330 B5R1.1 [C-]1=CC=CC1 Amb22231445 [1,0,0,0,0,0|1,0,2]=4 331 B5R1.1 c1ccoc1 Amb6608834 [1,0,0,0,0,0|0,0,3]=4 332 B5R1.1 c1cnoc1 Amb2694985 [1,0,0,0,0,0|1,0,2]=4 333 B5R1.1 c1cocn1 Amb2608869 [1,0,0,0,0,0|1,0,2]=4 334 B5R1.1 c1nnco1 Amb10552366 [1,0,0,0,0,0|2,0,1]=4 335 B7R1.1 BrC=C1CCCC1 Amb27592183 [0,1,0,0,0,0|2,0,0]=3 336 B7R1.1 BrC=C1OCCO1 Amb25697137 [0,1,0,0,0,0|2,0,0]=3 337 B7R1.1 BrCC1=CCCC1 Amb23439168 [0,1,0,0,0,0|2,0,0]=3 338 B7R1.1 BrCC1CCCC1 Amb8631537 [0,1,0,0,0,0|2,0,1]=4 339 B7R1.1 BrCC1CCCN1 Amb20618588 [0,1,0,0,0,0|2,0,1]=4 340 B7R1.1 BrCC1CCCN1 Amb21962027 [0,1,0,0,0,0|2,0,1]=4 341 B7R1.1 BrCC1CCCN1 Amb32411817 [0,1,0,0,0,0|2,0,1]=4 342 B7R1.1 BrCC1CCCO1 Amb9703505 [0,1,0,0,0,0|1,0,1]=3 343 B7R1.1 BrCC1CCCS1 Amb27832399 [0,1,0,0,0,0|1,1,1]=4 344 B7R1.1 BrCC1OCCO1 Amb3940345 [0,1,0,0,0,0|2,0,1]=4 345 B7R1.1 BrC[C@@H]1CCCN1 Amb25809414 [0,1,0,0,0,0|2,0,1]=4 346 B7R1.1 BrC[C@@H]1CCCN1 Amb32668728 [0,1,0,0,0,0|2,0,1]=4 347 B7R1.1 BrC[C@@H]1CCCO1 Amb24046261 [0,1,0,0,0,0|1,0,1]=3 348 B7R1.1 BrC[C@H]1CCCO1 Amb26844489 [0,1,0,0,0,0|1,0,1]=3 349 B7R1.1 Br\C=C1\COCO1 Amb27656799 [0,1,0,0,0,0|2,0,0]=3 350 B7R1.1 C#CC1=CCCC1 Amb17689255 [0,1,0,0,0,0|2,0,0]=3 351 B7R1.1 C#CC1CCCC1 Amb8396063 [0,1,0,0,0,0|2,0,1]=4 352 B7R1.1 C#CC1CCCN1 Amb23598273 [0,1,0,0,0,0|2,0,1]=4 353 B7R1.1 C#CC1CCCN1 Amb30584690 [0,1,0,0,0,0|2,0,1]=4 354 B7R1.1 C#CC1CCCO1 Amb27874548 [0,1,0,0,0,0|1,0,1]=3 355 B7R1.1 C#CC1CCCS1 Amb33169129 [0,1,0,0,0,0|1,1,1]=4 356 B7R1.1 C#C[C@@H]1CCCN1 Amb24479840 [0,1,0,0,0,0|2,0,1]=4 357 B7R1.1 C#C[C@H]1CCCN1 Amb26968270 [0,1,0,0,0,0|2,0,1]=4 358 B7R1.1 C=CB1OCCO1 Amb27216062 [0,1,0,0,0,0|3,0,0]=4 359 B7R1.1 C=CC1=NCCO1 Amb28399250 [0,1,0,0,0,0|2,0,0]=3 360 B7R1.1 C=CC1CCCC1 Amb17934190 [0,1,0,0,0,0|2,0,1]=4 361 B7R1.1 C=CC1CCCN1 Amb23536605 [0,1,0,0,0,0|2,0,1]=4 362 B7R1.1 C=CC1CCCN1 Amb24082686 [0,1,0,0,0,0|2,0,1]=4 363 B7R1.1 C=CC1CCCO1 Amb28137321 [0,1,0,0,0,0|1,0,1]=3 364 B7R1.1 C=CC1CCCS1 Amb33415623 [0,1,0,0,0,0|1,1,1]=4 365 B7R1.1 C=CC1OCCO1 Amb3941557 [0,1,0,0,0,0|2,0,1]=4 366 B7R1.1 C=CN1CCCC1 Amb25133406 [0,1,0,0,0,0|3,0,0]=4 367 B7R1.1 CC=C1CCCC1 Amb4035880 [0,1,0,0,0,0|2,0,0]=3 368 B7R1.1 CCC1=CCCC1 Amb4035875 [0,1,0,0,0,0|2,0,0]=3 369 B7R1.1 CCC1=NCCC1 Amb22055207 [0,1,0,0,0,0|2,0,0]=3 370 B7R1.1 CCC1=NCCN1 Amb17670469 [0,1,0,0,0,0|3,0,0]=4 371 B7R1.1 CCC1=NCCO1 Amb8513557 [0,1,0,0,0,0|2,0,0]=3 372 B7R1.1 CCC1=NCCS1 Amb28141823 [0,1,0,0,0,0|2,1,0]=4 373 B7R1.1 CCC1CCCC1 Amb22053788 [0,1,0,0,0,0|2,0,1]=4 374 B7R1.1 CCC1CCCN1 Amb19515009 [0,1,0,0,0,0|2,0,1]=4 375 B7R1.1 CCC1CCCN1 Amb3788096 [0,1,0,0,0,0|2,0,1]=4 376 B7R1.1 CCC1CCCS1 Amb17939242 [0,1,0,0,0,0|1,1,1]=4 377 B7R1.1 CCC1CCC[Cl+]1 Amb28076649 [0,1,0,0,0,0|2,0,1]=4 378 B7R1.1 CCC1COCO1 Amb24567580 [0,1,0,0,0,0|2,0,1]=4 379 B7R1.1 CCC1NCCO1 Amb17506183 [0,1,0,0,0,0|2,0,1]=4 380 B7R1.1 CCC1OCCO1 Amb19892413 [0,1,0,0,0,0|2,0,1]=4 381 B7R1.1 CCN1CCCC1 Amb17938866 [0,1,0,0,0,0|3,0,0]=4 382 B7R1.1 CCN1CCCN1 Amb27776139 [0,1,0,0,0,0|3,0,0]=4 383 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [0,1,0,0,0,0|2,0,1]=4 384 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [0,1,0,0,0,0|2,0,1]=4 385 B7R1.1 CNC1=NCCC1 Amb33249673 [0,1,0,0,0,0|2,0,0]=3 386 B7R1.1 CNC1=NCCC1 Amb4136373 [0,1,0,0,0,0|2,0,0]=3 387 B7R1.1 CNC1=NCCN1 Amb4006094 [0,1,0,0,0,0|3,0,0]=4 388 B7R1.1 CNC1=NCCO1 Amb28187093 [0,1,0,0,0,0|2,0,0]=3 389 B7R1.1 CNC1=NCCS1 Amb10609697 [0,1,0,0,0,0|2,1,0]=4 390 B7R1.1 CNC1=NCCS1 Amb7762036 [0,1,0,0,0,0|2,1,0]=4 391 B7R1.1 CNC1CCCC1 Amb1223228 [0,1,0,0,0,0|2,0,1]=4 392 B7R1.1 CNC1CCCC1 Amb9677383 [0,1,0,0,0,0|2,0,1]=4 393 B7R1.1 CNC1CCCO1 Amb27254048 [0,1,0,0,0,0|1,0,1]=3 394 B7R1.1 COC1=CCCN1 Amb19883801 [0,1,0,0,0,0|1,0,2]=4 395 B7R1.1 COC1=NCCC1 Amb1694184 [0,1,0,0,0,0|1,0,1]=3 396 B7R1.1 COC1=NCCN1 Amb15693394 [0,1,0,0,0,0|2,0,1]=4 397 B7R1.1 COC1CCCC1 Amb8517656 [0,1,0,0,0,0|1,0,2]=4 398 B7R1.1 COC1CCCO1 Amb22505257 [0,1,0,0,0,0|0,0,2]=3 399 B7R1.1 COP1OCCO1 Amb26476014 [0,1,0,0,0,0|2,0,1]=4 400 B7R1.1 CO[C+]1CCCN1 Amb27799825 [0,1,0,0,0,0|1,0,2]=4 401 B7R1.1 CO[C@@H]1CCCN1 Amb27948785 [0,1,0,0,0,0|1,0,2]=4 402 B7R1.1 CSC1=NCCN1 Amb1630604 [0,1,0,0,0,0|2,1,0]=4 403 B7R1.1 CSC1=NCCN1 Amb22492600 [0,1,0,0,0,0|2,1,0]=4 404 B7R1.1 CSC1=NCCN1 Amb2689699 [0,1,0,0,0,0|2,1,0]=4 405 B7R1.1 CSC1=NCCN1 Amb33550658 [0,1,0,0,0,0|2,1,0]=4 406 B7R1.1 CSC1=NCCS1 Amb4037058 [0,1,0,0,0,0|1,2,0]=4 407 B7R1.1 CSC1=NCCS1 Amb6861322 [0,1,0,0,0,0|1,2,0]=4 408 B7R1.1 CSC1CCCC1 Amb22230463 [0,1,0,0,0,0|1,1,1]=4 409 B7R1.1 C\C=C1/CCNC1 Amb31161498 [0,1,0,0,0,0|3,0,0]=4 410 B7R1.1 C\C=C1/CCNC1 Amb33611505 [0,1,0,0,0,0|3,0,0]=4 411 B7R1.1 C\N=C1\[NH2+]CCS1 Amb4303480 [0,1,0,0,0,0|2,1,0]=4 412 B7R1.1 ClC=C1CCCC1 Amb28118913 [0,1,0,0,0,0|2,0,0]=3 413 B7R1.1 ClCC1=NCCN1 Amb2372055 [0,1,0,0,0,0|3,0,0]=4 414 B7R1.1 ClCC1=NCCN1 Amb2691261 [0,1,0,0,0,0|3,0,0]=4 415 B7R1.1 ClCC1=NCCO1 Amb24599141 [0,1,0,0,0,0|2,0,0]=3 416 B7R1.1 ClCC1=NOCC1 Amb32660442 [0,1,0,0,0,0|3,0,0]=4 417 B7R1.1 ClCC1CCCC1 Amb9004338 [0,1,0,0,0,0|2,0,1]=4 418 B7R1.1 ClCC1CCCN1 Amb1102532 [0,1,0,0,0,0|2,0,1]=4 419 B7R1.1 ClCC1CCCN1 Amb22228750 [0,1,0,0,0,0|2,0,1]=4 420 B7R1.1 ClCC1CCCO1 Amb5716848 [0,1,0,0,0,0|1,0,1]=3 421 B7R1.1 ClCC1CCCS1 Amb25339278 [0,1,0,0,0,0|1,1,1]=4 422 B7R1.1 ClCC1COCO1 Amb25147241 [0,1,0,0,0,0|2,0,1]=4 423 B7R1.1 ClCC1OCCO1 Amb2792894 [0,1,0,0,0,0|2,0,1]=4 424 B7R1.1 ClC[C@@H]1CCCN1 Amb22226498 [0,1,0,0,0,0|2,0,1]=4 425 B7R1.1 ClC[C@@H]1CCCN1 Amb22232498 [0,1,0,0,0,0|2,0,1]=4 426 B7R1.1 ClC[C@H]1CCCN1 Amb26577168 [0,1,0,0,0,0|2,0,1]=4 427 B7R1.1 FCC1CCCN1 Amb13953136 [0,1,0,0,0,0|2,0,1]=4 428 B7R1.1 FCC1CCCN1 Amb28827628 [0,1,0,0,0,0|2,0,1]=4 429 B7R1.1 FC[C@@H]1CCCN1 Amb22405982 [0,1,0,0,0,0|2,0,1]=4 430 B7R1.1 FC[C@@H]1CCCN1 Amb27973462 [0,1,0,0,0,0|2,0,1]=4 431 B7R1.1 FC[C@H]1CCCN1 Amb27602129 [0,1,0,0,0,0|2,0,1]=4 432 B7R1.1 FC[C@H]1CCCN1 Amb32409431 [0,1,0,0,0,0|2,0,1]=4 433 B7R1.1 F[BH2-][O+]1CCCC1 Amb27214531 [0,1,0,0,0,0|3,0,0]=4 434 B7R1.1 ICC1=CCCC1 Amb27838217 [0,1,0,0,0,0|2,0,0]=3 435 B7R1.1 ICC1CCCC1 Amb8517132 [0,1,0,0,0,0|2,0,1]=4 436 B7R1.1 ICC1CCCO1 Amb24060886 [0,1,0,0,0,0|1,0,1]=3 437 B7R1.1 N#CC1=CCCC1 Amb2720765 [0,1,0,0,0,0|2,0,0]=3 438 B7R1.1 N#CC1=CCCO1 Amb19149010 [0,1,0,0,0,0|1,0,1]=3 439 B7R1.1 N#CC1=CCSC1 Amb25949534 [0,1,0,0,0,0|3,0,0]=4 440 B7R1.1 N#CC1=NOCC1 Amb24624782 [0,1,0,0,0,0|3,0,0]=4 441 B7R1.1 N#CC1CCCC1 Amb2721544 [0,1,0,0,0,0|2,0,1]=4 442 B7R1.1 N#CC1CCCN1 Amb10069328 [0,1,0,0,0,0|2,0,1]=4 443 B7R1.1 N#CC1CCCN1 Amb18198112 [0,1,0,0,0,0|2,0,1]=4 444 B7R1.1 N#CC1CCCN1 Amb22405979 [0,1,0,0,0,0|2,0,1]=4 445 B7R1.1 N#CC1CCCO1 Amb17506326 [0,1,0,0,0,0|1,0,1]=3 446 B7R1.1 N#CC1CCCS1 Amb20171416 [0,1,0,0,0,0|1,1,1]=4 447 B7R1.1 N#CN1CCCC1 Amb2725447 [0,1,0,0,0,0|3,0,0]=4 448 B7R1.1 N#C[C@@H]1CCCN1 Amb17399785 [0,1,0,0,0,0|2,0,1]=4 449 B7R1.1 N#C[C@@H]1CCCN1 Amb2690445 [0,1,0,0,0,0|2,0,1]=4 450 B7R1.1 N#C[C@@H]1CCCN1 Amb30625709 [0,1,0,0,0,0|2,0,1]=4 451 B7R1.1 N#C[C@@H]1CCCO1 Amb4166302 [0,1,0,0,0,0|1,0,1]=3 452 B7R1.1 N#C[C@H]1CCCN1 Amb22225409 [0,1,0,0,0,0|2,0,1]=4 453 B7R1.1 N#C[C@H]1CCCN1 Amb2690444 [0,1,0,0,0,0|2,0,1]=4 454 B7R1.1 N#C[C@H]1CCCN1 Amb31204640 [0,1,0,0,0,0|2,0,1]=4 455 B7R1.1 N#C[C@H]1CCCO1 Amb4166296 [0,1,0,0,0,0|1,0,1]=3 456 B7R1.1 NCC1=CCCC1 Amb18120760 [0,1,0,0,0,0|2,0,0]=3 457 B7R1.1 NCC1=CCNC1 Amb24714742 [0,1,0,0,0,0|3,0,0]=4 458 B7R1.1 NCC1=CCSC1 Amb35743801 [0,1,0,0,0,0|3,0,0]=4 459 B7R1.1 NCC1=NCCN1 Amb24479837 [0,1,0,0,0,0|3,0,0]=4 460 B7R1.1 NCC1=NCCN1 Amb30584686 [0,1,0,0,0,0|3,0,0]=4 461 B7R1.1 NCC1=NCCO1 Amb25938147 [0,1,0,0,0,0|2,0,0]=3 462 B7R1.1 NCC1=NCCS1 Amb27843296 [0,1,0,0,0,0|2,1,0]=4 463 B7R1.1 NCC1=NOCC1 Amb19148524 [0,1,0,0,0,0|3,0,0]=4 464 B7R1.1 NCC1=NOCC1 Amb33330960 [0,1,0,0,0,0|3,0,0]=4 465 B7R1.1 NCC1CCCC1 Amb1127194 [0,1,0,0,0,0|2,0,1]=4 466 B7R1.1 NCC1CCCC1 Amb13951760 [0,1,0,0,0,0|2,0,1]=4 467 B7R1.1 NCC1CCCC1 Amb6892868 [0,1,0,0,0,0|2,0,1]=4 468 B7R1.1 NCC1CCCN1 Amb19516137 [0,1,0,0,0,0|2,0,1]=4 469 B7R1.1 NCC1CCCN1 Amb4418336 [0,1,0,0,0,0|2,0,1]=4 470 B7R1.1 NCC1CCCO1 Amb2568046 [0,1,0,0,0,0|1,0,1]=3 471 B7R1.1 NCC1CCCO1 Amb3903680 [0,1,0,0,0,0|1,0,1]=3 472 B7R1.1 NCC1CCCS1 Amb20668756 [0,1,0,0,0,0|1,1,1]=4 473 B7R1.1 NCC1COCO1 Amb25261501 [0,1,0,0,0,0|2,0,1]=4 474 B7R1.1 NCC1COCO1 Amb28827653 [0,1,0,0,0,0|2,0,1]=4 475 B7R1.1 NCC1CSCO1 Amb27234625 [0,1,0,0,0,0|2,0,1]=4 476 B7R1.1 NCC1OCCO1 Amb3940009 [0,1,0,0,0,0|2,0,1]=4 477 B7R1.1 NCC1OCCS1 Amb23447046 [0,1,0,0,0,0|2,0,1]=4 478 B7R1.1 NC[C@@H]1CCCN1 Amb22405933 [0,1,0,0,0,0|2,0,1]=4 479 B7R1.1 NC[C@@H]1CCCO1 Amb32661832 [0,1,0,0,0,0|1,0,1]=3 480 B7R1.1 NC[C@@H]1CCCO1 Amb3940181 [0,1,0,0,0,0|1,0,1]=3 481 B7R1.1 NC[C@H]1CCCN1 Amb2699509 [0,1,0,0,0,0|2,0,1]=4 482 B7R1.1 NC[C@H]1CCCN1 Amb30584681 [0,1,0,0,0,0|2,0,1]=4 483 B7R1.1 NC[C@H]1CCCO1 Amb33859030 [0,1,0,0,0,0|1,0,1]=3 484 B7R1.1 NC[C@H]1CCCO1 Amb3940188 [0,1,0,0,0,0|1,0,1]=3 485 B7R1.1 NC[C@H]1CNCO1 Amb27950283 [0,1,0,0,0,0|2,0,1]=4 486 B7R1.1 NN=C1NCCN1 Amb2719792 [0,1,0,0,0,0|3,0,0]=4 487 B7R1.1 NNC1=CCCO1 Amb27461530 [0,1,0,0,0,0|1,0,1]=3 488 B7R1.1 NNC1=NCCC1 Amb24119297 [0,1,0,0,0,0|2,0,0]=3 489 B7R1.1 NNC1=NCCC1 Amb33621235 [0,1,0,0,0,0|2,0,0]=3 490 B7R1.1 NNC1=NCCN1 Amb24056434 [0,1,0,0,0,0|3,0,0]=4 491 B7R1.1 NNC1=NCCN1 Amb32663682 [0,1,0,0,0,0|3,0,0]=4 492 B7R1.1 NNC1=NCCN1 Amb5260821 [0,1,0,0,0,0|3,0,0]=4 493 B7R1.1 NNC1=NCCS1 Amb1059846 [0,1,0,0,0,0|2,1,0]=4 494 B7R1.1 NNC1=NCCS1 Amb3428548 [0,1,0,0,0,0|2,1,0]=4 495 B7R1.1 NNC1CCCC1 Amb10071294 [0,1,0,0,0,0|2,0,1]=4 496 B7R1.1 NNC1CCCC1 Amb2785873 [0,1,0,0,0,0|2,0,1]=4 497 B7R1.1 NNC1CCCC1 Amb8371028 [0,1,0,0,0,0|2,0,1]=4 498 B7R1.1 NOC1CCCC1 Amb17101093 [0,1,0,0,0,0|1,0,2]=4 499 B7R1.1 O=C=C1CC=CN1 Amb27851531 [0,1,0,0,0,0|1,0,2]=4 500 B7R1.1 O=C=C1CCCC1 Amb17673796 [0,1,0,0,0,0|1,0,0]=2 501 B7R1.1 O=CC1=CC=CC1 Amb25799627 [0,1,0,0,0,0|1,0,2]=4 502 B7R1.1 O=CC1=CCCC1 Amb17138358 [0,1,0,0,0,0|1,0,0]=2 503 B7R1.1 O=CC1=CCCO1 Amb18120782 [0,1,0,0,0,0|0,0,1]=2 504 B7R1.1 O=CC1=CCSC1 Amb423472 [0,1,0,0,0,0|2,0,0]=3 505 B7R1.1 O=CC1=COCC1 Amb18120774 [0,1,0,0,0,0|2,0,0]=3 506 B7R1.1 O=CC1=NCCS1 Amb27799744 [0,1,0,0,0,0|1,1,0]=3 507 B7R1.1 O=CC1=NOCC1 Amb35788708 [0,1,0,0,0,0|2,0,0]=3 508 B7R1.1 O=CC1C=CCC1 Amb27229924 [0,1,0,0,0,0|1,0,2]=4 509 B7R1.1 O=CC1CCCC1 Amb31292855 [0,1,0,0,0,0|1,0,1]=3 510 B7R1.1 O=CC1CCCC1 Amb4605847 [0,1,0,0,0,0|1,0,1]=3 511 B7R1.1 O=CC1CCCC1 Amb6297186 [0,1,0,0,0,0|1,0,1]=3 512 B7R1.1 O=CC1CCCO1 Amb3939388 [0,1,0,0,0,0|0,0,1]=2 513 B7R1.1 O=CC1CCCS1 Amb27214645 [0,1,0,0,0,0|0,1,1]=3 514 B7R1.1 O=CC1CCNC1 Amb18197564 [0,1,0,0,0,0|2,0,1]=4 515 B7R1.1 O=CC1CCOC1 Amb6608994 [0,1,0,0,0,0|2,0,1]=4 516 B7R1.1 O=CC1CCSC1 Amb18199140 [0,1,0,0,0,0|2,0,1]=4 517 B7R1.1 O=CC1OCCO1 Amb27592967 [0,1,0,0,0,0|1,0,1]=3 518 B7R1.1 O=CN1CCCC1 Amb2720947 [0,1,0,0,0,0|2,0,0]=3 519 B7R1.1 O=C[C@@H]1CCCN1 Amb27261498 [0,1,0,0,0,0|1,0,1]=3 520 B7R1.1 O=C[C@@H]1CCCS1 Amb28130403 [0,1,0,0,0,0|0,1,1]=3 521 B7R1.1 O=C[C@@H]1CCOC1 Amb27801459 [0,1,0,0,0,0|2,0,1]=4 522 B7R1.1 O=Cc1ccco1 Amb2720358 [0,1,0,0,0,0|0,0,3]=4 523 B7R1.1 O=Cc1ccno1 Amb33546951 [0,1,0,0,0,0|1,0,2]=4 524 B7R1.1 O=Cc1cnco1 Amb8010823 [0,1,0,0,0,0|1,0,2]=4 525 B7R1.1 O=Cc1cnno1 Amb8010941 [0,1,0,0,0,0|2,0,1]=4 526 B7R1.1 O=Cc1ncco1 Amb33544448 [0,1,0,0,0,0|1,0,2]=4 527 B7R1.1 O=Cc1nnco1 Amb21856468 [0,1,0,0,0,0|2,0,1]=4 528 B7R1.1 O=NC1CCCN1 Amb27488681 [0,1,0,0,0,0|1,0,1]=3 529 B7R1.1 O=NN1C=CCC1 Amb27845186 [0,1,0,0,0,0|2,0,1]=4 530 B7R1.1 O=NN1CCCC1 Amb9787681 [0,1,0,0,0,0|2,0,0]=3 531 B7R1.1 O=NN1CCSC1 Amb25104685 [0,1,0,0,0,0|3,0,0]=4 532 B7R1.1 O=S=C1NCCO1 Amb28350550 [0,1,0,0,0,0|1,0,0]=2 533 B7R1.1 OCC1=CCCC1 Amb24479891 [0,1,0,0,0,0|1,0,1]=3 534 B7R1.1 OCC1=CCSC1 Amb35606324 [0,1,0,0,0,0|2,0,1]=4 535 B7R1.1 OCC1=COCC1 Amb27827039 [0,1,0,0,0,0|2,0,1]=4 536 B7R1.1 OCC1=CSCC1 Amb28345026 [0,1,0,0,0,0|2,0,1]=4 537 B7R1.1 OCC1=NCCN1 Amb27260047 [0,1,0,0,0,0|2,0,1]=4 538 B7R1.1 OCC1=NOCC1 Amb35746891 [0,1,0,0,0,0|2,0,1]=4 539 B7R1.1 OCC1CCCC1 Amb2721271 [0,1,0,0,0,0|1,0,2]=4 540 B7R1.1 OCC1CCCN1 Amb2237182 [0,1,0,0,0,0|1,0,2]=4 541 B7R1.1 OCC1CCCO1 Amb3939084 [0,1,0,0,0,0|0,0,2]=3 542 B7R1.1 OCC1CCCS1 Amb33545363 [0,1,0,0,0,0|0,1,2]=4 543 B7R1.1 OCC1COCO1 Amb8393650 [0,1,0,0,0,0|1,0,2]=4 544 B7R1.1 OCC1OCCO1 Amb9786986 [0,1,0,0,0,0|1,0,2]=4 545 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [0,1,0,0,0,0|1,0,2]=4 546 B7R1.1 OC[C@@H]1CCCN1 Amb3938965 [0,1,0,0,0,0|1,0,2]=4 547 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [0,1,0,0,0,0|0,0,2]=3 548 B7R1.1 OC[C@@H]1OCCS1 Amb22748777 [0,1,0,0,0,0|1,0,2]=4 549 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [0,1,0,0,0,0|1,0,2]=4 550 B7R1.1 OC[C@H]1CCCN1 Amb30874072 [0,1,0,0,0,0|1,0,2]=4 551 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [0,1,0,0,0,0|0,0,2]=3 552 B7R1.1 ON=C1CCCC1 Amb6538721 [0,1,0,0,0,0|1,0,1]=3 553 B7R1.1 ONC1CCCC1 Amb27467457 [0,1,0,0,0,0|1,0,2]=4 554 B7R1.1 ONC1CCCC1 Amb30625652 [0,1,0,0,0,0|1,0,2]=4 555 B7R1.1 O\N=C1/C=CCC1 Amb27838262 [0,1,0,0,0,0|1,0,2]=4 556 B7R1.1 O\N=C1/CCCN1 Amb19769769 [0,1,0,0,0,0|1,0,1]=3 557 B7R1.1 O\N=C1/CCCN1 Amb33309985 [0,1,0,0,0,0|1,0,1]=3 558 B7R1.1 SCC1=CCSC1 Amb32788040 [0,1,0,0,0,0|2,1,0]=4 559 B7R1.1 SCC1CCCC1 Amb19514712 [0,1,0,0,0,0|1,1,1]=4 560 B7R1.1 SCC1CCCN1 Amb25874415 [0,1,0,0,0,0|1,1,1]=4 561 B7R1.1 SCC1CCCN1 Amb35752888 [0,1,0,0,0,0|1,1,1]=4 562 B7R1.1 SCC1CCCO1 Amb33531279 [0,1,0,0,0,0|0,1,1]=3 563 B7R1.1 SCC1CCCS1 Amb33416783 [0,1,0,0,0,0|0,2,1]=4 564 B7R1.1 SCC1COCO1 Amb32650877 [0,1,0,0,0,0|1,1,1]=4 565 B7R1.1 SCC1OCCO1 Amb32650838 [0,1,0,0,0,0|1,1,1]=4 566 B7R1.1 SC[C@H]1CCCN1 Amb29854514 [0,1,0,0,0,0|1,1,1]=4 567 B7R1.1 [C-]#[N+]C1CCCC1 Amb1981028 [0,1,0,0,0,0|2,0,1]=4 568 B7R1.1 [C-]#[N+]C1CCCN1 Amb27646808 [0,1,0,0,0,0|2,0,1]=4 569 B7R1.1 [C-]#[N+]C1CCCO1 Amb27635418 [0,1,0,0,0,0|1,0,1]=3 570 B7R1.1 [C-]#[N+]C1CCCS1 Amb27481891 [0,1,0,0,0,0|1,1,1]=4 571 B7R1.2 C=C1CCC(Br)C1 Amb25135798 [0,1,0,0,0,0|2,0,0]=3 572 B7R1.2 C=C1COC(=O)C1 Amb24589821 [0,1,0,0,0,0|0,0,1]=2 573 B7R1.2 C=C1COC(C)C1 Amb35695393 [0,1,0,0,0,0|1,0,2]=4 574 B7R1.2 C=C1NC(=O)CO1 Amb27847146 [0,1,0,0,0,0|2,0,1]=4 575 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [0,1,0,0,0,0|1,0,1]=3 576 B7R1.2 CC1=CC(=O)CN1 Amb27390872 [0,1,0,0,0,0|2,0,1]=4 577 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [0,1,0,0,0,0|1,0,2]=4 578 B7R1.2 CC1=CC(=O)NC1 Amb24479892 [0,1,0,0,0,0|1,0,2]=4 579 B7R1.2 CC1=CC(=O)OC1 Amb22002703 [0,1,0,0,0,0|0,0,2]=3 580 B7R1.2 CC1=CC(C)CC1 Amb24479860 [0,1,0,0,0,0|2,0,0]=3 581 B7R1.2 CC1=CC(C)NC1 Amb17593062 [0,1,0,0,0,0|3,0,0]=4 582 B7R1.2 CC1=CC(N)CC1 Amb28186103 [0,1,0,0,0,0|2,0,0]=3 583 B7R1.2 CC1=CCC(O)O1 Amb27241898 [0,1,0,0,0,0|1,0,1]=3 584 B7R1.2 CC1=CCP(Cl)C1 Amb27261470 [0,1,0,0,0,0|3,0,0]=4 585 B7R1.2 CC1=COC(=O)C1 Amb27624758 [0,1,0,0,0,0|0,0,2]=3 586 B7R1.2 CC1=COC(=O)N1 Amb27185570 [0,1,0,0,0,0|1,0,2]=4 587 B7R1.2 CC1=NC(=O)CS1 Amb27838191 [0,1,0,0,0,0|2,0,1]=4 588 B7R1.2 CC1=NC(=O)ON1 Amb22491279 [0,1,0,0,0,0|2,0,1]=4 589 B7R1.2 CC1=NC(Br)CS1 Amb26074574 [0,1,0,0,0,0|2,1,0]=4 590 B7R1.2 CC1=NC(C)CN1 Amb22733191 [0,1,0,0,0,0|3,0,0]=4 591 B7R1.2 CC1=NC(C)CO1 Amb9805507 [0,1,0,0,0,0|2,0,0]=3 592 B7R1.2 CC1=NC(Cl)CS1 Amb26396887 [0,1,0,0,0,0|2,1,0]=4 593 B7R1.2 CC1=NCC(=O)N1 Amb27827848 [0,1,0,0,0,0|2,0,1]=4 594 B7R1.2 CC1=NCC(=O)O1 Amb27783804 [0,1,0,0,0,0|1,0,1]=3 595 B7R1.2 CC1=NCC(Br)S1 Amb26359428 [0,1,0,0,0,0|2,1,0]=4 596 B7R1.2 CC1=NCC(C)S1 Amb26396899 [0,1,0,0,0,0|2,1,0]=4 597 B7R1.2 CC1=NCC(Cl)S1 Amb28069174 [0,1,0,0,0,0|2,1,0]=4 598 B7R1.2 CC1=NNC(=O)C1 Amb932788 [0,1,0,0,0,0|2,0,1]=4 599 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [0,1,0,0,0,0|2,0,1]=4 600 B7R1.2 CC1=NOC(=O)C1 Amb22274079 [0,1,0,0,0,0|1,0,1]=3 601 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [0,1,0,0,0,0|2,0,1]=4 602 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [0,1,0,0,0,0|1,0,1]=3 603 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [0,1,0,0,0,0|0,0,2]=3 604 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [0,1,0,0,0,0|0,1,2]=4 605 B7R1.2 CC1CC(=O)CN1 Amb28349308 [0,1,0,0,0,0|2,0,0]=3 606 B7R1.2 CC1CC(=O)CO1 Amb25888380 [0,1,0,0,0,0|2,0,0]=3 607 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,1,0,0,0,0|2,0,0]=3 608 B7R1.2 CC1CC(=O)NN1 Amb493880 [0,1,0,0,0,0|2,0,0]=3 609 B7R1.2 CC1CC(Br)CN1 Amb27634494 [0,1,0,0,0,0|2,0,1]=4 610 B7R1.2 CC1CC(Cl)=NN1 Amb27771490 [0,1,0,0,0,0|3,0,0]=4 611 B7R1.2 CC1CC(Cl)CN1 Amb28455910 [0,1,0,0,0,0|2,0,1]=4 612 B7R1.2 CC1CC(Cl)CO1 Amb35679295 [0,1,0,0,0,0|1,0,1]=3 613 B7R1.2 CC1CC(F)CN1 Amb25888440 [0,1,0,0,0,0|2,0,1]=4 614 B7R1.2 CC1CC(F)CN1 Amb33803405 [0,1,0,0,0,0|2,0,1]=4 615 B7R1.2 CC1CC(N)=NO1 Amb26627705 [0,1,0,0,0,0|3,0,0]=4 616 B7R1.2 CC1CC(N)CN1 Amb27168248 [0,1,0,0,0,0|2,0,1]=4 617 B7R1.2 CC1CC(N)CO1 Amb28283957 [0,1,0,0,0,0|1,0,1]=3 618 B7R1.2 CC1CC(N)CO1 Amb28827641 [0,1,0,0,0,0|1,0,1]=3 619 B7R1.2 CC1CC(N)CS1 Amb18202610 [0,1,0,0,0,0|1,1,1]=4 620 B7R1.2 CC1CC(O)CN1 Amb33329377 [0,1,0,0,0,0|2,0,1]=4 621 B7R1.2 CC1CC(O)CN1 Amb33545349 [0,1,0,0,0,0|2,0,1]=4 622 B7R1.2 CC1CC(O)CO1 Amb28430079 [0,1,0,0,0,0|1,0,1]=3 623 B7R1.2 CC1CC(S)CN1 Amb32788618 [0,1,0,0,0,0|2,0,1]=4 624 B7R1.2 CC1CC(S)CO1 Amb32788641 [0,1,0,0,0,0|1,0,1]=3 625 B7R1.2 CC1CC(S)CS1 Amb28050071 [0,1,0,0,0,0|1,1,1]=4 626 B7R1.2 CC1CCC(=O)C1 Amb8513672 [0,1,0,0,0,0|1,0,0]=2 627 B7R1.2 CC1CCC(=O)N1 Amb19267101 [0,1,0,0,0,0|1,0,0]=2 628 B7R1.2 CC1CCC(=O)O1 Amb6298321 [0,1,0,0,0,0|0,0,0]=1 629 B7R1.2 CC1CCC(=O)S1 Amb27252897 [0,1,0,0,0,0|0,1,0]=2 630 B7R1.2 CC1CCC(=S)N1 Amb27849283 [0,1,0,0,0,0|1,1,0]=3 631 B7R1.2 CC1CCC(Br)C1 Amb26339047 [0,1,0,0,0,0|2,0,1]=4 632 B7R1.2 CC1CCC(C)N1 Amb20626165 [0,1,0,0,0,0|2,0,1]=4 633 B7R1.2 CC1CCC(C)N1 Amb5716833 [0,1,0,0,0,0|2,0,1]=4 634 B7R1.2 CC1CCC(Cl)C1 Amb25129430 [0,1,0,0,0,0|2,0,1]=4 635 B7R1.2 CC1CCC(I)C1 Amb27402602 [0,1,0,0,0,0|2,0,1]=4 636 B7R1.2 CC1CCC(N)C1 Amb20669202 [0,1,0,0,0,0|2,0,1]=4 637 B7R1.2 CC1CCC(N)C1 Amb24062164 [0,1,0,0,0,0|2,0,1]=4 638 B7R1.2 CC1CCC(O)C1 Amb4605822 [0,1,0,0,0,0|1,0,2]=4 639 B7R1.2 CC1CCC(O)N1 Amb28067624 [0,1,0,0,0,0|1,0,2]=4 640 B7R1.2 CC1CCC(S)C1 Amb25829470 [0,1,0,0,0,0|1,1,1]=4 641 B7R1.2 CC1CCN(N)C1 Amb24385963 [0,1,0,0,0,0|3,0,0]=4 642 B7R1.2 CC1CN=C(Br)S1 Amb27476169 [0,1,0,0,0,0|2,1,0]=4 643 B7R1.2 CC1CN=C(Cl)O1 Amb27959043 [0,1,0,0,0,0|2,0,0]=3 644 B7R1.2 CC1CN=C(N)N1 Amb30584684 [0,1,0,0,0,0|3,0,0]=4 645 B7R1.2 CC1CN=C(N)O1 Amb26657342 [0,1,0,0,0,0|2,0,0]=3 646 B7R1.2 CC1CN=C(N)O1 Amb33611634 [0,1,0,0,0,0|2,0,0]=3 647 B7R1.2 CC1CN=C(N)S1 Amb6029194 [0,1,0,0,0,0|2,1,0]=4 648 B7R1.2 CC1CNC(=N)S1 Amb24684074 [0,1,0,0,0,0|2,1,0]=4 649 B7R1.2 CC1CNC(=O)C1 Amb10608004 [0,1,0,0,0,0|1,0,0]=2 650 B7R1.2 CC1CNC(=O)N1 Amb17506853 [0,1,0,0,0,0|2,0,0]=3 651 B7R1.2 CC1CNC(=O)O1 Amb19651732 [0,1,0,0,0,0|1,0,0]=2 652 B7R1.2 CC1CNC(=S)N1 Amb2724258 [0,1,0,0,0,0|2,1,0]=4 653 B7R1.2 CC1CNC(=S)S1 Amb17845151 [0,1,0,0,0,0|1,2,0]=4 654 B7R1.2 CC1CNC(C)C1 Amb17593077 [0,1,0,0,0,0|2,0,1]=4 655 B7R1.2 CC1CNC(C)C1 Amb19335336 [0,1,0,0,0,0|2,0,1]=4 656 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,1,0,0,0,0|0,0,0]=1 657 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,1,0,0,0,0|1,0,0]=2 658 B7R1.2 CC1COC(=O)O1 Amb8513300 [0,1,0,0,0,0|1,0,0]=2 659 B7R1.2 CC1COC(C)O1 Amb24074042 [0,1,0,0,0,0|2,0,1]=4 660 B7R1.2 CC1COC(N)=N1 Amb23449369 [0,1,0,0,0,0|2,0,0]=3 661 B7R1.2 CC1COC(O)C1 Amb28050442 [0,1,0,0,0,0|0,0,2]=3 662 B7R1.2 CC1COS(=O)O1 Amb22346070 [0,1,0,0,0,0|2,0,0]=3 663 B7R1.2 CC1CSC(=O)N1 Amb28320497 [0,1,0,0,0,0|1,1,0]=3 664 B7R1.2 CC1CSC(=S)N1 Amb25849326 [0,1,0,0,0,0|1,2,0]=4 665 B7R1.2 CC1CSC(Br)=N1 Amb26888125 [0,1,0,0,0,0|2,1,0]=4 666 B7R1.2 CC1NC(=O)CS1 Amb27806202 [0,1,0,0,0,0|2,0,0]=3 667 B7R1.2 CC1NCC(=O)N1 Amb28456791 [0,1,0,0,0,0|2,0,0]=3 668 B7R1.2 CC1OC(=O)CS1 Amb25314322 [0,1,0,0,0,0|1,0,0]=2 669 B7R1.2 CN1C=CC(=O)C1 Amb28201569 [0,1,0,0,0,0|2,0,1]=4 670 B7R1.2 CN1CC(O)CO1 Amb27980980 [0,1,0,0,0,0|2,0,0]=3 671 B7R1.2 CN1CCC(=O)C1 Amb22236123 [0,1,0,0,0,0|2,0,0]=3 672 B7R1.2 CN1CCC(=O)C1 Amb8947873 [0,1,0,0,0,0|2,0,0]=3 673 B7R1.2 CN1CCC(=O)N1 Amb24064860 [0,1,0,0,0,0|2,0,0]=3 674 B7R1.2 CN1CCC(Br)C1 Amb21861157 [0,1,0,0,0,0|3,0,0]=4 675 B7R1.2 CN1CCC(N)=N1 Amb28827647 [0,1,0,0,0,0|3,0,0]=4 676 B7R1.2 CN1CCC(N)C1 Amb10610163 [0,1,0,0,0,0|3,0,0]=4 677 B7R1.2 CN1CCC(N)C1 Amb8948079 [0,1,0,0,0,0|3,0,0]=4 678 B7R1.2 CN1CCC(O)C1 Amb32652719 [0,1,0,0,0,0|3,0,0]=4 679 B7R1.2 CN1CCC(O)C1 Amb8384297 [0,1,0,0,0,0|3,0,0]=4 680 B7R1.2 CN1CCC(S)C1 Amb24383489 [0,1,0,0,0,0|3,0,0]=4 681 B7R1.2 CN1CC[C@@H](Br)C1 Amb22225309 [0,1,0,0,0,0|3,0,0]=4 682 B7R1.2 CN1CC[C@@H](Cl)C1 Amb22225040 [0,1,0,0,0,0|3,0,0]=4 683 B7R1.2 CN1CC[C@@H](I)C1 Amb22225060 [0,1,0,0,0,0|3,0,0]=4 684 B7R1.2 CN1CC[C@@H](N)C1 Amb19891803 [0,1,0,0,0,0|3,0,0]=4 685 B7R1.2 CN1CC[C@@H](N)C1 Amb8386824 [0,1,0,0,0,0|3,0,0]=4 686 B7R1.2 CN1CC[C@@H](O)C1 Amb8386825 [0,1,0,0,0,0|3,0,0]=4 687 B7R1.2 CN1CC[C@H](Br)C1 Amb22226655 [0,1,0,0,0,0|3,0,0]=4 688 B7R1.2 CN1CC[C@H](Cl)C1 Amb22226392 [0,1,0,0,0,0|3,0,0]=4 689 B7R1.2 CN1CC[C@H](I)C1 Amb22226495 [0,1,0,0,0,0|3,0,0]=4 690 B7R1.2 CN1CC[C@H](N)C1 Amb19929627 [0,1,0,0,0,0|3,0,0]=4 691 B7R1.2 CN1CC[C@H](N)C1 Amb20671398 [0,1,0,0,0,0|3,0,0]=4 692 B7R1.2 CN1CC[C@H](O)C1 Amb10070789 [0,1,0,0,0,0|3,0,0]=4 693 B7R1.2 CN1C[C@H](O)CO1 Amb27761726 [0,1,0,0,0,0|2,0,0]=3 694 B7R1.2 CP1CC[C@H](O)C1 Amb27452496 [0,1,0,0,0,0|3,0,0]=4 695 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [0,1,0,0,0,0|1,0,1]=3 696 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,1,0,0,0,0|1,0,0]=2 697 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [0,1,0,0,0,0|1,0,0]=2 698 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [0,1,0,0,0,0|0,0,0]=1 699 B7R1.2 C[C@@H]1CC[C@@H](Br)C1 Amb27791803 [0,1,0,0,0,0|2,0,1]=4 700 B7R1.2 C[C@@H]1CC[C@@H](C)C1 Amb25176920 [0,1,0,0,0,0|2,0,1]=4 701 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb17613372 [0,1,0,0,0,0|2,0,1]=4 702 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb22366804 [0,1,0,0,0,0|2,0,1]=4 703 B7R1.2 C[C@@H]1CC[C@H](O)C1 Amb27853110 [0,1,0,0,0,0|1,0,2]=4 704 B7R1.2 C[C@@H]1CN=C(N)O1 Amb33742469 [0,1,0,0,0,0|2,0,0]=3 705 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,1,0,0,0,0|1,0,0]=2 706 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [0,1,0,0,0,0|1,0,0]=2 707 B7R1.2 C[C@@H]1CN[C@H](C)C1 Amb18195964 [0,1,0,0,0,0|2,0,1]=4 708 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,1,0,0,0,0|0,0,0]=1 709 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,1,0,0,0,0|1,0,0]=2 710 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [0,1,0,0,0,0|1,0,0]=2 711 B7R1.2 C[C@@H]1COC(O)C1 Amb27399504 [0,1,0,0,0,0|0,0,2]=3 712 B7R1.2 C[C@@H]1COS(=O)O1 Amb27979548 [0,1,0,0,0,0|2,0,0]=3 713 B7R1.2 C[C@@H]1CO[C@@H](O)C1 Amb27422487 [0,1,0,0,0,0|0,0,2]=3 714 B7R1.2 C[C@@H]1C[C@@H](F)CN1 Amb22886338 [0,1,0,0,0,0|2,0,1]=4 715 B7R1.2 C[C@@H]1C[C@@H](N)CN1 Amb27214176 [0,1,0,0,0,0|2,0,1]=4 716 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [0,1,0,0,0,0|2,0,1]=4 717 B7R1.2 C[C@@H]1C[C@H](F)CN1 Amb22886231 [0,1,0,0,0,0|2,0,1]=4 718 B7R1.2 C[C@@H]1C[C@H](N)CN1 Amb27421394 [0,1,0,0,0,0|2,0,1]=4 719 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [0,1,0,0,0,0|2,0,1]=4 720 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [0,1,0,0,0,0|1,0,1]=3 721 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [0,1,0,0,0,0|0,0,0]=1 722 B7R1.2 C[C@H]1CC[C@@H](C)N1 Amb10567751 [0,1,0,0,0,0|2,0,1]=4 723 B7R1.2 C[C@H]1CC[C@H](C)C1 Amb22747863 [0,1,0,0,0,0|2,0,1]=4 724 B7R1.2 C[C@H]1CC[C@H](C)N1 Amb26580691 [0,1,0,0,0,0|2,0,1]=4 725 B7R1.2 C[C@H]1CN=C(N)O1 Amb33744016 [0,1,0,0,0,0|2,0,0]=3 726 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [0,1,0,0,0,0|1,0,0]=2 727 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [0,1,0,0,0,0|2,0,0]=3 728 B7R1.2 C[C@H]1CNC(=S)O1 Amb27843992 [0,1,0,0,0,0|1,1,0]=3 729 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,1,0,0,0,0|0,0,0]=1 730 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [0,1,0,0,0,0|1,0,0]=2 731 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [0,1,0,0,0,0|1,0,0]=2 732 B7R1.2 C[C@H]1C[C@@H](N)CN1 Amb26406117 [0,1,0,0,0,0|2,0,1]=4 733 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb33872130 [0,1,0,0,0,0|2,0,1]=4 734 B7R1.2 C[C@H]1C[C@@H](O)CO1 Amb28245786 [0,1,0,0,0,0|1,0,1]=3 735 B7R1.2 C[C@H]1C[C@@H](O)CS1 Amb27662171 [0,1,0,0,0,0|1,1,1]=4 736 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb33801108 [0,1,0,0,0,0|2,0,1]=4 737 B7R1.2 ClC1=CC(Br)CC1 Amb27232977 [0,1,0,0,0,0|2,0,0]=3 738 B7R1.2 Cl[C@@H]1CC[C@@H](Cl)C1 Amb27478091 [0,1,0,0,0,0|2,0,1]=4 739 B7R1.2 N=C1C=C(N)CO1 Amb27631497 [0,1,0,0,0,0|1,0,2]=4 740 B7R1.2 N=C1C=C(O)CO1 Amb27445689 [0,1,0,0,0,0|1,0,2]=4 741 B7R1.2 N=C1CC(=O)CS1 Amb27227202 [0,1,0,0,0,0|1,1,1]=4 742 B7R1.2 N=C1CSC(=O)N1 Amb2537154 [0,1,0,0,0,0|1,1,1]=4 743 B7R1.2 N=C1N=C(N)CO1 Amb27963218 [0,1,0,0,0,0|2,0,1]=4 744 B7R1.2 N=C1NC(=O)CS1 Amb8468365 [0,1,0,0,0,0|2,0,1]=4 745 B7R1.2 NC1=CC(=O)CC1 Amb9753541 [0,1,0,0,0,0|1,0,1]=3 746 B7R1.2 NC1=CC(=O)CS1 Amb22229937 [0,1,0,0,0,0|2,0,1]=4 747 B7R1.2 NC1=CC(=O)NC1 Amb27454229 [0,1,0,0,0,0|1,0,2]=4 748 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [0,1,0,0,0,0|1,0,2]=4 749 B7R1.2 NC1=NC(=O)CN1 Amb18639307 [0,1,0,0,0,0|2,0,1]=4 750 B7R1.2 NC1=NC(=O)CO1 Amb9797441 [0,1,0,0,0,0|2,0,1]=4 751 B7R1.2 NC1=NC(=O)CS1 Amb6364701 [0,1,0,0,0,0|2,0,1]=4 752 B7R1.2 NC1=NC(=O)NC1 Amb22059492 [0,1,0,0,0,0|2,0,1]=4 753 B7R1.2 NC1=NC(=O)ON1 Amb24060381 [0,1,0,0,0,0|2,0,1]=4 754 B7R1.2 NC1=NCC(=O)N1 Amb21964674 [0,1,0,0,0,0|2,0,1]=4 755 B7R1.2 NC1=NCC(=O)N1 Amb475286 [0,1,0,0,0,0|2,0,1]=4 756 B7R1.2 NC1=NCC(=O)S1 Amb25810910 [0,1,0,0,0,0|1,1,1]=4 757 B7R1.2 NC1=NNC(=O)C1 Amb6409420 [0,1,0,0,0,0|2,0,1]=4 758 B7R1.2 NC1C=CC(=O)C1 Amb27445487 [0,1,0,0,0,0|1,0,1]=3 759 B7R1.2 NC1CCC(=O)C1 Amb22494268 [0,1,0,0,0,0|1,0,0]=2 760 B7R1.2 NC1CCC(=O)N1 Amb24480433 [0,1,0,0,0,0|1,0,0]=2 761 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,1,0,0,0,0|0,0,0]=1 762 B7R1.2 NC1CCC(F)C1 Amb23455257 [0,1,0,0,0,0|2,0,1]=4 763 B7R1.2 NC1CCC(F)C1 Amb32652021 [0,1,0,0,0,0|2,0,1]=4 764 B7R1.2 NC1CCC(N)C1 Amb22227723 [0,1,0,0,0,0|2,0,1]=4 765 B7R1.2 NC1CCC(N)C1 Amb32667170 [0,1,0,0,0,0|2,0,1]=4 766 B7R1.2 NC1CCC(N)C1 Amb32667206 [0,1,0,0,0,0|2,0,1]=4 767 B7R1.2 NC1CCC(O)C1 Amb18561405 [0,1,0,0,0,0|1,0,2]=4 768 B7R1.2 NC1CCC(O)C1 Amb19958405 [0,1,0,0,0,0|1,0,2]=4 769 B7R1.2 NC1CCC(S)C1 Amb32788711 [0,1,0,0,0,0|1,1,1]=4 770 B7R1.2 NC1CCS(=O)C1 Amb19149072 [0,1,0,0,0,0|2,0,0]=3 771 B7R1.2 NC1CCS(=O)C1 Amb25133789 [0,1,0,0,0,0|2,0,0]=3 772 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,1,0,0,0,0|1,0,0]=2 773 B7R1.2 NC1CNC(=O)C1 Amb33544169 [0,1,0,0,0,0|1,0,0]=2 774 B7R1.2 NC1COC(=O)C1 Amb30594428 [0,1,0,0,0,0|0,0,0]=1 775 B7R1.2 NC1COC(=O)C1 Amb9782136 [0,1,0,0,0,0|0,0,0]=1 776 B7R1.2 NC1CSC(=O)N1 Amb27596093 [0,1,0,0,0,0|1,1,0]=3 777 B7R1.2 NC1N=CC(=O)S1 Amb27589031 [0,1,0,0,0,0|1,1,1]=4 778 B7R1.2 NN1CCC(F)C1 Amb29849481 [0,1,0,0,0,0|3,0,0]=4 779 B7R1.2 NN1CC[C@H](O)C1 Amb27597182 [0,1,0,0,0,0|3,0,0]=4 780 B7R1.2 N[C@@H]1CC[C@@H](F)C1 Amb25967798 [0,1,0,0,0,0|2,0,1]=4 781 B7R1.2 N[C@@H]1CC[C@@H](N)C1 Amb26601894 [0,1,0,0,0,0|2,0,1]=4 782 B7R1.2 N[C@@H]1CC[C@@H](N)C1 Amb33813727 [0,1,0,0,0,0|2,0,1]=4 783 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb10066961 [0,1,0,0,0,0|1,0,2]=4 784 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb16233749 [0,1,0,0,0,0|1,0,2]=4 785 B7R1.2 N[C@@H]1CC[C@H](F)C1 Amb24499537 [0,1,0,0,0,0|2,0,1]=4 786 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb10066973 [0,1,0,0,0,0|1,0,2]=4 787 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb22406236 [0,1,0,0,0,0|1,0,2]=4 788 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,1,0,0,0,0|1,0,0]=2 789 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,1,0,0,0,0|1,0,0]=2 790 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [0,1,0,0,0,0|1,0,0]=2 791 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [0,1,0,0,0,0|0,0,0]=1 792 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [0,1,0,0,0,0|0,0,0]=1 793 B7R1.2 N[C@H]1CCC(=O)N1 Amb27482175 [0,1,0,0,0,0|1,0,0]=2 794 B7R1.2 N[C@H]1CC[C@@H](F)C1 Amb22886175 [0,1,0,0,0,0|2,0,1]=4 795 B7R1.2 N[C@H]1CC[C@@H](F)C1 Amb25228459 [0,1,0,0,0,0|2,0,1]=4 796 B7R1.2 N[C@H]1CC[C@@H](N)C1 Amb22746716 [0,1,0,0,0,0|2,0,1]=4 797 B7R1.2 N[C@H]1CC[C@@H](N)C1 Amb22746800 [0,1,0,0,0,0|2,0,1]=4 798 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb10066971 [0,1,0,0,0,0|1,0,2]=4 799 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb22274622 [0,1,0,0,0,0|1,0,2]=4 800 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb34916039 [0,1,0,0,0,0|1,0,2]=4 801 B7R1.2 N[C@H]1CC[C@H](F)C1 Amb28128275 [0,1,0,0,0,0|2,0,1]=4 802 B7R1.2 N[C@H]1CC[C@H](N)C1 Amb22823163 [0,1,0,0,0,0|2,0,1]=4 803 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb10066972 [0,1,0,0,0,0|1,0,2]=4 804 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb22386861 [0,1,0,0,0,0|1,0,2]=4 805 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,1,0,0,0,0|1,0,0]=2 806 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [0,1,0,0,0,0|1,0,0]=2 807 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,1,0,0,0,0|0,0,0]=1 808 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,1,0,0,0,0|0,0,0]=1 809 B7R1.2 O=C1C=C(Br)CC1 Amb23399816 [0,1,0,0,0,0|1,0,1]=3 810 B7R1.2 O=C1C=C(Br)CN1 Amb23402184 [0,1,0,0,0,0|1,0,2]=4 811 B7R1.2 O=C1C=C(Br)CO1 Amb10067500 [0,1,0,0,0,0|0,0,2]=3 812 B7R1.2 O=C1C=C(Cl)CC1 Amb9753542 [0,1,0,0,0,0|1,0,1]=3 813 B7R1.2 O=C1C=C(I)CO1 Amb2455617 [0,1,0,0,0,0|0,0,2]=3 814 B7R1.2 O=C1C=C(O)CC1 Amb9901808 [0,1,0,0,0,0|1,0,1]=3 815 B7R1.2 O=C1C=C(O)CN1 Amb20623530 [0,1,0,0,0,0|1,0,2]=4 816 B7R1.2 O=C1C=C(O)CO1 Amb628324 [0,1,0,0,0,0|0,0,2]=3 817 B7R1.2 O=C1C=C(S)CO1 Amb28323506 [0,1,0,0,0,0|0,0,2]=3 818 B7R1.2 O=C1C=C(S)CS1 Amb27877546 [0,1,0,0,0,0|0,1,2]=4 819 B7R1.2 O=C1C=CC(=O)C1 Amb22338203 [0,1,0,0,0,0|1,0,2]=4 820 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [0,1,0,0,0,0|0,0,3]=4 821 B7R1.2 O=C1C=CC(=O)O1 Amb6297783 [0,1,0,0,0,0|0,0,3]=4 822 B7R1.2 O=C1C=CC(Br)C1 Amb27809803 [0,1,0,0,0,0|1,0,1]=3 823 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [0,1,0,0,0,0|0,0,2]=3 824 B7R1.2 O=C1C=CC(Br)S1 Amb26530759 [0,1,0,0,0,0|0,1,2]=4 825 B7R1.2 O=C1C=CC(Cl)O1 Amb27760027 [0,1,0,0,0,0|0,0,2]=3 826 B7R1.2 O=C1C=CC(Cl)S1 Amb28428650 [0,1,0,0,0,0|0,1,2]=4 827 B7R1.2 O=C1C=CC(F)O1 Amb27778280 [0,1,0,0,0,0|0,0,2]=3 828 B7R1.2 O=C1C=CC(O)C1 Amb9782767 [0,1,0,0,0,0|1,0,1]=3 829 B7R1.2 O=C1C=CC(O)N1 Amb27978638 [0,1,0,0,0,0|1,0,2]=4 830 B7R1.2 O=C1C=CC(O)O1 Amb24544763 [0,1,0,0,0,0|0,0,2]=3 831 B7R1.2 O=C1C=C[C@@H](O)C1 Amb27256512 [0,1,0,0,0,0|1,0,1]=3 832 B7R1.2 O=C1C=C[C@H](Cl)C1 Amb27984687 [0,1,0,0,0,0|1,0,1]=3 833 B7R1.2 O=C1C=C[C@H](O)C1 Amb2694980 [0,1,0,0,0,0|1,0,1]=3 834 B7R1.2 O=C1C=NC(S)S1 Amb22734244 [0,1,0,0,0,0|1,1,1]=4 835 B7R1.2 O=C1CC(=O)NN1 Amb9809314 [0,1,0,0,0,0|2,0,1]=4 836 B7R1.2 O=C1CC(=O)ON1 Amb33714889 [0,1,0,0,0,0|1,0,1]=3 837 B7R1.2 O=C1CC(Br)=CO1 Amb27263920 [0,1,0,0,0,0|0,0,2]=3 838 B7R1.2 O=C1CC(Cl)=CS1 Amb27239976 [0,1,0,0,0,0|0,1,2]=4 839 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,1,0,0,0,0|0,0,0]=1 840 B7R1.2 O=C1CC(I)CO1 Amb27401189 [0,1,0,0,0,0|0,0,0]=1 841 B7R1.2 O=C1CC(O)CN1 Amb19958404 [0,1,0,0,0,0|1,0,0]=2 842 B7R1.2 O=C1CC(O)CO1 Amb4006296 [0,1,0,0,0,0|0,0,0]=1 843 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,1,0,0,0,0|1,0,0]=2 844 B7R1.2 O=C1CC=C(Br)S1 Amb25961289 [0,1,0,0,0,0|0,1,2]=4 845 B7R1.2 O=C1CC=C(S)S1 Amb27621600 [0,1,0,0,0,0|0,1,2]=4 846 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [0,1,0,0,0,0|1,0,1]=3 847 B7R1.2 O=C1CCC(=O)N1 Amb2793049 [0,1,0,0,0,0|1,0,1]=3 848 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [0,1,0,0,0,0|0,0,1]=2 849 B7R1.2 O=C1CCC(=O)S1 Amb2691584 [0,1,0,0,0,0|0,1,1]=3 850 B7R1.2 O=C1CCC(=S)N1 Amb28122939 [0,1,0,0,0,0|1,0,1]=3 851 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [0,1,0,0,0,0|1,0,0]=2 852 B7R1.2 O=C1CCC(Br)N1 Amb27592181 [0,1,0,0,0,0|1,0,0]=2 853 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,1,0,0,0,0|0,0,0]=1 854 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [0,1,0,0,0,0|1,0,0]=2 855 B7R1.2 O=C1CCC(Cl)O1 Amb27477474 [0,1,0,0,0,0|0,0,0]=1 856 B7R1.2 O=C1CCC(F)C1 Amb21963553 [0,1,0,0,0,0|1,0,0]=2 857 B7R1.2 O=C1CCC(O)C1 Amb22057378 [0,1,0,0,0,0|1,0,0]=2 858 B7R1.2 O=C1CCC(O)O1 Amb22740957 [0,1,0,0,0,0|0,0,0]=1 859 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [0,1,0,0,0,0|2,0,0]=3 860 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [0,1,0,0,0,0|1,0,0]=2 861 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [0,1,0,0,0,0|1,0,0]=2 862 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [0,1,0,0,0,0|1,0,0]=2 863 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [0,1,0,0,0,0|1,0,0]=2 864 B7R1.2 O=C1CN(Cl)CN1 Amb27795741 [0,1,0,0,0,0|2,0,0]=3 865 B7R1.2 O=C1CN=C(S)N1 Amb22058713 [0,1,0,0,0,0|2,0,1]=4 866 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [0,1,0,0,0,0|1,0,1]=3 867 B7R1.2 O=C1CNC(=O)N1 Amb3598086 [0,1,0,0,0,0|2,0,1]=4 868 B7R1.2 O=C1CNC(=O)O1 Amb2695392 [0,1,0,0,0,0|1,0,1]=3 869 B7R1.2 O=C1CNC(=O)S1 Amb22372196 [0,1,0,0,0,0|1,1,1]=4 870 B7R1.2 O=C1CNC(=S)N1 Amb1151361 [0,1,0,0,0,0|2,0,1]=4 871 B7R1.2 O=C1CNC(=S)O1 Amb27393154 [0,1,0,0,0,0|1,0,1]=3 872 B7R1.2 O=C1CNC(=S)S1 Amb621648 [0,1,0,0,0,0|1,1,1]=4 873 B7R1.2 O=C1CNC(S)S1 Amb24460897 [0,1,0,0,0,0|1,1,0]=3 874 B7R1.2 O=C1COC(=O)C1 Amb2721303 [0,1,0,0,0,0|0,0,1]=2 875 B7R1.2 O=C1COC(=O)N1 Amb1625991 [0,1,0,0,0,0|1,0,1]=3 876 B7R1.2 O=C1COC(=O)O1 Amb27837383 [0,1,0,0,0,0|1,0,1]=3 877 B7R1.2 O=C1COC(=O)[N-]1 Amb32656005 [0,1,0,0,0,0|1,0,1]=3 878 B7R1.2 O=C1COC(Br)=N1 Amb29849631 [0,1,0,0,0,0|2,0,1]=4 879 B7R1.2 O=C1COC(I)=N1 Amb29849639 [0,1,0,0,0,0|2,0,1]=4 880 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [0,1,0,0,0,0|0,1,1]=3 881 B7R1.2 O=C1CSC(=O)N1 Amb1853667 [0,1,0,0,0,0|1,1,1]=4 882 B7R1.2 O=C1CSC(=O)[N-]1 Amb435911 [0,1,0,0,0,0|1,1,1]=4 883 B7R1.2 O=C1CSC(=S)N1 Amb1008361 [0,1,0,0,0,0|2,0,1]=4 884 B7R1.2 O=C1CSC(Br)=N1 Amb29850234 [0,1,0,0,0,0|2,0,1]=4 885 B7R1.2 O=C1CSC(Cl)=N1 Amb29850164 [0,1,0,0,0,0|2,0,1]=4 886 B7R1.2 O=C1CSC(S)=N1 Amb837069 [0,1,0,0,0,0|2,0,1]=4 887 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [0,1,0,0,0,0|1,0,0]=2 888 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [0,1,0,0,0,0|0,0,0]=1 889 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,1,0,0,0,0|1,0,0]=2 890 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [0,1,0,0,0,0|1,0,0]=2 891 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [0,1,0,0,0,0|0,0,0]=1 892 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,1,0,0,0,0|1,0,0]=2 893 B7R1.2 O=C1NC(=S)CO1 Amb28384997 [0,1,0,0,0,0|1,0,1]=3 894 B7R1.2 O=C1NC(=S)CS1 Amb2469502 [0,1,0,0,0,0|1,1,1]=4 895 B7R1.2 O=C1NC(S)=CO1 Amb27441431 [0,1,0,0,0,0|1,0,2]=4 896 B7R1.2 O=C1NCC(=S)N1 Amb2794498 [0,1,0,0,0,0|2,0,1]=4 897 B7R1.2 O=C1NCC(=S)S1 Amb27785367 [0,1,0,0,0,0|1,1,1]=4 898 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [0,1,0,0,0,0|2,0,1]=4 899 B7R1.2 O=C1OC(O)CS1 Amb28066979 [0,1,0,0,0,0|1,0,0]=2 900 B7R1.2 O=C1OCC(Cl)O1 Amb10842117 [0,1,0,0,0,0|1,0,0]=2 901 B7R1.2 O=C1OCC(F)O1 Amb10841016 [0,1,0,0,0,0|1,0,0]=2 902 B7R1.2 O=S1CCC(Br)C1 Amb27872345 [0,1,0,0,0,0|2,0,0]=3 903 B7R1.2 O=S1CCC(O)C1 Amb26600157 [0,1,0,0,0,0|2,0,0]=3 904 B7R1.2 O=S1CCS(=O)C1 Amb27217021 [0,1,0,0,0,0|3,0,0]=4 905 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [0,1,0,0,0,0|2,0,0]=3 906 B7R1.2 OC1C=C(Br)CC1 Amb8391790 [0,1,0,0,0,0|2,0,0]=3 907 B7R1.2 OC1C=C(I)CC1 Amb26903566 [0,1,0,0,0,0|2,0,0]=3 908 B7R1.2 OC1CC=C(Br)C1 Amb25662365 [0,1,0,0,0,0|2,0,0]=3 909 B7R1.2 OC1CCC(O)C1 Amb8513837 [0,1,0,0,0,0|1,0,2]=4 910 B7R1.2 OC1CCC(O)O1 Amb4018883 [0,1,0,0,0,0|0,0,2]=3 911 B7R1.2 OC1CCN(O)C1 Amb27430271 [0,1,0,0,0,0|2,0,1]=4 912 B7R1.2 OC1C[C@H](O)CO1 Amb27650382 [0,1,0,0,0,0|0,0,2]=3 913 B7R1.2 O[C@@H]1C=C(Br)CC1 Amb24479014 [0,1,0,0,0,0|2,0,0]=3 914 B7R1.2 O[C@@H]1CC[C@@H](O)C1 Amb24519755 [0,1,0,0,0,0|1,0,2]=4 915 B7R1.2 O[C@@H]1CO[C@@H](O)C1 Amb27478741 [0,1,0,0,0,0|0,0,2]=3 916 B7R1.2 O[C@@H]1CO[C@H](O)C1 Amb27797261 [0,1,0,0,0,0|0,0,2]=3 917 B7R1.2 O[C@H]1C=C(Br)CC1 Amb27213930 [0,1,0,0,0,0|2,0,0]=3 918 B7R1.2 O[C@H]1CC[C@@H](O)C1 Amb26035335 [0,1,0,0,0,0|1,0,2]=4 919 B7R1.2 O[C@H]1CC[C@H](O)C1 Amb26400686 [0,1,0,0,0,0|1,0,2]=4 920 B7R1.2 S=C1CCC(=S)N1 Amb24479225 [0,1,0,0,0,0|1,1,1]=4 921 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,1,0,0,0,0|1,0,0]=2 922 B7R1.4 BrC1=C(Br)CCC1 Amb8389430 [0,1,0,0,0,0|2,0,0]=3 923 B7R1.4 BrC1CCCC1Br Amb9787330 [0,1,0,0,0,0|2,0,1]=4 924 B7R1.4 BrC1CCOC1Br Amb17673849 [0,1,0,0,0,0|1,0,1]=3 925 B7R1.4 Br[C@@H]1CCC[C@H]1Br Amb26627934 [0,1,0,0,0,0|2,0,1]=4 926 B7R1.4 C=C1CCCC1=O Amb17593061 [0,1,0,0,0,0|1,0,0]=2 927 B7R1.4 C=C1CCNC1=O Amb26415156 [0,1,0,0,0,0|1,0,1]=3 928 B7R1.4 C=C1CCOC1=O Amb3941636 [0,1,0,0,0,0|0,0,1]=2 929 B7R1.4 C=C1CNCC1=C Amb17593055 [0,1,0,0,0,0|3,0,0]=4 930 B7R1.4 C=C1CNCC1C Amb28197991 [0,1,0,0,0,0|3,0,0]=4 931 B7R1.4 C=C1COCC1=C Amb27838190 [0,1,0,0,0,0|3,0,0]=4 932 B7R1.4 C=C1COCC1N Amb31252146 [0,1,0,0,0,0|3,0,0]=4 933 B7R1.4 C=C1COCC1N Amb32795022 [0,1,0,0,0,0|3,0,0]=4 934 B7R1.4 C=C1COCC1O Amb24423437 [0,1,0,0,0,0|3,0,0]=4 935 B7R1.4 CC1=C(Br)CCC1 Amb24479762 [0,1,0,0,0,0|2,0,0]=3 936 B7R1.4 CC1=C(C)CCC1 Amb22227705 [0,1,0,0,0,0|2,0,0]=3 937 B7R1.4 CC1=C(C)CNC1 Amb28326117 [0,1,0,0,0,0|3,0,0]=4 938 B7R1.4 CC1=C(S)CCO1 Amb16232456 [0,1,0,0,0,0|1,0,1]=3 939 B7R1.4 CC1=CCCC1=O Amb8514958 [0,1,0,0,0,0|1,0,1]=3 940 B7R1.4 CC1=CCCC1C Amb24479857 [0,1,0,0,0,0|2,0,0]=3 941 B7R1.4 CC1=CCCC1O Amb25220686 [0,1,0,0,0,0|2,0,0]=3 942 B7R1.4 CC1=CCCN1C Amb17938859 [0,1,0,0,0,0|2,0,1]=4 943 B7R1.4 CC1=CCNC1C Amb27975662 [0,1,0,0,0,0|3,0,0]=4 944 B7R1.4 CC1=CCOC1=O Amb16231256 [0,1,0,0,0,0|0,0,2]=3 945 B7R1.4 CC1=NCCN1C Amb28456778 [0,1,0,0,0,0|3,0,0]=4 946 B7R1.4 CC1=[N+](C)CCS1 Amb24060954 [0,1,0,0,0,0|2,1,0]=4 947 B7R1.4 CC1C=COC1=O Amb27862334 [0,1,0,0,0,0|0,0,2]=3 948 B7R1.4 CC1C=NNC1=O Amb22232312 [0,1,0,0,0,0|2,0,1]=4 949 B7R1.4 CC1CCCC1=O Amb8514830 [0,1,0,0,0,0|1,0,0]=2 950 B7R1.4 CC1CCCC1=S Amb27483022 [0,1,0,0,0,0|1,1,0]=3 951 B7R1.4 CC1CCCC1Br Amb18180261 [0,1,0,0,0,0|2,0,1]=4 952 B7R1.4 CC1CCCC1C Amb4019559 [0,1,0,0,0,0|2,0,1]=4 953 B7R1.4 CC1CCCC1Cl Amb27853965 [0,1,0,0,0,0|2,0,1]=4 954 B7R1.4 CC1CCCC1N Amb33548666 [0,1,0,0,0,0|2,0,1]=4 955 B7R1.4 CC1CCCC1N Amb9776219 [0,1,0,0,0,0|2,0,1]=4 956 B7R1.4 CC1CCCC1O Amb22052652 [0,1,0,0,0,0|1,0,2]=4 957 B7R1.4 CC1CCCC1S Amb26021537 [0,1,0,0,0,0|1,1,1]=4 958 B7R1.4 CC1CCCN1N Amb25068361 [0,1,0,0,0,0|2,0,1]=4 959 B7R1.4 CC1CCNC1=O Amb10603701 [0,1,0,0,0,0|1,0,0]=2 960 B7R1.4 CC1CCNC1C Amb18277375 [0,1,0,0,0,0|2,0,1]=4 961 B7R1.4 CC1CCNC1C Amb20623813 [0,1,0,0,0,0|2,0,1]=4 962 B7R1.4 CC1CCOC1=O Amb16185414 [0,1,0,0,0,0|0,0,0]=1 963 B7R1.4 CC1CNN=C1N Amb27257625 [0,1,0,0,0,0|3,0,0]=4 964 B7R1.4 CC1CNNC1=O Amb27228083 [0,1,0,0,0,0|2,0,0]=3 965 B7R1.4 CC1COCC1=O Amb24333426 [0,1,0,0,0,0|2,0,0]=3 966 B7R1.4 CC1CON=C1N Amb27404510 [0,1,0,0,0,0|3,0,0]=4 967 B7R1.4 CC1CONC1=O Amb33714888 [0,1,0,0,0,0|2,0,0]=3 968 B7R1.4 CC1CSCC1=O Amb21964769 [0,1,0,0,0,0|2,0,0]=3 969 B7R1.4 CC1NC=CC1=O Amb28201187 [0,1,0,0,0,0|2,0,1]=4 970 B7R1.4 CC1NCCC1=O Amb26950680 [0,1,0,0,0,0|2,0,0]=3 971 B7R1.4 CC1NCCC1=O Amb32410228 [0,1,0,0,0,0|2,0,0]=3 972 B7R1.4 CC1NCCC1O Amb27838277 [0,1,0,0,0,0|2,0,1]=4 973 B7R1.4 CC1NCCC1O Amb32882554 [0,1,0,0,0,0|2,0,1]=4 974 B7R1.4 CC1OC=CC1=O Amb28053998 [0,1,0,0,0,0|2,0,1]=4 975 B7R1.4 CC1OCCC1=O Amb2725497 [0,1,0,0,0,0|2,0,0]=3 976 B7R1.4 CC1OCCC1Br Amb25073861 [0,1,0,0,0,0|1,0,1]=3 977 B7R1.4 CC1OCCC1Cl Amb24470094 [0,1,0,0,0,0|1,0,1]=3 978 B7R1.4 CC1OCCC1N Amb22058722 [0,1,0,0,0,0|1,0,1]=3 979 B7R1.4 CC1OCCC1N Amb32660981 [0,1,0,0,0,0|1,0,1]=3 980 B7R1.4 CC1OCCC1O Amb25888399 [0,1,0,0,0,0|1,0,1]=3 981 B7R1.4 CC1OCCC1S Amb8515792 [0,1,0,0,0,0|1,0,1]=3 982 B7R1.4 CC1OCNC1=O Amb28046854 [0,1,0,0,0,0|2,0,0]=3 983 B7R1.4 CC1OCOC1C Amb26430935 [0,1,0,0,0,0|2,0,1]=4 984 B7R1.4 CC1SCCC1=O Amb8392845 [0,1,0,0,0,0|2,0,0]=3 985 B7R1.4 CC1SCCC1=S Amb27792245 [0,1,0,0,0,0|2,1,0]=4 986 B7R1.4 CC1SCCC1Cl Amb28144167 [0,1,0,0,0,0|1,1,1]=4 987 B7R1.4 CC1SCCC1N Amb20623835 [0,1,0,0,0,0|1,1,1]=4 988 B7R1.4 CC1SCCC1N Amb28827634 [0,1,0,0,0,0|1,1,1]=4 989 B7R1.4 CC1SCCC1O Amb20623836 [0,1,0,0,0,0|1,1,1]=4 990 B7R1.4 CC1SCCC1S Amb26335064 [0,1,0,0,0,0|1,1,1]=4 991 B7R1.4 CC1SCC[C@@H]1O Amb20623838 [0,1,0,0,0,0|1,1,1]=4 992 B7R1.4 CC1SCC[C@H]1O Amb20623837 [0,1,0,0,0,0|1,1,1]=4 993 B7R1.4 CC1SCNC1=O Amb27211661 [0,1,0,0,0,0|2,0,0]=3 994 B7R1.4 CN1=NCCC1O Amb21952741 [0,1,0,0,0,0|3,0,0]=4 995 B7R1.4 CN1CC=CC1=O Amb22372248 [0,1,0,0,0,0|1,0,2]=4 996 B7R1.4 CN1CCCC1=N Amb20669437 [0,1,0,0,0,0|2,0,0]=3 997 B7R1.4 CN1CCCC1=O Amb22493780 [0,1,0,0,0,0|1,0,0]=2 998 B7R1.4 CN1CCCC1=O Amb6608842 [0,1,0,0,0,0|1,0,0]=2 999 B7R1.4 CN1CCCC1=S Amb10562641 [0,1,0,0,0,0|1,1,0]=3 1000 B7R1.4 CN1CCCC1N Amb27631265 [0,1,0,0,0,0|2,0,1]=4 1001 B7R1.4 CN1CCN=C1N Amb18639451 [0,1,0,0,0,0|3,0,0]=4 1002 B7R1.4 CN1CCN=C1N Amb32412656 [0,1,0,0,0,0|3,0,0]=4 1003 B7R1.4 CN1CCN=C1N Amb6383421 [0,1,0,0,0,0|3,0,0]=4 1004 B7R1.4 CN1CCN=C1S Amb8387135 [0,1,0,0,0,0|2,1,0]=4 1005 B7R1.4 CN1CCNC1=O Amb5718647 [0,1,0,0,0,0|2,0,0]=3 1006 B7R1.4 CN1CCNC1=S Amb2720707 [0,1,0,0,0,0|2,1,0]=4 1007 B7R1.4 CN1CCOC1=O Amb22347786 [0,1,0,0,0,0|1,0,0]=2 1008 B7R1.4 CN1CCSC1=N Amb3318644 [0,1,0,0,0,0|2,1,0]=4 1009 B7R1.4 CN1CCSC1=N Amb4286381 [0,1,0,0,0,0|2,1,0]=4 1010 B7R1.4 CN1CCSC1=S Amb17845152 [0,1,0,0,0,0|1,2,0]=4 1011 B7R1.4 CN1CNCC1=O Amb26582942 [0,1,0,0,0,0|2,0,0]=3 1012 B7R1.4 CN1CNCC1=O Amb28827643 [0,1,0,0,0,0|2,0,0]=3 1013 B7R1.4 CN1N=CCC1=O Amb22233815 [0,1,0,0,0,0|2,0,1]=4 1014 B7R1.4 CN1NCCC1=O Amb18559311 [0,1,0,0,0,0|2,0,0]=3 1015 B7R1.4 C[C@@H]1CCCN1N Amb26843100 [0,1,0,0,0,0|2,0,1]=4 1016 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [0,1,0,0,0,0|2,0,1]=4 1017 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [0,1,0,0,0,0|2,0,1]=4 1018 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [0,1,0,0,0,0|1,0,2]=4 1019 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [0,1,0,0,0,0|2,0,1]=4 1020 B7R1.4 C[C@@H]1CCC[C@H]1N Amb27858497 [0,1,0,0,0,0|2,0,1]=4 1021 B7R1.4 C[C@@H]1CCC[C@H]1O Amb8513780 [0,1,0,0,0,0|1,0,2]=4 1022 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,1,0,0,0,0|1,0,0]=2 1023 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [0,1,0,0,0,0|2,0,1]=4 1024 B7R1.4 C[C@@H]1CCOC1O Amb28074771 [0,1,0,0,0,0|0,0,2]=3 1025 B7R1.4 C[C@@H]1CCO[C@H]1O Amb27857930 [0,1,0,0,0,0|0,0,2]=3 1026 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [0,1,0,0,0,0|2,0,0]=3 1027 B7R1.4 C[C@@H]1NCCC1N Amb18202992 [0,1,0,0,0,0|2,0,1]=4 1028 B7R1.4 C[C@@H]1NCCC1O Amb18202778 [0,1,0,0,0,0|2,0,1]=4 1029 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb24425021 [0,1,0,0,0,0|2,0,1]=4 1030 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb32412686 [0,1,0,0,0,0|2,0,1]=4 1031 B7R1.4 C[C@@H]1NCC[C@H]1C Amb32412685 [0,1,0,0,0,0|2,0,1]=4 1032 B7R1.4 C[C@@H]1NCC[C@H]1N Amb28250867 [0,1,0,0,0,0|2,0,1]=4 1033 B7R1.4 C[C@@H]1NCC[C@H]1O Amb26412930 [0,1,0,0,0,0|2,0,1]=4 1034 B7R1.4 C[C@@H]1NCC[C@H]1O Amb32412687 [0,1,0,0,0,0|2,0,1]=4 1035 B7R1.4 C[C@@H]1OCC[C@@H]1I Amb27962293 [0,1,0,0,0,0|1,0,1]=3 1036 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [0,1,0,0,0,0|1,0,1]=3 1037 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [0,1,0,0,0,0|1,0,1]=3 1038 B7R1.4 C[C@@H]1OCC[C@H]1I Amb27664288 [0,1,0,0,0,0|1,0,1]=3 1039 B7R1.4 C[C@@H]1OCC[C@H]1N Amb27435305 [0,1,0,0,0,0|1,0,1]=3 1040 B7R1.4 C[C@@H]1OCC[C@H]1N Amb34915721 [0,1,0,0,0,0|1,0,1]=3 1041 B7R1.4 C[C@@H]1SCC[C@@H]1O Amb28144028 [0,1,0,0,0,0|1,1,1]=4 1042 B7R1.4 C[C@@H]1SCC[C@H]1O Amb27853254 [0,1,0,0,0,0|1,1,1]=4 1043 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [0,1,0,0,0,0|1,0,0]=2 1044 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [0,1,0,0,0,0|2,0,1]=4 1045 B7R1.4 C[C@H]1CCC[C@@H]1O Amb10844719 [0,1,0,0,0,0|1,0,2]=4 1046 B7R1.4 C[C@H]1CCC[C@H]1C Amb22230410 [0,1,0,0,0,0|2,0,1]=4 1047 B7R1.4 C[C@H]1CCC[C@H]1I Amb28135188 [0,1,0,0,0,0|2,0,1]=4 1048 B7R1.4 C[C@H]1CCC[C@H]1O Amb26012367 [0,1,0,0,0,0|1,0,2]=4 1049 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [0,1,0,0,0,0|1,0,0]=2 1050 B7R1.4 C[C@H]1CCN[C@H]1C Amb27879886 [0,1,0,0,0,0|2,0,1]=4 1051 B7R1.4 C[C@H]1CCO[C@H]1Cl Amb27444980 [0,1,0,0,0,0|1,0,1]=3 1052 B7R1.4 C[C@H]1CCO[C@H]1O Amb27642053 [0,1,0,0,0,0|0,0,2]=3 1053 B7R1.4 C[C@H]1NCC[C@@H]1O Amb28322208 [0,1,0,0,0,0|2,0,1]=4 1054 B7R1.4 C[C@H]1OCC[C@@H]1O Amb28388631 [0,1,0,0,0,0|1,0,1]=3 1055 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [0,1,0,0,0,0|1,0,1]=3 1056 B7R1.4 C[C@H]1SCC[C@@H]1O Amb27441450 [0,1,0,0,0,0|1,1,1]=4 1057 B7R1.4 ClC1=CCCC1Cl Amb27262105 [0,1,0,0,0,0|2,0,0]=3 1058 B7R1.4 ClC1CCCC1Cl Amb9787196 [0,1,0,0,0,0|2,0,1]=4 1059 B7R1.4 ClC1CCOC1Cl Amb22731370 [0,1,0,0,0,0|1,0,1]=3 1060 B7R1.4 ClC1CCSC1Cl Amb28325647 [0,1,0,0,0,0|1,1,1]=4 1061 B7R1.4 ClC1OCOC1Cl Amb28050505 [0,1,0,0,0,0|2,0,1]=4 1062 B7R1.4 Cl[C@@H]1CCC[C@@H]1Br Amb27658896 [0,1,0,0,0,0|2,0,1]=4 1063 B7R1.4 Cl[C@@H]1OCC[C@H]1Cl Amb27430492 [0,1,0,0,0,0|1,0,1]=3 1064 B7R1.4 Cl[C@H]1CCC[C@@H]1Br Amb27227433 [0,1,0,0,0,0|2,0,1]=4 1065 B7R1.4 Cl[C@H]1CCO[C@@H]1Cl Amb27419902 [0,1,0,0,0,0|1,0,1]=3 1066 B7R1.4 FC1CCCC1I Amb27236860 [0,1,0,0,0,0|2,0,1]=4 1067 B7R1.4 F[C@@H]1CCC[C@H]1I Amb27811995 [0,1,0,0,0,0|2,0,1]=4 1068 B7R1.4 N=C1OCCN1N Amb27803735 [0,1,0,0,0,0|2,0,0]=3 1069 B7R1.4 NC1=CCOC1=O Amb22234102 [0,1,0,0,0,0|0,0,2]=3 1070 B7R1.4 NC1=NCCN1N Amb24713156 [0,1,0,0,0,0|3,0,0]=4 1071 B7R1.4 NC1C=NNC1=O Amb18202634 [0,1,0,0,0,0|2,0,1]=4 1072 B7R1.4 NC1CCC=C1Br Amb33295394 [0,1,0,0,0,0|2,0,0]=3 1073 B7R1.4 NC1CCC=C1Br Amb33484034 [0,1,0,0,0,0|2,0,0]=3 1074 B7R1.4 NC1CCCC1=O Amb17939050 [0,1,0,0,0,0|1,0,0]=2 1075 B7R1.4 NC1CCCC1=O Amb28994832 [0,1,0,0,0,0|1,0,0]=2 1076 B7R1.4 NC1CCCC1Br Amb20667786 [0,1,0,0,0,0|2,0,1]=4 1077 B7R1.4 NC1CCCC1Br Amb24691577 [0,1,0,0,0,0|2,0,1]=4 1078 B7R1.4 NC1CCCC1Cl Amb3428719 [0,1,0,0,0,0|2,0,1]=4 1079 B7R1.4 NC1CCCC1Cl Amb4451124 [0,1,0,0,0,0|2,0,1]=4 1080 B7R1.4 NC1CCCC1F Amb23538754 [0,1,0,0,0,0|2,0,1]=4 1081 B7R1.4 NC1CCCC1F Amb32658048 [0,1,0,0,0,0|2,0,1]=4 1082 B7R1.4 NC1CCCC1N Amb18639642 [0,1,0,0,0,0|2,0,1]=4 1083 B7R1.4 NC1CCCC1N Amb31291256 [0,1,0,0,0,0|2,0,1]=4 1084 B7R1.4 NC1CCCC1O Amb13951342 [0,1,0,0,0,0|1,0,2]=4 1085 B7R1.4 NC1CCCC1O Amb8385206 [0,1,0,0,0,0|1,0,2]=4 1086 B7R1.4 NC1CCNC1=O Amb21955321 [0,1,0,0,0,0|1,0,0]=2 1087 B7R1.4 NC1CCNC1=O Amb6739903 [0,1,0,0,0,0|1,0,0]=2 1088 B7R1.4 NC1CCOC1=O Amb17614991 [0,1,0,0,0,0|0,0,0]=1 1089 B7R1.4 NC1CCOC1=O Amb6609049 [0,1,0,0,0,0|0,0,0]=1 1090 B7R1.4 NC1CCOC1=O Amb9761351 [0,1,0,0,0,0|0,0,0]=1 1091 B7R1.4 NC1CCOC1O Amb27408022 [0,1,0,0,0,0|0,0,2]=3 1092 B7R1.4 NC1CCSC1=O Amb1151877 [0,1,0,0,0,0|0,1,0]=2 1093 B7R1.4 NC1CCSC1=O Amb2720274 [0,1,0,0,0,0|0,1,0]=2 1094 B7R1.4 NC1COCC1=O Amb18202885 [0,1,0,0,0,0|2,0,0]=3 1095 B7R1.4 NC1COCC1=O Amb33328736 [0,1,0,0,0,0|2,0,0]=3 1096 B7R1.4 NC1CONC1=O Amb1865548 [0,1,0,0,0,0|2,0,0]=3 1097 B7R1.4 NC1CSCC1=O Amb18202693 [0,1,0,0,0,0|2,0,0]=3 1098 B7R1.4 NC1CSNC1=O Amb27435893 [0,1,0,0,0,0|2,0,0]=3 1099 B7R1.4 NN1CCCC1=O Amb8496496 [0,1,0,0,0,0|1,0,0]=2 1100 B7R1.4 NN1CCCC1=O Amb9174227 [0,1,0,0,0,0|1,0,0]=2 1101 B7R1.4 NN1CCNC1=O Amb5722000 [0,1,0,0,0,0|2,0,0]=3 1102 B7R1.4 NN1CCOC1=O Amb10068971 [0,1,0,0,0,0|1,0,0]=2 1103 B7R1.4 NN1CCOC1=O Amb33532698 [0,1,0,0,0,0|1,0,0]=2 1104 B7R1.4 N[C@@H]1CCC[C@@H]1Cl Amb32650234 [0,1,0,0,0,0|2,0,1]=4 1105 B7R1.4 N[C@@H]1CCC[C@@H]1Cl Amb32650235 [0,1,0,0,0,0|2,0,1]=4 1106 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb25174659 [0,1,0,0,0,0|2,0,1]=4 1107 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb32661555 [0,1,0,0,0,0|2,0,1]=4 1108 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb32661660 [0,1,0,0,0,0|2,0,1]=4 1109 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993810 [0,1,0,0,0,0|1,0,2]=4 1110 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993921 [0,1,0,0,0,0|1,0,2]=4 1111 B7R1.4 N[C@@H]1CCC[C@H]1Cl Amb27882439 [0,1,0,0,0,0|2,0,1]=4 1112 B7R1.4 N[C@@H]1CCC[C@H]1F Amb28429786 [0,1,0,0,0,0|2,0,1]=4 1113 B7R1.4 N[C@@H]1CCC[C@H]1F Amb31308557 [0,1,0,0,0,0|2,0,1]=4 1114 B7R1.4 N[C@@H]1CCC[C@H]1N Amb16231433 [0,1,0,0,0,0|2,0,1]=4 1115 B7R1.4 N[C@@H]1CCC[C@H]1N Amb22748826 [0,1,0,0,0,0|2,0,1]=4 1116 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993811 [0,1,0,0,0,0|1,0,2]=4 1117 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993922 [0,1,0,0,0,0|1,0,2]=4 1118 B7R1.4 N[C@@H]1CCC[C@H]1O Amb30451169 [0,1,0,0,0,0|1,0,2]=4 1119 B7R1.4 N[C@@H]1CCC[C@H]1O Amb33714404 [0,1,0,0,0,0|1,0,2]=4 1120 B7R1.4 N[C@@H]1CCC[C@H]1S Amb28345579 [0,1,0,0,0,0|1,1,1]=4 1121 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [0,1,0,0,0,0|1,0,0]=2 1122 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [0,1,0,0,0,0|1,0,0]=2 1123 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [0,1,0,0,0,0|0,0,0]=1 1124 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,1,0,0,0,0|0,0,0]=1 1125 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [0,1,0,0,0,0|0,0,0]=1 1126 B7R1.4 N[C@@H]1CONC1=O Amb533888 [0,1,0,0,0,0|2,0,0]=3 1127 B7R1.4 N[C@H]1CCC[C@@H]1Cl Amb27203393 [0,1,0,0,0,0|2,0,1]=4 1128 B7R1.4 N[C@H]1CCC[C@@H]1F Amb34916180 [0,1,0,0,0,0|2,0,1]=4 1129 B7R1.4 N[C@H]1CCC[C@@H]1N Amb16231434 [0,1,0,0,0,0|2,0,1]=4 1130 B7R1.4 N[C@H]1CCC[C@@H]1O Amb10604100 [0,1,0,0,0,0|1,0,2]=4 1131 B7R1.4 N[C@H]1CCC[C@@H]1O Amb3941725 [0,1,0,0,0,0|1,0,2]=4 1132 B7R1.4 N[C@H]1CCC[C@H]1F Amb27476530 [0,1,0,0,0,0|2,0,1]=4 1133 B7R1.4 N[C@H]1CCC[C@H]1F Amb34162936 [0,1,0,0,0,0|2,0,1]=4 1134 B7R1.4 N[C@H]1CCC[C@H]1N Amb28346940 [0,1,0,0,0,0|2,0,1]=4 1135 B7R1.4 N[C@H]1CCC[C@H]1N Amb30988009 [0,1,0,0,0,0|2,0,1]=4 1136 B7R1.4 N[C@H]1CCC[C@H]1O Amb10603107 [0,1,0,0,0,0|1,0,2]=4 1137 B7R1.4 N[C@H]1CCC[C@H]1O Amb28133706 [0,1,0,0,0,0|1,0,2]=4 1138 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [0,1,0,0,0,0|1,0,0]=2 1139 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [0,1,0,0,0,0|1,0,0]=2 1140 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [0,1,0,0,0,0|0,0,0]=1 1141 B7R1.4 N[C@H]1CCOC1=O Amb541960 [0,1,0,0,0,0|0,0,0]=1 1142 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [0,1,0,0,0,0|0,0,0]=1 1143 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [0,1,0,0,0,0|0,1,0]=2 1144 B7R1.4 N[C@H]1CCSC1=O Amb33758042 [0,1,0,0,0,0|0,1,0]=2 1145 B7R1.4 N[C@H]1CCSC1=O Amb8628572 [0,1,0,0,0,0|0,1,0]=2 1146 B7R1.4 N[C@H]1CNOC1=O Amb27778477 [0,1,0,0,0,0|1,0,0]=2 1147 B7R1.4 N[C@H]1CONC1=O Amb2719694 [0,1,0,0,0,0|2,0,0]=3 1148 B7R1.4 O=C1C=CCC1Cl Amb27482393 [0,1,0,0,0,0|1,0,1]=3 1149 B7R1.4 O=C1C=CCN1O Amb28255915 [0,1,0,0,0,0|1,0,2]=4 1150 B7R1.4 O=C1C=COC1O Amb27638452 [0,1,0,0,0,0|2,0,1]=4 1151 B7R1.4 O=C1CCC=C1Br Amb10067494 [0,1,0,0,0,0|1,0,1]=3 1152 B7R1.4 O=C1CCC=C1I Amb26585706 [0,1,0,0,0,0|1,0,1]=3 1153 B7R1.4 O=C1CCC=C1O Amb17593067 [0,1,0,0,0,0|1,0,1]=3 1154 B7R1.4 O=C1CCCC1=O Amb24053064 [0,1,0,0,0,0|1,0,0]=2 1155 B7R1.4 O=C1CCCC1Br Amb16234114 [0,1,0,0,0,0|1,0,0]=2 1156 B7R1.4 O=C1CCCC1Cl Amb3939970 [0,1,0,0,0,0|1,0,0]=2 1157 B7R1.4 O=C1CCCC1F Amb28050533 [0,1,0,0,0,0|1,0,0]=2 1158 B7R1.4 O=C1CCCC1I Amb25756212 [0,1,0,0,0,0|1,0,0]=2 1159 B7R1.4 O=C1CCCC1O Amb17593081 [0,1,0,0,0,0|1,0,0]=2 1160 B7R1.4 O=C1CCCC1S Amb27838260 [0,1,0,0,0,0|1,0,0]=2 1161 B7R1.4 O=C1CCCN1O Amb33484242 [0,1,0,0,0,0|1,0,0]=2 1162 B7R1.4 O=C1CCC[C@@H]1F Amb35788466 [0,1,0,0,0,0|1,0,0]=2 1163 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [0,1,0,0,0,0|1,0,0]=2 1164 B7R1.4 O=C1CCNC1=O Amb21858086 [0,1,0,0,0,0|1,0,1]=3 1165 B7R1.4 O=C1CCOC1=O Amb27849805 [0,1,0,0,0,0|0,0,1]=2 1166 B7R1.4 O=C1CNC=C1O Amb27962752 [0,1,0,0,0,0|2,0,1]=4 1167 B7R1.4 O=C1COC=C1O Amb27838226 [0,1,0,0,0,0|2,0,1]=4 1168 B7R1.4 O=C1NCCC1Br Amb20623055 [0,1,0,0,0,0|1,0,0]=2 1169 B7R1.4 O=C1NCCC1Cl Amb28050511 [0,1,0,0,0,0|1,0,0]=2 1170 B7R1.4 O=C1NCCC1F Amb25838145 [0,1,0,0,0,0|1,0,0]=2 1171 B7R1.4 O=C1NCCC1O Amb10603089 [0,1,0,0,0,0|1,0,0]=2 1172 B7R1.4 O=C1NCCC1S Amb18202686 [0,1,0,0,0,0|1,0,0]=2 1173 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [0,1,0,0,0,0|1,0,0]=2 1174 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [0,1,0,0,0,0|1,0,0]=2 1175 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,1,0,0,0,0|0,0,2]=3 1176 B7R1.4 O=C1OC=CC1S Amb27624883 [0,1,0,0,0,0|0,0,2]=3 1177 B7R1.4 O=C1OC=C[C@@H]1O Amb27472742 [0,1,0,0,0,0|0,0,2]=3 1178 B7R1.4 O=C1OCC=C1Br Amb10067498 [0,1,0,0,0,0|0,0,2]=3 1179 B7R1.4 O=C1OCC=C1Cl Amb23571857 [0,1,0,0,0,0|0,0,2]=3 1180 B7R1.4 O=C1OCC=C1F Amb28144969 [0,1,0,0,0,0|0,0,2]=3 1181 B7R1.4 O=C1OCCC1Br Amb3940058 [0,1,0,0,0,0|0,0,0]=1 1182 B7R1.4 O=C1OCCC1F Amb27642041 [0,1,0,0,0,0|0,0,0]=1 1183 B7R1.4 O=C1OCCC1I Amb24418518 [0,1,0,0,0,0|0,0,0]=1 1184 B7R1.4 O=C1OCCC1O Amb5718058 [0,1,0,0,0,0|0,0,0]=1 1185 B7R1.4 O=C1OCCC1S Amb25146639 [0,1,0,0,0,0|0,0,0]=1 1186 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [0,1,0,0,0,0|0,0,0]=1 1187 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [0,1,0,0,0,0|0,0,0]=1 1188 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [0,1,0,0,0,0|0,0,0]=1 1189 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [0,1,0,0,0,0|0,0,0]=1 1190 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [0,1,0,0,0,0|0,0,0]=1 1191 B7R1.4 O=C1OCNC1Br Amb25299209 [0,1,0,0,0,0|1,0,0]=2 1192 B7R1.4 O=C1O[Sr]OC1=O Amb22338392 [0,1,0,0,0,0|2,0,1]=4 1193 B7R1.4 O=C1SCC=C1Br Amb27462381 [0,1,0,0,0,0|0,1,2]=4 1194 B7R1.4 O=C1SCC[C@@H]1Br Amb27482200 [0,1,0,0,0,0|0,1,0]=2 1195 B7R1.4 O=S1CCCC1Br Amb28046103 [0,1,0,0,0,0|2,0,0]=3 1196 B7R1.4 O=S1CCCC1Cl Amb27796334 [0,1,0,0,0,0|2,0,0]=3 1197 B7R1.4 OC1CCC=C1Br Amb24429462 [0,1,0,0,0,0|2,0,0]=3 1198 B7R1.4 OC1CCC=C1Cl Amb25202022 [0,1,0,0,0,0|2,0,0]=3 1199 B7R1.4 OC1CCCC1Br Amb27201322 [0,1,0,0,0,0|1,0,2]=4 1200 B7R1.4 OC1CCCC1Cl Amb9787194 [0,1,0,0,0,0|1,0,2]=4 1201 B7R1.4 OC1CCCC1F Amb25746323 [0,1,0,0,0,0|1,0,2]=4 1202 B7R1.4 OC1CCCC1I Amb27478744 [0,1,0,0,0,0|1,0,2]=4 1203 B7R1.4 OC1CCCC1O Amb17935884 [0,1,0,0,0,0|1,0,2]=4 1204 B7R1.4 OC1CCOC1O Amb28291442 [0,1,0,0,0,0|0,0,2]=3 1205 B7R1.4 OC1OCCC1F Amb22641467 [0,1,0,0,0,0|0,0,2]=3 1206 B7R1.4 O[C@@H]1CCC=C1Cl Amb28340922 [0,1,0,0,0,0|2,0,0]=3 1207 B7R1.4 O[C@@H]1CCC[C@@H]1Br Amb24470331 [0,1,0,0,0,0|1,0,2]=4 1208 B7R1.4 O[C@@H]1CCC[C@@H]1F Amb34916184 [0,1,0,0,0,0|1,0,2]=4 1209 B7R1.4 O[C@@H]1CCC[C@H]1Br Amb26427919 [0,1,0,0,0,0|1,0,2]=4 1210 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb17938993 [0,1,0,0,0,0|1,0,2]=4 1211 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb30628647 [0,1,0,0,0,0|1,0,2]=4 1212 B7R1.4 O[C@@H]1CCC[C@H]1F Amb26891974 [0,1,0,0,0,0|1,0,2]=4 1213 B7R1.4 O[C@@H]1CCC[C@H]1O Amb33524011 [0,1,0,0,0,0|1,0,2]=4 1214 B7R1.4 O[C@H]1CCC[C@@H]1F Amb24612635 [0,1,0,0,0,0|1,0,2]=4 1215 B7R1.4 O[C@H]1CCC[C@@H]1I Amb27857258 [0,1,0,0,0,0|1,0,2]=4 1216 B7R1.4 O[C@H]1CCC[C@@H]1O Amb22350708 [0,1,0,0,0,0|1,0,2]=4 1217 B7R1.4 O[C@H]1CCC[C@H]1Br Amb8394047 [0,1,0,0,0,0|1,0,2]=4 1218 B7R1.4 O[C@H]1CCC[C@H]1Cl Amb8394048 [0,1,0,0,0,0|1,0,2]=4 1219 B7R1.4 O[C@H]1CCC[C@H]1O Amb2721263 [0,1,0,0,0,0|1,0,2]=4 1220 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [0,1,0,0,0,0|0,1,0]=2 1221 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [0,1,0,0,0,0|0,1,0]=2 1222 B7R1.4 [O-][N+]1=C(O)NCC1 Amb28367242 [0,1,0,0,0,0|2,0,1]=4 1223 B7R1.14 CC1(Br)CCCC1 Amb24612443 [0,1,0,0,0,0|2,0,1]=4 1224 B7R1.14 CC1(C)CCCC1 Amb4019558 [0,1,0,0,0,0|2,0,1]=4 1225 B7R1.14 CC1(C)CCCN1 Amb8428102 [0,1,0,0,0,0|2,0,1]=4 1226 B7R1.14 CC1(C)CCCN1 Amb9173089 [0,1,0,0,0,0|2,0,1]=4 1227 B7R1.14 CC1(C)CCCO1 Amb22053786 [0,1,0,0,0,0|1,0,1]=3 1228 B7R1.14 CC1(C)CCCS1 Amb27838272 [0,1,0,0,0,0|1,1,1]=4 1229 B7R1.14 CC1(C)CNCO1 Amb17506151 [0,1,0,0,0,0|2,0,1]=4 1230 B7R1.14 CC1(C)OCCO1 Amb8395262 [0,1,0,0,0,0|2,0,1]=4 1231 B7R1.14 CC1(C)OCCS1 Amb27591507 [0,1,0,0,0,0|2,0,1]=4 1232 B7R1.14 CC1(N)CCCC1 Amb10609055 [0,1,0,0,0,0|2,0,1]=4 1233 B7R1.14 CC1(N)CCCC1 Amb9477037 [0,1,0,0,0,0|2,0,1]=4 1234 B7R1.14 CC1(N)OCCO1 Amb28068238 [0,1,0,0,0,0|2,0,1]=4 1235 B7R1.14 CC1(O)CCCC1 Amb4037281 [0,1,0,0,0,0|1,0,2]=4 1236 B7R1.14 CP1(=O)C=CCC1 Amb27833507 [0,1,0,0,0,0|2,0,1]=4 1237 B7R1.14 CP1(=O)C=CCO1 Amb25345454 [0,1,0,0,0,0|1,0,2]=4 1238 B7R1.14 CP1(=O)OCCO1 Amb27781737 [0,1,0,0,0,0|2,0,0]=3 1239 B7R1.14 C[Si]1(C)CCCC1 Amb19893503 [0,1,0,0,0,0|2,1,0]=4 1240 B7R1.14 C[Si]1(Cl)CCCC1 Amb19893715 [0,1,0,0,0,0|2,1,0]=4 1241 B7R1.14 ClC1(Cl)CCCC1 Amb22733951 [0,1,0,0,0,0|2,0,1]=4 1242 B7R1.14 Cl[Si]1(Cl)CCCC1 Amb19893524 [0,1,0,0,0,0|2,1,0]=4 1243 B7R1.14 FC1(F)CCCC1 Amb10838599 [0,1,0,0,0,0|2,0,1]=4 1244 B7R1.14 N=S1(=N)CCCC1 Amb27453018 [0,1,0,0,0,0|3,0,0]=4 1245 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [0,1,0,0,0,0|2,0,0]=3 1246 B7R1.14 NC1(F)CCCC1 Amb28283925 [0,1,0,0,0,0|2,0,1]=4 1247 B7R1.14 O=P1(Cl)OCCO1 Amb8515778 [0,1,0,0,0,0|2,0,0]=3 1248 B7R1.14 O=P1(F)C=CCC1 Amb35789660 [0,1,0,0,0,0|2,0,1]=4 1249 B7R1.14 O=P1([O-])OCCO1 Amb32653504 [0,1,0,0,0,0|2,0,0]=3 1250 B7R1.14 O=S1(=O)C=CCC1 Amb1099221 [0,1,0,0,0,0|2,0,1]=4 1251 B7R1.14 O=S1(=O)C=CCO1 Amb19957378 [0,1,0,0,0,0|1,0,2]=4 1252 B7R1.14 O=S1(=O)CCC=N1 Amb21964374 [0,1,0,0,0,0|2,0,1]=4 1253 B7R1.14 O=S1(=O)CCCC1 Amb2973382 [0,1,0,0,0,0|2,0,0]=3 1254 B7R1.14 O=S1(=O)CCCN1 Amb6893202 [0,1,0,0,0,0|2,0,0]=3 1255 B7R1.14 O=S1(=O)CCCO1 Amb6608684 [0,1,0,0,0,0|1,0,0]=2 1256 B7R1.14 O=S1(=O)CCNC1 Amb27877957 [0,1,0,0,0,0|3,0,0]=4 1257 B7R1.14 O=S1(=O)NCCN1 Amb21520325 [0,1,0,0,0,0|3,0,0]=4 1258 B7R1.14 O=S1(=O)NCCO1 Amb23440061 [0,1,0,0,0,0|2,0,0]=3 1259 B7R1.14 O=S1(=O)OCCO1 Amb15691656 [0,1,0,0,0,0|2,0,0]=3 1260 B5R0.1 BC(=O)NCC Amb27430059 [0,0,1,0,0,0|2,0,0]=3 1261 B5R0.1 C#CCC(=O)O Amb33532662 [0,0,1,0,0,0|0,0,2]=3 1262 B5R0.1 C=C(Br)CCBr Amb25827098 [0,0,1,0,0,0|3,0,0]=4 1263 B5R0.1 C=C(Br)CCCl Amb8391241 [0,0,1,0,0,0|3,0,0]=4 1264 B5R0.1 C=C(Br)CCO Amb4014497 [0,0,1,0,0,0|3,0,0]=4 1265 B5R0.1 C=C(Br)CNC Amb18950247 [0,0,1,0,0,0|3,0,0]=4 1266 B5R0.1 C=C(Br)COC Amb25361496 [0,0,1,0,0,0|3,0,0]=4 1267 B5R0.1 C=C(Br)CSC Amb28313326 [0,0,1,0,0,0|3,0,0]=4 1268 B5R0.1 C=C(C)C#CC Amb25062515 [0,0,1,0,0,0|2,0,1]=4 1269 B5R0.1 C=C(C)CCBr Amb21857866 [0,0,1,0,0,0|3,0,0]=4 1270 B5R0.1 C=C(C)CCC Amb8513259 [0,0,1,0,0,0|2,0,0]=3 1271 B5R0.1 C=C(C)CCCl Amb27810807 [0,0,1,0,0,0|3,0,0]=4 1272 B5R0.1 C=C(C)CCI Amb26649317 [0,0,1,0,0,0|3,0,0]=4 1273 B5R0.1 C=C(C)CCN Amb17673481 [0,0,1,0,0,0|3,0,0]=4 1274 B5R0.1 C=C(C)CCN Amb33543001 [0,0,1,0,0,0|3,0,0]=4 1275 B5R0.1 C=C(C)CCO Amb34916534 [0,0,1,0,0,0|3,0,0]=4 1276 B5R0.1 C=C(C)CCO Amb8513522 [0,0,1,0,0,0|3,0,0]=4 1277 B5R0.1 C=C(C)CCS Amb25887673 [0,0,1,0,0,0|3,0,0]=4 1278 B5R0.1 C=C(C)CNC Amb30625043 [0,0,1,0,0,0|3,0,0]=4 1279 B5R0.1 C=C(C)CNC Amb3941317 [0,0,1,0,0,0|3,0,0]=4 1280 B5R0.1 C=C(C)COC Amb26589016 [0,0,1,0,0,0|3,0,0]=4 1281 B5R0.1 C=C(C)CSC Amb20671946 [0,0,1,0,0,0|3,0,0]=4 1282 B5R0.1 C=C(C)OCC Amb8393241 [0,0,1,0,0,0|1,0,0]=2 1283 B5R0.1 C=C(Cl)CCI Amb28187982 [0,0,1,0,0,0|3,0,0]=4 1284 B5R0.1 C=C(Cl)CCN Amb27493165 [0,0,1,0,0,0|3,0,0]=4 1285 B5R0.1 C=C(F)CNC Amb28194424 [0,0,1,0,0,0|3,0,0]=4 1286 B5R0.1 C=CCC(=O)Cl Amb33543701 [0,0,1,0,0,0|1,0,2]=4 1287 B5R0.1 C=CCC(=O)O Amb3940098 [0,0,1,0,0,0|0,0,2]=3 1288 B5R0.1 C=CCC(C)=O Amb8396482 [0,0,1,0,0,0|1,0,2]=4 1289 B5R0.1 C=CCC(N)=O Amb17610156 [0,0,1,0,0,0|1,0,2]=4 1290 B5R0.1 C=CCS(=O)O Amb33534190 [0,0,1,0,0,0|1,0,2]=4 1291 B5R0.1 C=CC[PH](=O)O Amb8391287 [0,0,1,0,0,0|1,0,2]=4 1292 B5R0.1 C=CNC(C)=O Amb24323579 [0,0,1,0,0,0|1,0,2]=4 1293 B5R0.1 C=COC(=O)Cl Amb8514993 [0,0,1,0,0,0|1,0,2]=4 1294 B5R0.1 C=COC(C)=O Amb8513382 [0,0,1,0,0,0|0,0,2]=3 1295 B5R0.1 C=NCC(N)=O Amb26548445 [0,0,1,0,0,0|2,0,1]=4 1296 B5R0.1 C=NNC(C)=O Amb29626225 [0,0,1,0,0,0|2,0,1]=4 1297 B5R0.1 CC#CC(=O)Cl Amb27778056 [0,0,1,0,0,0|1,0,2]=4 1298 B5R0.1 CC#CC(=O)O Amb2685714 [0,0,1,0,0,0|0,0,2]=3 1299 B5R0.1 CC#CC(C)=O Amb17593016 [0,0,1,0,0,0|1,0,1]=3 1300 B5R0.1 CC#CC(N)=O Amb10552409 [0,0,1,0,0,0|1,0,2]=4 1301 B5R0.1 CC(=O)C=C=O Amb10603952 [0,0,1,0,0,0|2,0,1]=4 1302 B5R0.1 CC(=O)C=[N+]=[N-] Amb27808588 [0,0,1,0,0,0|3,0,0]=4 1303 B5R0.1 CC(=O)CC#N Amb1102132 [0,0,1,0,0,0|2,0,1]=4 1304 B5R0.1 CC(=O)CC=N Amb28285098 [0,0,1,0,0,0|2,0,1]=4 1305 B5R0.1 CC(=O)CCBr Amb24078246 [0,0,1,0,0,0|2,0,0]=3 1306 B5R0.1 CC(=O)CCCl Amb2720823 [0,0,1,0,0,0|2,0,0]=3 1307 B5R0.1 CC(=O)CCF Amb26427773 [0,0,1,0,0,0|2,0,0]=3 1308 B5R0.1 CC(=O)CCN Amb18632933 [0,0,1,0,0,0|2,0,0]=3 1309 B5R0.1 CC(=O)CCN Amb33544540 [0,0,1,0,0,0|2,0,0]=3 1310 B5R0.1 CC(=O)CCO Amb836357 [0,0,1,0,0,0|2,0,0]=3 1311 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [0,0,1,0,0,0|2,0,0]=3 1312 B5R0.1 CC(=O)CNO Amb28049954 [0,0,1,0,0,0|3,0,0]=4 1313 B5R0.1 CC(=O)CSN Amb28430346 [0,0,1,0,0,0|3,0,0]=4 1314 B5R0.1 CC(=O)N=C=O Amb17231800 [0,0,1,0,0,0|2,0,1]=4 1315 B5R0.1 CC(=O)N=C=S Amb9249840 [0,0,1,0,0,0|2,0,1]=4 1316 B5R0.1 CC(=O)N=S=O Amb9786964 [0,0,1,0,0,0|3,0,0]=4 1317 B5R0.1 CC(=O)N=[N+]=[N-] Amb27837645 [0,0,1,0,0,0|3,0,0]=4 1318 B5R0.1 CC(=O)NC=O Amb27850191 [0,0,1,0,0,0|2,0,1]=4 1319 B5R0.1 CC(=O)NCO Amb8516057 [0,0,1,0,0,0|2,0,0]=3 1320 B5R0.1 CC(=O)OC=O Amb25283525 [0,0,1,0,0,0|1,0,1]=3 1321 B5R0.1 CC(=O)OCBr Amb3941481 [0,0,1,0,0,0|1,0,0]=2 1322 B5R0.1 CC(=O)OCCl Amb33542858 [0,0,1,0,0,0|1,0,0]=2 1323 B5R0.1 CC(=O)OCI Amb25226851 [0,0,1,0,0,0|1,0,0]=2 1324 B5R0.1 CC(=O)SCBr Amb25349900 [0,0,1,0,0,0|1,1,0]=3 1325 B5R0.1 CC(=O)SCI Amb33339258 [0,0,1,0,0,0|1,1,0]=3 1326 B5R0.1 CC(=O)SCO Amb27255261 [0,0,1,0,0,0|1,1,0]=3 1327 B5R0.1 CC(=O)[CH-]C#N Amb26476728 [0,0,1,0,0,0|2,0,1]=4 1328 B5R0.1 CC(=O)\C=C/N Amb25147403 [0,0,1,0,0,0|2,0,1]=4 1329 B5R0.1 CC(=O)\C=C/[O-] Amb30876865 [0,0,1,0,0,0|2,0,1]=4 1330 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [0,0,1,0,0,0|2,0,1]=4 1331 B5R0.1 CC(=O)\C=C\N Amb8395283 [0,0,1,0,0,0|2,0,1]=4 1332 B5R0.1 CC(=O)\C=C\[O-] Amb32644521 [0,0,1,0,0,0|2,0,1]=4 1333 B5R0.1 CC(=O)\C=N/O Amb26474151 [0,0,1,0,0,0|3,0,0]=4 1334 B5R0.1 CC(=O)\C=N\O Amb33719017 [0,0,1,0,0,0|3,0,0]=4 1335 B5R0.1 CC(=O)\C=N\O Amb8395285 [0,0,1,0,0,0|3,0,0]=4 1336 B5R0.1 CC(=S)SCCl Amb27231112 [0,0,1,0,0,0|1,2,0]=4 1337 B5R0.1 CC(C)=CCBr Amb3940211 [0,0,1,0,0,0|3,0,0]=4 1338 B5R0.1 CC(C)=CCCl Amb2371433 [0,0,1,0,0,0|3,0,0]=4 1339 B5R0.1 CC(C)=CCN Amb10601678 [0,0,1,0,0,0|3,0,0]=4 1340 B5R0.1 CC(C)=CCN Amb10601679 [0,0,1,0,0,0|3,0,0]=4 1341 B5R0.1 CC(C)=CCO Amb4605830 [0,0,1,0,0,0|3,0,0]=4 1342 B5R0.1 CC(C)=CCS Amb17617244 [0,0,1,0,0,0|3,0,0]=4 1343 B5R0.1 CC(C)OCCl Amb33545059 [0,0,1,0,0,0|2,0,1]=4 1344 B5R0.1 CC(C)OCN Amb28315690 [0,0,1,0,0,0|2,0,1]=4 1345 B5R0.1 CC(O)CCBr Amb33548043 [0,0,1,0,0,0|2,0,1]=4 1346 B5R0.1 CC(O)CCCl Amb24551052 [0,0,1,0,0,0|2,0,1]=4 1347 B5R0.1 CC(O)CCF Amb26449397 [0,0,1,0,0,0|2,0,1]=4 1348 B5R0.1 CC(O)CCN Amb32666140 [0,0,1,0,0,0|2,0,1]=4 1349 B5R0.1 CC(O)CCN Amb33537908 [0,0,1,0,0,0|2,0,1]=4 1350 B5R0.1 CC(O)CCO Amb6608662 [0,0,1,0,0,0|2,0,1]=4 1351 B5R0.1 CCC=C(Br)Br Amb25887651 [0,0,1,0,0,0|2,0,1]=4 1352 B5R0.1 CCC=C(C)C Amb22336412 [0,0,1,0,0,0|2,0,0]=3 1353 B5R0.1 CCC=C(F)F Amb10839842 [0,0,1,0,0,0|2,0,1]=4 1354 B5R0.1 CCCB(O)O Amb2447105 [0,0,1,0,0,0|1,0,1]=3 1355 B5R0.1 CCCC(=N)N Amb10610381 [0,0,1,0,0,0|2,0,0]=3 1356 B5R0.1 CCCC(=N)N Amb2695914 [0,0,1,0,0,0|2,0,0]=3 1357 B5R0.1 CCCC(=O)Br Amb22734023 [0,0,1,0,0,0|1,0,0]=2 1358 B5R0.1 CCCC(=O)Cl Amb2792903 [0,0,1,0,0,0|1,0,0]=2 1359 B5R0.1 CCCC(=O)O Amb3939012 [0,0,1,0,0,0|0,0,0]=1 1360 B5R0.1 CCCC(=O)[O-] Amb8514901 [0,0,1,0,0,0|0,0,1]=2 1361 B5R0.1 CCCC(=S)Cl Amb24626931 [0,0,1,0,0,0|1,1,0]=3 1362 B5R0.1 CCCC(Br)Br Amb27801326 [0,0,1,0,0,0|2,0,1]=4 1363 B5R0.1 CCCC(C)=O Amb6608910 [0,0,1,0,0,0|1,0,0]=2 1364 B5R0.1 CCCC(C)Br Amb3940201 [0,0,1,0,0,0|2,0,1]=4 1365 B5R0.1 CCCC(C)Cl Amb4018346 [0,0,1,0,0,0|2,0,1]=4 1366 B5R0.1 CCCC(C)I Amb17939400 [0,0,1,0,0,0|2,0,1]=4 1367 B5R0.1 CCCC(C)N Amb10609075 [0,0,1,0,0,0|2,0,1]=4 1368 B5R0.1 CCCC(C)N Amb3941259 [0,0,1,0,0,0|2,0,1]=4 1369 B5R0.1 CCCC(C)O Amb4605839 [0,0,1,0,0,0|1,0,1]=3 1370 B5R0.1 CCCC(C)S Amb7784731 [0,0,1,0,0,0|1,1,1]=4 1371 B5R0.1 CCCC(Cl)Br Amb27657591 [0,0,1,0,0,0|2,0,1]=4 1372 B5R0.1 CCCC(Cl)Cl Amb25062516 [0,0,1,0,0,0|2,0,1]=4 1373 B5R0.1 CCCC(F)Br Amb27856781 [0,0,1,0,0,0|2,0,1]=4 1374 B5R0.1 CCCC(N)=O Amb3886524 [0,0,1,0,0,0|1,0,0]=2 1375 B5R0.1 CCCC(N)=S Amb6245403 [0,0,1,0,0,0|1,1,0]=3 1376 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [0,0,1,0,0,0|2,0,0]=3 1377 B5R0.1 CCCC(O)=S Amb22229383 [0,0,1,0,0,0|0,1,0]=2 1378 B5R0.1 CCCC(O)Cl Amb22552567 [0,0,1,0,0,0|1,0,1]=3 1379 B5R0.1 CCCC(O)O Amb26364594 [0,0,1,0,0,0|0,0,2]=3 1380 B5R0.1 CCCN(C)C Amb22733186 [0,0,1,0,0,0|3,0,0]=4 1381 B5R0.1 CCCN(C)O Amb25024622 [0,0,1,0,0,0|2,0,0]=3 1382 B5R0.1 CCCP(Cl)Cl Amb22053969 [0,0,1,0,0,0|3,0,0]=4 1383 B5R0.1 CCCS(=O)Cl Amb25025566 [0,0,1,0,0,0|2,0,0]=3 1384 B5R0.1 CCCS(=O)[O-] Amb19929119 [0,0,1,0,0,0|1,0,1]=3 1385 B5R0.1 CCCS(N)=O Amb24733579 [0,0,1,0,0,0|2,0,0]=3 1386 B5R0.1 CCC[C@@H](C)N Amb22898992 [0,0,1,0,0,0|2,0,1]=4 1387 B5R0.1 CCC[C@@H](C)N Amb23439500 [0,0,1,0,0,0|2,0,1]=4 1388 B5R0.1 CCC[C@@H](C)O Amb8628178 [0,0,1,0,0,0|1,0,1]=3 1389 B5R0.1 CCC[C@@H](N)O Amb28074861 [0,0,1,0,0,0|1,0,1]=3 1390 B5R0.1 CCC[C@H](C)Br Amb27650565 [0,0,1,0,0,0|2,0,1]=4 1391 B5R0.1 CCC[C@H](C)N Amb21618754 [0,0,1,0,0,0|2,0,1]=4 1392 B5R0.1 CCC[C@H](C)N Amb31204590 [0,0,1,0,0,0|2,0,1]=4 1393 B5R0.1 CCC[C@H](C)O Amb8389338 [0,0,1,0,0,0|1,0,1]=3 1394 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [0,0,1,0,0,0|1,0,1]=3 1395 B5R0.1 CCNC(=N)N Amb21964689 [0,0,1,0,0,0|3,0,0]=4 1396 B5R0.1 CCNC(=N)N Amb22053912 [0,0,1,0,0,0|3,0,0]=4 1397 B5R0.1 CCNC(=O)Cl Amb25791793 [0,0,1,0,0,0|2,0,0]=3 1398 B5R0.1 CCNC(=S)S Amb26505127 [0,0,1,0,0,0|1,2,0]=4 1399 B5R0.1 CCNC(C)=O Amb2780415 [0,0,1,0,0,0|1,0,0]=2 1400 B5R0.1 CCNC(C)C Amb3938992 [0,0,1,0,0,0|2,0,1]=4 1401 B5R0.1 CCNC(N)=O Amb6608844 [0,0,1,0,0,0|2,0,0]=3 1402 B5R0.1 CCNC(N)=S Amb6608838 [0,0,1,0,0,0|2,1,0]=4 1403 B5R0.1 CCNC(N)=[NH2+] Amb22734753 [0,0,1,0,0,0|3,0,0]=4 1404 B5R0.1 CCOB(O)O Amb27221375 [0,0,1,0,0,0|2,0,1]=4 1405 B5R0.1 CCOC(=N)N Amb16231402 [0,0,1,0,0,0|2,0,0]=3 1406 B5R0.1 CCOC(=N)N Amb27173000 [0,0,1,0,0,0|2,0,0]=3 1407 B5R0.1 CCOC(=O)Cl Amb2793045 [0,0,1,0,0,0|1,0,0]=2 1408 B5R0.1 CCOC(=O)O Amb8393208 [0,0,1,0,0,0|1,0,0]=2 1409 B5R0.1 CCOC(=S)Cl Amb26030825 [0,0,1,0,0,0|1,1,0]=3 1410 B5R0.1 CCOC(=S)[S-] Amb22729921 [0,0,1,0,0,0|1,1,0]=3 1411 B5R0.1 CCOC(=S)[S-] Amb8480129 [0,0,1,0,0,0|1,1,0]=3 1412 B5R0.1 CCOC(C)=N Amb8394853 [0,0,1,0,0,0|1,0,0]=2 1413 B5R0.1 CCOC(C)=N Amb8514666 [0,0,1,0,0,0|1,0,0]=2 1414 B5R0.1 CCOC(C)=O Amb3940488 [0,0,1,0,0,0|0,0,0]=1 1415 B5R0.1 CCOC(C)=S Amb22047276 [0,0,1,0,0,0|0,1,0]=2 1416 B5R0.1 CCOC(C)C Amb22230687 [0,0,1,0,0,0|1,0,1]=3 1417 B5R0.1 CCOC(C)Cl Amb17939011 [0,0,1,0,0,0|1,0,1]=3 1418 B5R0.1 CCOC(C)N Amb27493166 [0,0,1,0,0,0|1,0,1]=3 1419 B5R0.1 CCOC(N)=O Amb6608672 [0,0,1,0,0,0|1,0,0]=2 1420 B5R0.1 CCOC(N)=S Amb10241338 [0,0,1,0,0,0|1,1,0]=3 1421 B5R0.1 CCOP(Cl)Cl Amb4297338 [0,0,1,0,0,0|3,0,0]=4 1422 B5R0.1 CCOS(=O)Cl Amb25239825 [0,0,1,0,0,0|2,0,0]=3 1423 B5R0.1 CCO[N+](=O)[O-] Amb22732543 [0,0,1,0,0,0|2,0,0]=3 1424 B5R0.1 CCO[PH](=O)O Amb22360741 [0,0,1,0,0,0|2,0,0]=3 1425 B5R0.1 CCO[PH](=O)[O-] Amb22731647 [0,0,1,0,0,0|2,0,0]=3 1426 B5R0.1 CCO[SiH](C)C Amb2687519 [0,0,1,0,0,0|1,1,0]=3 1427 B5R0.1 CCO[Si](=O)O Amb26569259 [0,0,1,0,0,0|1,1,0]=3 1428 B5R0.1 CCO[Si](C)C Amb33813144 [0,0,1,0,0,0|1,1,0]=3 1429 B5R0.1 CCSC(=N)N Amb16205363 [0,0,1,0,0,0|2,1,0]=4 1430 B5R0.1 CCSC(=N)N Amb8393903 [0,0,1,0,0,0|2,1,0]=4 1431 B5R0.1 CCSC(=N)[NH3+] Amb24113877 [0,0,1,0,0,0|2,1,0]=4 1432 B5R0.1 CCSC(=O)Cl Amb8516064 [0,0,1,0,0,0|1,1,0]=3 1433 B5R0.1 CCSC(=S)[S-] Amb27247124 [0,0,1,0,0,0|1,2,0]=4 1434 B5R0.1 CCSC(C)=S Amb8394854 [0,0,1,0,0,0|0,2,0]=3 1435 B5R0.1 CCSC(C)C Amb22731934 [0,0,1,0,0,0|1,1,1]=4 1436 B5R0.1 CCSC(N)=S Amb25969673 [0,0,1,0,0,0|1,2,0]=4 1437 B5R0.1 CC[O+]=C(N)N Amb22492446 [0,0,1,0,0,0|2,0,1]=4 1438 B5R0.1 CC\N=[N+](\C)[O-] Amb27427413 [0,0,1,0,0,0|2,0,1]=4 1439 B5R0.1 CN(O)CCCl Amb27473361 [0,0,1,0,0,0|3,0,0]=4 1440 B5R0.1 CN(O)CCF Amb33377280 [0,0,1,0,0,0|3,0,0]=4 1441 B5R0.1 CNC=C(C)C Amb28313754 [0,0,1,0,0,0|3,0,0]=4 1442 B5R0.1 CNCC(=O)O Amb6298808 [0,0,1,0,0,0|1,0,0]=2 1443 B5R0.1 CNCC(=O)O Amb6599996 [0,0,1,0,0,0|1,0,0]=2 1444 B5R0.1 CNCC(=O)[O-] Amb20246714 [0,0,1,0,0,0|1,0,1]=3 1445 B5R0.1 CNCC(C)=O Amb17621974 [0,0,1,0,0,0|2,0,0]=3 1446 B5R0.1 CNCC(C)=O Amb21959975 [0,0,1,0,0,0|2,0,0]=3 1447 B5R0.1 CNCC(C)O Amb32666238 [0,0,1,0,0,0|2,0,1]=4 1448 B5R0.1 CNCC(C)O Amb9247471 [0,0,1,0,0,0|2,0,1]=4 1449 B5R0.1 CNCC(N)=O Amb19134307 [0,0,1,0,0,0|2,0,0]=3 1450 B5R0.1 CNCC(N)=O Amb3940074 [0,0,1,0,0,0|2,0,0]=3 1451 B5R0.1 CNCC(N)=O Amb9151172 [0,0,1,0,0,0|2,0,0]=3 1452 B5R0.1 CNC[C@@H](C)O Amb26972484 [0,0,1,0,0,0|2,0,1]=4 1453 B5R0.1 CNC[C@@H](C)O Amb32652763 [0,0,1,0,0,0|2,0,1]=4 1454 B5R0.1 CNC[C@H](C)O Amb27596614 [0,0,1,0,0,0|2,0,1]=4 1455 B5R0.1 CNC[C@H](C)O Amb32652861 [0,0,1,0,0,0|2,0,1]=4 1456 B5R0.1 CNN=C(C)C Amb25266075 [0,0,1,0,0,0|3,0,0]=4 1457 B5R0.1 CNOC(N)=O Amb28341734 [0,0,1,0,0,0|2,0,0]=3 1458 B5R0.1 CN\N=C(\C)N Amb20622969 [0,0,1,0,0,0|3,0,0]=4 1459 B5R0.1 CN\N=C(\C)N Amb33141031 [0,0,1,0,0,0|3,0,0]=4 1460 B5R0.1 COC=C(C)C Amb25063853 [0,0,1,0,0,0|3,0,0]=4 1461 B5R0.1 COCB(O)O Amb28401589 [0,0,1,0,0,0|2,0,1]=4 1462 B5R0.1 COCC(=N)N Amb2696281 [0,0,1,0,0,0|3,0,0]=4 1463 B5R0.1 COCC(=N)N Amb33551686 [0,0,1,0,0,0|3,0,0]=4 1464 B5R0.1 COCC(=O)Cl Amb3939326 [0,0,1,0,0,0|2,0,0]=3 1465 B5R0.1 COCC(=O)O Amb3939876 [0,0,1,0,0,0|1,0,0]=2 1466 B5R0.1 COCC(C)=O Amb8513767 [0,0,1,0,0,0|2,0,0]=3 1467 B5R0.1 COCC(C)O Amb33544397 [0,0,1,0,0,0|2,0,1]=4 1468 B5R0.1 COCC(N)=O Amb1153776 [0,0,1,0,0,0|2,0,0]=3 1469 B5R0.1 COCC(N)=S Amb6268129 [0,0,1,0,0,0|2,1,0]=4 1470 B5R0.1 COC[C@@H](C)O Amb8383545 [0,0,1,0,0,0|2,0,1]=4 1471 B5R0.1 COC[C@H](C)O Amb8515770 [0,0,1,0,0,0|2,0,1]=4 1472 B5R0.1 CON=C(C)C Amb24118020 [0,0,1,0,0,0|3,0,0]=4 1473 B5R0.1 CONC(C)=O Amb25046114 [0,0,1,0,0,0|2,0,0]=3 1474 B5R0.1 CONC(C)=S Amb27759908 [0,0,1,0,0,0|2,1,0]=4 1475 B5R0.1 CONC(N)=O Amb2417193 [0,0,1,0,0,0|3,0,0]=4 1476 B5R0.1 CS(=O)CCBr Amb28049280 [0,0,1,0,0,0|3,0,0]=4 1477 B5R0.1 CS(=O)CCCl Amb24116979 [0,0,1,0,0,0|3,0,0]=4 1478 B5R0.1 CS(=O)CCI Amb27752977 [0,0,1,0,0,0|3,0,0]=4 1479 B5R0.1 CS(=O)CCN Amb2786559 [0,0,1,0,0,0|3,0,0]=4 1480 B5R0.1 CS(=O)CCN Amb33543191 [0,0,1,0,0,0|3,0,0]=4 1481 B5R0.1 CS(=O)CCO Amb28075364 [0,0,1,0,0,0|3,0,0]=4 1482 B5R0.1 CSCC(=N)N Amb2696282 [0,0,1,0,0,0|3,0,0]=4 1483 B5R0.1 CSCC(=N)N Amb8630183 [0,0,1,0,0,0|3,0,0]=4 1484 B5R0.1 CSCC(=O)Cl Amb24528357 [0,0,1,0,0,0|2,0,0]=3 1485 B5R0.1 CSCC(=O)O Amb1152425 [0,0,1,0,0,0|1,0,0]=2 1486 B5R0.1 CSCC(C)=O Amb20621731 [0,0,1,0,0,0|2,0,0]=3 1487 B5R0.1 CSCC(C)O Amb20622311 [0,0,1,0,0,0|2,0,1]=4 1488 B5R0.1 CSCC(N)=O Amb19515874 [0,0,1,0,0,0|2,0,0]=3 1489 B5R0.1 CSCC(N)=S Amb17503394 [0,0,1,0,0,0|2,1,0]=4 1490 B5R0.1 CSCS(C)=O Amb22045140 [0,0,1,0,0,0|3,0,0]=4 1491 B5R0.1 CSC[C@@H](C)O Amb24408899 [0,0,1,0,0,0|2,0,1]=4 1492 B5R0.1 CSC[C@H](C)O Amb24699036 [0,0,1,0,0,0|2,0,1]=4 1493 B5R0.1 CSNC(C)=O Amb22500292 [0,0,1,0,0,0|2,0,0]=3 1494 B5R0.1 C[C@@H](O)CCBr Amb27392288 [0,0,1,0,0,0|2,0,1]=4 1495 B5R0.1 C[C@@H](O)CCF Amb33376906 [0,0,1,0,0,0|2,0,1]=4 1496 B5R0.1 C[C@@H](O)CCI Amb27594639 [0,0,1,0,0,0|2,0,1]=4 1497 B5R0.1 C[C@@H](O)CCN Amb22736702 [0,0,1,0,0,0|2,0,1]=4 1498 B5R0.1 C[C@@H](O)CCN Amb28555327 [0,0,1,0,0,0|2,0,1]=4 1499 B5R0.1 C[C@@H](O)CCO Amb4166294 [0,0,1,0,0,0|2,0,1]=4 1500 B5R0.1 C[C@H](O)CCBr Amb28367228 [0,0,1,0,0,0|2,0,1]=4 1501 B5R0.1 C[C@H](O)CCF Amb33376900 [0,0,1,0,0,0|2,0,1]=4 1502 B5R0.1 C[C@H](O)CCN Amb22736705 [0,0,1,0,0,0|2,0,1]=4 1503 B5R0.1 C[C@H](O)CCN Amb34159890 [0,0,1,0,0,0|2,0,1]=4 1504 B5R0.1 C[C@H](O)CCO Amb4166300 [0,0,1,0,0,0|2,0,1]=4 1505 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [0,0,1,0,0,0|2,0,0]=3 1506 B5R0.1 C\C(Br)=C/CO Amb30621790 [0,0,1,0,0,0|3,0,0]=4 1507 B5R0.1 C\C(Cl)=C/CCl Amb25917865 [0,0,1,0,0,0|3,0,0]=4 1508 B5R0.1 C\C(Cl)=C\CCl Amb24564316 [0,0,1,0,0,0|3,0,0]=4 1509 B5R0.1 C\C(Cl)=C\CI Amb27185852 [0,0,1,0,0,0|3,0,0]=4 1510 B5R0.1 C\C(Cl)=C\CN Amb2693573 [0,0,1,0,0,0|3,0,0]=4 1511 B5R0.1 C\C(Cl)=C\CO Amb25663061 [0,0,1,0,0,0|3,0,0]=4 1512 B5R0.1 C\C(I)=C/CO Amb17616110 [0,0,1,0,0,0|3,0,0]=4 1513 B5R0.1 C\C(I)=C\CCl Amb27619763 [0,0,1,0,0,0|3,0,0]=4 1514 B5R0.1 C\C(I)=C\CI Amb27843437 [0,0,1,0,0,0|3,0,0]=4 1515 B5R0.1 C\C(I)=C\CN Amb27216485 [0,0,1,0,0,0|3,0,0]=4 1516 B5R0.1 C\C(I)=C\CO Amb30621783 [0,0,1,0,0,0|3,0,0]=4 1517 B5R0.1 C\C(O)=C\CN Amb33294274 [0,0,1,0,0,0|2,0,1]=4 1518 B5R0.1 C\C=C/C(=O)O Amb27779315 [0,0,1,0,0,0|0,0,2]=3 1519 B5R0.1 C\C=C/C(C)=O Amb28351405 [0,0,1,0,0,0|1,0,1]=3 1520 B5R0.1 C\C=C\C(=O)Br Amb25026006 [0,0,1,0,0,0|1,0,2]=4 1521 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [0,0,1,0,0,0|1,0,2]=4 1522 B5R0.1 C\C=C\C(=O)O Amb8385856 [0,0,1,0,0,0|0,0,2]=3 1523 B5R0.1 C\C=C\C(C)=O Amb33941980 [0,0,1,0,0,0|1,0,1]=3 1524 B5R0.1 C\C=C\C(N)=O Amb4025906 [0,0,1,0,0,0|1,0,2]=4 1525 B5R0.1 C\C=N\S(C)=O Amb35718869 [0,0,1,0,0,0|2,0,1]=4 1526 B5R0.1 N#CCC(=O)Cl Amb17593096 [0,0,1,0,0,0|2,0,1]=4 1527 B5R0.1 N#CCC(=O)O Amb2609022 [0,0,1,0,0,0|1,0,1]=3 1528 B5R0.1 N#CCC(N)=O Amb6336473 [0,0,1,0,0,0|2,0,1]=4 1529 B5R0.1 N=C(Br)CCBr Amb27653883 [0,0,1,0,0,0|3,0,0]=4 1530 B5R0.1 N=C(N)CCBr Amb4297021 [0,0,1,0,0,0|3,0,0]=4 1531 B5R0.1 N=C(N)CCCl Amb25839424 [0,0,1,0,0,0|3,0,0]=4 1532 B5R0.1 N=C(N)CCF Amb26024692 [0,0,1,0,0,0|3,0,0]=4 1533 B5R0.1 N=C(N)CCN Amb27265608 [0,0,1,0,0,0|3,0,0]=4 1534 B5R0.1 N=C(N)CCN Amb32687503 [0,0,1,0,0,0|3,0,0]=4 1535 B5R0.1 N=C(N)CCN Amb33164129 [0,0,1,0,0,0|3,0,0]=4 1536 B5R0.1 N=C(N)CCO Amb2696134 [0,0,1,0,0,0|3,0,0]=4 1537 B5R0.1 N=C(N)CCO Amb8630168 [0,0,1,0,0,0|3,0,0]=4 1538 B5R0.1 NC(=O)CC=O Amb25777522 [0,0,1,0,0,0|2,0,1]=4 1539 B5R0.1 NC(=O)CCBr Amb21618712 [0,0,1,0,0,0|2,0,0]=3 1540 B5R0.1 NC(=O)CCCl Amb1127569 [0,0,1,0,0,0|2,0,0]=3 1541 B5R0.1 NC(=O)CCF Amb28289353 [0,0,1,0,0,0|2,0,0]=3 1542 B5R0.1 NC(=O)CCI Amb27966778 [0,0,1,0,0,0|2,0,0]=3 1543 B5R0.1 NC(=O)CCO Amb9421407 [0,0,1,0,0,0|2,0,0]=3 1544 B5R0.1 NC(=O)CCS Amb27154802 [0,0,1,0,0,0|2,0,0]=3 1545 B5R0.1 NC(=O)CNCl Amb28315673 [0,0,1,0,0,0|3,0,0]=4 1546 B5R0.1 NC(=O)NCO Amb17674341 [0,0,1,0,0,0|3,0,0]=4 1547 B5R0.1 NC(=O)SCCl Amb26419693 [0,0,1,0,0,0|2,1,0]=4 1548 B5R0.1 NC(=S)CCCl Amb33328368 [0,0,1,0,0,0|2,1,0]=4 1549 B5R0.1 NC(=S)CCF Amb27950563 [0,0,1,0,0,0|2,1,0]=4 1550 B5R0.1 NC(=S)CCO Amb8855295 [0,0,1,0,0,0|2,1,0]=4 1551 B5R0.1 NC(=S)CCS Amb17503271 [0,0,1,0,0,0|2,1,0]=4 1552 B5R0.1 NC(O)CCO Amb28252327 [0,0,1,0,0,0|2,0,1]=4 1553 B5R0.1 NCCB(O)O Amb27859105 [0,0,1,0,0,0|2,0,1]=4 1554 B5R0.1 NCCC(=O)Cl Amb24117140 [0,0,1,0,0,0|2,0,0]=3 1555 B5R0.1 NCCC(=O)O Amb1935127 [0,0,1,0,0,0|1,0,0]=2 1556 B5R0.1 NCCC(=O)[O-] Amb28991330 [0,0,1,0,0,0|1,0,1]=3 1557 B5R0.1 NCCC(N)=O Amb1137251 [0,0,1,0,0,0|2,0,0]=3 1558 B5R0.1 NCCC(N)=O Amb9147573 [0,0,1,0,0,0|2,0,0]=3 1559 B5R0.1 NCCC(N)=S Amb18523221 [0,0,1,0,0,0|2,1,0]=4 1560 B5R0.1 NCCC(N)=S Amb33456385 [0,0,1,0,0,0|2,1,0]=4 1561 B5R0.1 NCCC(O)O Amb27449145 [0,0,1,0,0,0|1,0,2]=4 1562 B5R0.1 NCCS(=O)O Amb6600043 [0,0,1,0,0,0|2,0,0]=3 1563 B5R0.1 NCCS(N)=O Amb33512527 [0,0,1,0,0,0|3,0,0]=4 1564 B5R0.1 NCC[N+](=O)[O-] Amb18203119 [0,0,1,0,0,0|2,0,1]=4 1565 B5R0.1 NCC[PH](=O)O Amb22168066 [0,0,1,0,0,0|2,0,0]=3 1566 B5R0.1 NCC[PH](=O)O Amb35788864 [0,0,1,0,0,0|2,0,0]=3 1567 B5R0.1 NCO[N+](=O)[O-] Amb28049282 [0,0,1,0,0,0|3,0,0]=4 1568 B5R0.1 NNCC(=O)O Amb32751165 [0,0,1,0,0,0|2,0,0]=3 1569 B5R0.1 NNCC(=O)O Amb6740299 [0,0,1,0,0,0|2,0,0]=3 1570 B5R0.1 NNCC(N)=O Amb32990162 [0,0,1,0,0,0|3,0,0]=4 1571 B5R0.1 NOCC(=O)O Amb1154237 [0,0,1,0,0,0|2,0,0]=3 1572 B5R0.1 NOCC(=O)O Amb4324355 [0,0,1,0,0,0|2,0,0]=3 1573 B5R0.1 NOCC(=O)O Amb8513076 [0,0,1,0,0,0|2,0,0]=3 1574 B5R0.1 NOCC(N)=O Amb33528973 [0,0,1,0,0,0|3,0,0]=4 1575 B5R0.1 NS(=O)CCCl Amb24407159 [0,0,1,0,0,0|3,0,0]=4 1576 B5R0.1 NS(=O)CCF Amb32720391 [0,0,1,0,0,0|3,0,0]=4 1577 B5R0.1 NS(=O)CCO Amb32720357 [0,0,1,0,0,0|3,0,0]=4 1578 B5R0.1 N\C=C\C(=O)O Amb27217920 [0,0,1,0,0,0|1,0,2]=4 1579 B5R0.1 O=C(Br)CCBr Amb24624022 [0,0,1,0,0,0|2,0,0]=3 1580 B5R0.1 O=C(Cl)CCBr Amb3941484 [0,0,1,0,0,0|2,0,0]=3 1581 B5R0.1 O=C(Cl)CCCl Amb3939313 [0,0,1,0,0,0|2,0,0]=3 1582 B5R0.1 O=C(Cl)CCF Amb27148631 [0,0,1,0,0,0|2,0,0]=3 1583 B5R0.1 O=C(Cl)CCI Amb28454579 [0,0,1,0,0,0|2,0,0]=3 1584 B5R0.1 O=C(Cl)CCO Amb27270014 [0,0,1,0,0,0|2,0,0]=3 1585 B5R0.1 O=C(Cl)NCCl Amb28315820 [0,0,1,0,0,0|3,0,0]=4 1586 B5R0.1 O=C(Cl)OCCl Amb8389474 [0,0,1,0,0,0|2,0,0]=3 1587 B5R0.1 O=C(F)CCCl Amb27257545 [0,0,1,0,0,0|2,0,0]=3 1588 B5R0.1 O=C(F)OCCl Amb27860169 [0,0,1,0,0,0|2,0,0]=3 1589 B5R0.1 O=C(O)C#CBr Amb17593707 [0,0,1,0,0,0|1,0,2]=4 1590 B5R0.1 O=C(O)C#CCl Amb17593098 [0,0,1,0,0,0|1,0,2]=4 1591 B5R0.1 O=C(O)CCBr Amb2685479 [0,0,1,0,0,0|1,0,0]=2 1592 B5R0.1 O=C(O)CCCl Amb5395408 [0,0,1,0,0,0|1,0,0]=2 1593 B5R0.1 O=C(O)CCF Amb10603694 [0,0,1,0,0,0|1,0,0]=2 1594 B5R0.1 O=C(O)CCI Amb2688882 [0,0,1,0,0,0|1,0,0]=2 1595 B5R0.1 O=C(O)CCO Amb2688785 [0,0,1,0,0,0|1,0,0]=2 1596 B5R0.1 O=C(O)CCS Amb6608916 [0,0,1,0,0,0|1,0,0]=2 1597 B5R0.1 O=C(O)CNO Amb24120360 [0,0,1,0,0,0|2,0,0]=3 1598 B5R0.1 O=C(O)\C=C/Br Amb18644453 [0,0,1,0,0,0|1,0,2]=4 1599 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [0,0,1,0,0,0|1,0,2]=4 1600 B5R0.1 O=C(O)\C=C/I Amb28315824 [0,0,1,0,0,0|1,0,2]=4 1601 B5R0.1 O=C(O)\C=C\Br Amb27423608 [0,0,1,0,0,0|1,0,2]=4 1602 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [0,0,1,0,0,0|1,0,2]=4 1603 B5R0.1 O=C(O)\C=C\I Amb30584673 [0,0,1,0,0,0|1,0,2]=4 1604 B5R0.1 O=C(O)\C=C\O Amb26055842 [0,0,1,0,0,0|1,0,2]=4 1605 B5R0.1 O=C(O)\C=C\S Amb28401590 [0,0,1,0,0,0|1,0,2]=4 1606 B5R0.1 O=C(O)\C=N\O Amb20671938 [0,0,1,0,0,0|2,0,1]=4 1607 B5R0.1 O=C(S)CCCl Amb27461454 [0,0,1,0,0,0|1,1,0]=3 1608 B5R0.1 O=C([O-])CCO Amb22055495 [0,0,1,0,0,0|1,0,1]=3 1609 B5R0.1 O=C([O-])NCCl Amb27777248 [0,0,1,0,0,0|2,0,1]=4 1610 B5R0.1 O=CCC(=O)O Amb22169407 [0,0,1,0,0,0|1,0,1]=3 1611 B5R0.1 O=CCC(=O)[Na] Amb27949540 [0,0,1,0,0,0|2,0,1]=4 1612 B5R0.1 O=S(Cl)CCCl Amb26494051 [0,0,1,0,0,0|3,0,0]=4 1613 B5R0.1 O=S(Cl)CCF Amb32720386 [0,0,1,0,0,0|3,0,0]=4 1614 B5R0.1 O=S(Cl)CCO Amb32720404 [0,0,1,0,0,0|3,0,0]=4 1615 B5R0.1 O=S(O)CCO Amb25937057 [0,0,1,0,0,0|2,0,0]=3 1616 B5R0.1 O=S([O-])CCCl Amb27639192 [0,0,1,0,0,0|2,0,1]=4 1617 B5R0.1 O=S([O-])CCF Amb27213259 [0,0,1,0,0,0|2,0,1]=4 1618 B5R0.1 O=S([O-])CCO Amb32754124 [0,0,1,0,0,0|2,0,1]=4 1619 B5R0.1 O=[N+]([O-])CCBr Amb25965752 [0,0,1,0,0,0|2,0,1]=4 1620 B5R0.1 O=[N+]([O-])CCCl Amb28381478 [0,0,1,0,0,0|2,0,1]=4 1621 B5R0.1 O=[N+]([O-])CCF Amb17674352 [0,0,1,0,0,0|2,0,1]=4 1622 B5R0.1 O=[N+]([O-])CCO Amb3940447 [0,0,1,0,0,0|2,0,1]=4 1623 B5R0.1 O=[N+]([O-])CCS Amb26620894 [0,0,1,0,0,0|2,0,1]=4 1624 B5R0.1 OB(O)CCF Amb27479949 [0,0,1,0,0,0|2,0,1]=4 1625 B5R0.1 OC(Br)CCBr Amb27457468 [0,0,1,0,0,0|2,0,1]=4 1626 B5R0.1 OC(Cl)CCCl Amb28255432 [0,0,1,0,0,0|2,0,1]=4 1627 B5R0.1 OC(O)CCS Amb25746150 [0,0,1,0,0,0|1,0,2]=4 1628 B5R0.1 OCCC(O)Cl Amb26052481 [0,0,1,0,0,0|2,0,1]=4 1629 B5R0.1 OP(O)CCCl Amb27169424 [0,0,1,0,0,0|2,0,1]=4 1630 B5R0.2 BrCCCCBr Amb2686718 [0,0,1,0,0,0|2,0,1]=4 1631 B5R0.2 BrCCCCI Amb25861429 [0,0,1,0,0,0|2,0,1]=4 1632 B5R0.2 BrCCCNBr Amb27424198 [0,0,1,0,0,0|3,0,0]=4 1633 B5R0.2 Br\C=C\CCBr Amb25663040 [0,0,1,0,0,0|2,0,1]=4 1634 B5R0.2 C#CCCC=C Amb18117518 [0,0,1,0,0,0|2,0,1]=4 1635 B5R0.2 C#CCCC=O Amb28049678 [0,0,1,0,0,0|1,0,1]=3 1636 B5R0.2 C#CCCCBr Amb17610060 [0,0,1,0,0,0|2,0,1]=4 1637 B5R0.2 C#CCCCC Amb4135448 [0,0,1,0,0,0|2,0,1]=4 1638 B5R0.2 C#CCCCCl Amb3940276 [0,0,1,0,0,0|2,0,1]=4 1639 B5R0.2 C#CCCCF Amb26904785 [0,0,1,0,0,0|2,0,1]=4 1640 B5R0.2 C#CCCCI Amb25843530 [0,0,1,0,0,0|2,0,1]=4 1641 B5R0.2 C#CCCCN Amb18962495 [0,0,1,0,0,0|2,0,1]=4 1642 B5R0.2 C#CCCCN Amb33532759 [0,0,1,0,0,0|2,0,1]=4 1643 B5R0.2 C#CCCCO Amb1219893 [0,0,1,0,0,0|1,0,1]=3 1644 B5R0.2 C#CCCCS Amb24333394 [0,0,1,0,0,0|1,1,1]=4 1645 B5R0.2 C#CCOCO Amb28453666 [0,0,1,0,0,0|2,0,1]=4 1646 B5R0.2 C#NCCCC Amb31132446 [0,0,1,0,0,0|3,0,0]=4 1647 B5R0.2 C=C=CCC=O Amb27234481 [0,0,1,0,0,0|1,0,2]=4 1648 B5R0.2 C=C=CCCO Amb17593020 [0,0,1,0,0,0|1,0,2]=4 1649 B5R0.2 C=CC#CCC Amb24333935 [0,0,1,0,0,0|2,0,1]=4 1650 B5R0.2 C=CC#CCO Amb17593015 [0,0,1,0,0,0|1,0,2]=4 1651 B5R0.2 C=CCCC#N Amb10605750 [0,0,1,0,0,0|2,0,1]=4 1652 B5R0.2 C=CCCC=C Amb8513514 [0,0,1,0,0,0|2,0,1]=4 1653 B5R0.2 C=CCCC=O Amb4358616 [0,0,1,0,0,0|1,0,1]=3 1654 B5R0.2 C=CCCCBr Amb3940219 [0,0,1,0,0,0|2,0,0]=3 1655 B5R0.2 C=CCCCC Amb3940497 [0,0,1,0,0,0|2,0,0]=3 1656 B5R0.2 C=CCCCCl Amb22229585 [0,0,1,0,0,0|2,0,0]=3 1657 B5R0.2 C=CCCCF Amb25689705 [0,0,1,0,0,0|2,0,0]=3 1658 B5R0.2 C=CCCCI Amb25278794 [0,0,1,0,0,0|2,0,0]=3 1659 B5R0.2 C=CCCCN Amb18299670 [0,0,1,0,0,0|2,0,0]=3 1660 B5R0.2 C=CCCCN Amb22001451 [0,0,1,0,0,0|2,0,0]=3 1661 B5R0.2 C=CCCCO Amb8513439 [0,0,1,0,0,0|1,0,0]=2 1662 B5R0.2 C=CCCC[CH2-] Amb32644015 [0,0,1,0,0,0|2,0,0]=3 1663 B5R0.2 C=CCCNC Amb18993048 [0,0,1,0,0,0|3,0,0]=4 1664 B5R0.2 C=CCCNC Amb33553635 [0,0,1,0,0,0|3,0,0]=4 1665 B5R0.2 C=CCCOC Amb28065418 [0,0,1,0,0,0|3,0,0]=4 1666 B5R0.2 C=CCCON Amb22233632 [0,0,1,0,0,0|3,0,0]=4 1667 B5R0.2 C=CCCON Amb22896384 [0,0,1,0,0,0|3,0,0]=4 1668 B5R0.2 C=CCCSC Amb24431590 [0,0,1,0,0,0|3,0,0]=4 1669 B5R0.2 C=CCNC=O Amb2781857 [0,0,1,0,0,0|1,0,2]=4 1670 B5R0.2 C=CCNCC Amb13951161 [0,0,1,0,0,0|3,0,0]=4 1671 B5R0.2 C=CCNCC Amb6683951 [0,0,1,0,0,0|3,0,0]=4 1672 B5R0.2 C=CCOC=C Amb17933943 [0,0,1,0,0,0|1,0,2]=4 1673 B5R0.2 C=CCOCBr Amb28384107 [0,0,1,0,0,0|3,0,0]=4 1674 B5R0.2 C=CCOCC Amb2684299 [0,0,1,0,0,0|3,0,0]=4 1675 B5R0.2 C=CCOCCl Amb28429831 [0,0,1,0,0,0|3,0,0]=4 1676 B5R0.2 C=CCSCC Amb6366495 [0,0,1,0,0,0|3,0,0]=4 1677 B5R0.2 C=CCSCCl Amb25859631 [0,0,1,0,0,0|3,0,0]=4 1678 B5R0.2 C=CNCCC Amb27461242 [0,0,1,0,0,0|2,0,0]=3 1679 B5R0.2 C=COCCC Amb17940706 [0,0,1,0,0,0|1,0,0]=2 1680 B5R0.2 C=COCCI Amb28245341 [0,0,1,0,0,0|2,0,0]=3 1681 B5R0.2 C=COCCN Amb17593030 [0,0,1,0,0,0|2,0,0]=3 1682 B5R0.2 C=COCCN Amb32409664 [0,0,1,0,0,0|2,0,0]=3 1683 B5R0.2 C=COCCO Amb17674184 [0,0,1,0,0,0|2,0,0]=3 1684 B5R0.2 C=COCOC Amb28131655 [0,0,1,0,0,0|2,0,0]=3 1685 B5R0.2 C=CSCCCl Amb27390785 [0,0,1,0,0,0|2,1,0]=4 1686 B5R0.2 C=CSCCO Amb27607172 [0,0,1,0,0,0|2,0,0]=3 1687 B5R0.2 C=C\C=C\CC Amb8513434 [0,0,1,0,0,0|2,0,1]=4 1688 B5R0.2 C=NCCCCl Amb28346586 [0,0,1,0,0,0|3,0,0]=4 1689 B5R0.2 CC#CCC=O Amb27850282 [0,0,1,0,0,0|1,0,2]=4 1690 B5R0.2 CC#CCCC Amb8515369 [0,0,1,0,0,0|2,0,1]=4 1691 B5R0.2 CC#CCCO Amb2721725 [0,0,1,0,0,0|1,0,2]=4 1692 B5R0.2 CCC#CC=O Amb25663194 [0,0,1,0,0,0|1,0,1]=3 1693 B5R0.2 CCC=C=CBr Amb27194333 [0,0,1,0,0,0|2,0,1]=4 1694 B5R0.2 CCCC#CBr Amb24648680 [0,0,1,0,0,0|2,0,1]=4 1695 B5R0.2 CCCC#CI Amb22733682 [0,0,1,0,0,0|2,0,1]=4 1696 B5R0.2 CCCCC#N Amb6662839 [0,0,1,0,0,0|2,0,1]=4 1697 B5R0.2 CCCCC=O Amb3939655 [0,0,1,0,0,0|1,0,0]=2 1698 B5R0.2 CCCCCBr Amb3940084 [0,0,1,0,0,0|2,0,1]=4 1699 B5R0.2 CCCCCC Amb2447471 [0,0,1,0,0,0|2,0,1]=4 1700 B5R0.2 CCCCCCl Amb8514576 [0,0,1,0,0,0|2,0,1]=4 1701 B5R0.2 CCCCCF Amb10838686 [0,0,1,0,0,0|2,0,1]=4 1702 B5R0.2 CCCCCI Amb6891946 [0,0,1,0,0,0|2,0,1]=4 1703 B5R0.2 CCCCCN Amb3939830 [0,0,1,0,0,0|2,0,1]=4 1704 B5R0.2 CCCCCO Amb3939051 [0,0,1,0,0,0|1,0,1]=3 1705 B5R0.2 CCCCCS Amb8513287 [0,0,1,0,0,0|1,1,1]=4 1706 B5R0.2 CCCCC[SiH3] Amb19893989 [0,0,1,0,0,0|2,0,1]=4 1707 B5R0.2 CCCCNC Amb3939351 [0,0,1,0,0,0|3,0,0]=4 1708 B5R0.2 CCCCNN Amb1105203 [0,0,1,0,0,0|3,0,0]=4 1709 B5R0.2 CCCCNN Amb22230363 [0,0,1,0,0,0|3,0,0]=4 1710 B5R0.2 CCCCNN Amb33055062 [0,0,1,0,0,0|3,0,0]=4 1711 B5R0.2 CCCCNO Amb24686451 [0,0,1,0,0,0|2,0,1]=4 1712 B5R0.2 CCCCNO Amb32687485 [0,0,1,0,0,0|2,0,1]=4 1713 B5R0.2 CCCCON Amb17101066 [0,0,1,0,0,0|3,0,0]=4 1714 B5R0.2 CCCCON Amb6308542 [0,0,1,0,0,0|3,0,0]=4 1715 B5R0.2 CCCCSC Amb4036342 [0,0,1,0,0,0|3,0,0]=4 1716 B5R0.2 CCCN=C=O Amb3939331 [0,0,1,0,0,0|1,0,1]=3 1717 B5R0.2 CCCN=C=S Amb6572523 [0,0,1,0,0,0|1,1,1]=4 1718 B5R0.2 CCCN=[N+]=[N-] Amb25811439 [0,0,1,0,0,0|3,0,0]=4 1719 B5R0.2 CCCNC=S Amb27754027 [0,0,1,0,0,0|1,1,0]=3 1720 B5R0.2 CCCNCC Amb3939843 [0,0,1,0,0,0|2,0,1]=4 1721 B5R0.2 CCCNNC Amb25283190 [0,0,1,0,0,0|3,0,0]=4 1722 B5R0.2 CCCOCBr Amb25351883 [0,0,1,0,0,0|1,0,1]=3 1723 B5R0.2 CCCOCC Amb17673668 [0,0,1,0,0,0|1,0,1]=3 1724 B5R0.2 CCCOCCl Amb22002403 [0,0,1,0,0,0|1,0,1]=3 1725 B5R0.2 CCCSCC Amb22168047 [0,0,1,0,0,0|1,1,1]=4 1726 B5R0.2 CCCSCCl Amb28146719 [0,0,1,0,0,0|1,1,1]=4 1727 B5R0.2 CCC\C=C\Br Amb17673688 [0,0,1,0,0,0|2,0,0]=3 1728 B5R0.2 CCC\C=C\Cl Amb25026521 [0,0,1,0,0,0|2,0,0]=3 1729 B5R0.2 CCC\C=C\N Amb27217273 [0,0,1,0,0,0|2,0,0]=3 1730 B5R0.2 CCC\C=N\O Amb27213413 [0,0,1,0,0,0|2,0,1]=4 1731 B5R0.2 CCNCCO Amb19372818 [0,0,1,0,0,0|2,0,1]=4 1732 B5R0.2 CCNCCO Amb3940070 [0,0,1,0,0,0|2,0,1]=4 1733 B5R0.2 CCNOCC Amb26852166 [0,0,1,0,0,0|2,0,1]=4 1734 B5R0.2 CCNOCC Amb32655926 [0,0,1,0,0,0|2,0,1]=4 1735 B5R0.2 CCOCCBr Amb1158671 [0,0,1,0,0,0|2,0,1]=4 1736 B5R0.2 CCOCCCl Amb8390350 [0,0,1,0,0,0|2,0,1]=4 1737 B5R0.2 CCOCCI Amb25117446 [0,0,1,0,0,0|2,0,1]=4 1738 B5R0.2 CCOCCN Amb1130918 [0,0,1,0,0,0|2,0,1]=4 1739 B5R0.2 CCOCCN Amb29844456 [0,0,1,0,0,0|2,0,1]=4 1740 B5R0.2 CCOCCO Amb3939142 [0,0,1,0,0,0|2,0,1]=4 1741 B5R0.2 CCOCCS Amb9316644 [0,0,1,0,0,0|2,0,1]=4 1742 B5R0.2 CCO\C=C/Br Amb2455970 [0,0,1,0,0,0|3,0,0]=4 1743 B5R0.2 CCO\C=C/Cl Amb28315611 [0,0,1,0,0,0|3,0,0]=4 1744 B5R0.2 CCO\C=C\Br Amb10068669 [0,0,1,0,0,0|3,0,0]=4 1745 B5R0.2 CCSCC=O Amb17940620 [0,0,1,0,0,0|2,0,0]=3 1746 B5R0.2 CCSCCO Amb1085958 [0,0,1,0,0,0|2,0,1]=4 1747 B5R0.2 CCS\C=C/Cl Amb28244706 [0,0,1,0,0,0|3,0,0]=4 1748 B5R0.2 CC\C=C\C=O Amb33986391 [0,0,1,0,0,0|1,0,1]=3 1749 B5R0.2 CNCCCBr Amb28291325 [0,0,1,0,0,0|3,0,0]=4 1750 B5R0.2 CNCCCBr Amb33473632 [0,0,1,0,0,0|3,0,0]=4 1751 B5R0.2 CNCCCCl Amb22002154 [0,0,1,0,0,0|3,0,0]=4 1752 B5R0.2 CNCCCCl Amb3941419 [0,0,1,0,0,0|3,0,0]=4 1753 B5R0.2 CNCCCF Amb27405698 [0,0,1,0,0,0|3,0,0]=4 1754 B5R0.2 CNCCCN Amb2698065 [0,0,1,0,0,0|3,0,0]=4 1755 B5R0.2 CNCCCO Amb9246656 [0,0,1,0,0,0|2,0,0]=3 1756 B5R0.2 CNCCNO Amb27976196 [0,0,1,0,0,0|3,0,0]=4 1757 B5R0.2 CNC\C=C/I Amb23539307 [0,0,1,0,0,0|3,0,0]=4 1758 B5R0.2 CNOCCN Amb22411501 [0,0,1,0,0,0|3,0,0]=4 1759 B5R0.2 CNOCCN Amb22490915 [0,0,1,0,0,0|3,0,0]=4 1760 B5R0.2 CNOCCO Amb27637954 [0,0,1,0,0,0|3,0,0]=4 1761 B5R0.2 CN\C=C\C=O Amb24564349 [0,0,1,0,0,0|2,0,1]=4 1762 B5R0.2 COCCC=O Amb10602324 [0,0,1,0,0,0|2,0,0]=3 1763 B5R0.2 COCCCBr Amb8828205 [0,0,1,0,0,0|3,0,0]=4 1764 B5R0.2 COCCCCl Amb6255994 [0,0,1,0,0,0|3,0,0]=4 1765 B5R0.2 COCCCF Amb22007998 [0,0,1,0,0,0|3,0,0]=4 1766 B5R0.2 COCCCI Amb33546474 [0,0,1,0,0,0|3,0,0]=4 1767 B5R0.2 COCCCN Amb3939346 [0,0,1,0,0,0|3,0,0]=4 1768 B5R0.2 COCCCO Amb8385593 [0,0,1,0,0,0|2,0,0]=3 1769 B5R0.2 COCCCS Amb13952794 [0,0,1,0,0,0|2,1,0]=4 1770 B5R0.2 COCCNO Amb25284480 [0,0,1,0,0,0|3,0,0]=4 1771 B5R0.2 COCN=C=O Amb6265212 [0,0,1,0,0,0|2,0,1]=4 1772 B5R0.2 COCNC=O Amb28049834 [0,0,1,0,0,0|2,0,0]=3 1773 B5R0.2 CONCCO Amb27658816 [0,0,1,0,0,0|3,0,0]=4 1774 B5R0.2 CO\C=C/C=O Amb28049941 [0,0,1,0,0,0|2,0,1]=4 1775 B5R0.2 CO\C=C\C=O Amb26873964 [0,0,1,0,0,0|2,0,1]=4 1776 B5R0.2 CSCCC=O Amb3939952 [0,0,1,0,0,0|2,0,0]=3 1777 B5R0.2 CSCCCBr Amb18180189 [0,0,1,0,0,0|3,0,0]=4 1778 B5R0.2 CSCCCCl Amb10602296 [0,0,1,0,0,0|3,0,0]=4 1779 B5R0.2 CSCCCN Amb33801570 [0,0,1,0,0,0|3,0,0]=4 1780 B5R0.2 CSCCCN Amb6718923 [0,0,1,0,0,0|3,0,0]=4 1781 B5R0.2 CSCCCO Amb3939523 [0,0,1,0,0,0|2,0,0]=3 1782 B5R0.2 CSCCCS Amb25744031 [0,0,1,0,0,0|2,1,0]=4 1783 B5R0.2 CSCCNO Amb33272071 [0,0,1,0,0,0|3,0,0]=4 1784 B5R0.2 C[SiH2]CCCN Amb28049027 [0,0,1,0,0,0|2,1,0]=4 1785 B5R0.2 C\C=C/CCC Amb6366719 [0,0,1,0,0,0|2,0,0]=3 1786 B5R0.2 C\C=C/CCO Amb19930204 [0,0,1,0,0,0|1,0,1]=3 1787 B5R0.2 C\C=C\CC=O Amb26655030 [0,0,1,0,0,0|1,0,2]=4 1788 B5R0.2 C\C=C\CCBr Amb32667161 [0,0,1,0,0,0|2,0,1]=4 1789 B5R0.2 C\C=C\CCCl Amb26978891 [0,0,1,0,0,0|2,0,1]=4 1790 B5R0.2 C\C=C\CCN Amb19374038 [0,0,1,0,0,0|2,0,1]=4 1791 B5R0.2 C\C=C\CCN Amb33038294 [0,0,1,0,0,0|2,0,1]=4 1792 B5R0.2 C\C=C\CCO Amb24655557 [0,0,1,0,0,0|1,0,1]=3 1793 B5R0.2 C\C=C\CNC Amb28049814 [0,0,1,0,0,0|3,0,0]=4 1794 B5R0.2 C\C=C\OCC Amb8516635 [0,0,1,0,0,0|3,0,0]=4 1795 B5R0.2 C\C=N\CCC Amb27954749 [0,0,1,0,0,0|2,0,0]=3 1796 B5R0.2 C\C=N\CCN Amb27837883 [0,0,1,0,0,0|3,0,0]=4 1797 B5R0.2 ClCCCCBr Amb8391065 [0,0,1,0,0,0|2,0,1]=4 1798 B5R0.2 ClCCCCCl Amb6608890 [0,0,1,0,0,0|2,0,1]=4 1799 B5R0.2 ClCCCCI Amb8517518 [0,0,1,0,0,0|2,0,1]=4 1800 B5R0.2 ClCCCNCl Amb27165116 [0,0,1,0,0,0|3,0,0]=4 1801 B5R0.2 ClCCC[SiH2]Cl Amb27629993 [0,0,1,0,0,0|2,1,0]=4 1802 B5R0.2 ClCCOCCl Amb22000864 [0,0,1,0,0,0|2,0,1]=4 1803 B5R0.2 ClCOCCBr Amb2696015 [0,0,1,0,0,0|2,0,1]=4 1804 B5R0.2 Cl\C=C\CCCl Amb25929864 [0,0,1,0,0,0|2,0,1]=4 1805 B5R0.2 Cl\C=C\CCI Amb27647471 [0,0,1,0,0,0|2,0,1]=4 1806 B5R0.2 FCCCCBr Amb2685210 [0,0,1,0,0,0|2,0,1]=4 1807 B5R0.2 FCCCCCl Amb27655616 [0,0,1,0,0,0|2,0,1]=4 1808 B5R0.2 FCCCCF Amb10839858 [0,0,1,0,0,0|2,0,1]=4 1809 B5R0.2 FCCCCI Amb28283837 [0,0,1,0,0,0|2,0,1]=4 1810 B5R0.2 FCCCCS Amb25065453 [0,0,1,0,0,0|1,1,1]=4 1811 B5R0.2 ICCCCI Amb17672573 [0,0,1,0,0,0|2,0,1]=4 1812 B5R0.2 N#CCCC=O Amb3941009 [0,0,1,0,0,0|1,0,1]=3 1813 B5R0.2 N#CCCCBr Amb3940093 [0,0,1,0,0,0|2,0,1]=4 1814 B5R0.2 N#CCCCCl Amb3940298 [0,0,1,0,0,0|2,0,1]=4 1815 B5R0.2 N#CCCCF Amb25146362 [0,0,1,0,0,0|2,0,1]=4 1816 B5R0.2 N#CCCCI Amb8517592 [0,0,1,0,0,0|2,0,1]=4 1817 B5R0.2 N#CCCCN Amb28555321 [0,0,1,0,0,0|2,0,1]=4 1818 B5R0.2 N#CCCCN Amb6271100 [0,0,1,0,0,0|2,0,1]=4 1819 B5R0.2 N#CCCCO Amb4021727 [0,0,1,0,0,0|1,0,1]=3 1820 B5R0.2 N#CCCCS Amb17504257 [0,0,1,0,0,0|1,1,1]=4 1821 B5R0.2 N#CCCNO Amb22748730 [0,0,1,0,0,0|2,0,1]=4 1822 B5R0.2 N#CCNCO Amb27215184 [0,0,1,0,0,0|2,0,1]=4 1823 B5R0.2 N#CCOC=O Amb22347946 [0,0,1,0,0,0|1,0,1]=3 1824 B5R0.2 N#COCCO Amb27790421 [0,0,1,0,0,0|2,0,1]=4 1825 B5R0.2 NCCCC=O Amb26851044 [0,0,1,0,0,0|1,0,0]=2 1826 B5R0.2 NCCCCBr Amb21858985 [0,0,1,0,0,0|2,0,1]=4 1827 B5R0.2 NCCCCCl Amb18640687 [0,0,1,0,0,0|2,0,1]=4 1828 B5R0.2 NCCCCCl Amb22233734 [0,0,1,0,0,0|2,0,1]=4 1829 B5R0.2 NCCCCF Amb26017241 [0,0,1,0,0,0|2,0,1]=4 1830 B5R0.2 NCCCCF Amb28555328 [0,0,1,0,0,0|2,0,1]=4 1831 B5R0.2 NCCCCI Amb27837961 [0,0,1,0,0,0|2,0,1]=4 1832 B5R0.2 NCCCCN Amb22489528 [0,0,1,0,0,0|2,0,1]=4 1833 B5R0.2 NCCCCN Amb6608640 [0,0,1,0,0,0|2,0,1]=4 1834 B5R0.2 NCCCCN Amb8514498 [0,0,1,0,0,0|2,0,1]=4 1835 B5R0.2 NCCCCO Amb3939336 [0,0,1,0,0,0|1,0,1]=3 1836 B5R0.2 NCCCCS Amb17500976 [0,0,1,0,0,0|1,1,1]=4 1837 B5R0.2 NCCCCS Amb22546260 [0,0,1,0,0,0|1,1,1]=4 1838 B5R0.2 NCCCN=O Amb28049442 [0,0,1,0,0,0|2,0,0]=3 1839 B5R0.2 NCCCNN Amb27392601 [0,0,1,0,0,0|3,0,0]=4 1840 B5R0.2 NCCCNO Amb27882495 [0,0,1,0,0,0|2,0,1]=4 1841 B5R0.2 NCCCNO Amb32729324 [0,0,1,0,0,0|2,0,1]=4 1842 B5R0.2 NCCOC=O Amb24612320 [0,0,1,0,0,0|1,0,0]=2 1843 B5R0.2 NCCOCF Amb33378706 [0,0,1,0,0,0|2,0,1]=4 1844 B5R0.2 NCCSN=O Amb27950442 [0,0,1,0,0,0|2,1,0]=4 1845 B5R0.2 NCC\C=C\Cl Amb27391191 [0,0,1,0,0,0|2,0,1]=4 1846 B5R0.2 NNCCCF Amb25696672 [0,0,1,0,0,0|3,0,0]=4 1847 B5R0.2 NNCCCO Amb19514839 [0,0,1,0,0,0|2,0,0]=3 1848 B5R0.2 NNCCCO Amb22058994 [0,0,1,0,0,0|2,0,0]=3 1849 B5R0.2 NOCCCF Amb24632017 [0,0,1,0,0,0|3,0,0]=4 1850 B5R0.2 NOCCCO Amb18061671 [0,0,1,0,0,0|2,0,0]=3 1851 B5R0.2 NOCCCS Amb17608230 [0,0,1,0,0,0|2,1,0]=4 1852 B5R0.2 NOCCCS Amb27489799 [0,0,1,0,0,0|2,1,0]=4 1853 B5R0.2 N\C=N\OC=O Amb28118665 [0,0,1,0,0,0|2,0,1]=4 1854 B5R0.2 O=BOCCBr Amb27954923 [0,0,1,0,0,0|2,0,0]=3 1855 B5R0.2 O=C=NCCBr Amb17194090 [0,0,1,0,0,0|2,0,1]=4 1856 B5R0.2 O=C=NCCCl Amb535458 [0,0,1,0,0,0|2,0,1]=4 1857 B5R0.2 O=C=NCCF Amb24710430 [0,0,1,0,0,0|2,0,1]=4 1858 B5R0.2 O=C=NCCO Amb27659445 [0,0,1,0,0,0|1,0,1]=3 1859 B5R0.2 O=CCCC=O Amb8395090 [0,0,1,0,0,0|0,0,2]=3 1860 B5R0.2 O=CCCCBr Amb18644189 [0,0,1,0,0,0|1,0,0]=2 1861 B5R0.2 O=CCCCCl Amb8395190 [0,0,1,0,0,0|1,0,0]=2 1862 B5R0.2 O=CCCCF Amb24056028 [0,0,1,0,0,0|1,0,0]=2 1863 B5R0.2 O=CCCCI Amb27249641 [0,0,1,0,0,0|1,0,0]=2 1864 B5R0.2 O=CCCCO Amb24589235 [0,0,1,0,0,0|0,0,0]=1 1865 B5R0.2 O=CCCSS Amb22524519 [0,0,1,0,0,0|1,1,0]=3 1866 B5R0.2 O=CCNC=O Amb26370295 [0,0,1,0,0,0|1,0,2]=4 1867 B5R0.2 O=CC\C=C\Cl Amb24571938 [0,0,1,0,0,0|1,0,2]=4 1868 B5R0.2 O=CNCCF Amb28205988 [0,0,1,0,0,0|2,0,0]=3 1869 B5R0.2 O=COCCBr Amb27816149 [0,0,1,0,0,0|1,0,0]=2 1870 B5R0.2 O=COCCO Amb26625741 [0,0,1,0,0,0|1,0,0]=2 1871 B5R0.2 O=C\C=C\CCl Amb18122401 [0,0,1,0,0,0|1,0,2]=4 1872 B5R0.2 O=C\C=C\CF Amb33475269 [0,0,1,0,0,0|1,0,2]=4 1873 B5R0.2 O=C\C=C\CO Amb24356008 [0,0,1,0,0,0|0,0,2]=3 1874 B5R0.2 O=NOCCCl Amb27205298 [0,0,1,0,0,0|2,0,0]=3 1875 B5R0.2 O=NOCCI Amb28188003 [0,0,1,0,0,0|2,0,0]=3 1876 B5R0.2 O=NOCCO Amb22363071 [0,0,1,0,0,0|2,0,0]=3 1877 B5R0.2 O=S=NCCCl Amb27634384 [0,0,1,0,0,0|3,0,0]=4 1878 B5R0.2 OCC=C=CCl Amb28137866 [0,0,1,0,0,0|1,0,2]=4 1879 B5R0.2 OCCC#CBr Amb25887923 [0,0,1,0,0,0|1,0,2]=4 1880 B5R0.2 OCCC#CI Amb2229180 [0,0,1,0,0,0|1,0,2]=4 1881 B5R0.2 OCCC#C[SiH3] Amb27466285 [0,0,1,0,0,0|1,0,2]=4 1882 B5R0.2 OCCCCBr Amb8395353 [0,0,1,0,0,0|1,0,1]=3 1883 B5R0.2 OCCCCCl Amb1101976 [0,0,1,0,0,0|1,0,1]=3 1884 B5R0.2 OCCCCF Amb17593046 [0,0,1,0,0,0|1,0,1]=3 1885 B5R0.2 OCCCCO Amb2793029 [0,0,1,0,0,0|0,0,2]=3 1886 B5R0.2 OCCNCO Amb22228429 [0,0,1,0,0,0|1,0,2]=4 1887 B5R0.2 OCCOCCl Amb24673634 [0,0,1,0,0,0|2,0,1]=4 1888 B5R0.2 OCC\C=C\Br Amb27425005 [0,0,1,0,0,0|1,0,1]=3 1889 B5R0.2 OCC\C=C\Cl Amb27859286 [0,0,1,0,0,0|1,0,1]=3 1890 B5R0.2 OCC\N=N\O Amb25747385 [0,0,1,0,0,0|2,0,1]=4 1891 B5R0.2 ONCCCF Amb25931859 [0,0,1,0,0,0|2,0,1]=4 1892 B5R0.2 O\C=N\CCCl Amb24684796 [0,0,1,0,0,0|2,0,1]=4 1893 B5R0.2 SCCCCS Amb8513069 [0,0,1,0,0,0|0,2,1]=4 1894 B5R0.2 [C-]#[N+]CCCC Amb2235001 [0,0,1,0,0,0|3,0,0]=4 1895 B5R0.2 [C-]#[N+]CCCF Amb26423847 [0,0,1,0,0,0|3,0,0]=4 1896 B5R0.2 [N-]=[N+]=NCC=O Amb26953499 [0,0,1,0,0,0|3,0,0]=4 1897 B5R0.2 [N-]=[N+]=NCCO Amb19514563 [0,0,1,0,0,0|3,0,0]=4 1898 B5R0.3 C#CC(=C)OC Amb17939756 [0,0,1,0,0,0|1,0,2]=4 1899 B5R0.3 C#CC(=O)CBr Amb28144836 [0,0,1,0,0,0|2,0,1]=4 1900 B5R0.3 C#CC(=O)CC Amb25989183 [0,0,1,0,0,0|1,0,1]=3 1901 B5R0.3 C#CC(=O)CN Amb27424437 [0,0,1,0,0,0|2,0,1]=4 1902 B5R0.3 C#CC(=O)NC Amb25147319 [0,0,1,0,0,0|1,0,2]=4 1903 B5R0.3 C#CC(=O)OC Amb2725608 [0,0,1,0,0,0|0,0,2]=3 1904 B5R0.3 C=C(C#N)CC Amb33038421 [0,0,1,0,0,0|3,0,0]=4 1905 B5R0.3 C=C(C=O)CC Amb17940102 [0,0,1,0,0,0|3,0,0]=4 1906 B5R0.3 C=C(C=O)OC Amb27863725 [0,0,1,0,0,0|2,0,1]=4 1907 B5R0.3 C=C(CBr)OC Amb25177183 [0,0,1,0,0,0|2,0,0]=3 1908 B5R0.3 C=C(CC)CBr Amb22059701 [0,0,1,0,0,0|3,0,0]=4 1909 B5R0.3 C=C(CC)CC Amb17940707 [0,0,1,0,0,0|2,0,0]=3 1910 B5R0.3 C=C(CC)CCl Amb26959470 [0,0,1,0,0,0|3,0,0]=4 1911 B5R0.3 C=C(CC)CN Amb27195088 [0,0,1,0,0,0|3,0,0]=4 1912 B5R0.3 C=C(CC)CN Amb28555329 [0,0,1,0,0,0|3,0,0]=4 1913 B5R0.3 C=C(CC)CO Amb33549724 [0,0,1,0,0,0|3,0,0]=4 1914 B5R0.3 C=C(CCl)SC Amb27810808 [0,0,1,0,0,0|2,1,0]=4 1915 B5R0.3 C=C(SC)SC Amb22731907 [0,0,1,0,0,0|2,1,0]=4 1916 B5R0.3 C=CC(=C)CC Amb28141349 [0,0,1,0,0,0|2,0,1]=4 1917 B5R0.3 C=CC(=C)OC Amb28145100 [0,0,1,0,0,0|1,0,2]=4 1918 B5R0.3 C=CC(=O)CBr Amb10602446 [0,0,1,0,0,0|2,0,1]=4 1919 B5R0.3 C=CC(=O)CC Amb3940490 [0,0,1,0,0,0|1,0,1]=3 1920 B5R0.3 C=CC(=O)CCl Amb27211112 [0,0,1,0,0,0|2,0,1]=4 1921 B5R0.3 C=CC(=O)CO Amb28074769 [0,0,1,0,0,0|2,0,1]=4 1922 B5R0.3 C=CC(=O)NC Amb9480402 [0,0,1,0,0,0|1,0,2]=4 1923 B5R0.3 C=CC(=O)OC Amb22351400 [0,0,1,0,0,0|0,0,2]=3 1924 B5R0.3 C=CC(=O)OC Amb2793072 [0,0,1,0,0,0|0,0,2]=3 1925 B5R0.3 C=CC(=O)O[Na] Amb22336198 [0,0,1,0,0,0|1,0,2]=4 1926 B5R0.3 CCC(=N)C#N Amb28313691 [0,0,1,0,0,0|3,0,0]=4 1927 B5R0.3 CCC(=N)NO Amb19515903 [0,0,1,0,0,0|3,0,0]=4 1928 B5R0.3 CCC(=O)C#N Amb17231799 [0,0,1,0,0,0|2,0,0]=3 1929 B5R0.3 CCC(=O)C=O Amb22228532 [0,0,1,0,0,0|2,0,0]=3 1930 B5R0.3 CCC(=O)CBr Amb2684976 [0,0,1,0,0,0|2,0,0]=3 1931 B5R0.3 CCC(=O)CC Amb4605995 [0,0,1,0,0,0|1,0,0]=2 1932 B5R0.3 CCC(=O)CCl Amb19338105 [0,0,1,0,0,0|2,0,0]=3 1933 B5R0.3 CCC(=O)CF Amb23454809 [0,0,1,0,0,0|2,0,0]=3 1934 B5R0.3 CCC(=O)CN Amb18203134 [0,0,1,0,0,0|2,0,0]=3 1935 B5R0.3 CCC(=O)CN Amb19959206 [0,0,1,0,0,0|2,0,0]=3 1936 B5R0.3 CCC(=O)CO Amb22227965 [0,0,1,0,0,0|2,0,0]=3 1937 B5R0.3 CCC(=O)CO Amb33529428 [0,0,1,0,0,0|2,0,0]=3 1938 B5R0.3 CCC(=O)CS Amb27843254 [0,0,1,0,0,0|2,0,0]=3 1939 B5R0.3 CCC(=O)NN Amb1104708 [0,0,1,0,0,0|2,0,0]=3 1940 B5R0.3 CCC(=O)NO Amb6273963 [0,0,1,0,0,0|2,0,0]=3 1941 B5R0.3 CCC(=O)OC Amb8513418 [0,0,1,0,0,0|0,0,0]=1 1942 B5R0.3 CCC(=S)NN Amb26505324 [0,0,1,0,0,0|2,1,0]=4 1943 B5R0.3 CCC(=S)OC Amb22168046 [0,0,1,0,0,0|0,1,0]=2 1944 B5R0.3 CCC(=[OH-])CC Amb27749891 [0,0,1,0,0,0|1,0,1]=3 1945 B5R0.3 CCC(Br)CC Amb3940200 [0,0,1,0,0,0|2,0,1]=4 1946 B5R0.3 CCC(C)NC Amb10609216 [0,0,1,0,0,0|2,0,1]=4 1947 B5R0.3 CCC(C)NC Amb9713591 [0,0,1,0,0,0|2,0,1]=4 1948 B5R0.3 CCC(C)OC Amb10069005 [0,0,1,0,0,0|1,0,1]=3 1949 B5R0.3 CCC(C)ON Amb26449467 [0,0,1,0,0,0|2,0,1]=4 1950 B5R0.3 CCC(C)ON Amb32712096 [0,0,1,0,0,0|2,0,1]=4 1951 B5R0.3 CCC(C)SC Amb22043308 [0,0,1,0,0,0|1,1,1]=4 1952 B5R0.3 CCC(Cl)OC Amb28121174 [0,0,1,0,0,0|1,0,1]=3 1953 B5R0.3 CCC(Cl)SC Amb27650678 [0,0,1,0,0,0|1,1,1]=4 1954 B5R0.3 CCC(F)CC Amb24372682 [0,0,1,0,0,0|2,0,1]=4 1955 B5R0.3 CCC(I)CC Amb17673918 [0,0,1,0,0,0|2,0,1]=4 1956 B5R0.3 CCC(N)CC Amb3939864 [0,0,1,0,0,0|2,0,1]=4 1957 B5R0.3 CCC(O)CC Amb4605838 [0,0,1,0,0,0|1,0,2]=4 1958 B5R0.3 CCC(O)NC Amb28315667 [0,0,1,0,0,0|1,0,2]=4 1959 B5R0.3 CCC(S)CC Amb7784704 [0,0,1,0,0,0|1,1,1]=4 1960 B5R0.3 CCN(C)CC Amb8513122 [0,0,1,0,0,0|3,0,0]=4 1961 B5R0.3 CCN(C)OC Amb28386271 [0,0,1,0,0,0|2,0,0]=3 1962 B5R0.3 CCN(N)CC Amb836813 [0,0,1,0,0,0|3,0,0]=4 1963 B5R0.3 CCN(O)CC Amb8395098 [0,0,1,0,0,0|2,0,1]=4 1964 B5R0.3 CCP(Cl)CC Amb8516137 [0,0,1,0,0,0|3,0,0]=4 1965 B5R0.3 CC[AlH3](Cl)CC Amb8514172 [0,0,1,0,0,0|3,0,0]=4 1966 B5R0.3 CC[AlH3](Cl)CC Amb8517213 [0,0,1,0,0,0|3,0,0]=4 1967 B5R0.3 CC[C@@H](C)NC Amb27253380 [0,0,1,0,0,0|2,0,1]=4 1968 B5R0.3 CC[C@H](C)NC Amb28049633 [0,0,1,0,0,0|2,0,1]=4 1969 B5R0.3 CC[PH](=O)CC Amb28049809 [0,0,1,0,0,0|2,0,0]=3 1970 B5R0.3 CC[S+](C)CC Amb27954547 [0,0,1,0,0,0|3,0,0]=4 1971 B5R0.3 CC[SiH](Cl)CC Amb22730140 [0,0,1,0,0,0|2,1,0]=4 1972 B5R0.3 CC\C(C)=C\Cl Amb27848092 [0,0,1,0,0,0|3,0,0]=4 1973 B5R0.3 CC\C(C)=N\O Amb8516521 [0,0,1,0,0,0|3,0,0]=4 1974 B5R0.3 CC\C(N)=N/O Amb10609125 [0,0,1,0,0,0|3,0,0]=4 1975 B5R0.3 CC\C(N)=N\N Amb17934241 [0,0,1,0,0,0|3,0,0]=4 1976 B5R0.3 CC\C(N)=N\N Amb4296910 [0,0,1,0,0,0|3,0,0]=4 1977 B5R0.3 CC\C(N)=N\O Amb1125701 [0,0,1,0,0,0|3,0,0]=4 1978 B5R0.3 CC\C(N)=N\O Amb19883708 [0,0,1,0,0,0|3,0,0]=4 1979 B5R0.3 CNC(=N)CO Amb23514994 [0,0,1,0,0,0|3,0,0]=4 1980 B5R0.3 CNC(=N)NC Amb22731268 [0,0,1,0,0,0|3,0,0]=4 1981 B5R0.3 CNC(=N)SC Amb19374860 [0,0,1,0,0,0|2,1,0]=4 1982 B5R0.3 CNC(=O)C#N Amb28423537 [0,0,1,0,0,0|2,0,1]=4 1983 B5R0.3 CNC(=O)CBr Amb33541701 [0,0,1,0,0,0|2,0,0]=3 1984 B5R0.3 CNC(=O)CCl Amb6365480 [0,0,1,0,0,0|2,0,0]=3 1985 B5R0.3 CNC(=O)CI Amb23512488 [0,0,1,0,0,0|2,0,0]=3 1986 B5R0.3 CNC(=O)CN Amb2371053 [0,0,1,0,0,0|2,0,0]=3 1987 B5R0.3 CNC(=O)CN Amb436613 [0,0,1,0,0,0|2,0,0]=3 1988 B5R0.3 CNC(=O)CO Amb3375431 [0,0,1,0,0,0|2,0,0]=3 1989 B5R0.3 CNC(=O)CS Amb22348209 [0,0,1,0,0,0|2,0,0]=3 1990 B5R0.3 CNC(=O)NC Amb4037273 [0,0,1,0,0,0|2,0,0]=3 1991 B5R0.3 CNC(=O)NN Amb8854034 [0,0,1,0,0,0|3,0,0]=4 1992 B5R0.3 CNC(=O)NO Amb25185417 [0,0,1,0,0,0|3,0,0]=4 1993 B5R0.3 CNC(=O)OC Amb16185431 [0,0,1,0,0,0|1,0,0]=2 1994 B5R0.3 CNC(=S)CCl Amb28411477 [0,0,1,0,0,0|2,1,0]=4 1995 B5R0.3 CNC(=S)CN Amb26326922 [0,0,1,0,0,0|2,1,0]=4 1996 B5R0.3 CNC(=S)NC Amb6891929 [0,0,1,0,0,0|2,1,0]=4 1997 B5R0.3 COB(F)OC Amb26589274 [0,0,1,0,0,0|3,0,0]=4 1998 B5R0.3 COC(=N)CBr Amb27206918 [0,0,1,0,0,0|2,0,0]=3 1999 B5R0.3 COC(=N)CCl Amb26458698 [0,0,1,0,0,0|2,0,0]=3 2000 B5R0.3 COC(=N)CCl Amb28991311 [0,0,1,0,0,0|2,0,0]=3 2001 B5R0.3 COC(=N)OC Amb25026539 [0,0,1,0,0,0|2,0,0]=3 2002 B5R0.3 COC(=O)BF Amb27639427 [0,0,1,0,0,0|2,0,0]=3 2003 B5R0.3 COC(=O)C#N Amb22350567 [0,0,1,0,0,0|1,0,1]=3 2004 B5R0.3 COC(=O)C=O Amb29083438 [0,0,1,0,0,0|1,0,1]=3 2005 B5R0.3 COC(=O)C=O Amb8384463 [0,0,1,0,0,0|1,0,1]=3 2006 B5R0.3 COC(=O)CBr Amb3939968 [0,0,1,0,0,0|1,0,0]=2 2007 B5R0.3 COC(=O)CCl Amb2792917 [0,0,1,0,0,0|1,0,0]=2 2008 B5R0.3 COC(=O)CF Amb2689433 [0,0,1,0,0,0|1,0,0]=2 2009 B5R0.3 COC(=O)CI Amb22036593 [0,0,1,0,0,0|1,0,0]=2 2010 B5R0.3 COC(=O)CN Amb1153098 [0,0,1,0,0,0|1,0,0]=2 2011 B5R0.3 COC(=O)CN Amb534106 [0,0,1,0,0,0|1,0,0]=2 2012 B5R0.3 COC(=O)CO Amb2778433 [0,0,1,0,0,0|1,0,0]=2 2013 B5R0.3 COC(=O)CS Amb6608893 [0,0,1,0,0,0|1,0,0]=2 2014 B5R0.3 COC(=O)NN Amb1800924 [0,0,1,0,0,0|2,0,0]=3 2015 B5R0.3 COC(=O)OC Amb6609028 [0,0,1,0,0,0|1,0,0]=2 2016 B5R0.3 COC(=O)SCl Amb2689119 [0,0,1,0,0,0|2,0,0]=3 2017 B5R0.3 COC(=S)NN Amb22504666 [0,0,1,0,0,0|2,1,0]=4 2018 B5R0.3 COC(=S)SC Amb25138885 [0,0,1,0,0,0|1,1,0]=3 2019 B5R0.3 COC(Br)OC Amb27838129 [0,0,1,0,0,0|2,0,1]=4 2020 B5R0.3 COC(C)CBr Amb24711458 [0,0,1,0,0,0|2,0,1]=4 2021 B5R0.3 COC(C)CCl Amb28315643 [0,0,1,0,0,0|2,0,1]=4 2022 B5R0.3 COC(C)CI Amb24371608 [0,0,1,0,0,0|2,0,1]=4 2023 B5R0.3 COC(C)CN Amb2140564 [0,0,1,0,0,0|2,0,1]=4 2024 B5R0.3 COC(C)CN Amb927898 [0,0,1,0,0,0|2,0,1]=4 2025 B5R0.3 COC(C)CO Amb19517078 [0,0,1,0,0,0|2,0,1]=4 2026 B5R0.3 COC(C)CS Amb25887604 [0,0,1,0,0,0|2,0,1]=4 2027 B5R0.3 COC(C)OC Amb2793080 [0,0,1,0,0,0|2,0,1]=4 2028 B5R0.3 COC(Cl)CCl Amb17689392 [0,0,1,0,0,0|2,0,1]=4 2029 B5R0.3 COC(N)OC Amb27837725 [0,0,1,0,0,0|2,0,1]=4 2030 B5R0.3 CON(C)CO Amb25745642 [0,0,1,0,0,0|3,0,0]=4 2031 B5R0.3 COP(C)OC Amb22730471 [0,0,1,0,0,0|3,0,0]=4 2032 B5R0.3 COP(Cl)OC Amb22731550 [0,0,1,0,0,0|3,0,0]=4 2033 B5R0.3 COP(O)OC Amb26936405 [0,0,1,0,0,0|2,0,1]=4 2034 B5R0.3 COS(=O)CCl Amb27468688 [0,0,1,0,0,0|2,0,0]=3 2035 B5R0.3 COS(=O)OC Amb8513416 [0,0,1,0,0,0|2,0,0]=3 2036 B5R0.3 CO[C@@H](C)CN Amb22746816 [0,0,1,0,0,0|2,0,1]=4 2037 B5R0.3 CO[C@@H](C)CN Amb27613930 [0,0,1,0,0,0|2,0,1]=4 2038 B5R0.3 CO[C@@H](C)CO Amb8515772 [0,0,1,0,0,0|2,0,1]=4 2039 B5R0.3 CO[C@H](C)CN Amb26959026 [0,0,1,0,0,0|2,0,1]=4 2040 B5R0.3 CO[C@H](C)CN Amb33801901 [0,0,1,0,0,0|2,0,1]=4 2041 B5R0.3 CO[C@H](C)CO Amb10603218 [0,0,1,0,0,0|2,0,1]=4 2042 B5R0.3 CO[PH](=O)OC Amb9787446 [0,0,1,0,0,0|2,0,0]=3 2043 B5R0.3 CO[PH](=S)OC Amb4297285 [0,0,1,0,0,0|2,1,0]=4 2044 B5R0.3 CO\C(C)=C\I Amb27863468 [0,0,1,0,0,0|2,0,1]=4 2045 B5R0.3 CO\C(Cl)=C\Cl Amb28121014 [0,0,1,0,0,0|2,0,1]=4 2046 B5R0.3 CO\C(F)=C\Br Amb27837588 [0,0,1,0,0,0|2,0,1]=4 2047 B5R0.3 CSC(=O)C=O Amb28284177 [0,0,1,0,0,0|1,1,1]=4 2048 B5R0.3 CSC(=O)CN Amb27482013 [0,0,1,0,0,0|1,1,0]=3 2049 B5R0.3 CSC(=O)SC Amb19944681 [0,0,1,0,0,0|1,1,0]=3 2050 B5R0.3 CS\C(O)=[SH]\C Amb22167602 [0,0,1,0,0,0|1,1,1]=4 2051 B5R0.3 C\C=C(/C)CBr Amb27954750 [0,0,1,0,0,0|3,0,0]=4 2052 B5R0.3 C\C=C(/C)CC Amb26540266 [0,0,1,0,0,0|2,0,0]=3 2053 B5R0.3 C\C=C(/C)CCl Amb33483104 [0,0,1,0,0,0|3,0,0]=4 2054 B5R0.3 C\C=C(/C)CI Amb27750414 [0,0,1,0,0,0|3,0,0]=4 2055 B5R0.3 C\C=C(/C)CO Amb26998405 [0,0,1,0,0,0|3,0,0]=4 2056 B5R0.3 C\C=C(/F)CBr Amb22546798 [0,0,1,0,0,0|3,0,0]=4 2057 B5R0.3 C\C=C(/F)CO Amb22546797 [0,0,1,0,0,0|3,0,0]=4 2058 B5R0.3 C\C=C(/I)CN Amb27392321 [0,0,1,0,0,0|3,0,0]=4 2059 B5R0.3 C\C=C(\Br)CBr Amb28053383 [0,0,1,0,0,0|3,0,0]=4 2060 B5R0.3 C\C=C(\Br)CN Amb27650590 [0,0,1,0,0,0|3,0,0]=4 2061 B5R0.3 C\C=C(\Br)CO Amb25809972 [0,0,1,0,0,0|3,0,0]=4 2062 B5R0.3 C\C=C(\C)CC Amb25332651 [0,0,1,0,0,0|2,0,0]=3 2063 B5R0.3 C\C=C(\C)CCl Amb27655615 [0,0,1,0,0,0|3,0,0]=4 2064 B5R0.3 C\C=C(\C)CO Amb26581579 [0,0,1,0,0,0|3,0,0]=4 2065 B5R0.3 C\C=C(\Cl)CCl Amb25727694 [0,0,1,0,0,0|3,0,0]=4 2066 B5R0.3 C\C=C(\F)CO Amb28384940 [0,0,1,0,0,0|3,0,0]=4 2067 B5R0.3 C\C=C(\I)CBr Amb27263914 [0,0,1,0,0,0|3,0,0]=4 2068 B5R0.3 C\N=C(/C)NC Amb28049638 [0,0,1,0,0,0|3,0,0]=4 2069 B5R0.3 C\N=C(/N)SC Amb32652891 [0,0,1,0,0,0|2,1,0]=4 2070 B5R0.3 C\N=C(/N)SC Amb445973 [0,0,1,0,0,0|2,1,0]=4 2071 B5R0.3 C\N=C(\C)NC Amb10552433 [0,0,1,0,0,0|3,0,0]=4 2072 B5R0.3 C\N=C(\N)NC Amb10552390 [0,0,1,0,0,0|3,0,0]=4 2073 B5R0.3 N#CC(=O)CBr Amb26381908 [0,0,1,0,0,0|3,0,0]=4 2074 B5R0.3 N#CC(=O)CN Amb27811242 [0,0,1,0,0,0|3,0,0]=4 2075 B5R0.3 NCC(=O)CCl Amb27225872 [0,0,1,0,0,0|3,0,0]=4 2076 B5R0.3 NCC(=O)CF Amb33377281 [0,0,1,0,0,0|3,0,0]=4 2077 B5R0.3 NCC(=O)CN Amb17593034 [0,0,1,0,0,0|3,0,0]=4 2078 B5R0.3 NCC(=O)CN Amb22227724 [0,0,1,0,0,0|3,0,0]=4 2079 B5R0.3 NCC(=O)NN Amb18559478 [0,0,1,0,0,0|3,0,0]=4 2080 B5R0.3 NCC(=O)NN Amb33804098 [0,0,1,0,0,0|3,0,0]=4 2081 B5R0.3 NCC(=O)NO Amb2433859 [0,0,1,0,0,0|3,0,0]=4 2082 B5R0.3 NCC(=O)OBr Amb27983785 [0,0,1,0,0,0|2,0,0]=3 2083 B5R0.3 NCC(=O)OCl Amb27628854 [0,0,1,0,0,0|2,0,0]=3 2084 B5R0.3 NCC(=O)ON Amb27473245 [0,0,1,0,0,0|2,0,0]=3 2085 B5R0.3 NNC(=O)CCl Amb10570260 [0,0,1,0,0,0|3,0,0]=4 2086 B5R0.3 NNC(=O)CCl Amb4037964 [0,0,1,0,0,0|3,0,0]=4 2087 B5R0.3 NNC(=O)CO Amb17615031 [0,0,1,0,0,0|3,0,0]=4 2088 B5R0.3 NNC(=O)CS Amb33537685 [0,0,1,0,0,0|3,0,0]=4 2089 B5R0.3 O=C(CBr)CBr Amb6296640 [0,0,1,0,0,0|3,0,0]=4 2090 B5R0.3 O=C(CBr)NBr Amb27432082 [0,0,1,0,0,0|3,0,0]=4 2091 B5R0.3 O=C(CBr)NCl Amb28284405 [0,0,1,0,0,0|3,0,0]=4 2092 B5R0.3 O=C(CBr)OBr Amb28454578 [0,0,1,0,0,0|2,0,0]=3 2093 B5R0.3 O=C(CCl)CCl Amb2725484 [0,0,1,0,0,0|3,0,0]=4 2094 B5R0.3 O=C(CCl)NO Amb25324352 [0,0,1,0,0,0|3,0,0]=4 2095 B5R0.3 O=C(CF)CCl Amb24531400 [0,0,1,0,0,0|3,0,0]=4 2096 B5R0.3 O=C(CF)CF Amb19895356 [0,0,1,0,0,0|3,0,0]=4 2097 B5R0.3 O=C(CI)CI Amb22227730 [0,0,1,0,0,0|3,0,0]=4 2098 B5R0.3 O=C(CI)NO Amb27635227 [0,0,1,0,0,0|3,0,0]=4 2099 B5R0.3 O=C(CO)CBr Amb25945111 [0,0,1,0,0,0|3,0,0]=4 2100 B5R0.3 O=C(CO)CCl Amb28322779 [0,0,1,0,0,0|3,0,0]=4 2101 B5R0.3 O=C(CO)CI Amb28121276 [0,0,1,0,0,0|3,0,0]=4 2102 B5R0.3 O=C(CO)CO Amb6600007 [0,0,1,0,0,0|3,0,0]=4 2103 B5R0.3 O=C(CO)NO Amb27596845 [0,0,1,0,0,0|3,0,0]=4 2104 B5R0.3 O=C(O[Ag])O[Ag] Amb20240527 [0,0,1,0,0,0|3,0,0]=4 2105 B5R0.3 O=C(O[Cs])O[Cs] Amb17674132 [0,0,1,0,0,0|3,0,0]=4 2106 B5R0.3 O=C(O[Na])O[Na] Amb22338269 [0,0,1,0,0,0|3,0,0]=4 2107 B5R0.3 O=C(O[Rb])O[Rb] Amb17674131 [0,0,1,0,0,0|3,0,0]=4 2108 B5R0.3 O=CC(=O)CO Amb17593031 [0,0,1,0,0,0|3,0,0]=4 2109 B5R0.3 [CH2-]C(CC)CC Amb24117230 [0,0,1,0,0,0|2,0,1]=4 2110 B7R2.4 BrC12CCC1C2 Amb32676124 [0,0,0,1,0,0|2,0,1]=4 2111 B7R2.4 ClC12CCC1C2 Amb32676119 [0,0,0,1,0,0|2,0,1]=4 2112 B7R2.4 NC12CCC1C2 Amb32676128 [0,0,0,1,0,0|2,0,1]=4 2113 B7R2.9 NC1C2CCC12 Amb33744197 [0,0,0,1,0,0|2,0,1]=4 2114 B7R2.9 O[C@H]1[C@H]2CC[C@@H]12 Amb27242765 [0,0,0,1,0,0|1,0,2]=4 2115 B7R2.10 O[C@@H]1C[C@@H]2C[C@@H]21 Amb28131658 [0,0,0,1,0,0|1,0,2]=4 2116 B7R2.10 O[C@H]1C[C@H]2C[C@@H]12 Amb27443293 [0,0,0,1,0,0|1,0,2]=4 2117 B7R2.11 C1CC2CC1C2 Amb25338323 [0,0,0,1,0,0|2,0,1]=4 2118 B7R2.11 C1CC2CC1N2 Amb24117066 [0,0,0,1,0,0|2,0,1]=4 2119 B7R2.11 C1CC2NC1O2 Amb28199129 [0,0,0,1,0,0|1,0,1]=3 2120 B7R2.11 C1NC2CC1C2 Amb21964458 [0,0,0,1,0,0|2,0,1]=4 2121 B7R2.11 C1NC2CC1C2 Amb22493767 [0,0,0,1,0,0|2,0,1]=4 2122 B7R2.13 C1CC2CC2C1 Amb25723975 [0,0,0,1,0,0|2,0,1]=4 2123 B7R2.13 C1CC2CC2N1 Amb19375213 [0,0,0,1,0,0|2,0,1]=4 2124 B7R2.13 C1CC2CC2N1 Amb22755961 [0,0,0,1,0,0|2,0,1]=4 2125 B7R2.13 C1CC2NC2C1 Amb10609121 [0,0,0,1,0,0|2,0,1]=4 2126 B7R2.13 C1CC2OC2C1 Amb9703221 [0,0,0,1,0,0|1,0,2]=4 2127 B7R2.13 C1C[C@@H]2C[C@@H]2N1 Amb25273841 [0,0,0,1,0,0|2,0,1]=4 2128 B7R2.13 C1C[C@@H]2C[C@@H]2N1 Amb35825119 [0,0,0,1,0,0|2,0,1]=4 2129 B7R2.13 C1C[C@H]2C[C@H]2N1 Amb27202835 [0,0,0,1,0,0|2,0,1]=4 2130 B5R1.2 BrC1CCC1 Amb3941489 [0,0,0,0,1,0|1,0,1]=3 2131 B5R1.2 BrC1CNC1 Amb22229230 [0,0,0,0,1,0|2,0,1]=4 2132 B5R1.2 BrC1CNC1 Amb22235472 [0,0,0,0,1,0|2,0,1]=4 2133 B5R1.2 BrC1CNC1 Amb22304219 [0,0,0,0,1,0|2,0,1]=4 2134 B5R1.2 BrC1COC1 Amb2383522 [0,0,0,0,1,0|2,0,1]=4 2135 B5R1.2 C=C1CCC1 Amb19374657 [0,0,0,0,1,0|1,0,0]=2 2136 B5R1.2 C=C1CCO1 Amb22736695 [0,0,0,0,1,0|1,0,0]=2 2137 B5R1.2 C=C1CNC1 Amb26026628 [0,0,0,0,1,0|2,0,0]=3 2138 B5R1.2 C=C1CNC1 Amb32666987 [0,0,0,0,1,0|2,0,0]=3 2139 B5R1.2 C=C1COC1 Amb27432949 [0,0,0,0,1,0|2,0,0]=3 2140 B5R1.2 CC1CCN1 Amb33544381 [0,0,0,0,1,0|2,0,1]=4 2141 B5R1.2 CC1CCN1 Amb7094895 [0,0,0,0,1,0|2,0,1]=4 2142 B5R1.2 CC1CCO1 Amb22284855 [0,0,0,0,1,0|1,0,1]=3 2143 B5R1.2 CC1CNC1 Amb19957931 [0,0,0,0,1,0|2,0,1]=4 2144 B5R1.2 CC1CNC1 Amb26579404 [0,0,0,0,1,0|2,0,1]=4 2145 B5R1.2 CC1COC1 Amb20621708 [0,0,0,0,1,0|2,0,1]=4 2146 B5R1.2 C[C@@H]1CCN1 Amb34148051 [0,0,0,0,1,0|2,0,1]=4 2147 B5R1.2 C[C@@H]1CCO1 Amb28292927 [0,0,0,0,1,0|1,0,1]=3 2148 B5R1.2 C[C@H]1CCN1 Amb33805340 [0,0,0,0,1,0|2,0,1]=4 2149 B5R1.2 C[C@H]1CCO1 Amb26503922 [0,0,0,0,1,0|1,0,1]=3 2150 B5R1.2 ClC1CCC1 Amb3941524 [0,0,0,0,1,0|1,0,1]=3 2151 B5R1.2 ClC1CNC1 Amb21960859 [0,0,0,0,1,0|2,0,1]=4 2152 B5R1.2 ClC1CNC1 Amb22232545 [0,0,0,0,1,0|2,0,1]=4 2153 B5R1.2 ClC1COC1 Amb22737242 [0,0,0,0,1,0|2,0,1]=4 2154 B5R1.2 FC1CNC1 Amb19148506 [0,0,0,0,1,0|2,0,1]=4 2155 B5R1.2 FC1CNC1 Amb8629955 [0,0,0,0,1,0|2,0,1]=4 2156 B5R1.2 FC1COC1 Amb21960819 [0,0,0,0,1,0|2,0,1]=4 2157 B5R1.2 IC1CCC1 Amb24476982 [0,0,0,0,1,0|1,0,1]=3 2158 B5R1.2 IC1CNC1 Amb22229328 [0,0,0,0,1,0|2,0,1]=4 2159 B5R1.2 IC1CNC1 Amb28247468 [0,0,0,0,1,0|2,0,1]=4 2160 B5R1.2 IC1COC1 Amb2383523 [0,0,0,0,1,0|2,0,1]=4 2161 B5R1.2 NC1CCC1 Amb3938963 [0,0,0,0,1,0|1,0,1]=3 2162 B5R1.2 NC1CCC1 Amb8631327 [0,0,0,0,1,0|1,0,1]=3 2163 B5R1.2 NC1CNC1 Amb2696234 [0,0,0,0,1,0|2,0,1]=4 2164 B5R1.2 NC1CNC1 Amb8630172 [0,0,0,0,1,0|2,0,1]=4 2165 B5R1.2 NC1COC1 Amb21928045 [0,0,0,0,1,0|2,0,1]=4 2166 B5R1.2 NC1COC1 Amb6259281 [0,0,0,0,1,0|2,0,1]=4 2167 B5R1.2 NC1CSC1 Amb17597694 [0,0,0,0,1,0|2,0,1]=4 2168 B5R1.2 NC1CSC1 Amb19373792 [0,0,0,0,1,0|2,0,1]=4 2169 B5R1.2 NC1CSC1 Amb22295804 [0,0,0,0,1,0|2,0,1]=4 2170 B5R1.2 NN1CCC1 Amb24392919 [0,0,0,0,1,0|2,0,0]=3 2171 B5R1.2 NN1CCC1 Amb32656115 [0,0,0,0,1,0|2,0,0]=3 2172 B5R1.2 O=C1BCN1 Amb27403064 [0,0,0,0,1,0|2,0,0]=3 2173 B5R1.2 O=C1C=CC1 Amb24477666 [0,0,0,0,1,0|0,0,2]=3 2174 B5R1.2 O=C1CCC1 Amb4605970 [0,0,0,0,1,0|0,0,0]=1 2175 B5R1.2 O=C1CCN1 Amb2779956 [0,0,0,0,1,0|1,0,0]=2 2176 B5R1.2 O=C1CCO1 Amb8514945 [0,0,0,0,1,0|0,0,0]=1 2177 B5R1.2 O=C1CCS1 Amb28430252 [0,0,0,0,1,0|0,1,0]=2 2178 B5R1.2 O=C1CNC1 Amb10975976 [0,0,0,0,1,0|1,0,0]=2 2179 B5R1.2 O=C1COC1 Amb10067645 [0,0,0,0,1,0|1,0,0]=2 2180 B5R1.2 O=C1CSC1 Amb19516222 [0,0,0,0,1,0|1,0,0]=2 2181 B5R1.2 O=C1O[Ba]O1 Amb22052524 [0,0,0,0,1,0|2,0,0]=3 2182 B5R1.2 O=C1O[Mg]O1 Amb22052493 [0,0,0,0,1,0|2,0,0]=3 2183 B5R1.2 O=C1O[PbH2]O1 Amb22052516 [0,0,0,0,1,0|2,0,0]=3 2184 B5R1.2 O=S1CCC1 Amb27653739 [0,0,0,0,1,0|1,0,0]=2 2185 B5R1.2 OC1CCC1 Amb4605821 [0,0,0,0,1,0|0,0,2]=3 2186 B5R1.2 OC1CCO1 Amb27424422 [0,0,0,0,1,0|0,0,2]=3 2187 B5R1.2 OC1CNC1 Amb22489446 [0,0,0,0,1,0|1,0,2]=4 2188 B5R1.2 OC1CNC1 Amb2688729 [0,0,0,0,1,0|1,0,2]=4 2189 B5R1.2 OC1CNC1 Amb2785246 [0,0,0,0,1,0|1,0,2]=4 2190 B5R1.2 OC1COC1 Amb10602318 [0,0,0,0,1,0|1,0,2]=4 2191 B5R1.2 OC1CSC1 Amb17593039 [0,0,0,0,1,0|1,0,2]=4 2192 B5R1.2 SC1CCC1 Amb25339328 [0,0,0,0,1,0|0,1,1]=3 2193 B5R1.2 SC1CNC1 Amb24477050 [0,0,0,0,1,0|1,1,1]=4 2194 B5R1.2 SC1CNC1 Amb33715987 [0,0,0,0,1,0|1,1,1]=4 2195 B5R1.2 SC1COC1 Amb22737528 [0,0,0,0,1,0|1,1,1]=4 2196 B5R1.2 SC1CSC1 Amb28142120 [0,0,0,0,1,0|1,1,1]=4 2197 B5R1.2 [Mg+]C1CCC1 Amb30591459 [0,0,0,0,1,0|1,0,1]=3 2198 B7R1.3 BrC1=CCCCC1 Amb21856761 [0,0,0,0,0,1|2,0,0]=3 2199 B7R1.3 BrC1=CCCCO1 Amb24322651 [0,0,0,0,0,1|1,0,0]=2 2200 B7R1.3 BrC1=CCCNC1 Amb27173423 [0,0,0,0,0,1|2,0,0]=3 2201 B7R1.3 BrC1=CCCNC1 Amb32651839 [0,0,0,0,0,1|2,0,0]=3 2202 B7R1.3 BrC1=CCNCC1 Amb24317585 [0,0,0,0,0,1|2,0,0]=3 2203 B7R1.3 BrC1=CCNCC1 Amb33189234 [0,0,0,0,0,1|2,0,0]=3 2204 B7R1.3 BrC1=CCOCC1 Amb21964919 [0,0,0,0,0,1|2,0,0]=3 2205 B7R1.3 BrC1=CCSCC1 Amb22229691 [0,0,0,0,0,1|2,0,0]=3 2206 B7R1.3 BrC1=COCCC1 Amb24322600 [0,0,0,0,0,1|1,0,0]=2 2207 B7R1.3 BrC1=COCCO1 Amb24322806 [0,0,0,0,0,1|1,0,1]=3 2208 B7R1.3 BrC1C=CCCC1 Amb2720845 [0,0,0,0,0,1|2,0,1]=4 2209 B7R1.3 BrC1C=NCCC1 Amb24322652 [0,0,0,0,0,1|2,0,1]=4 2210 B7R1.3 BrC1CCCCC1 Amb3940351 [0,0,0,0,0,1|2,0,1]=4 2211 B7R1.3 BrC1CCCCN1 Amb8629038 [0,0,0,0,0,1|2,0,1]=4 2212 B7R1.3 BrC1CCCCO1 Amb24322575 [0,0,0,0,0,1|1,0,1]=3 2213 B7R1.3 BrC1CCCNC1 Amb22497824 [0,0,0,0,0,1|2,0,1]=4 2214 B7R1.3 BrC1CCCNC1 Amb8629039 [0,0,0,0,0,1|2,0,1]=4 2215 B7R1.3 BrC1CCCOC1 Amb9173669 [0,0,0,0,0,1|1,0,1]=3 2216 B7R1.3 BrC1CCCSC1 Amb26545490 [0,0,0,0,0,1|1,1,1]=4 2217 B7R1.3 BrC1CCNCC1 Amb22229718 [0,0,0,0,0,1|2,0,1]=4 2218 B7R1.3 BrC1CCNCC1 Amb2778981 [0,0,0,0,0,1|2,0,1]=4 2219 B7R1.3 BrC1CCNCC1 Amb3941704 [0,0,0,0,0,1|2,0,1]=4 2220 B7R1.3 BrC1CCOCC1 Amb9472764 [0,0,0,0,0,1|2,0,1]=4 2221 B7R1.3 BrC1CCSCC1 Amb18181050 [0,0,0,0,0,1|2,0,1]=4 2222 B7R1.3 BrC1COCCO1 Amb24322807 [0,0,0,0,0,1|1,0,1]=3 2223 B7R1.3 Br[C@H]1C=CCCC1 Amb27442441 [0,0,0,0,0,1|2,0,1]=4 2224 B7R1.3 C=C1CCCCC1 Amb8515603 [0,0,0,0,0,1|2,0,0]=3 2225 B7R1.3 C=C1CCCCN1 Amb27801038 [0,0,0,0,0,1|2,0,0]=3 2226 B7R1.3 C=C1CCCCO1 Amb28345156 [0,0,0,0,0,1|1,0,0]=2 2227 B7R1.3 C=C1CCCNC1 Amb19514641 [0,0,0,0,0,1|2,0,0]=3 2228 B7R1.3 C=C1CCCNC1 Amb22059305 [0,0,0,0,0,1|2,0,0]=3 2229 B7R1.3 C=C1CCCOC1 Amb27594580 [0,0,0,0,0,1|1,0,0]=2 2230 B7R1.3 C=C1CCCSC1 Amb22494848 [0,0,0,0,0,1|1,1,0]=3 2231 B7R1.3 C=C1CCNCC1 Amb19514763 [0,0,0,0,0,1|2,0,0]=3 2232 B7R1.3 C=C1CCNCC1 Amb24079604 [0,0,0,0,0,1|2,0,0]=3 2233 B7R1.3 C=C1CCNCC1 Amb33715165 [0,0,0,0,0,1|2,0,0]=3 2234 B7R1.3 C=C1CCOCC1 Amb22000865 [0,0,0,0,0,1|2,0,0]=3 2235 B7R1.3 C=C1OCCCO1 Amb25734089 [0,0,0,0,0,1|1,0,0]=2 2236 B7R1.3 CC1=CCCCC1 Amb8513524 [0,0,0,0,0,1|2,0,0]=3 2237 B7R1.3 CC1=CCCCO1 Amb24480530 [0,0,0,0,0,1|1,0,0]=2 2238 B7R1.3 CC1=CCCNC1 Amb23439963 [0,0,0,0,0,1|2,0,0]=3 2239 B7R1.3 CC1=CCCNC1 Amb25063349 [0,0,0,0,0,1|2,0,0]=3 2240 B7R1.3 CC1=CCNCC1 Amb18639053 [0,0,0,0,0,1|2,0,0]=3 2241 B7R1.3 CC1=CCNCC1 Amb21961140 [0,0,0,0,0,1|2,0,0]=3 2242 B7R1.3 CC1=CCOCC1 Amb24070517 [0,0,0,0,0,1|2,0,0]=3 2243 B7R1.3 CC1=NCCCC1 Amb27459940 [0,0,0,0,0,1|2,0,0]=3 2244 B7R1.3 CC1=NCCCN1 Amb3650246 [0,0,0,0,0,1|2,0,0]=3 2245 B7R1.3 CC1=NCCCS1 Amb25808748 [0,0,0,0,0,1|1,1,0]=3 2246 B7R1.3 CC1=NCCNC1 Amb22755966 [0,0,0,0,0,1|2,0,0]=3 2247 B7R1.3 CC1C=CCCC1 Amb8515346 [0,0,0,0,0,1|2,0,1]=4 2248 B7R1.3 CC1C=CCCO1 Amb33715160 [0,0,0,0,0,1|1,0,2]=4 2249 B7R1.3 CC1CCCCN1 Amb2792828 [0,0,0,0,0,1|2,0,1]=4 2250 B7R1.3 CC1CCCCO1 Amb4035049 [0,0,0,0,0,1|1,0,1]=3 2251 B7R1.3 CC1CCCCS1 Amb17666899 [0,0,0,0,0,1|1,1,1]=4 2252 B7R1.3 CC1CCCNC1 Amb22491688 [0,0,0,0,0,1|2,0,1]=4 2253 B7R1.3 CC1CCCNC1 Amb9703089 [0,0,0,0,0,1|2,0,1]=4 2254 B7R1.3 CC1CCCOC1 Amb22347806 [0,0,0,0,0,1|1,0,1]=3 2255 B7R1.3 CC1CCNCC1 Amb2689655 [0,0,0,0,0,1|2,0,1]=4 2256 B7R1.3 CC1CCOCC1 Amb22043825 [0,0,0,0,0,1|2,0,1]=4 2257 B7R1.3 CC1CCOCN1 Amb32651825 [0,0,0,0,0,1|2,0,1]=4 2258 B7R1.3 CC1CCOCO1 Amb17776591 [0,0,0,0,0,1|1,0,1]=3 2259 B7R1.3 CC1CCSCC1 Amb27436849 [0,0,0,0,0,1|2,0,1]=4 2260 B7R1.3 CC1CNCCN1 Amb32666272 [0,0,0,0,0,1|2,0,1]=4 2261 B7R1.3 CC1CNCCN1 Amb9702774 [0,0,0,0,0,1|2,0,1]=4 2262 B7R1.3 CC1CNCCO1 Amb20621613 [0,0,0,0,0,1|1,0,1]=3 2263 B7R1.3 CC1CNCCO1 Amb32666325 [0,0,0,0,0,1|1,0,1]=3 2264 B7R1.3 CC1CNCCO1 Amb9703073 [0,0,0,0,0,1|1,0,1]=3 2265 B7R1.3 CC1CNCCS1 Amb32753223 [0,0,0,0,0,1|1,1,1]=4 2266 B7R1.3 CC1CNCCS1 Amb6683465 [0,0,0,0,0,1|1,1,1]=4 2267 B7R1.3 CC1COCCN1 Amb22728071 [0,0,0,0,0,1|2,0,1]=4 2268 B7R1.3 CC1COCCN1 Amb6740293 [0,0,0,0,0,1|2,0,1]=4 2269 B7R1.3 CC1CSCCN1 Amb9735876 [0,0,0,0,0,1|2,0,1]=4 2270 B7R1.3 CC1NCCCN1 Amb24381838 [0,0,0,0,0,1|2,0,1]=4 2271 B7R1.3 CC1NCCCO1 Amb17506191 [0,0,0,0,0,1|1,0,1]=3 2272 B7R1.3 CC1OCCCO1 Amb26557606 [0,0,0,0,0,1|1,0,1]=3 2273 B7R1.3 CC1SCCCS1 Amb10071965 [0,0,0,0,0,1|1,1,1]=4 2274 B7R1.3 CN1C=NCCC1 Amb30010877 [0,0,0,0,0,1|3,0,0]=4 2275 B7R1.3 CN1CCCCC1 Amb8387007 [0,0,0,0,0,1|3,0,0]=4 2276 B7R1.3 CN1CCCNC1 Amb18121429 [0,0,0,0,0,1|3,0,0]=4 2277 B7R1.3 CN1CCNCC1 Amb2689644 [0,0,0,0,0,1|3,0,0]=4 2278 B7R1.3 CN1CCNCC1 Amb2720207 [0,0,0,0,0,1|3,0,0]=4 2279 B7R1.3 CN1CCOCC1 Amb5718750 [0,0,0,0,0,1|3,0,0]=4 2280 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [0,0,0,0,0,1|2,0,1]=4 2281 B7R1.3 C[C@@H]1CCCCN1 Amb3939006 [0,0,0,0,0,1|2,0,1]=4 2282 B7R1.3 C[C@@H]1CCCNC1 Amb24461444 [0,0,0,0,0,1|2,0,1]=4 2283 B7R1.3 C[C@@H]1CCCNC1 Amb33801279 [0,0,0,0,0,1|2,0,1]=4 2284 B7R1.3 C[C@@H]1CNCCN1 Amb23399598 [0,0,0,0,0,1|2,0,1]=4 2285 B7R1.3 C[C@@H]1CNCCN1 Amb33716484 [0,0,0,0,0,1|2,0,1]=4 2286 B7R1.3 C[C@@H]1CNCCN1 Amb8396882 [0,0,0,0,0,1|2,0,1]=4 2287 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [0,0,0,0,0,1|1,0,1]=3 2288 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [0,0,0,0,0,1|1,0,1]=3 2289 B7R1.3 C[C@@H]1CNCCS1 Amb28423156 [0,0,0,0,0,1|1,1,1]=4 2290 B7R1.3 C[C@@H]1CNCCS1 Amb32671471 [0,0,0,0,0,1|1,1,1]=4 2291 B7R1.3 C[C@@H]1COCCN1 Amb10066948 [0,0,0,0,0,1|2,0,1]=4 2292 B7R1.3 C[C@@H]1COCCN1 Amb22169654 [0,0,0,0,0,1|2,0,1]=4 2293 B7R1.3 C[C@@H]1CSCCN1 Amb25241759 [0,0,0,0,0,1|2,0,1]=4 2294 B7R1.3 C[C@H]1CCCCN1 Amb8387006 [0,0,0,0,0,1|2,0,1]=4 2295 B7R1.3 C[C@H]1CCCNC1 Amb22745835 [0,0,0,0,0,1|2,0,1]=4 2296 B7R1.3 C[C@H]1CCCNC1 Amb8387001 [0,0,0,0,0,1|2,0,1]=4 2297 B7R1.3 C[C@H]1CNCCN1 Amb6306665 [0,0,0,0,0,1|2,0,1]=4 2298 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [0,0,0,0,0,1|1,0,1]=3 2299 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [0,0,0,0,0,1|1,0,1]=3 2300 B7R1.3 C[C@H]1CNCCO1 Amb32661569 [0,0,0,0,0,1|1,0,1]=3 2301 B7R1.3 C[C@H]1CNCCO1 Amb34916143 [0,0,0,0,0,1|1,0,1]=3 2302 B7R1.3 C[C@H]1COCCN1 Amb10066947 [0,0,0,0,0,1|2,0,1]=4 2303 B7R1.3 C[C@H]1COCCN1 Amb19516190 [0,0,0,0,0,1|2,0,1]=4 2304 B7R1.3 C[C@H]1CSCCN1 Amb25212371 [0,0,0,0,0,1|2,0,1]=4 2305 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [0,0,0,0,0,1|1,1,0]=3 2306 B7R1.3 ClC1=CCCCC1 Amb9785147 [0,0,0,0,0,1|2,0,0]=3 2307 B7R1.3 ClC1=CCCCO1 Amb27449514 [0,0,0,0,0,1|1,0,0]=2 2308 B7R1.3 ClC1=CCCNC1 Amb32664385 [0,0,0,0,0,1|2,0,0]=3 2309 B7R1.3 ClC1=CCCNC1 Amb32664386 [0,0,0,0,0,1|2,0,0]=3 2310 B7R1.3 ClC1=COCCO1 Amb27826498 [0,0,0,0,0,1|1,0,1]=3 2311 B7R1.3 ClC1=NCCCN1 Amb27948666 [0,0,0,0,0,1|2,0,0]=3 2312 B7R1.3 ClC1C=CCCC1 Amb22229267 [0,0,0,0,0,1|2,0,1]=4 2313 B7R1.3 ClC1CCCCC1 Amb3940352 [0,0,0,0,0,1|2,0,1]=4 2314 B7R1.3 ClC1CCCCN1 Amb20242688 [0,0,0,0,0,1|2,0,1]=4 2315 B7R1.3 ClC1CCCCO1 Amb17673285 [0,0,0,0,0,1|1,0,1]=3 2316 B7R1.3 ClC1CCCCS1 Amb28123985 [0,0,0,0,0,1|1,1,1]=4 2317 B7R1.3 ClC1CCCOC1 Amb20622589 [0,0,0,0,0,1|1,0,1]=3 2318 B7R1.3 ClC1CCNCC1 Amb8009567 [0,0,0,0,0,1|2,0,1]=4 2319 B7R1.3 ClC1CCNCC1 Amb8629021 [0,0,0,0,0,1|2,0,1]=4 2320 B7R1.3 ClC1CCOCC1 Amb6760778 [0,0,0,0,0,1|2,0,1]=4 2321 B7R1.3 ClC1CSCCS1 Amb27659242 [0,0,0,0,0,1|1,1,1]=4 2322 B7R1.3 ClN1CCCCC1 Amb25950915 [0,0,0,0,0,1|3,0,0]=4 2323 B7R1.3 ClN1CCOCC1 Amb20670597 [0,0,0,0,0,1|3,0,0]=4 2324 B7R1.3 FC1=CCCNC1 Amb27181097 [0,0,0,0,0,1|2,0,0]=3 2325 B7R1.3 FC1=CCCNC1 Amb28314663 [0,0,0,0,0,1|2,0,0]=3 2326 B7R1.3 FC1=CCNCC1 Amb27600797 [0,0,0,0,0,1|2,0,0]=3 2327 B7R1.3 FC1=CCNCC1 Amb33484309 [0,0,0,0,0,1|2,0,0]=3 2328 B7R1.3 FC1=COCCC1 Amb24322810 [0,0,0,0,0,1|1,0,0]=2 2329 B7R1.3 FC1C=CCCC1 Amb27164038 [0,0,0,0,0,1|2,0,1]=4 2330 B7R1.3 FC1CCCCC1 Amb2688084 [0,0,0,0,0,1|2,0,1]=4 2331 B7R1.3 FC1CCCCO1 Amb24322826 [0,0,0,0,0,1|1,0,1]=3 2332 B7R1.3 FC1CCCNC1 Amb13953137 [0,0,0,0,0,1|2,0,1]=4 2333 B7R1.3 FC1CCCNC1 Amb2688404 [0,0,0,0,0,1|2,0,1]=4 2334 B7R1.3 FC1CCCOC1 Amb24322825 [0,0,0,0,0,1|1,0,1]=3 2335 B7R1.3 FC1CCC[NH2+]C1 Amb22042691 [0,0,0,0,0,1|2,0,1]=4 2336 B7R1.3 FC1CCNCC1 Amb13885425 [0,0,0,0,0,1|2,0,1]=4 2337 B7R1.3 FC1CCNCC1 Amb2688405 [0,0,0,0,0,1|2,0,1]=4 2338 B7R1.3 FC1CCOCC1 Amb22296909 [0,0,0,0,0,1|2,0,1]=4 2339 B7R1.3 FC1CNCCO1 Amb27641873 [0,0,0,0,0,1|1,0,1]=3 2340 B7R1.3 FC1COCCO1 Amb24322827 [0,0,0,0,0,1|1,0,1]=3 2341 B7R1.3 F[C@@H]1CCCNC1 Amb20242276 [0,0,0,0,0,1|2,0,1]=4 2342 B7R1.3 F[C@@H]1CCCNC1 Amb27619341 [0,0,0,0,0,1|2,0,1]=4 2343 B7R1.3 F[C@H]1CCCNC1 Amb20242275 [0,0,0,0,0,1|2,0,1]=4 2344 B7R1.3 IC1=CCCCC1 Amb27750996 [0,0,0,0,0,1|2,0,0]=3 2345 B7R1.3 IC1=CCOCC1 Amb25364046 [0,0,0,0,0,1|2,0,0]=3 2346 B7R1.3 IC1=COCCC1 Amb24322812 [0,0,0,0,0,1|1,0,0]=2 2347 B7R1.3 IC1=COCCO1 Amb24322818 [0,0,0,0,0,1|1,0,1]=3 2348 B7R1.3 IC1CCCCC1 Amb6608670 [0,0,0,0,0,1|2,0,1]=4 2349 B7R1.3 IC1CCCNC1 Amb22496356 [0,0,0,0,0,1|2,0,1]=4 2350 B7R1.3 IC1CCCOC1 Amb22831295 [0,0,0,0,0,1|1,0,1]=3 2351 B7R1.3 IC1CCOCC1 Amb2723453 [0,0,0,0,0,1|2,0,1]=4 2352 B7R1.3 IC1CCSCC1 Amb2724105 [0,0,0,0,0,1|2,0,1]=4 2353 B7R1.3 IN1CCOCC1 Amb24106962 [0,0,0,0,0,1|3,0,0]=4 2354 B7R1.3 N=C1CCCCC1 Amb26924126 [0,0,0,0,0,1|2,0,0]=3 2355 B7R1.3 N=C1CCCCN1 Amb17616049 [0,0,0,0,0,1|2,0,0]=3 2356 B7R1.3 N=C1CCCCN1 Amb2780013 [0,0,0,0,0,1|2,0,0]=3 2357 B7R1.3 N=C1COCCN1 Amb24654396 [0,0,0,0,0,1|2,0,0]=3 2358 B7R1.3 N=C1COCCN1 Amb28468104 [0,0,0,0,0,1|2,0,0]=3 2359 B7R1.3 N=C1CSCCN1 Amb32679434 [0,0,0,0,0,1|2,0,0]=3 2360 B7R1.3 N=C1NCCCN1 Amb22642014 [0,0,0,0,0,1|2,0,0]=3 2361 B7R1.3 N=C1NCCCO1 Amb23597225 [0,0,0,0,0,1|1,0,0]=2 2362 B7R1.3 N=C1NCCCO1 Amb28990985 [0,0,0,0,0,1|1,0,0]=2 2363 B7R1.3 N=C1NCCCS1 Amb22524353 [0,0,0,0,0,1|1,1,0]=3 2364 B7R1.3 NC1=CC=CCO1 Amb22167473 [0,0,0,0,0,1|1,0,2]=4 2365 B7R1.3 NC1=CCCCC1 Amb28456773 [0,0,0,0,0,1|2,0,0]=3 2366 B7R1.3 NC1=NCCCC1 Amb3997189 [0,0,0,0,0,1|2,0,0]=3 2367 B7R1.3 NC1=NCCCN1 Amb17608307 [0,0,0,0,0,1|2,0,0]=3 2368 B7R1.3 NC1=NCCCS1 Amb6817862 [0,0,0,0,0,1|1,1,0]=3 2369 B7R1.3 NC1=NCCCS1 Amb8468160 [0,0,0,0,0,1|1,1,0]=3 2370 B7R1.3 NC1=NCCOC1 Amb33743898 [0,0,0,0,0,1|2,0,0]=3 2371 B7R1.3 NC1=NCCSC1 Amb844759 [0,0,0,0,0,1|2,0,0]=3 2372 B7R1.3 NC1C=CCCC1 Amb20668839 [0,0,0,0,0,1|2,0,1]=4 2373 B7R1.3 NC1C=CCCC1 Amb23385297 [0,0,0,0,0,1|2,0,1]=4 2374 B7R1.3 NC1CCCCC1 Amb2792843 [0,0,0,0,0,1|2,0,1]=4 2375 B7R1.3 NC1CCCCC1 Amb4035820 [0,0,0,0,0,1|2,0,1]=4 2376 B7R1.3 NC1CCCCC1 Amb6366094 [0,0,0,0,0,1|2,0,1]=4 2377 B7R1.3 NC1CCCCN1 Amb16233706 [0,0,0,0,0,1|2,0,1]=4 2378 B7R1.3 NC1CCCCS1 Amb28052869 [0,0,0,0,0,1|1,1,1]=4 2379 B7R1.3 NC1CCCNC1 Amb2694718 [0,0,0,0,0,1|2,0,1]=4 2380 B7R1.3 NC1CCCNC1 Amb2720311 [0,0,0,0,0,1|2,0,1]=4 2381 B7R1.3 NC1CCCNC1 Amb8385620 [0,0,0,0,0,1|2,0,1]=4 2382 B7R1.3 NC1CCCOC1 Amb1091859 [0,0,0,0,0,1|1,0,1]=3 2383 B7R1.3 NC1CCCOC1 Amb19889218 [0,0,0,0,0,1|1,0,1]=3 2384 B7R1.3 NC1CCCSC1 Amb13953228 [0,0,0,0,0,1|1,1,1]=4 2385 B7R1.3 NC1CCCSC1 Amb32660970 [0,0,0,0,0,1|1,1,1]=4 2386 B7R1.3 NC1CCNCC1 Amb17943826 [0,0,0,0,0,1|2,0,1]=4 2387 B7R1.3 NC1CCNCC1 Amb6270512 [0,0,0,0,0,1|2,0,1]=4 2388 B7R1.3 NC1CCOCC1 Amb1102242 [0,0,0,0,0,1|2,0,1]=4 2389 B7R1.3 NC1CCOCC1 Amb8503255 [0,0,0,0,0,1|2,0,1]=4 2390 B7R1.3 NC1CCSCC1 Amb13952147 [0,0,0,0,0,1|2,0,1]=4 2391 B7R1.3 NC1CCSCC1 Amb2724106 [0,0,0,0,0,1|2,0,1]=4 2392 B7R1.3 NC1CNCCN1 Amb22228552 [0,0,0,0,0,1|2,0,1]=4 2393 B7R1.3 NC1CNCCS1 Amb28365414 [0,0,0,0,0,1|1,1,1]=4 2394 B7R1.3 NC1COCOC1 Amb28384919 [0,0,0,0,0,1|2,0,1]=4 2395 B7R1.3 NC1COCOC1 Amb32667993 [0,0,0,0,0,1|2,0,1]=4 2396 B7R1.3 NN1CCCCC1 Amb535734 [0,0,0,0,0,1|3,0,0]=4 2397 B7R1.3 NN1CCCCC1 Amb6892706 [0,0,0,0,0,1|3,0,0]=4 2398 B7R1.3 NN1CCNCC1 Amb10071260 [0,0,0,0,0,1|3,0,0]=4 2399 B7R1.3 NN1CCNCC1 Amb31308598 [0,0,0,0,0,1|3,0,0]=4 2400 B7R1.3 NN1CCOCC1 Amb836802 [0,0,0,0,0,1|3,0,0]=4 2401 B7R1.3 NN1CCSCC1 Amb18641480 [0,0,0,0,0,1|3,0,0]=4 2402 B7R1.3 N[C@@H]1C=CCCC1 Amb24640515 [0,0,0,0,0,1|2,0,1]=4 2403 B7R1.3 N[C@@H]1CCCNC1 Amb16233705 [0,0,0,0,0,1|2,0,1]=4 2404 B7R1.3 N[C@@H]1CCCNC1 Amb2695443 [0,0,0,0,0,1|2,0,1]=4 2405 B7R1.3 N[C@@H]1CCCOC1 Amb19516292 [0,0,0,0,0,1|1,0,1]=3 2406 B7R1.3 N[C@@H]1CCCOC1 Amb20241267 [0,0,0,0,0,1|1,0,1]=3 2407 B7R1.3 N[C@H]1CCCCO1 Amb27655590 [0,0,0,0,0,1|1,0,1]=3 2408 B7R1.3 N[C@H]1CCCNC1 Amb17134809 [0,0,0,0,0,1|2,0,1]=4 2409 B7R1.3 N[C@H]1CCCNC1 Amb2695444 [0,0,0,0,0,1|2,0,1]=4 2410 B7R1.3 N[C@H]1CCCOC1 Amb19516313 [0,0,0,0,0,1|1,0,1]=3 2411 B7R1.3 N[C@H]1CCCOC1 Amb20241266 [0,0,0,0,0,1|1,0,1]=3 2412 B7R1.3 N[C@H]1CCCOC1 Amb34916114 [0,0,0,0,0,1|1,0,1]=3 2413 B7R1.3 O=C1C=CC=CO1 Amb21951679 [0,0,0,0,0,1|0,0,3]=4 2414 B7R1.3 O=C1C=CCC=N1 Amb24076140 [0,0,0,0,0,1|1,0,2]=4 2415 B7R1.3 O=C1C=CCCC1 Amb17843126 [0,0,0,0,0,1|1,0,0]=2 2416 B7R1.3 O=C1C=CCCN1 Amb22001783 [0,0,0,0,0,1|1,0,1]=3 2417 B7R1.3 O=C1C=CCCO1 Amb15693457 [0,0,0,0,0,1|0,0,1]=2 2418 B7R1.3 O=C1C=CCOC1 Amb22234519 [0,0,0,0,0,1|0,0,2]=3 2419 B7R1.3 O=C1C=CCSC1 Amb26544956 [0,0,0,0,0,1|1,0,1]=3 2420 B7R1.3 O=C1C=CNCC1 Amb2700614 [0,0,0,0,0,1|1,0,1]=3 2421 B7R1.3 O=C1C=COCC1 Amb22000873 [0,0,0,0,0,1|1,0,1]=3 2422 B7R1.3 O=C1C=CSCC1 Amb25375022 [0,0,0,0,0,1|1,0,1]=3 2423 B7R1.3 O=C1C=NC=NC1 Amb24093715 [0,0,0,0,0,1|2,0,1]=4 2424 B7R1.3 O=C1C=NCCN1 Amb28341190 [0,0,0,0,0,1|1,0,1]=3 2425 B7R1.3 O=C1CC=NC=N1 Amb10601894 [0,0,0,0,0,1|1,0,2]=4 2426 B7R1.3 O=C1CCC=CN1 Amb26365285 [0,0,0,0,0,1|1,0,1]=3 2427 B7R1.3 O=C1CCCCC1 Amb2793026 [0,0,0,0,0,1|1,0,0]=2 2428 B7R1.3 O=C1CCCCN1 Amb6892006 [0,0,0,0,0,1|1,0,0]=2 2429 B7R1.3 O=C1CCCCO1 Amb8513592 [0,0,0,0,0,1|0,0,0]=1 2430 B7R1.3 O=C1CCCCS1 Amb25186924 [0,0,0,0,0,1|0,1,0]=2 2431 B7R1.3 O=C1CCCNC1 Amb10070944 [0,0,0,0,0,1|1,0,0]=2 2432 B7R1.3 O=C1CCCNC1 Amb10602349 [0,0,0,0,0,1|1,0,0]=2 2433 B7R1.3 O=C1CCCNC1 Amb19958010 [0,0,0,0,0,1|1,0,0]=2 2434 B7R1.3 O=C1CCCNN1 Amb18061622 [0,0,0,0,0,1|1,0,0]=2 2435 B7R1.3 O=C1CCCOC1 Amb19373430 [0,0,0,0,0,1|0,0,0]=1 2436 B7R1.3 O=C1CCCON1 Amb26560803 [0,0,0,0,0,1|0,0,0]=1 2437 B7R1.3 O=C1CCCSC1 Amb13952257 [0,0,0,0,0,1|0,1,0]=2 2438 B7R1.3 O=C1CCN=CN1 Amb27447786 [0,0,0,0,0,1|1,0,1]=3 2439 B7R1.3 O=C1CCNCC1 Amb2690392 [0,0,0,0,0,1|1,0,0]=2 2440 B7R1.3 O=C1CCNCC1 Amb2793002 [0,0,0,0,0,1|1,0,0]=2 2441 B7R1.3 O=C1CCNCC1 Amb8394939 [0,0,0,0,0,1|1,0,0]=2 2442 B7R1.3 O=C1CCNCN1 Amb27458283 [0,0,0,0,0,1|1,0,0]=2 2443 B7R1.3 O=C1CCOCC1 Amb2725565 [0,0,0,0,0,1|1,0,0]=2 2444 B7R1.3 O=C1CCSCC1 Amb1154265 [0,0,0,0,0,1|1,0,0]=2 2445 B7R1.3 O=C1CNC=NN1 Amb27817820 [0,0,0,0,0,1|2,0,1]=4 2446 B7R1.3 O=C1CNCCN1 Amb4138465 [0,0,0,0,0,1|1,0,0]=2 2447 B7R1.3 O=C1CNCCN1 Amb6334808 [0,0,0,0,0,1|1,0,0]=2 2448 B7R1.3 O=C1CNCCO1 Amb19958702 [0,0,0,0,0,1|0,0,0]=1 2449 B7R1.3 O=C1CNCCO1 Amb32410210 [0,0,0,0,0,1|0,0,0]=1 2450 B7R1.3 O=C1COCCN1 Amb15691115 [0,0,0,0,0,1|1,0,0]=2 2451 B7R1.3 O=C1COCCO1 Amb17933352 [0,0,0,0,0,1|0,0,0]=1 2452 B7R1.3 O=C1CSC=CN1 Amb2386683 [0,0,0,0,0,1|1,0,2]=4 2453 B7R1.3 O=C1CSCCN1 Amb674722 [0,0,0,0,0,1|1,0,0]=2 2454 B7R1.3 O=C1CSCCO1 Amb28069740 [0,0,0,0,0,1|0,0,0]=1 2455 B7R1.3 O=C1CSCCS1 Amb24539369 [0,0,0,0,0,1|0,1,0]=2 2456 B7R1.3 O=C1CSCSC1 Amb19148039 [0,0,0,0,0,1|1,1,0]=3 2457 B7R1.3 O=C1N=CCCN1 Amb24480889 [0,0,0,0,0,1|1,0,1]=3 2458 B7R1.3 O=C1NCCCN1 Amb4034594 [0,0,0,0,0,1|1,0,0]=2 2459 B7R1.3 O=C1NCCCO1 Amb10608499 [0,0,0,0,0,1|0,0,0]=1 2460 B7R1.3 O=C1NCCCS1 Amb24117134 [0,0,0,0,0,1|0,1,0]=2 2461 B7R1.3 O=C1NCCNN1 Amb28341733 [0,0,0,0,0,1|2,0,0]=3 2462 B7R1.3 O=C1NCNCN1 Amb25146452 [0,0,0,0,0,1|2,0,0]=3 2463 B7R1.3 O=C1NNCCO1 Amb32683554 [0,0,0,0,0,1|1,0,0]=2 2464 B7R1.3 O=C1OCCCO1 Amb4034896 [0,0,0,0,0,1|0,0,0]=1 2465 B7R1.3 O=S1CCCNC1 Amb27195521 [0,0,0,0,0,1|2,0,0]=3 2466 B7R1.3 O=S1CCNCC1 Amb18943760 [0,0,0,0,0,1|2,0,0]=3 2467 B7R1.3 O=S1CCNCC1 Amb6307179 [0,0,0,0,0,1|2,0,0]=3 2468 B7R1.3 O=S1CCOCC1 Amb26535052 [0,0,0,0,0,1|2,0,0]=3 2469 B7R1.3 O=S1CCSCC1 Amb25679286 [0,0,0,0,0,1|2,0,0]=3 2470 B7R1.3 O=S1OCCCO1 Amb20240777 [0,0,0,0,0,1|1,0,0]=2 2471 B7R1.3 OC1=CN=NCC1 Amb22756935 [0,0,0,0,0,1|2,0,1]=4 2472 B7R1.3 OC1=NCCNC1 Amb22330543 [0,0,0,0,0,1|1,0,1]=3 2473 B7R1.3 OC1C=CCCC1 Amb4605824 [0,0,0,0,0,1|1,0,2]=4 2474 B7R1.3 OC1CCCCC1 Amb4605832 [0,0,0,0,0,1|1,0,2]=4 2475 B7R1.3 OC1CCCCN1 Amb8393085 [0,0,0,0,0,1|1,0,2]=4 2476 B7R1.3 OC1CCCCO1 Amb8517292 [0,0,0,0,0,1|0,0,2]=3 2477 B7R1.3 OC1CCCNC1 Amb3939221 [0,0,0,0,0,1|1,0,2]=4 2478 B7R1.3 OC1CCCNC1 Amb4036802 [0,0,0,0,0,1|1,0,2]=4 2479 B7R1.3 OC1CCCOC1 Amb16192108 [0,0,0,0,0,1|0,0,2]=3 2480 B7R1.3 OC1CCCSC1 Amb4034626 [0,0,0,0,0,1|0,1,2]=4 2481 B7R1.3 OC1CCNCC1 Amb1152974 [0,0,0,0,0,1|1,0,2]=4 2482 B7R1.3 OC1CCNCC1 Amb2720309 [0,0,0,0,0,1|1,0,2]=4 2483 B7R1.3 OC1CCNCC1 Amb32679563 [0,0,0,0,0,1|1,0,2]=4 2484 B7R1.3 OC1CCNOC1 Amb32698233 [0,0,0,0,0,1|1,0,2]=4 2485 B7R1.3 OC1CCOCC1 Amb2723454 [0,0,0,0,0,1|1,0,2]=4 2486 B7R1.3 OC1CCSCC1 Amb2610612 [0,0,0,0,0,1|1,0,2]=4 2487 B7R1.3 OC1CNCCO1 Amb13883759 [0,0,0,0,0,1|0,0,2]=3 2488 B7R1.3 OC1CNCCO1 Amb22011707 [0,0,0,0,0,1|0,0,2]=3 2489 B7R1.3 OC1COCOC1 Amb4020024 [0,0,0,0,0,1|1,0,2]=4 2490 B7R1.3 OC1COCOC1 Amb6357756 [0,0,0,0,0,1|1,0,2]=4 2491 B7R1.3 ON1CCCCC1 Amb6468702 [0,0,0,0,0,1|2,0,1]=4 2492 B7R1.3 ON1CCOCC1 Amb25243510 [0,0,0,0,0,1|2,0,1]=4 2493 B7R1.3 O[C@@H]1CCCNC1 Amb20241315 [0,0,0,0,0,1|1,0,2]=4 2494 B7R1.3 O[C@@H]1CCCNC1 Amb8628462 [0,0,0,0,0,1|1,0,2]=4 2495 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [0,0,0,0,0,1|0,0,2]=3 2496 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [0,0,0,0,0,1|1,0,2]=4 2497 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [0,0,0,0,0,1|1,0,2]=4 2498 B7R1.3 O[C@H]1CCCNC1 Amb2688784 [0,0,0,0,0,1|1,0,2]=4 2499 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [0,0,0,0,0,1|0,0,2]=3 2500 B7R1.3 S=C1CCCCN1 Amb5720520 [0,0,0,0,0,1|1,1,0]=3 2501 B7R1.3 S=C1CCNCC1 Amb27232690 [0,0,0,0,0,1|1,1,0]=3 2502 B7R1.3 S=C1CCNCN1 Amb27205983 [0,0,0,0,0,1|1,1,0]=3 2503 B7R1.3 S=C1NCCCN1 Amb2690553 [0,0,0,0,0,1|1,1,0]=3 2504 B7R1.3 S=C1NCCCO1 Amb22524560 [0,0,0,0,0,1|0,1,0]=2 2505 B7R1.3 S=C1NCCCS1 Amb4012551 [0,0,0,0,0,1|0,2,0]=3 2506 B7R1.3 S=C1NCNCN1 Amb1289820 [0,0,0,0,0,1|2,1,0]=4 2507 B7R1.3 S=C1NCSCN1 Amb27838255 [0,0,0,0,0,1|2,1,0]=4 2508 B7R1.3 S=C1SCCCS1 Amb5717576 [0,0,0,0,0,1|0,2,0]=3 2509 B7R1.3 SC1=COCCC1 Amb33319911 [0,0,0,0,0,1|0,1,0]=2 2510 B7R1.3 SC1=NCCCN1 Amb2537133 [0,0,0,0,0,1|1,1,0]=3 2511 B7R1.3 SC1=NCCCS1 Amb4017252 [0,0,0,0,0,1|0,2,0]=3 2512 B7R1.3 SC1CCCCC1 Amb6608750 [0,0,0,0,0,1|1,1,1]=4 2513 B7R1.3 SC1CCCCN1 Amb27639704 [0,0,0,0,0,1|1,1,1]=4 2514 B7R1.3 SC1CCCNC1 Amb22371077 [0,0,0,0,0,1|1,1,1]=4 2515 B7R1.3 SC1CCCNC1 Amb27453630 [0,0,0,0,0,1|1,1,1]=4 2516 B7R1.3 SC1CCCOC1 Amb24066221 [0,0,0,0,0,1|0,1,1]=3 2517 B7R1.3 SC1CCCSC1 Amb27480711 [0,0,0,0,0,1|0,2,1]=4 2518 B7R1.3 SC1CCNCC1 Amb17502200 [0,0,0,0,0,1|1,1,1]=4 2519 B7R1.3 SC1CCNCC1 Amb22371055 [0,0,0,0,0,1|1,1,1]=4 2520 B7R1.3 SC1CCOCC1 Amb9472951 [0,0,0,0,0,1|1,1,1]=4 2521 B7R1.3 SC1CCSCC1 Amb26045860 [0,0,0,0,0,1|1,1,1]=4 2522 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [0,0,0,0,0,1|2,0,1]=4 2523 B7R1.3 [NH3+]C1CCOCC1 Amb22008598 [0,0,0,0,0,1|2,0,1]=4 2524 B4R0.1 C#CC(=O)O Amb6600128 [1,0,1,0,0,0|0,0,2]=4 2525 B4R0.1 C#CC(C)=O Amb2685717 [1,0,1,0,0,0|0,0,2]=4 2526 B4R0.1 C=C(C)CBr Amb33531183 [1,0,1,0,0,0|2,0,0]=4 2527 B4R0.1 C=C(C)CCl Amb2792918 [1,0,1,0,0,0|2,0,0]=4 2528 B4R0.1 C=C(C)CF Amb26019368 [1,0,1,0,0,0|2,0,0]=4 2529 B4R0.1 C=C(C)CI Amb26588956 [1,0,1,0,0,0|2,0,0]=4 2530 B4R0.1 C=C(C)CN Amb17749039 [1,0,1,0,0,0|2,0,0]=4 2531 B4R0.1 C=C(C)CO Amb8513444 [1,0,1,0,0,0|2,0,0]=4 2532 B4R0.1 C=C(C)CS Amb19888160 [1,0,1,0,0,0|2,0,0]=4 2533 B4R0.1 C=C(C)OC Amb6296633 [1,0,1,0,0,0|1,0,0]=3 2534 B4R0.1 C=C(Cl)CC Amb22228725 [1,0,1,0,0,0|1,0,1]=4 2535 B4R0.1 C=CC(=O)O Amb2792871 [1,0,1,0,0,0|0,0,2]=4 2536 B4R0.1 C=CC(C)=O Amb6608725 [1,0,1,0,0,0|0,0,2]=4 2537 B4R0.1 CC(=O)C#N Amb17231798 [1,0,1,0,0,0|1,0,1]=4 2538 B4R0.1 CC(=O)C=O Amb3940421 [1,0,1,0,0,0|1,0,1]=4 2539 B4R0.1 CC(=O)C=S Amb28118569 [1,0,1,0,0,0|1,0,1]=4 2540 B4R0.1 CC(=O)CBr Amb6673867 [1,0,1,0,0,0|1,0,0]=3 2541 B4R0.1 CC(=O)CCl Amb2792923 [1,0,1,0,0,0|1,0,0]=3 2542 B4R0.1 CC(=O)CI Amb22831972 [1,0,1,0,0,0|1,0,0]=3 2543 B4R0.1 CC(=O)CN Amb10603379 [1,0,1,0,0,0|1,0,0]=3 2544 B4R0.1 CC(=O)CN Amb22489444 [1,0,1,0,0,0|1,0,0]=3 2545 B4R0.1 CC(=O)CN Amb8393368 [1,0,1,0,0,0|1,0,0]=3 2546 B4R0.1 CC(=O)CO Amb2404925 [1,0,1,0,0,0|1,0,0]=3 2547 B4R0.1 CC(=O)CS Amb19148935 [1,0,1,0,0,0|1,0,0]=3 2548 B4R0.1 CC(=O)NBr Amb17672559 [1,0,1,0,0,0|2,0,0]=4 2549 B4R0.1 CC(=O)NCl Amb17939326 [1,0,1,0,0,0|2,0,0]=4 2550 B4R0.1 CC(=O)NI Amb28247845 [1,0,1,0,0,0|2,0,0]=4 2551 B4R0.1 CC(=O)NN Amb1153969 [1,0,1,0,0,0|2,0,0]=4 2552 B4R0.1 CC(=O)NO Amb2781575 [1,0,1,0,0,0|2,0,0]=4 2553 B4R0.1 CC(=O)OCl Amb28074273 [1,0,1,0,0,0|1,0,0]=3 2554 B4R0.1 CC(=O)OO Amb8517283 [1,0,1,0,0,0|1,0,0]=3 2555 B4R0.1 CC(=S)CI Amb28131646 [1,0,1,0,0,0|1,1,0]=4 2556 B4R0.1 CC=C(C)C Amb8513245 [1,0,1,0,0,0|1,0,1]=4 2557 B4R0.1 CCB(C)C Amb27253082 [1,0,1,0,0,0|2,0,0]=4 2558 B4R0.1 CCB(O)O Amb8387605 [1,0,1,0,0,0|1,0,1]=4 2559 B4R0.1 CCC(=N)N Amb2695032 [1,0,1,0,0,0|2,0,0]=4 2560 B4R0.1 CCC(=N)N Amb6316131 [1,0,1,0,0,0|2,0,0]=4 2561 B4R0.1 CCC(=O)Br Amb8517649 [1,0,1,0,0,0|1,0,0]=3 2562 B4R0.1 CCC(=O)Cl Amb2792924 [1,0,1,0,0,0|1,0,0]=3 2563 B4R0.1 CCC(=O)F Amb10839798 [1,0,1,0,0,0|1,0,0]=3 2564 B4R0.1 CCC(=O)O Amb3938995 [1,0,1,0,0,0|0,0,0]=2 2565 B4R0.1 CCC(=O)S Amb26953905 [1,0,1,0,0,0|0,1,0]=3 2566 B4R0.1 CCC(=O)[O-] Amb22731204 [1,0,1,0,0,0|0,0,1]=3 2567 B4R0.1 CCC(=O)[O-] Amb8513417 [1,0,1,0,0,0|0,0,1]=3 2568 B4R0.1 CCC(C)=O Amb4606002 [1,0,1,0,0,0|0,0,0]=2 2569 B4R0.1 CCC(C)Br Amb3940199 [1,0,1,0,0,0|1,0,1]=4 2570 B4R0.1 CCC(C)Cl Amb6608698 [1,0,1,0,0,0|1,0,1]=4 2571 B4R0.1 CCC(C)F Amb22008012 [1,0,1,0,0,0|1,0,1]=4 2572 B4R0.1 CCC(C)I Amb3940278 [1,0,1,0,0,0|1,0,1]=4 2573 B4R0.1 CCC(C)N Amb3939365 [1,0,1,0,0,0|1,0,1]=4 2574 B4R0.1 CCC(C)O Amb9748253 [1,0,1,0,0,0|0,0,2]=4 2575 B4R0.1 CCC(C)S Amb6608745 [1,0,1,0,0,0|0,1,1]=4 2576 B4R0.1 CCC(C)[NH3+] Amb34915660 [1,0,1,0,0,0|1,0,1]=4 2577 B4R0.1 CCC(C)[Zn+] Amb22228696 [1,0,1,0,0,0|1,0,1]=4 2578 B4R0.1 CCC(N)=O Amb3886522 [1,0,1,0,0,0|1,0,0]=3 2579 B4R0.1 CCC(N)=S Amb1114671 [1,0,1,0,0,0|1,1,0]=4 2580 B4R0.1 CCC(O)F Amb27763763 [1,0,1,0,0,0|1,0,1]=4 2581 B4R0.1 CCC(O)O Amb28280915 [1,0,1,0,0,0|0,0,2]=4 2582 B4R0.1 CCN(C)C Amb8514592 [1,0,1,0,0,0|2,0,0]=4 2583 B4R0.1 CCN(C)N Amb19664241 [1,0,1,0,0,0|2,0,0]=4 2584 B4R0.1 CCN(C)N Amb29844658 [1,0,1,0,0,0|2,0,0]=4 2585 B4R0.1 CCN(C)N Amb32653079 [1,0,1,0,0,0|2,0,0]=4 2586 B4R0.1 CCN(C)O Amb25746619 [1,0,1,0,0,0|1,0,1]=4 2587 B4R0.1 CCS(=O)Cl Amb24647938 [1,0,1,0,0,0|2,0,0]=4 2588 B4R0.1 CCS(=O)O Amb24332177 [1,0,1,0,0,0|1,0,0]=3 2589 B4R0.1 CCS(=O)[O-] Amb17943109 [1,0,1,0,0,0|1,0,1]=4 2590 B4R0.1 CCS(=O)[O-] Amb22411287 [1,0,1,0,0,0|1,0,1]=4 2591 B4R0.1 CCS(C)=O Amb25301908 [1,0,1,0,0,0|1,0,0]=3 2592 B4R0.1 CCS(N)=O Amb24734600 [1,0,1,0,0,0|2,0,0]=4 2593 B4R0.1 CC[C@@H](C)N Amb3939366 [1,0,1,0,0,0|1,0,1]=4 2594 B4R0.1 CC[C@@H](C)O Amb8514550 [1,0,1,0,0,0|0,0,2]=4 2595 B4R0.1 CC[C@@H](C)S Amb28197564 [1,0,1,0,0,0|0,1,1]=4 2596 B4R0.1 CC[C@H](C)Br Amb27657814 [1,0,1,0,0,0|1,0,1]=4 2597 B4R0.1 CC[C@H](C)N Amb19889468 [1,0,1,0,0,0|1,0,1]=4 2598 B4R0.1 CC[C@H](C)N Amb3939823 [1,0,1,0,0,0|1,0,1]=4 2599 B4R0.1 CC[C@H](C)O Amb4606006 [1,0,1,0,0,0|0,0,2]=4 2600 B4R0.1 CC[N+](=O)[O-] Amb6608854 [1,0,1,0,0,0|1,0,1]=4 2601 B4R0.1 CC[PH](=O)O Amb8391284 [1,0,1,0,0,0|1,0,0]=3 2602 B4R0.1 CC[SiH](C)Cl Amb27624485 [1,0,1,0,0,0|1,1,0]=4 2603 B4R0.1 CNC(=O)Cl Amb17942998 [1,0,1,0,0,0|2,0,0]=4 2604 B4R0.1 CNC(=O)F Amb27778388 [1,0,1,0,0,0|2,0,0]=4 2605 B4R0.1 CNC(C)=N Amb27407381 [1,0,1,0,0,0|2,0,0]=4 2606 B4R0.1 CNC(C)=N Amb28555318 [1,0,1,0,0,0|2,0,0]=4 2607 B4R0.1 CNC(C)=O Amb3886523 [1,0,1,0,0,0|1,0,0]=3 2608 B4R0.1 CNC(C)=S Amb23590663 [1,0,1,0,0,0|1,1,0]=4 2609 B4R0.1 CNC(N)=O Amb1152075 [1,0,1,0,0,0|2,0,0]=4 2610 B4R0.1 COC(=N)N Amb13777319 [1,0,1,0,0,0|2,0,0]=4 2611 B4R0.1 COC(=N)N Amb16232017 [1,0,1,0,0,0|2,0,0]=4 2612 B4R0.1 COC(=N)N Amb16232485 [1,0,1,0,0,0|2,0,0]=4 2613 B4R0.1 COC(=N)N Amb22552499 [1,0,1,0,0,0|2,0,0]=4 2614 B4R0.1 COC(=N)[NH3+] Amb24113668 [1,0,1,0,0,0|2,0,0]=4 2615 B4R0.1 COC(=O)Cl Amb3940230 [1,0,1,0,0,0|1,0,0]=3 2616 B4R0.1 COC(=O)[O-] Amb25688001 [1,0,1,0,0,0|1,0,0]=3 2617 B4R0.1 COC(=S)S Amb22011691 [1,0,1,0,0,0|1,1,0]=4 2618 B4R0.1 COC(=S)[S-] Amb19650987 [1,0,1,0,0,0|1,1,0]=4 2619 B4R0.1 COC(C)=N Amb10844798 [1,0,1,0,0,0|1,0,0]=3 2620 B4R0.1 COC(C)=N Amb6366201 [1,0,1,0,0,0|1,0,0]=3 2621 B4R0.1 COC(C)=O Amb6608821 [1,0,1,0,0,0|0,0,0]=2 2622 B4R0.1 COC(C)C Amb22732422 [1,0,1,0,0,0|1,0,1]=4 2623 B4R0.1 COC(C)Cl Amb17689403 [1,0,1,0,0,0|1,0,1]=4 2624 B4R0.1 COC(N)=O Amb6608701 [1,0,1,0,0,0|1,0,0]=3 2625 B4R0.1 COC(N)=S Amb25067716 [1,0,1,0,0,0|1,1,0]=4 2626 B4R0.1 COC(N)=[NH2+] Amb19957963 [1,0,1,0,0,0|2,0,0]=4 2627 B4R0.1 COC(N)=[NH2+] Amb22733848 [1,0,1,0,0,0|2,0,0]=4 2628 B4R0.1 CON(C)C Amb22732357 [1,0,1,0,0,0|2,0,0]=4 2629 B4R0.1 CO[N+](=O)[O-] Amb17938647 [1,0,1,0,0,0|2,0,0]=4 2630 B4R0.1 CO[PH](=O)O Amb27489021 [1,0,1,0,0,0|2,0,0]=4 2631 B4R0.1 CO[SiH](C)C Amb19893837 [1,0,1,0,0,0|1,1,0]=4 2632 B4R0.1 CS(=O)CBr Amb24476829 [1,0,1,0,0,0|2,0,0]=4 2633 B4R0.1 CS(=O)CCl Amb28457220 [1,0,1,0,0,0|2,0,0]=4 2634 B4R0.1 CSC(=O)Cl Amb22336225 [1,0,1,0,0,0|1,1,0]=4 2635 B4R0.1 CSC(C)=N Amb28344632 [1,0,1,0,0,0|1,1,0]=4 2636 B4R0.1 CSC(C)=S Amb25992258 [1,0,1,0,0,0|0,2,0]=4 2637 B4R0.1 CSC(N)=O Amb25082577 [1,0,1,0,0,0|1,1,0]=4 2638 B4R0.1 CSS(C)=O Amb25786159 [1,0,1,0,0,0|1,1,0]=4 2639 B4R0.1 C\C=C(/C)Cl Amb25025045 [1,0,1,0,0,0|1,0,1]=4 2640 B4R0.1 C\C=C(\C)Br Amb20001493 [1,0,1,0,0,0|1,0,1]=4 2641 B4R0.1 C\C=C(\C)Cl Amb22731715 [1,0,1,0,0,0|1,0,1]=4 2642 B4R0.1 C\C=C(\C)N Amb26529209 [1,0,1,0,0,0|1,0,1]=4 2643 B4R0.1 NC(=O)CBr Amb4477263 [1,0,1,0,0,0|2,0,0]=4 2644 B4R0.1 NC(=O)CCl Amb1933827 [1,0,1,0,0,0|2,0,0]=4 2645 B4R0.1 NC(=O)CF Amb6891955 [1,0,1,0,0,0|2,0,0]=4 2646 B4R0.1 NC(=O)CI Amb2688829 [1,0,1,0,0,0|2,0,0]=4 2647 B4R0.1 NC(=O)CO Amb1804460 [1,0,1,0,0,0|2,0,0]=4 2648 B4R0.1 NC(=O)CS Amb2724286 [1,0,1,0,0,0|2,0,0]=4 2649 B4R0.1 NC(=O)C[SiH3] Amb27807227 [1,0,1,0,0,0|1,1,0]=4 2650 B4R0.1 NCC(=O)Br Amb27810916 [1,0,1,0,0,0|2,0,0]=4 2651 B4R0.1 NCC(=O)Cl Amb6740270 [1,0,1,0,0,0|2,0,0]=4 2652 B4R0.1 NCC(=O)O Amb2609025 [1,0,1,0,0,0|1,0,0]=3 2653 B4R0.1 NCC(=O)O Amb33869972 [1,0,1,0,0,0|1,0,0]=3 2654 B4R0.1 NCC(=O)O Amb8516646 [1,0,1,0,0,0|1,0,0]=3 2655 B4R0.1 NCC(=O)S Amb17593043 [1,0,1,0,0,0|1,1,0]=4 2656 B4R0.1 NCC(=O)[O-] Amb21962917 [1,0,1,0,0,0|1,0,1]=4 2657 B4R0.1 NCC(=O)[O-] Amb22493796 [1,0,1,0,0,0|1,0,1]=4 2658 B4R0.1 NCC(=O)[O-] Amb440282 [1,0,1,0,0,0|1,0,1]=4 2659 B4R0.1 NCC(=O)[O-] Amb5722007 [1,0,1,0,0,0|1,0,1]=4 2660 B4R0.1 NCC(N)=O Amb10604177 [1,0,1,0,0,0|2,0,0]=4 2661 B4R0.1 NCC(N)=O Amb22234569 [1,0,1,0,0,0|2,0,0]=4 2662 B4R0.1 NCC(N)=O Amb6609053 [1,0,1,0,0,0|2,0,0]=4 2663 B4R0.1 NC[PH](=O)O Amb776032 [1,0,1,0,0,0|2,0,0]=4 2664 B4R0.1 NNC(=O)O Amb33512897 [1,0,1,0,0,0|2,0,0]=4 2665 B4R0.1 O=C(Br)CBr Amb2793022 [1,0,1,0,0,0|2,0,0]=4 2666 B4R0.1 O=C(Br)CCl Amb27168386 [1,0,1,0,0,0|2,0,0]=4 2667 B4R0.1 O=C(Cl)CBr Amb6608953 [1,0,1,0,0,0|2,0,0]=4 2668 B4R0.1 O=C(Cl)CCl Amb2793043 [1,0,1,0,0,0|2,0,0]=4 2669 B4R0.1 O=C(Cl)CF Amb16185604 [1,0,1,0,0,0|2,0,0]=4 2670 B4R0.1 O=C(Cl)CI Amb22045163 [1,0,1,0,0,0|2,0,0]=4 2671 B4R0.1 O=C(F)CCl Amb10839258 [1,0,1,0,0,0|2,0,0]=4 2672 B4R0.1 O=C(I)CCl Amb27639296 [1,0,1,0,0,0|2,0,0]=4 2673 B4R0.1 O=C(O)C=S Amb28042222 [1,0,1,0,0,0|1,0,1]=4 2674 B4R0.1 O=C(O)CBr Amb6608658 [1,0,1,0,0,0|1,0,0]=3 2675 B4R0.1 O=C(O)CCl Amb2792919 [1,0,1,0,0,0|1,0,0]=3 2676 B4R0.1 O=C(O)CF Amb6740304 [1,0,1,0,0,0|1,0,0]=3 2677 B4R0.1 O=C(O)CI Amb1916034 [1,0,1,0,0,0|1,0,0]=3 2678 B4R0.1 O=C(O)CO Amb2793019 [1,0,1,0,0,0|1,0,0]=3 2679 B4R0.1 O=C(O)CS Amb6608659 [1,0,1,0,0,0|1,0,0]=3 2680 B4R0.1 O=C(O)C[Na] Amb28255644 [1,0,1,0,0,0|1,0,0]=3 2681 B4R0.1 O=C(O)O[Na] Amb22411585 [1,0,1,0,0,0|2,0,0]=4 2682 B4R0.1 O=C([O-])CO Amb22730982 [1,0,1,0,0,0|1,0,1]=4 2683 B4R0.1 O=C([O-])CO Amb8516148 [1,0,1,0,0,0|1,0,1]=4 2684 B4R0.1 O=C([O-])CS Amb8395172 [1,0,1,0,0,0|1,0,1]=4 2685 B4R0.1 O=CC(=O)O Amb3940872 [1,0,1,0,0,0|1,0,1]=4 2686 B4R0.1 O=CC(=O)O Amb6609044 [1,0,1,0,0,0|1,0,1]=4 2687 B4R0.1 O=S(O)CCl Amb27468736 [1,0,1,0,0,0|2,0,0]=4 2688 B4R0.1 O=S(O)CO Amb27621151 [1,0,1,0,0,0|2,0,0]=4 2689 B4R0.1 [Li]C(C)CC Amb8513857 [1,0,1,0,0,0|1,0,1]=4 2690 B4R0.2 BOCCN Amb28363843 [1,0,1,0,0,0|2,0,0]=4 2691 B4R0.2 BrCCCBr Amb2686759 [1,0,1,0,0,0|2,0,0]=4 2692 B4R0.2 BrCCCI Amb18090828 [1,0,1,0,0,0|2,0,0]=4 2693 B4R0.2 C#CCCC Amb3940495 [1,0,1,0,0,0|1,0,1]=4 2694 B4R0.2 C#CCCO Amb2685716 [1,0,1,0,0,0|0,0,2]=4 2695 B4R0.2 C#CCCO Amb34916688 [1,0,1,0,0,0|0,0,2]=4 2696 B4R0.2 C#COCC Amb2687848 [1,0,1,0,0,0|0,0,2]=4 2697 B4R0.2 C#NCCC Amb31132336 [1,0,1,0,0,0|1,0,1]=4 2698 B4R0.2 C=C=CCC Amb10565985 [1,0,1,0,0,0|1,0,1]=4 2699 B4R0.2 C=C=CCO Amb17673299 [1,0,1,0,0,0|0,0,2]=4 2700 B4R0.2 C=C=COC Amb17673262 [1,0,1,0,0,0|0,0,2]=4 2701 B4R0.2 C=CCC=O Amb25058716 [1,0,1,0,0,0|0,0,2]=4 2702 B4R0.2 C=CCCBr Amb2684977 [1,0,1,0,0,0|1,0,1]=4 2703 B4R0.2 C=CCCC Amb8514606 [1,0,1,0,0,0|1,0,0]=3 2704 B4R0.2 C=CCCCl Amb22229725 [1,0,1,0,0,0|1,0,1]=4 2705 B4R0.2 C=CCCF Amb27869562 [1,0,1,0,0,0|1,0,1]=4 2706 B4R0.2 C=CCCI Amb33546459 [1,0,1,0,0,0|1,0,1]=4 2707 B4R0.2 C=CCCN Amb10601640 [1,0,1,0,0,0|1,0,1]=4 2708 B4R0.2 C=CCCN Amb33484127 [1,0,1,0,0,0|1,0,1]=4 2709 B4R0.2 C=CCCN Amb5717434 [1,0,1,0,0,0|1,0,1]=4 2710 B4R0.2 C=CCCO Amb6609024 [1,0,1,0,0,0|0,0,1]=3 2711 B4R0.2 C=CCC[NH3+] Amb5718705 [1,0,1,0,0,0|1,0,1]=4 2712 B4R0.2 C=CCNC Amb3940004 [1,0,1,0,0,0|2,0,0]=4 2713 B4R0.2 C=CCSC Amb3940478 [1,0,1,0,0,0|2,0,0]=4 2714 B4R0.2 C=CNCC Amb24120592 [1,0,1,0,0,0|1,0,1]=4 2715 B4R0.2 C=COC=O Amb22734253 [1,0,1,0,0,0|0,0,2]=4 2716 B4R0.2 C=COCBr Amb27434716 [1,0,1,0,0,0|1,0,1]=4 2717 B4R0.2 C=COCC Amb2447619 [1,0,1,0,0,0|0,0,1]=3 2718 B4R0.2 C=COCCl Amb28387218 [1,0,1,0,0,0|1,0,1]=4 2719 B4R0.2 C=CSCC Amb10604172 [1,0,1,0,0,0|0,1,1]=4 2720 B4R0.2 C=NCCO Amb27827243 [1,0,1,0,0,0|1,0,0]=3 2721 B4R0.2 CC#CC=O Amb24477088 [1,0,1,0,0,0|0,0,2]=4 2722 B4R0.2 CC=C=CC Amb17670597 [1,0,1,0,0,0|1,0,1]=4 2723 B4R0.2 CCCC#N Amb6662840 [1,0,1,0,0,0|1,0,1]=4 2724 B4R0.2 CCCC=O Amb3940026 [1,0,1,0,0,0|0,0,0]=2 2725 B4R0.2 CCCCBr Amb2795761 [1,0,1,0,0,0|1,0,1]=4 2726 B4R0.2 CCCCCl Amb3940273 [1,0,1,0,0,0|1,0,1]=4 2727 B4R0.2 CCCCF Amb2688075 [1,0,1,0,0,0|1,0,1]=4 2728 B4R0.2 CCCCI Amb4606011 [1,0,1,0,0,0|1,0,1]=4 2729 B4R0.2 CCCCN Amb22002333 [1,0,1,0,0,0|1,0,1]=4 2730 B4R0.2 CCCCN Amb3939832 [1,0,1,0,0,0|1,0,1]=4 2731 B4R0.2 CCCCO Amb2793053 [1,0,1,0,0,0|0,0,1]=3 2732 B4R0.2 CCCCS Amb8513452 [1,0,1,0,0,0|0,1,1]=4 2733 B4R0.2 CCCC[SiH3] Amb19883792 [1,0,1,0,0,0|1,0,1]=4 2734 B4R0.2 CCCNC Amb1125050 [1,0,1,0,0,0|1,0,1]=4 2735 B4R0.2 CCCNC Amb13951517 [1,0,1,0,0,0|1,0,1]=4 2736 B4R0.2 CCCNN Amb22490873 [1,0,1,0,0,0|2,0,0]=4 2737 B4R0.2 CCCNN Amb6246347 [1,0,1,0,0,0|2,0,0]=4 2738 B4R0.2 CCCNN Amb9147579 [1,0,1,0,0,0|2,0,0]=4 2739 B4R0.2 CCCOC Amb22227974 [1,0,1,0,0,0|0,0,1]=3 2740 B4R0.2 CCCON Amb21929105 [1,0,1,0,0,0|1,0,0]=3 2741 B4R0.2 CCCON Amb4061686 [1,0,1,0,0,0|1,0,0]=3 2742 B4R0.2 CCCSC Amb22045208 [1,0,1,0,0,0|0,1,1]=4 2743 B4R0.2 CCISC Amb27753276 [1,0,1,0,0,0|1,1,0]=4 2744 B4R0.2 CCN=C=O Amb3939325 [1,0,1,0,0,0|1,0,1]=4 2745 B4R0.2 CCNC=O Amb22229692 [1,0,1,0,0,0|1,0,0]=3 2746 B4R0.2 CCNC=S Amb24476965 [1,0,1,0,0,0|1,1,0]=4 2747 B4R0.2 CCNCC Amb21520464 [1,0,1,0,0,0|1,0,1]=4 2748 B4R0.2 CCNCC Amb22047271 [1,0,1,0,0,0|1,0,1]=4 2749 B4R0.2 CCNCC Amb2793074 [1,0,1,0,0,0|1,0,1]=4 2750 B4R0.2 CCNCC Amb8513512 [1,0,1,0,0,0|1,0,1]=4 2751 B4R0.2 CCNCO Amb28048578 [1,0,1,0,0,0|1,0,1]=4 2752 B4R0.2 CCNOC Amb25082359 [1,0,1,0,0,0|1,0,0]=3 2753 B4R0.2 CCNOC Amb33164114 [1,0,1,0,0,0|1,0,0]=3 2754 B4R0.2 CCOC=O Amb3429671 [1,0,1,0,0,0|0,0,0]=2 2755 B4R0.2 CCOCBr Amb26033270 [1,0,1,0,0,0|1,0,1]=4 2756 B4R0.2 CCOCC Amb10807375 [1,0,1,0,0,0|0,0,1]=3 2757 B4R0.2 CCOCC Amb8513220 [1,0,1,0,0,0|0,0,1]=3 2758 B4R0.2 CCOCCl Amb8516247 [1,0,1,0,0,0|1,0,1]=4 2759 B4R0.2 CCOCO Amb25042105 [1,0,1,0,0,0|0,0,2]=4 2760 B4R0.2 CCONC Amb22388890 [1,0,1,0,0,0|1,0,0]=3 2761 B4R0.2 CCONC Amb33495158 [1,0,1,0,0,0|1,0,0]=3 2762 B4R0.2 CCPCC Amb19889866 [1,0,1,0,0,0|1,0,1]=4 2763 B4R0.2 CCSCC Amb8386438 [1,0,1,0,0,0|0,1,1]=4 2764 B4R0.2 CCSSC Amb22230676 [1,0,1,0,0,0|1,1,0]=4 2765 B4R0.2 CC[AlH3+]CC Amb22053728 [1,0,1,0,0,0|1,0,1]=4 2766 B4R0.2 CC[Ga]CC Amb33513021 [1,0,1,0,0,0|1,0,1]=4 2767 B4R0.2 CC[OH+]CC Amb27461536 [1,0,1,0,0,0|0,0,2]=4 2768 B4R0.2 CC[SiH2]CC Amb19893778 [1,0,1,0,0,0|1,0,1]=4 2769 B4R0.2 CC[Zn]CC Amb8514301 [1,0,1,0,0,0|1,0,1]=4 2770 B4R0.2 CC\C=C/I Amb27985379 [1,0,1,0,0,0|1,0,1]=4 2771 B4R0.2 CC\C=C\Cl Amb25024567 [1,0,1,0,0,0|1,0,1]=4 2772 B4R0.2 CC\C=C\I Amb28346900 [1,0,1,0,0,0|1,0,1]=4 2773 B4R0.2 CC\C=N\O Amb24369620 [1,0,1,0,0,0|1,0,1]=4 2774 B4R0.2 CNCC=O Amb28133605 [1,0,1,0,0,0|1,0,0]=3 2775 B4R0.2 CNCCO Amb2793086 [1,0,1,0,0,0|1,0,1]=4 2776 B4R0.2 COCC=O Amb3941034 [1,0,1,0,0,0|1,0,0]=3 2777 B4R0.2 COCCBr Amb2685166 [1,0,1,0,0,0|1,0,1]=4 2778 B4R0.2 COCCCl Amb3940260 [1,0,1,0,0,0|1,0,1]=4 2779 B4R0.2 COCCI Amb22228848 [1,0,1,0,0,0|1,0,1]=4 2780 B4R0.2 COCCN Amb3939058 [1,0,1,0,0,0|1,0,1]=4 2781 B4R0.2 COCCO Amb4605828 [1,0,1,0,0,0|1,0,1]=4 2782 B4R0.2 COCCS Amb6255784 [1,0,1,0,0,0|1,0,1]=4 2783 B4R0.2 COCOC Amb6608858 [1,0,1,0,0,0|1,0,1]=4 2784 B4R0.2 COCON Amb22549472 [1,0,1,0,0,0|2,0,0]=4 2785 B4R0.2 CO\C=C\Br Amb27259287 [1,0,1,0,0,0|1,0,1]=4 2786 B4R0.2 CPCCO Amb27594723 [1,0,1,0,0,0|1,0,1]=4 2787 B4R0.2 CSCC=O Amb27250514 [1,0,1,0,0,0|1,0,0]=3 2788 B4R0.2 CSCCO Amb3568993 [1,0,1,0,0,0|1,0,1]=4 2789 B4R0.2 C\C=C/CC Amb8517400 [1,0,1,0,0,0|1,0,0]=3 2790 B4R0.2 C\C=C/CCl Amb28367227 [1,0,1,0,0,0|2,0,0]=4 2791 B4R0.2 C\C=C\C=O Amb6891937 [1,0,1,0,0,0|0,0,2]=4 2792 B4R0.2 C\C=C\CBr Amb3940083 [1,0,1,0,0,0|2,0,0]=4 2793 B4R0.2 C\C=C\CC Amb9134767 [1,0,1,0,0,0|1,0,0]=3 2794 B4R0.2 C\C=C\CCl Amb3940264 [1,0,1,0,0,0|2,0,0]=4 2795 B4R0.2 C\C=C\CI Amb26567317 [1,0,1,0,0,0|2,0,0]=4 2796 B4R0.2 C\C=C\CN Amb22490422 [1,0,1,0,0,0|2,0,0]=4 2797 B4R0.2 C\C=C\CN Amb32693433 [1,0,1,0,0,0|2,0,0]=4 2798 B4R0.2 C\C=C\CO Amb9277796 [1,0,1,0,0,0|1,0,1]=4 2799 B4R0.2 C\C=C\OC Amb25747348 [1,0,1,0,0,0|0,0,1]=3 2800 B4R0.2 C\C=C\SC Amb27782691 [1,0,1,0,0,0|0,1,1]=4 2801 B4R0.2 C\C=N\OC Amb24115747 [1,0,1,0,0,0|1,0,1]=4 2802 B4R0.2 C\N=C\C=O Amb27849988 [1,0,1,0,0,0|1,0,1]=4 2803 B4R0.2 ClCCCBr Amb6608966 [1,0,1,0,0,0|2,0,0]=4 2804 B4R0.2 ClCCCCl Amb2793083 [1,0,1,0,0,0|2,0,0]=4 2805 B4R0.2 ClCCCI Amb2686137 [1,0,1,0,0,0|2,0,0]=4 2806 B4R0.2 FCCCBr Amb10845700 [1,0,1,0,0,0|2,0,0]=4 2807 B4R0.2 FCCCF Amb10839359 [1,0,1,0,0,0|2,0,0]=4 2808 B4R0.2 FCCCI Amb10838561 [1,0,1,0,0,0|2,0,0]=4 2809 B4R0.2 FCCCS Amb28344639 [1,0,1,0,0,0|1,1,0]=4 2810 B4R0.2 ICCCI Amb8514578 [1,0,1,0,0,0|2,0,0]=4 2811 B4R0.2 N#CCC=O Amb9669129 [1,0,1,0,0,0|1,0,1]=4 2812 B4R0.2 N#CCCO Amb534940 [1,0,1,0,0,0|1,0,1]=4 2813 B4R0.2 NCCC=S Amb28366830 [1,0,1,0,0,0|1,1,0]=4 2814 B4R0.2 NCCCBr Amb22489540 [1,0,1,0,0,0|2,0,0]=4 2815 B4R0.2 NCCCBr Amb6609025 [1,0,1,0,0,0|2,0,0]=4 2816 B4R0.2 NCCCBr Amb932825 [1,0,1,0,0,0|2,0,0]=4 2817 B4R0.2 NCCCCl Amb2720482 [1,0,1,0,0,0|2,0,0]=4 2818 B4R0.2 NCCCCl Amb6306670 [1,0,1,0,0,0|2,0,0]=4 2819 B4R0.2 NCCCF Amb16186035 [1,0,1,0,0,0|2,0,0]=4 2820 B4R0.2 NCCCF Amb19374917 [1,0,1,0,0,0|2,0,0]=4 2821 B4R0.2 NCCCI Amb33249705 [1,0,1,0,0,0|2,0,0]=4 2822 B4R0.2 NCCCN Amb21953130 [1,0,1,0,0,0|2,0,0]=4 2823 B4R0.2 NCCCN Amb21953284 [1,0,1,0,0,0|2,0,0]=4 2824 B4R0.2 NCCCN Amb2793020 [1,0,1,0,0,0|2,0,0]=4 2825 B4R0.2 NCCCO Amb22229163 [1,0,1,0,0,0|1,0,0]=3 2826 B4R0.2 NCCCO Amb2793042 [1,0,1,0,0,0|1,0,0]=3 2827 B4R0.2 NCCCS Amb17500723 [1,0,1,0,0,0|1,1,0]=4 2828 B4R0.2 NCCCS Amb18368606 [1,0,1,0,0,0|1,1,0]=4 2829 B4R0.2 NCCCS Amb20623313 [1,0,1,0,0,0|1,1,0]=4 2830 B4R0.2 NCCNO Amb24476856 [1,0,1,0,0,0|2,0,0]=4 2831 B4R0.2 NCCON Amb19958432 [1,0,1,0,0,0|2,0,0]=4 2832 B4R0.2 NCCON Amb22054301 [1,0,1,0,0,0|2,0,0]=4 2833 B4R0.2 NCCON Amb22233863 [1,0,1,0,0,0|2,0,0]=4 2834 B4R0.2 NNCCO Amb2695098 [1,0,1,0,0,0|2,0,0]=4 2835 B4R0.2 NOCCF Amb22008453 [1,0,1,0,0,0|2,0,0]=4 2836 B4R0.2 NOCCF Amb25858004 [1,0,1,0,0,0|2,0,0]=4 2837 B4R0.2 NOCCO Amb17190317 [1,0,1,0,0,0|2,0,0]=4 2838 B4R0.2 N[NH2+]CCO Amb27867172 [1,0,1,0,0,0|2,0,0]=4 2839 B4R0.2 O=CCC=O Amb33512721 [1,0,1,0,0,0|0,0,2]=4 2840 B4R0.2 O=CCCCl Amb16233605 [1,0,1,0,0,0|1,0,0]=3 2841 B4R0.2 O=CCCF Amb21858609 [1,0,1,0,0,0|1,0,0]=3 2842 B4R0.2 O=CCCI Amb26847605 [1,0,1,0,0,0|1,0,0]=3 2843 B4R0.2 O=CCCO Amb24412391 [1,0,1,0,0,0|0,0,0]=2 2844 B4R0.2 O=CCCS Amb27755008 [1,0,1,0,0,0|0,1,0]=3 2845 B4R0.2 O=CNCO Amb27754843 [1,0,1,0,0,0|1,0,0]=3 2846 B4R0.2 O=CNCS Amb27846487 [1,0,1,0,0,0|1,1,0]=4 2847 B4R0.2 O=C\C=N\O Amb25746308 [1,0,1,0,0,0|1,0,1]=4 2848 B4R0.2 OCCCBr Amb932815 [1,0,1,0,0,0|1,0,0]=3 2849 B4R0.2 OCCCCl Amb6608905 [1,0,1,0,0,0|1,0,0]=3 2850 B4R0.2 OCCCF Amb2688406 [1,0,1,0,0,0|1,0,0]=3 2851 B4R0.2 OCCCI Amb2688881 [1,0,1,0,0,0|1,0,0]=3 2852 B4R0.2 OCCCO Amb2793089 [1,0,1,0,0,0|0,0,1]=3 2853 B4R0.2 OCCCS Amb8517566 [1,0,1,0,0,0|0,1,0]=3 2854 B4R0.2 OCCNBr Amb27265947 [1,0,1,0,0,0|2,0,0]=4 2855 B4R0.2 OCCNCl Amb27206146 [1,0,1,0,0,0|2,0,0]=4 2856 B4R0.2 OCCNF Amb27775764 [1,0,1,0,0,0|2,0,0]=4 2857 B4R0.2 OCNCCl Amb16224807 [1,0,1,0,0,0|2,0,0]=4 2858 B4R0.2 OCNCO Amb2793034 [1,0,1,0,0,0|1,0,1]=4 2859 B4R0.2 OCOCCl Amb28280946 [1,0,1,0,0,0|2,0,0]=4 2860 B4R0.2 OCSCO Amb27812260 [1,0,1,0,0,0|1,0,1]=4 2861 B4R0.2 OC\C=C/I Amb23539305 [1,0,1,0,0,0|1,0,1]=4 2862 B4R0.2 OC\C=C\Br Amb32653556 [1,0,1,0,0,0|1,0,1]=4 2863 B4R0.2 OC\C=C\Cl Amb33531874 [1,0,1,0,0,0|1,0,1]=4 2864 B4R0.2 OC\C=C\I Amb24642752 [1,0,1,0,0,0|1,0,1]=4 2865 B4R0.2 ONCCF Amb25931834 [1,0,1,0,0,0|2,0,0]=4 2866 B4R0.2 O\C=C\CCl Amb27449221 [1,0,1,0,0,0|1,0,1]=4 2867 B4R0.2 PCCCP Amb22227719 [1,0,1,0,0,0|2,0,0]=4 2868 B4R0.2 SCCCBr Amb22270209 [1,0,1,0,0,0|1,1,0]=4 2869 B4R0.2 SCCCS Amb7809241 [1,0,1,0,0,0|0,2,0]=4 2870 B4R0.2 [C-]#[N+]CCC Amb24117082 [1,0,1,0,0,0|1,0,1]=4 2871 B4R0.2 [SiH3]CCCCl Amb28346288 [1,0,1,0,0,0|1,1,0]=4 2872 B6R0.1 C#CC(=O)CCC Amb25696103 [0,1,1,0,0,0|1,0,0]=3 2873 B6R0.1 C#CC(=O)COC Amb27794422 [0,1,1,0,0,0|2,0,0]=4 2874 B6R0.1 C#CC(=O)CSC Amb27667610 [0,1,1,0,0,0|2,0,0]=4 2875 B6R0.1 C#CC(=O)NCC Amb24057137 [0,1,1,0,0,0|1,0,1]=4 2876 B6R0.1 C#CC(=O)OCC Amb2182884 [0,1,1,0,0,0|0,0,1]=3 2877 B6R0.1 C#CC(C)OCC Amb33425039 [0,1,1,0,0,0|1,0,1]=4 2878 B6R0.1 C#CC(O)CCC Amb4034577 [0,1,1,0,0,0|1,0,1]=4 2879 B6R0.1 C#CCC(=O)OC Amb5722531 [0,1,1,0,0,0|0,0,2]=4 2880 B6R0.1 C#C[C@@H](O)CCC Amb26381982 [0,1,1,0,0,0|1,0,1]=4 2881 B6R0.1 C#C[C@H](O)CCC Amb26865453 [0,1,1,0,0,0|1,0,1]=4 2882 B6R0.1 C=C(C#N)OCC Amb24552774 [0,1,1,0,0,0|1,0,1]=4 2883 B6R0.1 C=C(C=O)CCF Amb28253937 [0,1,1,0,0,0|2,0,0]=4 2884 B6R0.1 C=C(C=O)COC Amb28066424 [0,1,1,0,0,0|2,0,0]=4 2885 B6R0.1 C=C(C=O)SCC Amb28050273 [0,1,1,0,0,0|0,1,1]=4 2886 B6R0.1 C=C(CBr)CCC Amb26493276 [0,1,1,0,0,0|2,0,0]=4 2887 B6R0.1 C=C(CC)CCC Amb22228810 [0,1,1,0,0,0|2,0,0]=4 2888 B6R0.1 C=C(CCC)OC Amb27433625 [0,1,1,0,0,0|1,0,0]=3 2889 B6R0.1 C=C(CCl)CCC Amb25871331 [0,1,1,0,0,0|2,0,0]=4 2890 B6R0.1 C=C(CCl)OCC Amb27460162 [0,1,1,0,0,0|1,0,0]=3 2891 B6R0.1 C=C(CN)CCC Amb33204217 [0,1,1,0,0,0|2,0,0]=4 2892 B6R0.1 C=C(CO)CCN Amb24426567 [0,1,1,0,0,0|2,0,0]=4 2893 B6R0.1 C=C(CO)CCO Amb25825219 [0,1,1,0,0,0|2,0,0]=4 2894 B6R0.1 C=C(OCC)[Zn]Cl Amb32643980 [0,1,1,0,0,0|1,0,1]=4 2895 B6R0.1 C=CC(=N)OCC Amb27160809 [0,1,1,0,0,0|1,0,1]=4 2896 B6R0.1 C=CC(=O)CCC Amb8630773 [0,1,1,0,0,0|1,0,0]=3 2897 B6R0.1 C=CC(=O)CCCl Amb24446646 [0,1,1,0,0,0|2,0,0]=4 2898 B6R0.1 C=CC(=O)CCF Amb33480698 [0,1,1,0,0,0|2,0,0]=4 2899 B6R0.1 C=CC(=O)COC Amb22168158 [0,1,1,0,0,0|2,0,0]=4 2900 B6R0.1 C=CC(=O)CSC Amb26974013 [0,1,1,0,0,0|2,0,0]=4 2901 B6R0.1 C=CC(=O)NCC Amb9480404 [0,1,1,0,0,0|1,0,1]=4 2902 B6R0.1 C=CC(=O)OCC Amb3941513 [0,1,1,0,0,0|0,0,1]=3 2903 B6R0.1 C=CC(C)OCC Amb33425058 [0,1,1,0,0,0|1,0,1]=4 2904 B6R0.1 C=CC(O)CCC Amb22002474 [0,1,1,0,0,0|1,0,1]=4 2905 B6R0.1 C=COC(=O)CBr Amb22732072 [0,1,1,0,0,0|0,0,2]=4 2906 B6R0.1 C=COC(=O)CC Amb4018556 [0,1,1,0,0,0|0,0,2]=4 2907 B6R0.1 C=COC(=O)CI Amb17934194 [0,1,1,0,0,0|0,0,2]=4 2908 B6R0.1 C=C\C(C)=C/CC Amb27493400 [0,1,1,0,0,0|2,0,0]=4 2909 B6R0.1 CC#CC(=O)CC Amb26041340 [0,1,1,0,0,0|1,0,1]=4 2910 B6R0.1 CC#CC(=O)CCl Amb27257962 [0,1,1,0,0,0|1,0,1]=4 2911 B6R0.1 CC#CC(=O)OC Amb2689389 [0,1,1,0,0,0|0,0,2]=4 2912 B6R0.1 CCC(=O)CCBr Amb27401869 [0,1,1,0,0,0|2,0,0]=4 2913 B6R0.1 CCC(=O)CCI Amb27232362 [0,1,1,0,0,0|2,0,0]=4 2914 B6R0.1 CCC(=O)CCN Amb18202790 [0,1,1,0,0,0|2,0,0]=4 2915 B6R0.1 CCC(=O)CCO Amb26872941 [0,1,1,0,0,0|2,0,0]=4 2916 B6R0.1 CCC(=O)CCS Amb24733984 [0,1,1,0,0,0|2,0,0]=4 2917 B6R0.1 CCC(=O)CNC Amb26408381 [0,1,1,0,0,0|2,0,0]=4 2918 B6R0.1 CCC(=O)CNC Amb32410106 [0,1,1,0,0,0|2,0,0]=4 2919 B6R0.1 CCC(=O)COC Amb19515551 [0,1,1,0,0,0|2,0,0]=4 2920 B6R0.1 CCC(=O)CSC Amb8393183 [0,1,1,0,0,0|2,0,0]=4 2921 B6R0.1 CCC(=O)NCO Amb27235623 [0,1,1,0,0,0|2,0,0]=4 2922 B6R0.1 CCC(=O)OCBr Amb26425071 [0,1,1,0,0,0|1,0,0]=3 2923 B6R0.1 CCC(=O)OCCl Amb26580339 [0,1,1,0,0,0|1,0,0]=3 2924 B6R0.1 CCC(=O)OCN Amb27592382 [0,1,1,0,0,0|1,0,0]=3 2925 B6R0.1 CCC(=O)OCS Amb27593467 [0,1,1,0,0,0|1,0,0]=3 2926 B6R0.1 CCCC(=N)NC Amb27254401 [0,1,1,0,0,0|2,0,0]=4 2927 B6R0.1 CCCC(=O)CBr Amb24433274 [0,1,1,0,0,0|1,0,0]=3 2928 B6R0.1 CCCC(=O)CC Amb8513390 [0,1,1,0,0,0|1,0,0]=3 2929 B6R0.1 CCCC(=O)CCl Amb19372924 [0,1,1,0,0,0|1,0,0]=3 2930 B6R0.1 CCCC(=O)CI Amb27876205 [0,1,1,0,0,0|1,0,0]=3 2931 B6R0.1 CCCC(=O)CN Amb17593086 [0,1,1,0,0,0|1,0,0]=3 2932 B6R0.1 CCCC(=O)CN Amb28827644 [0,1,1,0,0,0|1,0,0]=3 2933 B6R0.1 CCCC(=O)CO Amb25125092 [0,1,1,0,0,0|0,0,0]=2 2934 B6R0.1 CCCC(=O)NC Amb3886531 [0,1,1,0,0,0|1,0,0]=3 2935 B6R0.1 CCCC(=O)NN Amb6366352 [0,1,1,0,0,0|1,0,0]=3 2936 B6R0.1 CCCC(=O)NO Amb6260495 [0,1,1,0,0,0|0,0,0]=2 2937 B6R0.1 CCCC(=O)OC Amb8516697 [0,1,1,0,0,0|0,0,0]=2 2938 B6R0.1 CCCC(=O)SC Amb8393184 [0,1,1,0,0,0|0,1,0]=3 2939 B6R0.1 CCCC(=S)NC Amb27259343 [0,1,1,0,0,0|1,1,0]=4 2940 B6R0.1 CCCC(=S)OC Amb22043317 [0,1,1,0,0,0|0,1,0]=3 2941 B6R0.1 CCCC(C)C=O Amb3939898 [0,1,1,0,0,0|1,0,1]=4 2942 B6R0.1 CCCC(C)CO Amb8999036 [0,1,1,0,0,0|1,0,1]=4 2943 B6R0.1 CCCC(C)OC Amb26319305 [0,1,1,0,0,0|1,0,1]=4 2944 B6R0.1 CCCC(C)ON Amb24424249 [0,1,1,0,0,0|1,0,1]=4 2945 B6R0.1 CCCC(Cl)C=O Amb18124277 [0,1,1,0,0,0|1,0,1]=4 2946 B6R0.1 CCCC(Cl)CO Amb25950697 [0,1,1,0,0,0|1,0,1]=4 2947 B6R0.1 CCCC(I)CO Amb27268581 [0,1,1,0,0,0|1,0,1]=4 2948 B6R0.1 CCCC(N)CO Amb3940003 [0,1,1,0,0,0|1,0,1]=4 2949 B6R0.1 CCCC(O)C#N Amb9294949 [0,1,1,0,0,0|1,0,1]=4 2950 B6R0.1 CCCC(O)CBr Amb24365915 [0,1,1,0,0,0|1,0,1]=4 2951 B6R0.1 CCCC(O)CC Amb4037277 [0,1,1,0,0,0|1,0,1]=4 2952 B6R0.1 CCCC(O)CCl Amb24470722 [0,1,1,0,0,0|1,0,1]=4 2953 B6R0.1 CCCC(O)CF Amb26604826 [0,1,1,0,0,0|1,0,1]=4 2954 B6R0.1 CCCC(O)CN Amb8630337 [0,1,1,0,0,0|1,0,1]=4 2955 B6R0.1 CCCC(O)CO Amb8385613 [0,1,1,0,0,0|0,0,2]=4 2956 B6R0.1 CCCC(O)OC Amb27447501 [0,1,1,0,0,0|0,0,2]=4 2957 B6R0.1 CCCN(C)N=O Amb25231763 [0,1,1,0,0,0|2,0,0]=4 2958 B6R0.1 CCCN(N)C=O Amb18121867 [0,1,1,0,0,0|2,0,0]=4 2959 B6R0.1 CCCN(O)C#N Amb28196833 [0,1,1,0,0,0|2,0,0]=4 2960 B6R0.1 CCC[C@@H](C)CO Amb22823174 [0,1,1,0,0,0|1,0,1]=4 2961 B6R0.1 CCC[C@@H](N)CO Amb22756532 [0,1,1,0,0,0|1,0,1]=4 2962 B6R0.1 CCC[C@@H](N)CO Amb3941479 [0,1,1,0,0,0|1,0,1]=4 2963 B6R0.1 CCC[C@@H](O)CC Amb25781736 [0,1,1,0,0,0|1,0,1]=4 2964 B6R0.1 CCC[C@@H](O)CCl Amb22736025 [0,1,1,0,0,0|1,0,1]=4 2965 B6R0.1 CCC[C@@H](O)CN Amb24428580 [0,1,1,0,0,0|1,0,1]=4 2966 B6R0.1 CCC[C@H](C)C=O Amb28248332 [0,1,1,0,0,0|1,0,1]=4 2967 B6R0.1 CCC[C@H](C)CO Amb27423081 [0,1,1,0,0,0|1,0,1]=4 2968 B6R0.1 CCC[C@H](F)C=O Amb27644096 [0,1,1,0,0,0|1,0,1]=4 2969 B6R0.1 CCC[C@H](N)C=O Amb27488589 [0,1,1,0,0,0|1,0,1]=4 2970 B6R0.1 CCC[C@H](N)CO Amb33869036 [0,1,1,0,0,0|1,0,1]=4 2971 B6R0.1 CCC[C@H](N)CO Amb3941480 [0,1,1,0,0,0|1,0,1]=4 2972 B6R0.1 CCC[C@H](O)CC Amb26022373 [0,1,1,0,0,0|1,0,1]=4 2973 B6R0.1 CCC[C@H](O)CCl Amb22735942 [0,1,1,0,0,0|1,0,1]=4 2974 B6R0.1 CCC[C@H](O)CF Amb28348521 [0,1,1,0,0,0|1,0,1]=4 2975 B6R0.1 CCC[C@H](O)CN Amb33204239 [0,1,1,0,0,0|1,0,1]=4 2976 B6R0.1 CCC\C(C)=N\O Amb24693854 [0,1,1,0,0,0|1,0,0]=3 2977 B6R0.1 CCC\C(Cl)=N\O Amb27829565 [0,1,1,0,0,0|1,0,0]=3 2978 B6R0.1 CCC\C(N)=N\N Amb2696446 [0,1,1,0,0,0|2,0,0]=4 2979 B6R0.1 CCC\C(N)=N\O Amb19890174 [0,1,1,0,0,0|1,0,0]=3 2980 B6R0.1 CCC\C(N)=N\O Amb2724965 [0,1,1,0,0,0|1,0,0]=3 2981 B6R0.1 CCNC(=N)CCl Amb27188662 [0,1,1,0,0,0|2,0,0]=4 2982 B6R0.1 CCNC(=N)NC Amb24404052 [0,1,1,0,0,0|2,0,0]=4 2983 B6R0.1 CCNC(=N)NC Amb31217473 [0,1,1,0,0,0|2,0,0]=4 2984 B6R0.1 CCNC(=O)CBr Amb2090261 [0,1,1,0,0,0|1,0,0]=3 2985 B6R0.1 CCNC(=O)CC Amb3886529 [0,1,1,0,0,0|1,0,0]=3 2986 B6R0.1 CCNC(=O)CCl Amb1643925 [0,1,1,0,0,0|1,0,0]=3 2987 B6R0.1 CCNC(=O)CF Amb28316230 [0,1,1,0,0,0|1,0,0]=3 2988 B6R0.1 CCNC(=O)CI Amb23512617 [0,1,1,0,0,0|1,0,0]=3 2989 B6R0.1 CCNC(=O)CN Amb21956656 [0,1,1,0,0,0|1,0,0]=3 2990 B6R0.1 CCNC(=O)CN Amb426696 [0,1,1,0,0,0|1,0,0]=3 2991 B6R0.1 CCNC(=O)CO Amb9421415 [0,1,1,0,0,0|1,0,0]=3 2992 B6R0.1 CCNC(=O)NC Amb24120627 [0,1,1,0,0,0|1,0,0]=3 2993 B6R0.1 CCNC(=O)NN Amb8854035 [0,1,1,0,0,0|2,0,0]=4 2994 B6R0.1 CCNC(=O)NO Amb28345704 [0,1,1,0,0,0|1,0,0]=3 2995 B6R0.1 CCNC(=O)OC Amb22734099 [0,1,1,0,0,0|1,0,0]=3 2996 B6R0.1 CCNC(=S)NC Amb9237395 [0,1,1,0,0,0|1,1,0]=4 2997 B6R0.1 CCNC(=S)SC Amb27216933 [0,1,1,0,0,0|1,1,0]=4 2998 B6R0.1 CCN\C(C)=N\O Amb28429781 [0,1,1,0,0,0|1,0,1]=4 2999 B6R0.1 CCOC(=N)C#N Amb17593071 [0,1,1,0,0,0|1,0,1]=4 3000 B6R0.1 CCOC(=N)CBr Amb20673075 [0,1,1,0,0,0|1,0,0]=3 3001 B6R0.1 CCOC(=N)CC Amb17673175 [0,1,1,0,0,0|1,0,0]=3 3002 B6R0.1 CCOC(=N)CC Amb20673165 [0,1,1,0,0,0|1,0,0]=3 3003 B6R0.1 CCOC(=N)CCl Amb17939373 [0,1,1,0,0,0|1,0,0]=3 3004 B6R0.1 CCOC(=N)CCl Amb20673164 [0,1,1,0,0,0|1,0,0]=3 3005 B6R0.1 CCOC(=N)CN Amb28422301 [0,1,1,0,0,0|1,0,0]=3 3006 B6R0.1 CCOC(=N)CO Amb17593094 [0,1,1,0,0,0|1,0,0]=3 3007 B6R0.1 CCOC(=O)C#N Amb8513165 [0,1,1,0,0,0|0,0,1]=3 3008 B6R0.1 CCOC(=O)C=O Amb8394919 [0,1,1,0,0,0|0,0,1]=3 3009 B6R0.1 CCOC(=O)CBr Amb2687783 [0,1,1,0,0,0|0,0,0]=2 3010 B6R0.1 CCOC(=O)CC Amb8513446 [0,1,1,0,0,0|0,0,0]=2 3011 B6R0.1 CCOC(=O)CCl Amb3941486 [0,1,1,0,0,0|0,0,0]=2 3012 B6R0.1 CCOC(=O)CF Amb2687849 [0,1,1,0,0,0|0,0,0]=2 3013 B6R0.1 CCOC(=O)CI Amb8514613 [0,1,1,0,0,0|0,0,0]=2 3014 B6R0.1 CCOC(=O)CN Amb2697340 [0,1,1,0,0,0|0,0,0]=2 3015 B6R0.1 CCOC(=O)CN Amb8513174 [0,1,1,0,0,0|0,0,0]=2 3016 B6R0.1 CCOC(=O)CO Amb3939196 [0,1,1,0,0,0|0,0,0]=2 3017 B6R0.1 CCOC(=O)CS Amb6608734 [0,1,1,0,0,0|0,0,0]=2 3018 B6R0.1 CCOC(=O)C[NH3+] Amb24113741 [0,1,1,0,0,0|0,0,0]=2 3019 B6R0.1 CCOC(=O)NC Amb8516631 [0,1,1,0,0,0|0,0,0]=2 3020 B6R0.1 CCOC(=O)NCl Amb24381604 [0,1,1,0,0,0|1,0,0]=3 3021 B6R0.1 CCOC(=O)NN Amb2780496 [0,1,1,0,0,0|1,0,0]=3 3022 B6R0.1 CCOC(=O)NO Amb8384324 [0,1,1,0,0,0|1,0,0]=3 3023 B6R0.1 CCOC(=O)OC Amb22732530 [0,1,1,0,0,0|0,0,0]=2 3024 B6R0.1 CCOC(=S)CC Amb26873773 [0,1,1,0,0,0|0,1,0]=3 3025 B6R0.1 CCOC(=S)CCl Amb28423418 [0,1,1,0,0,0|0,1,0]=3 3026 B6R0.1 CCOC(=S)S[K] Amb8516638 [0,1,1,0,0,0|1,1,0]=4 3027 B6R0.1 CCOC(C)C#N Amb17673808 [0,1,1,0,0,0|1,0,1]=4 3028 B6R0.1 CCOC(C)CBr Amb28050306 [0,1,1,0,0,0|1,0,1]=4 3029 B6R0.1 CCOC(C)CC Amb17939313 [0,1,1,0,0,0|1,0,1]=4 3030 B6R0.1 CCOC(C)CCl Amb24453724 [0,1,1,0,0,0|1,0,1]=4 3031 B6R0.1 CCOC(C)CN Amb19959926 [0,1,1,0,0,0|1,0,1]=4 3032 B6R0.1 CCOC(C)CN Amb2785992 [0,1,1,0,0,0|1,0,1]=4 3033 B6R0.1 CCOC(C)CO Amb22641850 [0,1,1,0,0,0|0,0,2]=4 3034 B6R0.1 CCOC(C)CS Amb33424941 [0,1,1,0,0,0|0,1,1]=4 3035 B6R0.1 CCOC(Cl)CC Amb27845437 [0,1,1,0,0,0|1,0,1]=4 3036 B6R0.1 CCOC(Cl)CCl Amb17940714 [0,1,1,0,0,0|1,0,1]=4 3037 B6R0.1 CCON(C)C=O Amb28247969 [0,1,1,0,0,0|1,0,0]=3 3038 B6R0.1 CCOP(C)CC Amb27783109 [0,1,1,0,0,0|2,0,0]=4 3039 B6R0.1 CCO[PH](=O)OC Amb27961218 [0,1,1,0,0,0|1,0,0]=3 3040 B6R0.1 CCO\C(C)=C\Br Amb28384131 [0,1,1,0,0,0|1,0,0]=3 3041 B6R0.1 CCO\C(C)=N/O Amb5719848 [0,1,1,0,0,0|0,0,1]=3 3042 B6R0.1 CCO\C(C)=N\O Amb28050479 [0,1,1,0,0,0|0,0,1]=3 3043 B6R0.1 CCO\C(Cl)=C/Cl Amb24479861 [0,1,1,0,0,0|1,0,1]=4 3044 B6R0.1 CCSC(=O)C=O Amb27403471 [0,1,1,0,0,0|0,1,1]=4 3045 B6R0.1 CCSC(=O)CC Amb22043397 [0,1,1,0,0,0|0,1,0]=3 3046 B6R0.1 CCSC(=O)NC Amb28368964 [0,1,1,0,0,0|0,1,0]=3 3047 B6R0.1 CCSC(=S)CC Amb27244778 [0,1,1,0,0,0|0,2,0]=4 3048 B6R0.1 CCSC(=S)OC Amb28280041 [0,1,1,0,0,0|0,2,0]=4 3049 B6R0.1 CCSC(C)C=O Amb28050282 [0,1,1,0,0,0|0,1,1]=4 3050 B6R0.1 CCSS(=O)CC Amb27437935 [0,1,1,0,0,0|1,1,0]=4 3051 B6R0.1 CCS\C(N)=N\C Amb25244293 [0,1,1,0,0,0|1,1,0]=4 3052 B6R0.1 CC\C=C(/C)C#N Amb25274256 [0,1,1,0,0,0|2,0,0]=4 3053 B6R0.1 CC\C=C(/C)C=O Amb3940425 [0,1,1,0,0,0|1,0,0]=3 3054 B6R0.1 CC\C=C(/C)CC Amb24379721 [0,1,1,0,0,0|2,0,0]=4 3055 B6R0.1 CC\C=C(/C)CO Amb22347713 [0,1,1,0,0,0|1,0,1]=4 3056 B6R0.1 CC\C=C(/Cl)C=O Amb28050393 [0,1,1,0,0,0|1,0,1]=4 3057 B6R0.1 CC\C=C(/O)C=O Amb27849683 [0,1,1,0,0,0|0,0,1]=3 3058 B6R0.1 CC\C=C(\C)C#N Amb28129296 [0,1,1,0,0,0|2,0,0]=4 3059 B6R0.1 CC\C=C(\C)CC Amb4019552 [0,1,1,0,0,0|2,0,0]=4 3060 B6R0.1 CC\C=C(\C)CO Amb24677771 [0,1,1,0,0,0|1,0,1]=4 3061 B6R0.1 CC\C=C(\O)C=O Amb27195226 [0,1,1,0,0,0|0,0,1]=3 3062 B6R0.1 CC\N=C(\N)SC Amb24479872 [0,1,1,0,0,0|2,0,0]=4 3063 B6R0.1 CNC(=O)CCBr Amb17332890 [0,1,1,0,0,0|2,0,0]=4 3064 B6R0.1 CNC(=O)CCCl Amb1130566 [0,1,1,0,0,0|2,0,0]=4 3065 B6R0.1 CNC(=O)CCN Amb1139824 [0,1,1,0,0,0|2,0,0]=4 3066 B6R0.1 CNC(=O)CCN Amb6893005 [0,1,1,0,0,0|2,0,0]=4 3067 B6R0.1 CNC(=O)CCO Amb10608414 [0,1,1,0,0,0|2,0,0]=4 3068 B6R0.1 CNC(=O)CCS Amb25727705 [0,1,1,0,0,0|2,0,0]=4 3069 B6R0.1 CNC(=O)COC Amb22275885 [0,1,1,0,0,0|2,0,0]=4 3070 B6R0.1 CNC(=O)OCCl Amb29886185 [0,1,1,0,0,0|1,0,0]=3 3071 B6R0.1 CNCC(=O)CF Amb33377251 [0,1,1,0,0,0|2,0,0]=4 3072 B6R0.1 CNCC(=O)NC Amb2371052 [0,1,1,0,0,0|2,0,0]=4 3073 B6R0.1 CNCC(=O)NC Amb423473 [0,1,1,0,0,0|2,0,0]=4 3074 B6R0.1 CNCC(=O)NN Amb16186920 [0,1,1,0,0,0|2,0,0]=4 3075 B6R0.1 CNCC(=O)NN Amb32667538 [0,1,1,0,0,0|2,0,0]=4 3076 B6R0.1 CNCC(=O)OC Amb1153975 [0,1,1,0,0,0|1,0,0]=3 3077 B6R0.1 CNCC(=O)OC Amb2371116 [0,1,1,0,0,0|1,0,0]=3 3078 B6R0.1 CNC\C(N)=N\O Amb24648670 [0,1,1,0,0,0|2,0,0]=4 3079 B6R0.1 CNNC(=O)NC Amb27461318 [0,1,1,0,0,0|2,0,0]=4 3080 B6R0.1 CNNC(=O)OC Amb22411352 [0,1,1,0,0,0|2,0,0]=4 3081 B6R0.1 COC(=N)CCBr Amb27478260 [0,1,1,0,0,0|2,0,0]=4 3082 B6R0.1 COC(=N)CCCl Amb19958799 [0,1,1,0,0,0|2,0,0]=4 3083 B6R0.1 COC(=N)CCCl Amb22234673 [0,1,1,0,0,0|2,0,0]=4 3084 B6R0.1 COC(=N)CCO Amb17593095 [0,1,1,0,0,0|2,0,0]=4 3085 B6R0.1 COC(=O)CC#N Amb3940296 [0,1,1,0,0,0|1,0,1]=4 3086 B6R0.1 COC(=O)CC=O Amb18199826 [0,1,1,0,0,0|1,0,1]=4 3087 B6R0.1 COC(=O)CCBr Amb3940216 [0,1,1,0,0,0|1,0,0]=3 3088 B6R0.1 COC(=O)CCCl Amb8387395 [0,1,1,0,0,0|1,0,0]=3 3089 B6R0.1 COC(=O)CCI Amb24442243 [0,1,1,0,0,0|1,0,0]=3 3090 B6R0.1 COC(=O)CCN Amb1105940 [0,1,1,0,0,0|1,0,0]=3 3091 B6R0.1 COC(=O)CCN Amb2605985 [0,1,1,0,0,0|1,0,0]=3 3092 B6R0.1 COC(=O)CCO Amb8855137 [0,1,1,0,0,0|1,0,0]=3 3093 B6R0.1 COC(=O)CCS Amb2725528 [0,1,1,0,0,0|1,0,0]=3 3094 B6R0.1 COC(=O)CON Amb18640433 [0,1,1,0,0,0|2,0,0]=4 3095 B6R0.1 COC(=O)CON Amb29848090 [0,1,1,0,0,0|2,0,0]=4 3096 B6R0.1 COC(=O)CSC Amb2689527 [0,1,1,0,0,0|1,0,0]=3 3097 B6R0.1 COC(=O)OCCl Amb20623618 [0,1,1,0,0,0|1,0,0]=3 3098 B6R0.1 COC(=O)OCI Amb35753057 [0,1,1,0,0,0|1,0,0]=3 3099 B6R0.1 COCC(=N)NO Amb21858420 [0,1,1,0,0,0|2,0,0]=4 3100 B6R0.1 COCC(=N)OC Amb28989427 [0,1,1,0,0,0|2,0,0]=4 3101 B6R0.1 COCC(=O)CCl Amb24523799 [0,1,1,0,0,0|2,0,0]=4 3102 B6R0.1 COCC(=O)CI Amb27414026 [0,1,1,0,0,0|2,0,0]=4 3103 B6R0.1 COCC(=O)CN Amb18833134 [0,1,1,0,0,0|2,0,0]=4 3104 B6R0.1 COCC(=O)NN Amb6548366 [0,1,1,0,0,0|2,0,0]=4 3105 B6R0.1 COCC(=O)OC Amb8513624 [0,1,1,0,0,0|1,0,0]=3 3106 B6R0.1 COC[C@@H](O)C=O Amb28132745 [0,1,1,0,0,0|1,0,1]=4 3107 B6R0.1 COC[C@H](O)C=O Amb27838256 [0,1,1,0,0,0|1,0,1]=4 3108 B6R0.1 COC\C(N)=N\O Amb8384549 [0,1,1,0,0,0|2,0,0]=4 3109 B6R0.1 CONC(=O)CCl Amb7969376 [0,1,1,0,0,0|2,0,0]=4 3110 B6R0.1 CONC(=O)CN Amb20669419 [0,1,1,0,0,0|2,0,0]=4 3111 B6R0.1 CONC(=O)CN Amb27398660 [0,1,1,0,0,0|2,0,0]=4 3112 B6R0.1 CONC(=O)CO Amb28344874 [0,1,1,0,0,0|2,0,0]=4 3113 B6R0.1 COS(=O)CCBr Amb27403603 [0,1,1,0,0,0|2,0,0]=4 3114 B6R0.1 CO[PH](=O)CCBr Amb27657609 [0,1,1,0,0,0|2,0,0]=4 3115 B6R0.1 CO\C=C(/O)C=O Amb27797385 [0,1,1,0,0,0|1,0,1]=4 3116 B6R0.1 CSC(=O)CCO Amb27662309 [0,1,1,0,0,0|1,1,0]=4 3117 B6R0.1 CSC(=O)OCCl Amb27602024 [0,1,1,0,0,0|1,0,0]=3 3118 B6R0.1 CSCC(=O)CCl Amb25965373 [0,1,1,0,0,0|2,0,0]=4 3119 B6R0.1 CSCC(=O)CN Amb33225415 [0,1,1,0,0,0|2,0,0]=4 3120 B6R0.1 CSCC(=O)NN Amb22058723 [0,1,1,0,0,0|2,0,0]=4 3121 B6R0.1 CSCC(=O)NO Amb28057751 [0,1,1,0,0,0|1,0,0]=3 3122 B6R0.1 CSCC(O)C=O Amb27438538 [0,1,1,0,0,0|1,0,1]=4 3123 B6R0.1 CSC\C(N)=N\O Amb8385720 [0,1,1,0,0,0|2,0,0]=4 3124 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [0,1,1,0,0,0|1,0,0]=3 3125 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [0,1,1,0,0,0|1,0,0]=3 3126 B6R0.1 C\C(C=O)=C/CCl Amb18122638 [0,1,1,0,0,0|2,0,0]=4 3127 B6R0.1 C\C(CCCl)=N/O Amb27832450 [0,1,1,0,0,0|2,0,0]=4 3128 B6R0.1 C\C=C(/C)CCC Amb25744974 [0,1,1,0,0,0|2,0,0]=4 3129 B6R0.1 C\C=C\C(=O)CC Amb8517594 [0,1,1,0,0,0|1,0,1]=4 3130 B6R0.1 C\C=C\C(=O)CCl Amb26438240 [0,1,1,0,0,0|1,0,1]=4 3131 B6R0.1 C\C=C\C(=O)OC Amb8513568 [0,1,1,0,0,0|0,0,2]=4 3132 B6R0.1 N=C(CCO)NO Amb22491265 [0,1,1,0,0,0|2,0,0]=4 3133 B6R0.1 NCC(=O)CCF Amb26604148 [0,1,1,0,0,0|2,0,0]=4 3134 B6R0.1 NCC(=O)OCCl Amb27204265 [0,1,1,0,0,0|1,0,0]=3 3135 B6R0.1 NCCC(=O)CF Amb33377162 [0,1,1,0,0,0|2,0,0]=4 3136 B6R0.1 NCCC(=O)CN Amb18121893 [0,1,1,0,0,0|2,0,0]=4 3137 B6R0.1 NCCC(=O)NN Amb18559344 [0,1,1,0,0,0|2,0,0]=4 3138 B6R0.1 NCCC(=O)NO Amb33543073 [0,1,1,0,0,0|1,0,0]=3 3139 B6R0.1 NCCC(O)C=O Amb25682881 [0,1,1,0,0,0|1,0,1]=4 3140 B6R0.1 NCC\C(N)=N\O Amb24761482 [0,1,1,0,0,0|2,0,0]=4 3141 B6R0.1 NNC(=O)CCO Amb20622339 [0,1,1,0,0,0|2,0,0]=4 3142 B6R0.1 NNC(=O)CCS Amb20622690 [0,1,1,0,0,0|2,0,0]=4 3143 B6R0.1 N\C(CCCl)=N/O Amb2695182 [0,1,1,0,0,0|2,0,0]=4 3144 B6R0.1 N\C(CCO)=N/O Amb1113605 [0,1,1,0,0,0|2,0,0]=4 3145 B6R0.1 O=C(CBr)CCBr Amb26567374 [0,1,1,0,0,0|2,0,0]=4 3146 B6R0.1 O=C(CBr)CCCl Amb27984732 [0,1,1,0,0,0|2,0,0]=4 3147 B6R0.1 O=C(CBr)NCO Amb25286051 [0,1,1,0,0,0|2,0,0]=4 3148 B6R0.1 O=C(CCBr)NO Amb28195718 [0,1,1,0,0,0|1,0,0]=3 3149 B6R0.1 O=C(CCCl)NO Amb25865278 [0,1,1,0,0,0|1,0,0]=3 3150 B6R0.1 O=C(CCl)CCCl Amb22395038 [0,1,1,0,0,0|2,0,0]=4 3151 B6R0.1 O=C(CCl)CCF Amb33413998 [0,1,1,0,0,0|2,0,0]=4 3152 B6R0.1 O=C(CCl)NCO Amb1153096 [0,1,1,0,0,0|2,0,0]=4 3153 B6R0.1 O=C(CCl)OCCl Amb27391668 [0,1,1,0,0,0|1,0,0]=3 3154 B6R0.1 O=C(CF)CCF Amb28424077 [0,1,1,0,0,0|2,0,0]=4 3155 B6R0.1 O=C(CF)NCO Amb27625787 [0,1,1,0,0,0|2,0,0]=4 3156 B6R0.1 O=C(CO)CCO Amb10603377 [0,1,1,0,0,0|1,0,0]=3 3157 B6R0.1 O=C(CO)NCO Amb27593459 [0,1,1,0,0,0|2,0,0]=4 3158 B6R0.1 O=C(NCl)OCCl Amb28074026 [0,1,1,0,0,0|2,0,0]=4 3159 B6R0.1 O=C(NO)OCCl Amb29886186 [0,1,1,0,0,0|2,0,0]=4 3160 B6R0.1 O=CC(=O)CCO Amb28050238 [0,1,1,0,0,0|1,0,1]=4 3161 B6R0.1 O=CC(O)CCBr Amb27838276 [0,1,1,0,0,0|1,0,1]=4 3162 B6R0.1 O=CC(O)CCO Amb27955546 [0,1,1,0,0,0|1,0,1]=4 3163 B6R0.1 O=COC(=O)CO Amb27457699 [0,1,1,0,0,0|1,0,1]=4 3164 B6R0.1 O=C[C@H](O)CCBr Amb28399793 [0,1,1,0,0,0|1,0,1]=4 3165 B6R0.1 O=NOC(=O)CBr Amb27761886 [0,1,1,0,0,0|2,0,0]=4 3166 B6R0.1 [C-]#[N+]CC(=O)OC Amb2697203 [0,1,1,0,0,0|1,0,1]=4 3167 B6R0.2 C=C(Br)CC(C)C Amb22583739 [0,1,1,0,0,0|2,0,0]=4 3168 B6R0.2 C=C(C)CC(=O)O Amb6278832 [0,1,1,0,0,0|0,0,1]=3 3169 B6R0.2 C=C(C)CC(C)=O Amb17593075 [0,1,1,0,0,0|1,0,1]=4 3170 B6R0.2 C=C(C)CC(C)Br Amb24365286 [0,1,1,0,0,0|2,0,0]=4 3171 B6R0.2 C=C(C)CC(C)C Amb4019530 [0,1,1,0,0,0|2,0,0]=4 3172 B6R0.2 C=C(C)CC(C)Cl Amb24558200 [0,1,1,0,0,0|2,0,0]=4 3173 B6R0.2 C=C(C)CC(C)O Amb17593083 [0,1,1,0,0,0|2,0,0]=4 3174 B6R0.2 C=C(C)C[C@@H](C)N Amb33199541 [0,1,1,0,0,0|2,0,0]=4 3175 B6R0.2 C=C(C)C[C@@H](C)O Amb25888510 [0,1,1,0,0,0|2,0,0]=4 3176 B6R0.2 C=C(C)C[C@H](C)N Amb33199534 [0,1,1,0,0,0|2,0,0]=4 3177 B6R0.2 C=C(C)C[C@H](C)O Amb27466720 [0,1,1,0,0,0|2,0,0]=4 3178 B6R0.2 C=C(C)OC(C)=O Amb6608981 [0,1,1,0,0,0|0,0,1]=3 3179 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [0,1,1,0,0,0|0,0,2]=4 3180 B6R0.2 C=C(Cl)CC(C)Cl Amb28396615 [0,1,1,0,0,0|2,0,0]=4 3181 B6R0.2 C=C(I)CC(=O)O Amb27598435 [0,1,1,0,0,0|0,0,2]=4 3182 B6R0.2 CC(=O)C=C(C)C Amb2793052 [0,1,1,0,0,0|1,0,1]=4 3183 B6R0.2 CC(=O)CC(=O)F Amb28122452 [0,1,1,0,0,0|1,0,1]=4 3184 B6R0.2 CC(=O)CC(=O)O Amb377432 [0,1,1,0,0,0|0,0,1]=3 3185 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [0,1,1,0,0,0|0,0,2]=4 3186 B6R0.2 CC(=O)CC(C)=O Amb2716228 [0,1,1,0,0,0|1,0,1]=4 3187 B6R0.2 CC(=O)CC(C)=S Amb28381251 [0,1,1,0,0,0|1,0,1]=4 3188 B6R0.2 CC(=O)CC(C)C Amb4605990 [0,1,1,0,0,0|1,0,0]=3 3189 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [0,1,1,0,0,0|1,0,0]=3 3190 B6R0.2 CC(=O)CC(C)N Amb22587050 [0,1,1,0,0,0|1,0,0]=3 3191 B6R0.2 CC(=O)CC(C)N Amb2583230 [0,1,1,0,0,0|1,0,0]=3 3192 B6R0.2 CC(=O)CC(C)O Amb17593091 [0,1,1,0,0,0|1,0,0]=3 3193 B6R0.2 CC(=O)CC(C)S Amb24600676 [0,1,1,0,0,0|1,0,0]=3 3194 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,1,1,0,0,0|1,0,0]=3 3195 B6R0.2 CC(=O)CC(F)F Amb24669174 [0,1,1,0,0,0|2,0,0]=4 3196 B6R0.2 CC(=O)CC(N)=O Amb6608777 [0,1,1,0,0,0|1,0,1]=4 3197 B6R0.2 CC(=O)CN(C)C Amb9217324 [0,1,1,0,0,0|2,0,0]=4 3198 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [0,1,1,0,0,0|1,0,0]=3 3199 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [0,1,1,0,0,0|1,0,0]=3 3200 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [0,1,1,0,0,0|1,0,1]=4 3201 B6R0.2 CC(=O)C[S+](C)Cl Amb27835653 [0,1,1,0,0,0|2,0,0]=4 3202 B6R0.2 CC(=O)NC(C)=O Amb4066511 [0,1,1,0,0,0|1,0,1]=4 3203 B6R0.2 CC(=O)NC(C)=S Amb28246616 [0,1,1,0,0,0|1,0,1]=4 3204 B6R0.2 CC(=O)NC(C)Br Amb27444682 [0,1,1,0,0,0|1,0,0]=3 3205 B6R0.2 CC(=O)NC(C)C Amb3366263 [0,1,1,0,0,0|1,0,0]=3 3206 B6R0.2 CC(=O)NC(C)N Amb27468729 [0,1,1,0,0,0|1,0,0]=3 3207 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,1,1,0,0,0|2,0,0]=4 3208 B6R0.2 CC(=O)OC(C)=O Amb2793035 [0,1,1,0,0,0|0,0,1]=3 3209 B6R0.2 CC(=O)OC(C)Br Amb19958925 [0,1,1,0,0,0|0,0,0]=2 3210 B6R0.2 CC(=O)OC(C)C Amb3940484 [0,1,1,0,0,0|0,0,0]=2 3211 B6R0.2 CC(=O)OC(C)Cl Amb24058273 [0,1,1,0,0,0|0,0,0]=2 3212 B6R0.2 CC(=O)OC(C)N Amb27184949 [0,1,1,0,0,0|0,0,0]=2 3213 B6R0.2 CC(=O)OC(C)O Amb27457187 [0,1,1,0,0,0|0,0,0]=2 3214 B6R0.2 CC(=O)OC(Cl)Cl Amb28382549 [0,1,1,0,0,0|1,0,0]=3 3215 B6R0.2 CC(=O)OC(N)=O Amb28283882 [0,1,1,0,0,0|1,0,1]=4 3216 B6R0.2 CC(=O)O[N+](=O)[O-] Amb27188405 [0,1,1,0,0,0|2,0,0]=4 3217 B6R0.2 CC(=O)O[SiH](C)C Amb2687439 [0,1,1,0,0,0|0,1,0]=3 3218 B6R0.2 CC(=O)SC(C)=O Amb4025813 [0,1,1,0,0,0|0,1,1]=4 3219 B6R0.2 CC(=O)[CH-]C(C)=O Amb34196937 [0,1,1,0,0,0|1,0,1]=4 3220 B6R0.2 CC(=O)[CH-]C(C)=O Amb9787378 [0,1,1,0,0,0|1,0,1]=4 3221 B6R0.2 CC(=O)\C=C(/C)N Amb1149988 [0,1,1,0,0,0|1,0,1]=4 3222 B6R0.2 CC(=O)\C=C(/C)S Amb27658727 [0,1,1,0,0,0|1,0,1]=4 3223 B6R0.2 CC(=O)\C=C(\C)Br Amb27838200 [0,1,1,0,0,0|1,0,1]=4 3224 B6R0.2 CC(=O)\C=C(\C)Cl Amb27196730 [0,1,1,0,0,0|1,0,1]=4 3225 B6R0.2 CC(=O)\C=C(\C)N Amb2720902 [0,1,1,0,0,0|1,0,1]=4 3226 B6R0.2 CC(=O)\C=C(\C)O Amb34915197 [0,1,1,0,0,0|1,0,1]=4 3227 B6R0.2 CC(=O)\C=C(\C)S Amb26910658 [0,1,1,0,0,0|1,0,1]=4 3228 B6R0.2 CC(=O)\C=C(\C)[O-] Amb19959976 [0,1,1,0,0,0|1,0,1]=4 3229 B6R0.2 CC(=O)\C=C(\C)[O-] Amb20239443 [0,1,1,0,0,0|1,0,1]=4 3230 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22045408 [0,1,1,0,0,0|1,0,1]=4 3231 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053071 [0,1,1,0,0,0|1,0,1]=4 3232 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053499 [0,1,1,0,0,0|1,0,1]=4 3233 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053500 [0,1,1,0,0,0|1,0,1]=4 3234 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053502 [0,1,1,0,0,0|1,0,1]=4 3235 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053503 [0,1,1,0,0,0|1,0,1]=4 3236 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053694 [0,1,1,0,0,0|1,0,1]=4 3237 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053940 [0,1,1,0,0,0|1,0,1]=4 3238 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22054020 [0,1,1,0,0,0|1,0,1]=4 3239 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22466635 [0,1,1,0,0,0|1,0,1]=4 3240 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22729908 [0,1,1,0,0,0|1,0,1]=4 3241 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22730050 [0,1,1,0,0,0|1,0,1]=4 3242 B6R0.2 CC(=O)\C=C(\C)[O-] Amb34915499 [0,1,1,0,0,0|1,0,1]=4 3243 B6R0.2 CC(=O)\N=C(/C)N Amb27796085 [0,1,1,0,0,0|1,0,1]=4 3244 B6R0.2 CC(=S)CC(=O)O Amb28067768 [0,1,1,0,0,0|0,0,1]=3 3245 B6R0.2 CC(=S)NC(C)C Amb27953313 [0,1,1,0,0,0|1,1,0]=4 3246 B6R0.2 CC(=S)OC(C)C Amb24697607 [0,1,1,0,0,0|0,1,0]=3 3247 B6R0.2 CC(=S)SC(C)Cl Amb27666932 [0,1,1,0,0,0|0,2,0]=4 3248 B6R0.2 CC(Br)CC(=O)O Amb8517108 [0,1,1,0,0,0|0,0,0]=2 3249 B6R0.2 CC(C)=CC(=O)O Amb1485519 [0,1,1,0,0,0|0,0,2]=4 3250 B6R0.2 CC(C)=CC(C)C Amb4016282 [0,1,1,0,0,0|2,0,0]=4 3251 B6R0.2 CC(C)=CC(C)Cl Amb27841415 [0,1,1,0,0,0|2,0,0]=4 3252 B6R0.2 CC(C)=CC(C)N Amb27258040 [0,1,1,0,0,0|2,0,0]=4 3253 B6R0.2 CC(C)=CC(C)O Amb22229846 [0,1,1,0,0,0|2,0,0]=4 3254 B6R0.2 CC(C)=C[C@@H](C)N Amb27405038 [0,1,1,0,0,0|2,0,0]=4 3255 B6R0.2 CC(C)=NC(C)C Amb2689015 [0,1,1,0,0,0|2,0,0]=4 3256 B6R0.2 CC(C)CB(O)O Amb2447316 [0,1,1,0,0,0|1,0,1]=4 3257 B6R0.2 CC(C)CC(=N)N Amb10066934 [0,1,1,0,0,0|2,0,0]=4 3258 B6R0.2 CC(C)CC(=N)N Amb2696279 [0,1,1,0,0,0|2,0,0]=4 3259 B6R0.2 CC(C)CC(=O)Br Amb26486664 [0,1,1,0,0,0|1,0,0]=3 3260 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [0,1,1,0,0,0|1,0,0]=3 3261 B6R0.2 CC(C)CC(=O)F Amb32667643 [0,1,1,0,0,0|1,0,0]=3 3262 B6R0.2 CC(C)CC(=O)O Amb3939848 [0,1,1,0,0,0|0,0,0]=2 3263 B6R0.2 CC(C)CC(C)O Amb6608920 [0,1,1,0,0,0|1,0,1]=4 3264 B6R0.2 CC(C)CC(N)=O Amb2722931 [0,1,1,0,0,0|1,0,0]=3 3265 B6R0.2 CC(C)CC(N)=S Amb6246355 [0,1,1,0,0,0|1,1,0]=4 3266 B6R0.2 CC(C)CC(N)O Amb28383510 [0,1,1,0,0,0|1,0,1]=4 3267 B6R0.2 CC(C)CC(O)O Amb27207854 [0,1,1,0,0,0|0,0,2]=4 3268 B6R0.2 CC(C)CN(C)O Amb33360311 [0,1,1,0,0,0|2,0,0]=4 3269 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [0,1,1,0,0,0|2,0,0]=4 3270 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [0,1,1,0,0,0|1,0,1]=4 3271 B6R0.2 CC(C)CS(C)=O Amb27972160 [0,1,1,0,0,0|2,0,0]=4 3272 B6R0.2 CC(C)CS(N)=O Amb24527860 [0,1,1,0,0,0|2,0,0]=4 3273 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [0,1,1,0,0,0|1,0,1]=4 3274 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [0,1,1,0,0,0|1,0,1]=4 3275 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [0,1,1,0,0,0|1,0,1]=4 3276 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [0,1,1,0,0,0|2,0,0]=4 3277 B6R0.2 CC(C)NC(=O)S Amb27817487 [0,1,1,0,0,0|1,1,0]=4 3278 B6R0.2 CC(C)NC(N)=O Amb1104587 [0,1,1,0,0,0|2,0,0]=4 3279 B6R0.2 CC(C)NS(C)=O Amb27777975 [0,1,1,0,0,0|2,0,0]=4 3280 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [0,1,1,0,0,0|1,0,0]=3 3281 B6R0.2 CC(C)OC(=S)S Amb24465791 [0,1,1,0,0,0|1,1,0]=4 3282 B6R0.2 CC(C)OC(=S)[S-] Amb19748282 [0,1,1,0,0,0|1,1,0]=4 3283 B6R0.2 CC(C)OC(=S)[S-] Amb534231 [0,1,1,0,0,0|1,1,0]=4 3284 B6R0.2 CC(C)OC(C)Cl Amb27650544 [0,1,1,0,0,0|1,0,1]=4 3285 B6R0.2 CC(C)OC(N)=O Amb4017684 [0,1,1,0,0,0|1,0,0]=3 3286 B6R0.2 CC(C)OC(N)=S Amb25732665 [0,1,1,0,0,0|1,1,0]=4 3287 B6R0.2 CC(C)O[PH](=O)S Amb27447273 [0,1,1,0,0,0|2,0,0]=4 3288 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [0,1,1,0,0,0|1,1,0]=4 3289 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [0,1,1,0,0,0|1,0,0]=3 3290 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [0,1,1,0,0,0|0,0,0]=2 3291 B6R0.2 CC(Cl)NC(N)=O Amb28130611 [0,1,1,0,0,0|2,0,0]=4 3292 B6R0.2 CC(Cl)OC(=O)Cl Amb6608999 [0,1,1,0,0,0|1,0,0]=3 3293 B6R0.2 CC(Cl)OC(C)Cl Amb17673696 [0,1,1,0,0,0|1,0,1]=4 3294 B6R0.2 CC(I)CC(=O)O Amb28398380 [0,1,1,0,0,0|0,0,0]=2 3295 B6R0.2 CC(N)CC(=O)O Amb8379759 [0,1,1,0,0,0|0,0,0]=2 3296 B6R0.2 CC(N)CC(=O)S Amb27413857 [0,1,1,0,0,0|0,1,0]=3 3297 B6R0.2 CC(N)CC(C)O Amb18640217 [0,1,1,0,0,0|1,0,1]=4 3298 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,1,1,0,0,0|1,0,0]=3 3299 B6R0.2 CC(N)CC(N)=O Amb33532770 [0,1,1,0,0,0|1,0,0]=3 3300 B6R0.2 CC(N)CS(C)=O Amb33546327 [0,1,1,0,0,0|2,0,0]=4 3301 B6R0.2 CC(O)CC(=O)O Amb8513187 [0,1,1,0,0,0|0,0,0]=2 3302 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [0,1,1,0,0,0|0,0,1]=3 3303 B6R0.2 CC(O)CC(C)F Amb28065744 [0,1,1,0,0,0|1,0,1]=4 3304 B6R0.2 CC(O)CC(C)O Amb10068523 [0,1,1,0,0,0|1,0,1]=4 3305 B6R0.2 CC(O)CC(C)S Amb24122653 [0,1,1,0,0,0|1,0,1]=4 3306 B6R0.2 CC(O)CC(N)=O Amb26394320 [0,1,1,0,0,0|1,0,0]=3 3307 B6R0.2 CC(O)CC(N)=S Amb24479794 [0,1,1,0,0,0|1,1,0]=4 3308 B6R0.2 CC(O)CS(C)=O Amb28137235 [0,1,1,0,0,0|2,0,0]=4 3309 B6R0.2 CC(O)C[N+](=O)[O-] Amb9678341 [0,1,1,0,0,0|1,0,1]=4 3310 B6R0.2 CC(S)CC(=O)O Amb33538201 [0,1,1,0,0,0|0,0,0]=2 3311 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,1,1,0,0,0|2,0,0]=4 3312 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [0,1,1,0,0,0|2,0,0]=4 3313 B6R0.2 CN(C)CC(=O)O Amb3319051 [0,1,1,0,0,0|1,0,0]=3 3314 B6R0.2 CN(C)CC(=O)O Amb3940366 [0,1,1,0,0,0|1,0,0]=3 3315 B6R0.2 CN(C)CC(N)=O Amb17231806 [0,1,1,0,0,0|2,0,0]=4 3316 B6R0.2 CN(C)CC(N)=O Amb33321491 [0,1,1,0,0,0|2,0,0]=4 3317 B6R0.2 CN(N)CC(=O)O Amb23592296 [0,1,1,0,0,0|1,0,0]=3 3318 B6R0.2 CN(O)CC(=O)O Amb29838290 [0,1,1,0,0,0|1,0,0]=3 3319 B6R0.2 CP(O)OC(N)=O Amb27436991 [0,1,1,0,0,0|2,0,0]=4 3320 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,1,1,0,0,0|2,0,0]=4 3321 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [0,1,1,0,0,0|0,0,0]=2 3322 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [0,1,1,0,0,0|0,0,0]=2 3323 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [0,1,1,0,0,0|0,0,0]=2 3324 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [0,1,1,0,0,0|0,0,0]=2 3325 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [0,1,1,0,0,0|0,0,0]=2 3326 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [0,1,1,0,0,0|0,0,1]=3 3327 B6R0.2 C[C@@H](O)CS(C)=O Amb27457390 [0,1,1,0,0,0|2,0,0]=4 3328 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [0,1,1,0,0,0|0,0,0]=2 3329 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [0,1,1,0,0,0|0,0,0]=2 3330 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [0,1,1,0,0,0|0,0,0]=2 3331 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [0,1,1,0,0,0|1,0,0]=3 3332 B6R0.2 C[C@H](N)C[C@H](C)O Amb27593805 [0,1,1,0,0,0|1,0,1]=4 3333 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [0,1,1,0,0,0|0,0,0]=2 3334 B6R0.2 C[C@H](O)C[C@@H](C)F Amb27486566 [0,1,1,0,0,0|1,0,1]=4 3335 B6R0.2 C[C@H](O)C[C@@H](C)O Amb27273041 [0,1,1,0,0,0|1,0,1]=4 3336 B6R0.2 C[C@H](O)C[C@H](C)I Amb28042894 [0,1,1,0,0,0|1,0,1]=4 3337 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [0,1,1,0,0,0|1,0,1]=4 3338 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,1,1,0,0,0|2,0,0]=4 3339 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [0,1,1,0,0,0|1,0,0]=3 3340 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [0,1,1,0,0,0|1,0,0]=3 3341 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [0,1,1,0,0,0|1,0,1]=4 3342 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [0,1,1,0,0,0|0,0,2]=4 3343 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [0,1,1,0,0,0|0,0,2]=4 3344 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [0,1,1,0,0,0|0,0,2]=4 3345 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [0,1,1,0,0,0|0,0,2]=4 3346 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [0,1,1,0,0,0|0,0,2]=4 3347 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [0,1,1,0,0,0|0,0,2]=4 3348 B6R0.2 NC(=O)CC(=O)O Amb4034884 [0,1,1,0,0,0|1,0,1]=4 3349 B6R0.2 NC(=O)CC(F)F Amb28401488 [0,1,1,0,0,0|2,0,0]=4 3350 B6R0.2 NC(=S)CC(=O)O Amb17465742 [0,1,1,0,0,0|1,0,1]=4 3351 B6R0.2 NC(S)CC(=O)O Amb27391244 [0,1,1,0,0,0|1,0,0]=3 3352 B6R0.2 O=C(Cl)OC(Cl)Cl Amb28050145 [0,1,1,0,0,0|2,0,0]=4 3353 B6R0.2 O=C(O)CB(O)O Amb24053058 [0,1,1,0,0,0|2,0,0]=4 3354 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [0,1,1,0,0,0|1,0,1]=4 3355 B6R0.2 O=C(O)CC(=O)O Amb2689065 [0,1,1,0,0,0|1,0,1]=4 3356 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [0,1,1,0,0,0|1,0,0]=3 3357 B6R0.2 O=C(O)CC(F)F Amb22001551 [0,1,1,0,0,0|1,0,0]=3 3358 B6R0.2 O=C(O)CS(=O)O Amb27788997 [0,1,1,0,0,0|2,0,0]=4 3359 B6R0.2 O=C([O-])CC(F)F Amb24117960 [0,1,1,0,0,0|1,0,1]=4 3360 B6R0.2 O=S(O)CC(F)F Amb30035176 [0,1,1,0,0,0|2,0,0]=4 3361 B6R0.2 OC(=S)CC(F)F Amb34179023 [0,1,1,0,0,0|1,1,0]=4 3362 B6R0.3 C#CC(N)C(=O)O Amb28282694 [0,1,1,0,0,0|0,0,2]=4 3363 B6R0.3 C#CC(O)C(=O)O Amb22731622 [0,1,1,0,0,0|0,0,2]=4 3364 B6R0.3 C=C(Br)C(C)CC Amb22583745 [0,1,1,0,0,0|2,0,0]=4 3365 B6R0.3 C=C(C)C(=O)CC Amb27486383 [0,1,1,0,0,0|2,0,0]=4 3366 B6R0.3 C=C(C)C(Cl)CC Amb27229374 [0,1,1,0,0,0|2,0,0]=4 3367 B6R0.3 C=C(C)C(O)CC Amb26365874 [0,1,1,0,0,0|2,0,0]=4 3368 B6R0.3 C=C(CBr)C(=O)O Amb6296612 [0,1,1,0,0,0|1,0,1]=4 3369 B6R0.3 C=C(CC)C(=O)Cl Amb22353554 [0,1,1,0,0,0|1,0,1]=4 3370 B6R0.3 C=C(CC)C(=O)O Amb18639591 [0,1,1,0,0,0|0,0,1]=3 3371 B6R0.3 C=C(CCl)C(=O)O Amb27851591 [0,1,1,0,0,0|1,0,1]=4 3372 B6R0.3 C=C(CO)C(=O)O Amb18121817 [0,1,1,0,0,0|1,0,1]=4 3373 B6R0.3 C=C(CO)C(C)=O Amb24571845 [0,1,1,0,0,0|2,0,0]=4 3374 B6R0.3 C=C(CS)C(=O)O Amb27263242 [0,1,1,0,0,0|1,0,1]=4 3375 B6R0.3 C=C(OC)C(=O)O Amb18639906 [0,1,1,0,0,0|1,0,1]=4 3376 B6R0.3 C=C(OC)C(C)=O Amb28126662 [0,1,1,0,0,0|2,0,0]=4 3377 B6R0.3 C=C(SC)C(=O)O Amb27882690 [0,1,1,0,0,0|1,0,1]=4 3378 B6R0.3 C=CC(C)C(=O)O Amb21618706 [0,1,1,0,0,0|0,0,2]=4 3379 B6R0.3 C=CC(Cl)C(=O)O Amb27216715 [0,1,1,0,0,0|0,0,2]=4 3380 B6R0.3 C=CC(N)C(=O)O Amb20240543 [0,1,1,0,0,0|0,0,2]=4 3381 B6R0.3 C=CC(O)C(=O)O Amb24061247 [0,1,1,0,0,0|0,0,2]=4 3382 B6R0.3 C=CC(S)C(=O)O Amb28069741 [0,1,1,0,0,0|0,0,2]=4 3383 B6R0.3 C=C[C@@H](C)C(=O)O Amb26350417 [0,1,1,0,0,0|0,0,2]=4 3384 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [0,1,1,0,0,0|0,0,2]=4 3385 B6R0.3 C=C[C@H](C)C(=O)O Amb25929549 [0,1,1,0,0,0|0,0,2]=4 3386 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [0,1,1,0,0,0|0,0,2]=4 3387 B6R0.3 CC(=O)C(=O)CBr Amb17506257 [0,1,1,0,0,0|2,0,0]=4 3388 B6R0.3 CC(=O)C(=O)CCl Amb17506258 [0,1,1,0,0,0|2,0,0]=4 3389 B6R0.3 CC(=O)C(Br)CBr Amb27597612 [0,1,1,0,0,0|2,0,0]=4 3390 B6R0.3 CC(=O)C(C)CCl Amb26477594 [0,1,1,0,0,0|2,0,0]=4 3391 B6R0.3 CC(=O)C(C)CO Amb10844844 [0,1,1,0,0,0|2,0,0]=4 3392 B6R0.3 CC(=O)C(Cl)CCl Amb27257955 [0,1,1,0,0,0|2,0,0]=4 3393 B6R0.3 CC(=O)C(O)CO Amb26463044 [0,1,1,0,0,0|2,0,0]=4 3394 B6R0.3 CC(=O)C([Na])CN Amb28423432 [0,1,1,0,0,0|2,0,0]=4 3395 B6R0.3 CC(=O)N(C)CO Amb28191296 [0,1,1,0,0,0|2,0,0]=4 3396 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [0,1,1,0,0,0|2,0,0]=4 3397 B6R0.3 CC(=O)[C@H](N)CO Amb27451047 [0,1,1,0,0,0|2,0,0]=4 3398 B6R0.3 CC(C#N)C(=O)O Amb17210512 [0,1,1,0,0,0|1,0,1]=4 3399 B6R0.3 CC(C=O)C(=O)O Amb27784775 [0,1,1,0,0,0|1,0,1]=4 3400 B6R0.3 CC(CBr)C(=O)O Amb22002601 [0,1,1,0,0,0|1,0,0]=3 3401 B6R0.3 CC(CCl)C(=O)O Amb18522181 [0,1,1,0,0,0|1,0,0]=3 3402 B6R0.3 CC(CF)C(=O)O Amb24432331 [0,1,1,0,0,0|1,0,0]=3 3403 B6R0.3 CC(CN)C(=O)O Amb2699128 [0,1,1,0,0,0|1,0,0]=3 3404 B6R0.3 CC(CN)C(=O)O Amb6773978 [0,1,1,0,0,0|1,0,0]=3 3405 B6R0.3 CC(CN)C(=O)O Amb8631418 [0,1,1,0,0,0|1,0,0]=3 3406 B6R0.3 CC(CO)C(=O)O Amb8011522 [0,1,1,0,0,0|1,0,0]=3 3407 B6R0.3 CC(NN)C(=O)O Amb18640367 [0,1,1,0,0,0|2,0,0]=4 3408 B6R0.3 CC(ON)C(=O)O Amb33038242 [0,1,1,0,0,0|2,0,0]=4 3409 B6R0.3 CCC(=O)C(=O)Cl Amb27838251 [0,1,1,0,0,0|1,0,1]=4 3410 B6R0.3 CCC(=O)C(=O)O Amb3940359 [0,1,1,0,0,0|0,0,1]=3 3411 B6R0.3 CCC(=O)C(=O)[O-] Amb9825450 [0,1,1,0,0,0|0,0,2]=4 3412 B6R0.3 CCC(=O)C(C)=O Amb8514604 [0,1,1,0,0,0|1,0,0]=3 3413 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,1,1,0,0,0|1,0,1]=4 3414 B6R0.3 CCC(=S)C(=O)O Amb27872099 [0,1,1,0,0,0|0,0,1]=3 3415 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [0,1,1,0,0,0|1,0,0]=3 3416 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [0,1,1,0,0,0|1,0,0]=3 3417 B6R0.3 CCC(Br)C(=O)O Amb5716858 [0,1,1,0,0,0|0,0,0]=2 3418 B6R0.3 CCC(Br)C(C)=O Amb24615269 [0,1,1,0,0,0|1,0,0]=3 3419 B6R0.3 CCC(Br)C(N)=O Amb13952819 [0,1,1,0,0,0|1,0,0]=3 3420 B6R0.3 CCC(Br)[N+](=O)[O-] Amb17673702 [0,1,1,0,0,0|1,0,1]=4 3421 B6R0.3 CCC(C)=C(C)C Amb4017694 [0,1,1,0,0,0|2,0,0]=4 3422 B6R0.3 CCC(C)B(O)O Amb10071974 [0,1,1,0,0,0|1,0,1]=4 3423 B6R0.3 CCC(C)C(=N)N Amb6740564 [0,1,1,0,0,0|2,0,0]=4 3424 B6R0.3 CCC(C)C(=N)N Amb8630181 [0,1,1,0,0,0|2,0,0]=4 3425 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [0,1,1,0,0,0|1,0,0]=3 3426 B6R0.3 CCC(C)C(=O)O Amb9703224 [0,1,1,0,0,0|0,0,0]=2 3427 B6R0.3 CCC(C)C(C)=O Amb4605996 [0,1,1,0,0,0|1,0,0]=3 3428 B6R0.3 CCC(C)C(C)O Amb8513435 [0,1,1,0,0,0|1,0,1]=4 3429 B6R0.3 CCC(C)C(N)=O Amb33548100 [0,1,1,0,0,0|1,0,0]=3 3430 B6R0.3 CCC(C)C(N)=S Amb6740516 [0,1,1,0,0,0|1,1,0]=4 3431 B6R0.3 CCC(C)C(O)O Amb27826789 [0,1,1,0,0,0|0,0,2]=4 3432 B6R0.3 CCC(C)S(=O)Cl Amb27841595 [0,1,1,0,0,0|2,0,0]=4 3433 B6R0.3 CCC(C)S(=O)[O-] Amb19893328 [0,1,1,0,0,0|1,0,1]=4 3434 B6R0.3 CCC(C)S(N)=O Amb32756501 [0,1,1,0,0,0|2,0,0]=4 3435 B6R0.3 CCC(C)[C@@H](C)O Amb27946951 [0,1,1,0,0,0|1,0,1]=4 3436 B6R0.3 CCC(C)[C@H](C)O Amb28281014 [0,1,1,0,0,0|1,0,1]=4 3437 B6R0.3 CCC(C)[N+](=O)[O-] Amb4036169 [0,1,1,0,0,0|1,0,1]=4 3438 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [0,1,1,0,0,0|1,0,0]=3 3439 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [0,1,1,0,0,0|1,0,0]=3 3440 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [0,1,1,0,0,0|0,0,0]=2 3441 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [0,1,1,0,0,0|1,0,0]=3 3442 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [0,1,1,0,0,0|1,0,0]=3 3443 B6R0.3 CCC(Cl)C(O)O Amb27400305 [0,1,1,0,0,0|0,0,2]=4 3444 B6R0.3 CCC(Cl)[N+](=O)[O-] Amb4016590 [0,1,1,0,0,0|1,0,1]=4 3445 B6R0.3 CCC(F)C(=N)N Amb32456109 [0,1,1,0,0,0|2,0,0]=4 3446 B6R0.3 CCC(F)C(=O)O Amb25716167 [0,1,1,0,0,0|0,0,0]=2 3447 B6R0.3 CCC(N)B(O)O Amb28367684 [0,1,1,0,0,0|1,0,1]=4 3448 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [0,1,1,0,0,0|1,0,0]=3 3449 B6R0.3 CCC(N)C(=O)O Amb9729506 [0,1,1,0,0,0|0,0,0]=2 3450 B6R0.3 CCC(N)C(C)O Amb32662794 [0,1,1,0,0,0|1,0,1]=4 3451 B6R0.3 CCC(N)C(C)O Amb8855230 [0,1,1,0,0,0|1,0,1]=4 3452 B6R0.3 CCC(N)C(N)=O Amb1914080 [0,1,1,0,0,0|1,0,0]=3 3453 B6R0.3 CCC(N)C(N)=O Amb33528521 [0,1,1,0,0,0|1,0,0]=3 3454 B6R0.3 CCC(N)C(N)O Amb28348585 [0,1,1,0,0,0|1,0,1]=4 3455 B6R0.3 CCC(N)P(=O)=O Amb27786328 [0,1,1,0,0,0|1,0,1]=4 3456 B6R0.3 CCC(O)C(=N)N Amb33321504 [0,1,1,0,0,0|2,0,0]=4 3457 B6R0.3 CCC(O)C(=O)O Amb6609018 [0,1,1,0,0,0|0,0,0]=2 3458 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [0,1,1,0,0,0|0,0,1]=3 3459 B6R0.3 CCC(O)C(C)=O Amb25336501 [0,1,1,0,0,0|1,0,0]=3 3460 B6R0.3 CCC(O)C(C)O Amb2227553 [0,1,1,0,0,0|1,0,1]=4 3461 B6R0.3 CCC(O)C(N)=O Amb24116514 [0,1,1,0,0,0|1,0,0]=3 3462 B6R0.3 CCC(O)C(N)=S Amb23449332 [0,1,1,0,0,0|1,1,0]=4 3463 B6R0.3 CCC(O)S(=O)[O-] Amb27166943 [0,1,1,0,0,0|1,0,1]=4 3464 B6R0.3 CCC(S)C(=O)O Amb17501370 [0,1,1,0,0,0|0,0,0]=2 3465 B6R0.3 CCC(S)C(C)=O Amb8393170 [0,1,1,0,0,0|1,0,0]=3 3466 B6R0.3 CCN(C)C(=O)Cl Amb8390927 [0,1,1,0,0,0|2,0,0]=4 3467 B6R0.3 CCN(C)C(C)=O Amb22753516 [0,1,1,0,0,0|1,0,0]=3 3468 B6R0.3 CCN(N)C(C)=O Amb18639976 [0,1,1,0,0,0|1,0,0]=3 3469 B6R0.3 CCN(N)C(N)=O Amb28184355 [0,1,1,0,0,0|2,0,0]=4 3470 B6R0.3 CCN(O)C(C)=O Amb27652499 [0,1,1,0,0,0|1,0,0]=3 3471 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [0,1,1,0,0,0|0,0,0]=2 3472 B6R0.3 CC[C@@H](C)B(O)O Amb27784066 [0,1,1,0,0,0|1,0,1]=4 3473 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [0,1,1,0,0,0|0,0,0]=2 3474 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [0,1,1,0,0,0|1,0,0]=3 3475 B6R0.3 CC[C@@H](C)[C@@H](C)O Amb27448466 [0,1,1,0,0,0|1,0,1]=4 3476 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [0,1,1,0,0,0|1,0,0]=3 3477 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [0,1,1,0,0,0|0,0,0]=2 3478 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [0,1,1,0,0,0|1,0,0]=3 3479 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [0,1,1,0,0,0|0,0,0]=2 3480 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [0,1,1,0,0,0|0,0,0]=2 3481 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [0,1,1,0,0,0|1,0,0]=3 3482 B6R0.3 CC[C@@H](N)C(C)O Amb28280672 [0,1,1,0,0,0|1,0,1]=4 3483 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [0,1,1,0,0,0|1,0,0]=3 3484 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [0,1,1,0,0,0|1,0,0]=3 3485 B6R0.3 CC[C@@H](N)[C@@H](C)O Amb24117050 [0,1,1,0,0,0|1,0,1]=4 3486 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [0,1,1,0,0,0|0,0,0]=2 3487 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [0,1,1,0,0,0|1,0,0]=3 3488 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [0,1,1,0,0,0|0,0,0]=2 3489 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [0,1,1,0,0,0|1,0,1]=4 3490 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [0,1,1,0,0,0|1,0,0]=3 3491 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [0,1,1,0,0,0|0,0,0]=2 3492 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [0,1,1,0,0,0|1,0,0]=3 3493 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [0,1,1,0,0,0|0,0,0]=2 3494 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [0,1,1,0,0,0|0,0,0]=2 3495 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [0,1,1,0,0,0|0,0,0]=2 3496 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [0,1,1,0,0,0|1,0,0]=3 3497 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [0,1,1,0,0,0|1,0,0]=3 3498 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [0,1,1,0,0,0|1,0,0]=3 3499 B6R0.3 CC[C@H](N)[C@@H](C)O Amb24117049 [0,1,1,0,0,0|1,0,1]=4 3500 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [0,1,1,0,0,0|0,0,0]=2 3501 B6R0.3 CC[C@H](O)[C@@H](C)O Amb27972258 [0,1,1,0,0,0|1,0,1]=4 3502 B6R0.3 CC[C@H](O)[C@H](C)O Amb27664238 [0,1,1,0,0,0|1,0,1]=4 3503 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [0,1,1,0,0,0|0,0,0]=2 3504 B6R0.3 CNC(=O)C(=O)O Amb2691295 [0,1,1,0,0,0|1,0,1]=4 3505 B6R0.3 CNC(=O)C(C)=O Amb17399787 [0,1,1,0,0,0|2,0,0]=4 3506 B6R0.3 CNC(C)C(=O)O Amb19373699 [0,1,1,0,0,0|1,0,0]=3 3507 B6R0.3 CNC(C)C(=O)O Amb9271766 [0,1,1,0,0,0|1,0,0]=3 3508 B6R0.3 CNC(C)C(C)=O Amb24369529 [0,1,1,0,0,0|2,0,0]=4 3509 B6R0.3 CNC(C)C(N)=O Amb33527202 [0,1,1,0,0,0|2,0,0]=4 3510 B6R0.3 CNC(C)C(N)=O Amb7758120 [0,1,1,0,0,0|2,0,0]=4 3511 B6R0.3 CNC(O)C(=O)O Amb27229907 [0,1,1,0,0,0|1,0,0]=3 3512 B6R0.3 CN[C@@H](C)C(=O)O Amb16233347 [0,1,1,0,0,0|1,0,0]=3 3513 B6R0.3 CN[C@@H](C)C(=O)O Amb16233348 [0,1,1,0,0,0|1,0,0]=3 3514 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [0,1,1,0,0,0|2,0,0]=4 3515 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [0,1,1,0,0,0|2,0,0]=4 3516 B6R0.3 CN[C@H](C)C(=O)O Amb10844859 [0,1,1,0,0,0|1,0,0]=3 3517 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [0,1,1,0,0,0|2,0,0]=4 3518 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [0,1,1,0,0,0|2,0,0]=4 3519 B6R0.3 COC(=O)C(=O)O Amb33545007 [0,1,1,0,0,0|1,0,1]=4 3520 B6R0.3 COC(=O)C(C)=O Amb8513262 [0,1,1,0,0,0|2,0,0]=4 3521 B6R0.3 COC(Br)C(=O)O Amb27439128 [0,1,1,0,0,0|1,0,0]=3 3522 B6R0.3 COC(Br)C(C)=O Amb25360111 [0,1,1,0,0,0|2,0,0]=4 3523 B6R0.3 COC(C)C(=O)Cl Amb26005661 [0,1,1,0,0,0|2,0,0]=4 3524 B6R0.3 COC(C)C(=O)O Amb9729215 [0,1,1,0,0,0|1,0,0]=3 3525 B6R0.3 COC(C)C(C)=O Amb9666021 [0,1,1,0,0,0|2,0,0]=4 3526 B6R0.3 COC(C)C(N)=O Amb6541307 [0,1,1,0,0,0|2,0,0]=4 3527 B6R0.3 COC(Cl)C(=O)O Amb28280799 [0,1,1,0,0,0|1,0,0]=3 3528 B6R0.3 COC(Cl)C(C)=O Amb28118971 [0,1,1,0,0,0|2,0,0]=4 3529 B6R0.3 COC(F)C(=O)O Amb27764863 [0,1,1,0,0,0|1,0,0]=3 3530 B6R0.3 COC(F)C(=O)[O-] Amb33447021 [0,1,1,0,0,0|1,0,1]=4 3531 B6R0.3 COC(O)C(C)=O Amb27954086 [0,1,1,0,0,0|2,0,0]=4 3532 B6R0.3 CON(C)C(C)=O Amb2689133 [0,1,1,0,0,0|2,0,0]=4 3533 B6R0.3 CO[C@@H](C)C(=O)Cl Amb26562182 [0,1,1,0,0,0|2,0,0]=4 3534 B6R0.3 CO[C@@H](C)C(=O)O Amb8515766 [0,1,1,0,0,0|1,0,0]=3 3535 B6R0.3 CO[C@@H](C)C(N)=O Amb8515768 [0,1,1,0,0,0|2,0,0]=4 3536 B6R0.3 CO[C@H](C)C(=O)Cl Amb27588755 [0,1,1,0,0,0|2,0,0]=4 3537 B6R0.3 CO[C@H](C)C(=O)O Amb8515771 [0,1,1,0,0,0|1,0,0]=3 3538 B6R0.3 CO[C@H](C)C(N)=O Amb17617080 [0,1,1,0,0,0|2,0,0]=4 3539 B6R0.3 CSC(=O)C(C)=O Amb27861244 [0,1,1,0,0,0|2,0,0]=4 3540 B6R0.3 CSC(C)C(=O)O Amb6274567 [0,1,1,0,0,0|1,0,0]=3 3541 B6R0.3 CSC(C)C(N)=O Amb28047863 [0,1,1,0,0,0|2,0,0]=4 3542 B6R0.3 CSC(Cl)C(=O)Cl Amb27392297 [0,1,1,0,0,0|2,0,0]=4 3543 B6R0.3 CSC(N)C(=O)O Amb28383509 [0,1,1,0,0,0|1,0,0]=3 3544 B6R0.3 CS[C@H](C)C(=O)O Amb26611205 [0,1,1,0,0,0|1,0,0]=3 3545 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [0,1,1,0,0,0|1,0,0]=3 3546 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [0,1,1,0,0,0|1,0,0]=3 3547 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [0,1,1,0,0,0|1,0,0]=3 3548 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [0,1,1,0,0,0|1,0,0]=3 3549 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [0,1,1,0,0,0|1,0,0]=3 3550 B6R0.3 C[C@@H](CO)C(N)=O Amb27254152 [0,1,1,0,0,0|2,0,0]=4 3551 B6R0.3 C[C@@H](ON)C(=O)O Amb27169414 [0,1,1,0,0,0|2,0,0]=4 3552 B6R0.3 C[C@@H](ON)C(=O)O Amb33620846 [0,1,1,0,0,0|2,0,0]=4 3553 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [0,1,1,0,0,0|1,0,0]=3 3554 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [0,1,1,0,0,0|2,0,0]=4 3555 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [0,1,1,0,0,0|1,0,0]=3 3556 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [0,1,1,0,0,0|1,0,0]=3 3557 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [0,1,1,0,0,0|1,0,0]=3 3558 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [0,1,1,0,0,0|1,0,0]=3 3559 B6R0.3 C[C@H](NBr)C(=O)O Amb28050211 [0,1,1,0,0,0|2,0,0]=4 3560 B6R0.3 C[C@H](NN)C(=O)O Amb28247936 [0,1,1,0,0,0|2,0,0]=4 3561 B6R0.3 C[C@H](ON)C(=O)O Amb25853808 [0,1,1,0,0,0|2,0,0]=4 3562 B6R0.3 C[C@H](ON)C(=O)O Amb33620847 [0,1,1,0,0,0|2,0,0]=4 3563 B6R0.3 C\C=C(/Br)C(=O)O Amb18646193 [0,1,1,0,0,0|0,0,2]=4 3564 B6R0.3 C\C=C(/C)C(=O)O Amb33723768 [0,1,1,0,0,0|0,0,2]=4 3565 B6R0.3 C\C=C(/C)C(C)=O Amb2725616 [0,1,1,0,0,0|1,0,1]=4 3566 B6R0.3 C\C=C(/F)C(=O)O Amb32663762 [0,1,1,0,0,0|0,0,2]=4 3567 B6R0.3 C\C=C(/O)C(=O)O Amb22727962 [0,1,1,0,0,0|0,0,2]=4 3568 B6R0.3 C\C=C(\Br)C(=O)O Amb4014486 [0,1,1,0,0,0|0,0,2]=4 3569 B6R0.3 C\C=C(\C)C(=O)O Amb3445181 [0,1,1,0,0,0|0,0,2]=4 3570 B6R0.3 C\C=C(\Cl)C(=O)O Amb28073985 [0,1,1,0,0,0|0,0,2]=4 3571 B6R0.3 C\C=C(\I)C(=O)O Amb27841305 [0,1,1,0,0,0|0,0,2]=4 3572 B6R0.3 C\N=C(/C)C(C)=O Amb27838250 [0,1,1,0,0,0|2,0,0]=4 3573 B6R0.3 N#CC(N)C(=O)O Amb25328320 [0,1,1,0,0,0|1,0,1]=4 3574 B6R0.3 N#CC(O)C(=O)O Amb27467286 [0,1,1,0,0,0|1,0,1]=4 3575 B6R0.3 NC(=O)C(Br)CBr Amb8390579 [0,1,1,0,0,0|2,0,0]=4 3576 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [0,1,1,0,0,0|2,0,0]=4 3577 B6R0.3 NC(=O)C(N)CO Amb17593097 [0,1,1,0,0,0|2,0,0]=4 3578 B6R0.3 NC(=O)C(N)CO Amb2720301 [0,1,1,0,0,0|2,0,0]=4 3579 B6R0.3 NC(=O)C(N)CS Amb18641990 [0,1,1,0,0,0|2,0,0]=4 3580 B6R0.3 NC(=O)C(N)CS Amb33330875 [0,1,1,0,0,0|2,0,0]=4 3581 B6R0.3 NC(=O)C(O)CO Amb27169520 [0,1,1,0,0,0|2,0,0]=4 3582 B6R0.3 NC(=O)[C@@H](N)CO Amb6336612 [0,1,1,0,0,0|2,0,0]=4 3583 B6R0.3 NC(=O)[C@@H](N)CO Amb8387630 [0,1,1,0,0,0|2,0,0]=4 3584 B6R0.3 NC(=O)[C@@H](N)CS Amb23437751 [0,1,1,0,0,0|2,0,0]=4 3585 B6R0.3 NC(=O)[C@@H](O)CO Amb27816733 [0,1,1,0,0,0|2,0,0]=4 3586 B6R0.3 NC(=O)[C@H](N)CO Amb22886957 [0,1,1,0,0,0|2,0,0]=4 3587 B6R0.3 NC(=O)[C@H](N)CO Amb26505098 [0,1,1,0,0,0|2,0,0]=4 3588 B6R0.3 NC(CCl)C(=O)O Amb19651457 [0,1,1,0,0,0|1,0,0]=3 3589 B6R0.3 NC(CCl)C(=O)O Amb21961077 [0,1,1,0,0,0|1,0,0]=3 3590 B6R0.3 NC(CF)C(=O)O Amb10839589 [0,1,1,0,0,0|1,0,0]=3 3591 B6R0.3 NC(CO)C(=O)O Amb9702805 [0,1,1,0,0,0|1,0,0]=3 3592 B6R0.3 NC(CP)C(=O)O Amb27234251 [0,1,1,0,0,0|1,0,0]=3 3593 B6R0.3 NC(CS)C(=O)Cl Amb28050358 [0,1,1,0,0,0|2,0,0]=4 3594 B6R0.3 NC(CS)C(=O)O Amb13961966 [0,1,1,0,0,0|1,0,0]=3 3595 B6R0.3 NC(CS)C(=O)O Amb22489523 [0,1,1,0,0,0|1,0,0]=3 3596 B6R0.3 NC(CS)C(=O)O Amb6537913 [0,1,1,0,0,0|1,0,0]=3 3597 B6R0.3 NC(CS)C(=O)O Amb6537914 [0,1,1,0,0,0|1,0,0]=3 3598 B6R0.3 NC(CS)C(=O)S Amb27838279 [0,1,1,0,0,0|1,1,0]=4 3599 B6R0.3 NC(CS)S(=O)O Amb27238568 [0,1,1,0,0,0|2,0,0]=4 3600 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [0,1,1,0,0,0|1,0,0]=3 3601 B6R0.3 NCC(Br)C(=O)O Amb28385732 [0,1,1,0,0,0|1,0,0]=3 3602 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [0,1,1,0,0,0|1,0,0]=3 3603 B6R0.3 NCC(F)C(=O)O Amb22733051 [0,1,1,0,0,0|1,0,0]=3 3604 B6R0.3 NCC(F)C(=O)O Amb2688010 [0,1,1,0,0,0|1,0,0]=3 3605 B6R0.3 NCC(F)C(N)=O Amb26984913 [0,1,1,0,0,0|2,0,0]=4 3606 B6R0.3 NCC(F)C(N)=O Amb32667436 [0,1,1,0,0,0|2,0,0]=4 3607 B6R0.3 NCC(N)C(=O)O Amb22899095 [0,1,1,0,0,0|1,0,0]=3 3608 B6R0.3 NCC(N)C(=O)O Amb2697095 [0,1,1,0,0,0|1,0,0]=3 3609 B6R0.3 NCC(N)C(=O)O Amb8514284 [0,1,1,0,0,0|1,0,0]=3 3610 B6R0.3 NCC(O)C(=O)O Amb8517492 [0,1,1,0,0,0|1,0,0]=3 3611 B6R0.3 NCC(O)C(N)=O Amb27164291 [0,1,1,0,0,0|2,0,0]=4 3612 B6R0.3 NCC(O)C(N)=O Amb28827639 [0,1,1,0,0,0|2,0,0]=4 3613 B6R0.3 NCC(S)C(=O)O Amb17593238 [0,1,1,0,0,0|1,0,0]=3 3614 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [0,1,1,0,0,0|1,0,0]=3 3615 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [0,1,1,0,0,0|1,0,0]=3 3616 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [0,1,1,0,0,0|1,0,0]=3 3617 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [0,1,1,0,0,0|1,0,0]=3 3618 B6R0.3 NC[C@@H](N)C(N)=O Amb27981260 [0,1,1,0,0,0|2,0,0]=4 3619 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [0,1,1,0,0,0|1,0,0]=3 3620 B6R0.3 NC[C@@H](O)C(N)=O Amb28282144 [0,1,1,0,0,0|2,0,0]=4 3621 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [0,1,1,0,0,0|1,0,0]=3 3622 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [0,1,1,0,0,0|1,0,0]=3 3623 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [0,1,1,0,0,0|1,0,0]=3 3624 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [0,1,1,0,0,0|1,0,0]=3 3625 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [0,1,1,0,0,0|1,0,0]=3 3626 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [0,1,1,0,0,0|1,0,0]=3 3627 B6R0.3 NC[C@H](O)C(N)=O Amb32645211 [0,1,1,0,0,0|2,0,0]=4 3628 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [0,1,1,0,0,0|1,0,1]=4 3629 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [0,1,1,0,0,0|1,0,0]=3 3630 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [0,1,1,0,0,0|1,0,0]=3 3631 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [0,1,1,0,0,0|1,0,0]=3 3632 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [0,1,1,0,0,0|1,0,0]=3 3633 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [0,1,1,0,0,0|1,0,0]=3 3634 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [0,1,1,0,0,0|1,0,0]=3 3635 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [0,1,1,0,0,0|1,0,0]=3 3636 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [0,1,1,0,0,0|1,0,0]=3 3637 B6R0.3 N[C@@H](CS)S(=O)O Amb27391675 [0,1,1,0,0,0|2,0,0]=4 3638 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [0,1,1,0,0,0|1,0,0]=3 3639 B6R0.3 N[C@H](CCl)C(=O)Cl Amb28143184 [0,1,1,0,0,0|2,0,0]=4 3640 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [0,1,1,0,0,0|1,0,0]=3 3641 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [0,1,1,0,0,0|1,0,0]=3 3642 B6R0.3 N[C@H](CO)C(=O)Cl Amb28058341 [0,1,1,0,0,0|2,0,0]=4 3643 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [0,1,1,0,0,0|1,0,0]=3 3644 B6R0.3 N[C@H](CS)C(=O)Cl Amb27166396 [0,1,1,0,0,0|2,0,0]=4 3645 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [0,1,1,0,0,0|1,0,0]=3 3646 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [0,1,1,0,0,0|1,0,0]=3 3647 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [0,1,1,0,0,0|1,0,0]=3 3648 B6R0.3 O=C(Cl)C(Br)CBr Amb3940235 [0,1,1,0,0,0|2,0,0]=4 3649 B6R0.3 O=C(Cl)C(Br)CCl Amb28198806 [0,1,1,0,0,0|2,0,0]=4 3650 B6R0.3 O=C(Cl)C(Br)CF Amb28129447 [0,1,1,0,0,0|2,0,0]=4 3651 B6R0.3 O=C(Cl)C(Cl)CCl Amb3940236 [0,1,1,0,0,0|2,0,0]=4 3652 B6R0.3 O=C(O)C(=O)CBr Amb10068671 [0,1,1,0,0,0|1,0,1]=4 3653 B6R0.3 O=C(O)C(=O)CBr Amb8389349 [0,1,1,0,0,0|1,0,1]=4 3654 B6R0.3 O=C(O)C(=O)CCl Amb16233358 [0,1,1,0,0,0|1,0,1]=4 3655 B6R0.3 O=C(O)C(=O)CI Amb27659477 [0,1,1,0,0,0|1,0,1]=4 3656 B6R0.3 O=C(O)C(=O)CO Amb6600025 [0,1,1,0,0,0|1,0,1]=4 3657 B6R0.3 O=C(O)C(=O)CS Amb6600041 [0,1,1,0,0,0|1,0,1]=4 3658 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [0,1,1,0,0,0|1,0,0]=3 3659 B6R0.3 O=C(O)C(Br)CF Amb10605519 [0,1,1,0,0,0|1,0,0]=3 3660 B6R0.3 O=C(O)C(Br)CO Amb18126327 [0,1,1,0,0,0|1,0,0]=3 3661 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [0,1,1,0,0,0|1,0,0]=3 3662 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [0,1,1,0,0,0|1,0,0]=3 3663 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [0,1,1,0,0,0|1,0,0]=3 3664 B6R0.3 O=C(O)C(F)CO Amb17593117 [0,1,1,0,0,0|1,0,0]=3 3665 B6R0.3 O=C(O)C(O)CBr Amb24061932 [0,1,1,0,0,0|1,0,0]=3 3666 B6R0.3 O=C(O)C(O)CCl Amb6371692 [0,1,1,0,0,0|1,0,0]=3 3667 B6R0.3 O=C(O)C(O)CF Amb27476477 [0,1,1,0,0,0|1,0,0]=3 3668 B6R0.3 O=C(O)C(O)CO Amb17593103 [0,1,1,0,0,0|1,0,0]=3 3669 B6R0.3 O=C(O)C(O)CS Amb18642053 [0,1,1,0,0,0|1,0,0]=3 3670 B6R0.3 O=C(O)C(S)CS Amb18643295 [0,1,1,0,0,0|1,0,0]=3 3671 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [0,1,1,0,0,0|1,0,0]=3 3672 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [0,1,1,0,0,0|1,0,0]=3 3673 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [0,1,1,0,0,0|1,0,0]=3 3674 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [0,1,1,0,0,0|1,0,0]=3 3675 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [0,1,1,0,0,0|1,0,0]=3 3676 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [0,1,1,0,0,0|1,0,0]=3 3677 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [0,1,1,0,0,0|1,0,0]=3 3678 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [0,1,1,0,0,0|1,0,0]=3 3679 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [0,1,1,0,0,0|1,0,0]=3 3680 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [0,1,1,0,0,0|1,0,0]=3 3681 B6R0.3 O=CC(Br)C(=O)O Amb27793774 [0,1,1,0,0,0|1,0,1]=4 3682 B6R0.3 O=CC(F)C(=O)O Amb22055301 [0,1,1,0,0,0|1,0,1]=4 3683 B6R0.3 O=C[C@@H](O)C(=O)O Amb27629391 [0,1,1,0,0,0|1,0,1]=4 3684 B6R0.3 [C-]#[N+]C(C)C(=O)O Amb27974746 [0,1,1,0,0,0|1,0,1]=4 3685 B6R0.4 C#CCCC(=O)Cl Amb26949181 [0,1,1,0,0,0|1,0,1]=4 3686 B6R0.4 C#CCCC(=O)O Amb33532622 [0,1,1,0,0,0|0,0,1]=3 3687 B6R0.4 C#CCCC(=O)[O-] Amb22232009 [0,1,1,0,0,0|0,0,2]=4 3688 B6R0.4 C#CCCC(C)=O Amb8869638 [0,1,1,0,0,0|1,0,1]=4 3689 B6R0.4 C#CCNC(C)=O Amb20623038 [0,1,1,0,0,0|1,0,1]=4 3690 B6R0.4 C#CCOC(=O)Cl Amb13777322 [0,1,1,0,0,0|1,0,1]=4 3691 B6R0.4 C#CCOC(C)=O Amb8517415 [0,1,1,0,0,0|0,0,1]=3 3692 B6R0.4 C#CCOC(N)=O Amb26654642 [0,1,1,0,0,0|1,0,1]=4 3693 B6R0.4 C#CCSC(C)=O Amb32683409 [0,1,1,0,0,0|0,1,1]=4 3694 B6R0.4 C=C(Br)CCCCl Amb28320778 [0,1,1,0,0,0|2,0,0]=4 3695 B6R0.4 C=C(Br)CCCN Amb27219336 [0,1,1,0,0,0|2,0,0]=4 3696 B6R0.4 C=C(Br)CCCO Amb27471781 [0,1,1,0,0,0|2,0,0]=4 3697 B6R0.4 C=C(Br)CSCC Amb28063803 [0,1,1,0,0,0|2,0,0]=4 3698 B6R0.4 C=C(C)C#CCC Amb2721682 [0,1,1,0,0,0|2,0,0]=4 3699 B6R0.4 C=C(C)CCCBr Amb22886717 [0,1,1,0,0,0|2,0,0]=4 3700 B6R0.4 C=C(C)CCCC Amb2721685 [0,1,1,0,0,0|2,0,0]=4 3701 B6R0.4 C=C(C)CCCCl Amb24089299 [0,1,1,0,0,0|2,0,0]=4 3702 B6R0.4 C=C(C)CCCN Amb24761452 [0,1,1,0,0,0|2,0,0]=4 3703 B6R0.4 C=C(C)CCCN Amb33534233 [0,1,1,0,0,0|2,0,0]=4 3704 B6R0.4 C=C(C)CCCO Amb22886814 [0,1,1,0,0,0|2,0,0]=4 3705 B6R0.4 C=C(C)CCCS Amb33198962 [0,1,1,0,0,0|2,0,0]=4 3706 B6R0.4 C=C(C)CCNC Amb18993045 [0,1,1,0,0,0|2,0,0]=4 3707 B6R0.4 C=C(C)CCOC Amb33546340 [0,1,1,0,0,0|2,0,0]=4 3708 B6R0.4 C=C(C)CCSC Amb28400079 [0,1,1,0,0,0|2,0,0]=4 3709 B6R0.4 C=C(C)CNCC Amb3940049 [0,1,1,0,0,0|2,0,0]=4 3710 B6R0.4 C=C(C)COCCl Amb27424965 [0,1,1,0,0,0|2,0,0]=4 3711 B6R0.4 C=C(Cl)CCCBr Amb25811643 [0,1,1,0,0,0|2,0,0]=4 3712 B6R0.4 C=C(Cl)CCCCl Amb24635037 [0,1,1,0,0,0|2,0,0]=4 3713 B6R0.4 C=C(Cl)CCCN Amb27413032 [0,1,1,0,0,0|2,0,0]=4 3714 B6R0.4 C=C(Cl)CCCO Amb28065233 [0,1,1,0,0,0|2,0,0]=4 3715 B6R0.4 C=C(Cl)CSCC Amb27972493 [0,1,1,0,0,0|2,0,0]=4 3716 B6R0.4 C=C(F)CCCO Amb25811029 [0,1,1,0,0,0|2,0,0]=4 3717 B6R0.4 C=C(I)CCCCl Amb27239930 [0,1,1,0,0,0|2,0,0]=4 3718 B6R0.4 C=C=CCC(=O)O Amb26657414 [0,1,1,0,0,0|0,0,2]=4 3719 B6R0.4 C=CCCC(=O)Cl Amb3939003 [0,1,1,0,0,0|1,0,1]=4 3720 B6R0.4 C=CCCC(=O)O Amb3940112 [0,1,1,0,0,0|0,0,1]=3 3721 B6R0.4 C=CCCC(C)=O Amb2721704 [0,1,1,0,0,0|1,0,1]=4 3722 B6R0.4 C=CCCC(N)=O Amb28136349 [0,1,1,0,0,0|1,0,1]=4 3723 B6R0.4 C=CCNC(C)=O Amb5797445 [0,1,1,0,0,0|1,0,1]=4 3724 B6R0.4 C=CCOC(=O)Cl Amb6600570 [0,1,1,0,0,0|1,0,1]=4 3725 B6R0.4 C=CCOC(N)=O Amb4017585 [0,1,1,0,0,0|1,0,1]=4 3726 B6R0.4 C=CNCC(=O)O Amb28346027 [0,1,1,0,0,0|0,0,2]=4 3727 B6R0.4 C=COCC(=O)O Amb27247261 [0,1,1,0,0,0|0,0,2]=4 3728 B6R0.4 C=COCC(C)=O Amb27838258 [0,1,1,0,0,0|0,0,2]=4 3729 B6R0.4 CC#CCC(=O)O Amb17939740 [0,1,1,0,0,0|0,0,1]=3 3730 B6R0.4 CC#CCC(C)=O Amb27648528 [0,1,1,0,0,0|1,0,1]=4 3731 B6R0.4 CC(=N)NCCF Amb28123831 [0,1,1,0,0,0|2,0,0]=4 3732 B6R0.4 CC(=O)CCC#N Amb17334046 [0,1,1,0,0,0|1,0,1]=4 3733 B6R0.4 CC(=O)CCC=O Amb18639597 [0,1,1,0,0,0|1,0,1]=4 3734 B6R0.4 CC(=O)CCCBr Amb8394105 [0,1,1,0,0,0|1,0,0]=3 3735 B6R0.4 CC(=O)CCCCl Amb3940272 [0,1,1,0,0,0|1,0,0]=3 3736 B6R0.4 CC(=O)CCCF Amb25068187 [0,1,1,0,0,0|1,0,0]=3 3737 B6R0.4 CC(=O)CCCN Amb18121547 [0,1,1,0,0,0|1,0,0]=3 3738 B6R0.4 CC(=O)CCCN Amb32661221 [0,1,1,0,0,0|1,0,0]=3 3739 B6R0.4 CC(=O)CCCN Amb32661286 [0,1,1,0,0,0|1,0,0]=3 3740 B6R0.4 CC(=O)CCCO Amb3940340 [0,1,1,0,0,0|1,0,0]=3 3741 B6R0.4 CC(=O)NCC#N Amb3886527 [0,1,1,0,0,0|1,0,1]=4 3742 B6R0.4 CC(=O)NCC=O Amb25757509 [0,1,1,0,0,0|1,0,1]=4 3743 B6R0.4 CC(=O)NCCBr Amb4311522 [0,1,1,0,0,0|1,0,0]=3 3744 B6R0.4 CC(=O)NCCCl Amb423758 [0,1,1,0,0,0|1,0,0]=3 3745 B6R0.4 CC(=O)NCCN Amb1218225 [0,1,1,0,0,0|1,0,0]=3 3746 B6R0.4 CC(=O)NCCO Amb2720909 [0,1,1,0,0,0|1,0,0]=3 3747 B6R0.4 CC(=O)NCCS Amb22230992 [0,1,1,0,0,0|1,0,0]=3 3748 B6R0.4 CC(=O)OCC#N Amb9677308 [0,1,1,0,0,0|0,0,1]=3 3749 B6R0.4 CC(=O)OCCBr Amb3940209 [0,1,1,0,0,0|0,0,0]=2 3750 B6R0.4 CC(=O)OCCN Amb18121947 [0,1,1,0,0,0|0,0,0]=2 3751 B6R0.4 CC(=O)OCCN Amb28827650 [0,1,1,0,0,0|0,0,0]=2 3752 B6R0.4 CC(=O)OCCO Amb3941004 [0,1,1,0,0,0|0,0,0]=2 3753 B6R0.4 CC(=O)O\C=C/Br Amb27484017 [0,1,1,0,0,0|0,0,2]=4 3754 B6R0.4 CC(=O)SCC=O Amb27873378 [0,1,1,0,0,0|0,1,1]=4 3755 B6R0.4 CC(=O)SCCBr Amb24608039 [0,1,1,0,0,0|0,1,0]=3 3756 B6R0.4 CC(=O)SCCN Amb21953963 [0,1,1,0,0,0|0,1,0]=3 3757 B6R0.4 CC(=O)SCCN Amb22011516 [0,1,1,0,0,0|0,1,0]=3 3758 B6R0.4 CC(=O)SCCN Amb31291049 [0,1,1,0,0,0|0,1,0]=3 3759 B6R0.4 CC(=O)SCCO Amb27481182 [0,1,1,0,0,0|0,1,0]=3 3760 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [0,1,1,0,0,0|1,0,1]=4 3761 B6R0.4 CC(=O)\C=C\CF Amb33379250 [0,1,1,0,0,0|1,0,1]=4 3762 B6R0.4 CC(=S)OCC#N Amb22492642 [0,1,1,0,0,0|0,1,1]=4 3763 B6R0.4 CC(=S)SCCCl Amb27952185 [0,1,1,0,0,0|0,2,0]=4 3764 B6R0.4 CC(=S)SCCO Amb28350218 [0,1,1,0,0,0|0,2,0]=4 3765 B6R0.4 CC(Br)OCCCl Amb27878562 [0,1,1,0,0,0|1,0,1]=4 3766 B6R0.4 CC(C)=CCCBr Amb3941652 [0,1,1,0,0,0|2,0,0]=4 3767 B6R0.4 CC(C)=CCCCl Amb27865707 [0,1,1,0,0,0|2,0,0]=4 3768 B6R0.4 CC(C)=CCCI Amb22395000 [0,1,1,0,0,0|2,0,0]=4 3769 B6R0.4 CC(C)=CCCN Amb18962494 [0,1,1,0,0,0|2,0,0]=4 3770 B6R0.4 CC(C)=CCCO Amb22002283 [0,1,1,0,0,0|2,0,0]=4 3771 B6R0.4 CC(C)=CCCS Amb35588788 [0,1,1,0,0,0|2,0,0]=4 3772 B6R0.4 CC(C)=NCCO Amb27612560 [0,1,1,0,0,0|2,0,0]=4 3773 B6R0.4 CC(C)OCCBr Amb1105066 [0,1,1,0,0,0|1,0,1]=4 3774 B6R0.4 CC(C)OCCCl Amb535223 [0,1,1,0,0,0|1,0,1]=4 3775 B6R0.4 CC(C)OCCF Amb27982936 [0,1,1,0,0,0|1,0,1]=4 3776 B6R0.4 CC(C)OCCI Amb25936982 [0,1,1,0,0,0|1,0,1]=4 3777 B6R0.4 CC(C)OCCN Amb22491045 [0,1,1,0,0,0|1,0,1]=4 3778 B6R0.4 CC(C)OCCN Amb2784936 [0,1,1,0,0,0|1,0,1]=4 3779 B6R0.4 CC(C)OCCO Amb3939032 [0,1,1,0,0,0|1,0,1]=4 3780 B6R0.4 CC(C)OCCS Amb25107566 [0,1,1,0,0,0|1,0,1]=4 3781 B6R0.4 CC(O)CCCBr Amb25889007 [0,1,1,0,0,0|1,0,1]=4 3782 B6R0.4 CC(O)CCCCl Amb22270232 [0,1,1,0,0,0|1,0,1]=4 3783 B6R0.4 CC(O)CCCF Amb24385806 [0,1,1,0,0,0|1,0,1]=4 3784 B6R0.4 CC(O)CCCN Amb8630414 [0,1,1,0,0,0|1,0,1]=4 3785 B6R0.4 CC(O)CCCO Amb22227752 [0,1,1,0,0,0|1,0,1]=4 3786 B6R0.4 CC(O)OCCO Amb28065279 [0,1,1,0,0,0|0,0,2]=4 3787 B6R0.4 CC(O)OCCS Amb25313392 [0,1,1,0,0,0|0,0,2]=4 3788 B6R0.4 CC=C=CC(=O)O Amb17593065 [0,1,1,0,0,0|0,0,2]=4 3789 B6R0.4 CCC#CC(=O)O Amb6336503 [0,1,1,0,0,0|0,0,1]=3 3790 B6R0.4 CCC#CC(C)=O Amb2721702 [0,1,1,0,0,0|1,0,0]=3 3791 B6R0.4 CCCC=C(C)C Amb4035860 [0,1,1,0,0,0|2,0,0]=4 3792 B6R0.4 CCCCB(O)O Amb2447142 [0,1,1,0,0,0|1,0,1]=4 3793 B6R0.4 CCCCC(=N)N Amb10066937 [0,1,1,0,0,0|2,0,0]=4 3794 B6R0.4 CCCCC(=N)N Amb2696360 [0,1,1,0,0,0|2,0,0]=4 3795 B6R0.4 CCCCC(=O)Cl Amb3939066 [0,1,1,0,0,0|1,0,0]=3 3796 B6R0.4 CCCCC(=O)O Amb3939877 [0,1,1,0,0,0|0,0,0]=2 3797 B6R0.4 CCCCC(=O)[O-] Amb22056343 [0,1,1,0,0,0|0,0,1]=3 3798 B6R0.4 CCCCC(=S)S Amb27195855 [0,1,1,0,0,0|0,2,0]=4 3799 B6R0.4 CCCCC(C)=O Amb6608652 [0,1,1,0,0,0|1,0,0]=3 3800 B6R0.4 CCCCC(C)O Amb4605977 [0,1,1,0,0,0|1,0,1]=4 3801 B6R0.4 CCCCC(N)=O Amb6891958 [0,1,1,0,0,0|1,0,0]=3 3802 B6R0.4 CCCCC(N)=S Amb6249558 [0,1,1,0,0,0|1,1,0]=4 3803 B6R0.4 CCCCN(C)O Amb33204268 [0,1,1,0,0,0|2,0,0]=4 3804 B6R0.4 CCCCS(=O)Cl Amb24551332 [0,1,1,0,0,0|2,0,0]=4 3805 B6R0.4 CCCCS(=O)[O-] Amb19889352 [0,1,1,0,0,0|1,0,1]=4 3806 B6R0.4 CCCCS(N)=O Amb32720302 [0,1,1,0,0,0|2,0,0]=4 3807 B6R0.4 CCCC[C@@H](C)O Amb19929139 [0,1,1,0,0,0|1,0,1]=4 3808 B6R0.4 CCCC[C@H](C)O Amb8515092 [0,1,1,0,0,0|1,0,1]=4 3809 B6R0.4 CCCC[N+](=O)[O-] Amb6298783 [0,1,1,0,0,0|1,0,1]=4 3810 B6R0.4 CCCC[PH](=O)O Amb8391286 [0,1,1,0,0,0|1,0,0]=3 3811 B6R0.4 CCCNC(=N)N Amb10844865 [0,1,1,0,0,0|2,0,0]=4 3812 B6R0.4 CCCNC(=N)N Amb20667746 [0,1,1,0,0,0|2,0,0]=4 3813 B6R0.4 CCCNC(=O)Cl Amb25688616 [0,1,1,0,0,0|1,0,0]=3 3814 B6R0.4 CCCNC(=S)S Amb28128280 [0,1,1,0,0,0|0,2,0]=4 3815 B6R0.4 CCCNC(C)=O Amb5835710 [0,1,1,0,0,0|1,0,0]=3 3816 B6R0.4 CCCNC(N)=O Amb1152241 [0,1,1,0,0,0|1,0,0]=3 3817 B6R0.4 CCCNC(N)=S Amb1152085 [0,1,1,0,0,0|1,1,0]=4 3818 B6R0.4 CCCN[N+](=O)[O-] Amb21953652 [0,1,1,0,0,0|1,0,1]=4 3819 B6R0.4 CCCOC(=O)Cl Amb10604123 [0,1,1,0,0,0|1,0,0]=3 3820 B6R0.4 CCCOC(=O)F Amb32667886 [0,1,1,0,0,0|1,0,0]=3 3821 B6R0.4 CCCOC(=S)[S-] Amb594778 [0,1,1,0,0,0|0,2,0]=4 3822 B6R0.4 CCCOC(C)C Amb27234578 [0,1,1,0,0,0|1,0,1]=4 3823 B6R0.4 CCCOC(C)Cl Amb26350769 [0,1,1,0,0,0|1,0,1]=4 3824 B6R0.4 CCCOC(N)=O Amb6334809 [0,1,1,0,0,0|1,0,0]=3 3825 B6R0.4 CCCO[N+](=O)[O-] Amb22732564 [0,1,1,0,0,0|1,0,1]=4 3826 B6R0.4 CCCSC(=N)N Amb20676008 [0,1,1,0,0,0|2,0,0]=4 3827 B6R0.4 CCCSC(=N)N Amb23482968 [0,1,1,0,0,0|2,0,0]=4 3828 B6R0.4 CCCSC(C)=O Amb22043301 [0,1,1,0,0,0|0,1,0]=3 3829 B6R0.4 CCCSC(N)=O Amb27167907 [0,1,1,0,0,0|1,0,0]=3 3830 B6R0.4 CCNCC(=N)N Amb28050789 [0,1,1,0,0,0|2,0,0]=4 3831 B6R0.4 CCNCC(=O)Cl Amb27948279 [0,1,1,0,0,0|1,0,0]=3 3832 B6R0.4 CCNCC(=O)O Amb10609667 [0,1,1,0,0,0|0,0,0]=2 3833 B6R0.4 CCNCC(=O)O Amb7764661 [0,1,1,0,0,0|0,0,0]=2 3834 B6R0.4 CCNCC(C)=O Amb24545893 [0,1,1,0,0,0|1,0,0]=3 3835 B6R0.4 CCNCC(C)=O Amb32661185 [0,1,1,0,0,0|1,0,0]=3 3836 B6R0.4 CCNCC(C)O Amb32666214 [0,1,1,0,0,0|1,0,1]=4 3837 B6R0.4 CCNCC(C)O Amb9247475 [0,1,1,0,0,0|1,0,1]=4 3838 B6R0.4 CCNCC(N)=O Amb1128676 [0,1,1,0,0,0|1,0,0]=3 3839 B6R0.4 CCNCC(N)=O Amb4035424 [0,1,1,0,0,0|1,0,0]=3 3840 B6R0.4 CCNC[C@@H](C)O Amb27827890 [0,1,1,0,0,0|1,0,1]=4 3841 B6R0.4 CCNC[C@@H](C)O Amb32652513 [0,1,1,0,0,0|1,0,1]=4 3842 B6R0.4 CCNC[C@H](C)O Amb25785620 [0,1,1,0,0,0|1,0,1]=4 3843 B6R0.4 CCNC[C@H](C)O Amb32652535 [0,1,1,0,0,0|1,0,1]=4 3844 B6R0.4 CCOC=C(C)C Amb27667358 [0,1,1,0,0,0|1,0,0]=3 3845 B6R0.4 CCOCC(=N)N Amb19890012 [0,1,1,0,0,0|2,0,0]=4 3846 B6R0.4 CCOCC(=N)N Amb6268669 [0,1,1,0,0,0|2,0,0]=4 3847 B6R0.4 CCOCC(=O)Cl Amb33528415 [0,1,1,0,0,0|1,0,0]=3 3848 B6R0.4 CCOCC(=O)O Amb3939880 [0,1,1,0,0,0|0,0,0]=2 3849 B6R0.4 CCOCC(=O)S Amb27813482 [0,1,1,0,0,0|0,1,0]=3 3850 B6R0.4 CCOCC(C)=O Amb9666086 [0,1,1,0,0,0|0,0,0]=2 3851 B6R0.4 CCOCC(C)Br Amb4012959 [0,1,1,0,0,0|1,0,1]=4 3852 B6R0.4 CCOCC(C)N Amb10610346 [0,1,1,0,0,0|1,0,1]=4 3853 B6R0.4 CCOCC(C)N Amb1133021 [0,1,1,0,0,0|1,0,1]=4 3854 B6R0.4 CCOCC(C)O Amb33535096 [0,1,1,0,0,0|0,0,2]=4 3855 B6R0.4 CCOCC(C)S Amb27451431 [0,1,1,0,0,0|0,1,1]=4 3856 B6R0.4 CCOCC(N)=S Amb6276655 [0,1,1,0,0,0|1,1,0]=4 3857 B6R0.4 CCOC[C@@H](C)N Amb18016634 [0,1,1,0,0,0|1,0,1]=4 3858 B6R0.4 CCOC[C@@H](C)N Amb33483972 [0,1,1,0,0,0|1,0,1]=4 3859 B6R0.4 CCOC[C@@H](C)O Amb27203934 [0,1,1,0,0,0|0,0,2]=4 3860 B6R0.4 CCOC[C@H](C)N Amb17061642 [0,1,1,0,0,0|1,0,1]=4 3861 B6R0.4 CCOC[C@H](C)N Amb33109791 [0,1,1,0,0,0|1,0,1]=4 3862 B6R0.4 CCONC(C)=O Amb22230675 [0,1,1,0,0,0|0,0,0]=2 3863 B6R0.4 CCONC(C)C Amb26324045 [0,1,1,0,0,0|1,0,1]=4 3864 B6R0.4 CCONC(C)C Amb32664372 [0,1,1,0,0,0|1,0,1]=4 3865 B6R0.4 CCONS(C)=O Amb27974850 [0,1,1,0,0,0|1,0,0]=3 3866 B6R0.4 CCPCC(=O)O Amb28321137 [0,1,1,0,0,0|0,0,0]=2 3867 B6R0.4 CCSCC(=N)N Amb6680834 [0,1,1,0,0,0|2,0,0]=4 3868 B6R0.4 CCSCC(=O)O Amb1125185 [0,1,1,0,0,0|0,0,0]=2 3869 B6R0.4 CCSCC(C)=O Amb4018179 [0,1,1,0,0,0|0,1,0]=3 3870 B6R0.4 CCSCC(N)=S Amb27188472 [0,1,1,0,0,0|1,1,0]=4 3871 B6R0.4 CCSC[C@@H](C)O Amb26059442 [0,1,1,0,0,0|1,0,1]=4 3872 B6R0.4 CCSC[C@H](C)O Amb25220206 [0,1,1,0,0,0|1,0,1]=4 3873 B6R0.4 CC\C=C/C(=O)O Amb28429841 [0,1,1,0,0,0|0,0,1]=3 3874 B6R0.4 CC\C=C/C(C)=O Amb27835645 [0,1,1,0,0,0|1,0,0]=3 3875 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [0,1,1,0,0,0|1,0,1]=4 3876 B6R0.4 CC\C=C\C(=O)O Amb6608967 [0,1,1,0,0,0|0,0,1]=3 3877 B6R0.4 CC\C=C\C(C)=O Amb26022886 [0,1,1,0,0,0|1,0,0]=3 3878 B6R0.4 CC\C=C\C(N)=O Amb25770876 [0,1,1,0,0,0|1,0,1]=4 3879 B6R0.4 CC\C=N\S(C)=O Amb35681661 [0,1,1,0,0,0|2,0,0]=4 3880 B6R0.4 CC\N=C\C(=O)O Amb28041425 [0,1,1,0,0,0|0,0,1]=3 3881 B6R0.4 CC\N=C\C(C)=O Amb27854982 [0,1,1,0,0,0|1,0,0]=3 3882 B6R0.4 CN(C)OCCN Amb28313748 [0,1,1,0,0,0|2,0,0]=4 3883 B6R0.4 CN(O)CCCF Amb33480871 [0,1,1,0,0,0|2,0,0]=4 3884 B6R0.4 CNCCC(=O)Cl Amb27422890 [0,1,1,0,0,0|1,0,0]=3 3885 B6R0.4 CNCCC(=O)O Amb10609760 [0,1,1,0,0,0|0,0,0]=2 3886 B6R0.4 CNCCC(=O)O Amb7766400 [0,1,1,0,0,0|0,0,0]=2 3887 B6R0.4 CNCCC(C)=O Amb24560306 [0,1,1,0,0,0|1,0,0]=3 3888 B6R0.4 CNCCC(C)=O Amb28827637 [0,1,1,0,0,0|1,0,0]=3 3889 B6R0.4 CNCCC(C)O Amb17569889 [0,1,1,0,0,0|1,0,1]=4 3890 B6R0.4 CNCCC(C)O Amb34141241 [0,1,1,0,0,0|1,0,1]=4 3891 B6R0.4 CNCCC(N)=O Amb19959913 [0,1,1,0,0,0|1,0,0]=3 3892 B6R0.4 CNCCC(N)=O Amb33538309 [0,1,1,0,0,0|1,0,0]=3 3893 B6R0.4 CNCCN(C)O Amb27628863 [0,1,1,0,0,0|2,0,0]=4 3894 B6R0.4 CNCCS(C)=O Amb21984676 [0,1,1,0,0,0|2,0,0]=4 3895 B6R0.4 CNCC[C@H](C)O Amb27801301 [0,1,1,0,0,0|1,0,1]=4 3896 B6R0.4 CNCC[N+](=O)[O-] Amb35704404 [0,1,1,0,0,0|1,0,1]=4 3897 B6R0.4 CN\C=C\C(C)=O Amb17593076 [0,1,1,0,0,0|1,0,1]=4 3898 B6R0.4 COCCB(O)O Amb27173037 [0,1,1,0,0,0|1,0,1]=4 3899 B6R0.4 COCCC(=N)N Amb2696283 [0,1,1,0,0,0|2,0,0]=4 3900 B6R0.4 COCCC(=N)N Amb8630184 [0,1,1,0,0,0|2,0,0]=4 3901 B6R0.4 COCCC(=O)Cl Amb2689274 [0,1,1,0,0,0|1,0,0]=3 3902 B6R0.4 COCCC(=O)O Amb3938990 [0,1,1,0,0,0|0,0,0]=2 3903 B6R0.4 COCCC(C)=O Amb7764907 [0,1,1,0,0,0|1,0,0]=3 3904 B6R0.4 COCCC(C)O Amb20621489 [0,1,1,0,0,0|1,0,1]=4 3905 B6R0.4 COCCC(N)=O Amb33538943 [0,1,1,0,0,0|1,0,0]=3 3906 B6R0.4 COCCC(N)=S Amb6250669 [0,1,1,0,0,0|1,1,0]=4 3907 B6R0.4 COCCC(O)Br Amb20242943 [0,1,1,0,0,0|1,0,1]=4 3908 B6R0.4 COCCC(O)O Amb28410462 [0,1,1,0,0,0|0,0,2]=4 3909 B6R0.4 COCCN(C)O Amb33428857 [0,1,1,0,0,0|2,0,0]=4 3910 B6R0.4 COCCS(=O)Cl Amb25914790 [0,1,1,0,0,0|2,0,0]=4 3911 B6R0.4 COCCS(=O)[O-] Amb26874008 [0,1,1,0,0,0|1,0,1]=4 3912 B6R0.4 COCCS(N)=O Amb32720336 [0,1,1,0,0,0|2,0,0]=4 3913 B6R0.4 COCC[C@@H](C)O Amb27237141 [0,1,1,0,0,0|1,0,1]=4 3914 B6R0.4 COCC[C@H](C)O Amb26559043 [0,1,1,0,0,0|1,0,1]=4 3915 B6R0.4 COCNC(N)=O Amb25744350 [0,1,1,0,0,0|2,0,0]=4 3916 B6R0.4 COCOC(=N)N Amb27619817 [0,1,1,0,0,0|2,0,0]=4 3917 B6R0.4 COCOC(C)Cl Amb27983760 [0,1,1,0,0,0|1,0,1]=4 3918 B6R0.4 CONCC(N)=O Amb28455463 [0,1,1,0,0,0|2,0,0]=4 3919 B6R0.4 CO\C=C/C(C)=O Amb27264758 [0,1,1,0,0,0|1,0,1]=4 3920 B6R0.4 CO\C=C\C(=O)O Amb18121767 [0,1,1,0,0,0|0,0,2]=4 3921 B6R0.4 CO\C=C\C(C)=O Amb8385700 [0,1,1,0,0,0|1,0,1]=4 3922 B6R0.4 CO\N=C\C(=O)O Amb10976081 [0,1,1,0,0,0|1,0,1]=4 3923 B6R0.4 CP(Cl)OCCCl Amb17674071 [0,1,1,0,0,0|2,0,0]=4 3924 B6R0.4 CP(O)OCCCl Amb28384727 [0,1,1,0,0,0|1,0,1]=4 3925 B6R0.4 CS(=O)CCCN Amb18974527 [0,1,1,0,0,0|2,0,0]=4 3926 B6R0.4 CS(=O)CCCN Amb32684177 [0,1,1,0,0,0|2,0,0]=4 3927 B6R0.4 CS(=O)NCCN Amb25888549 [0,1,1,0,0,0|2,0,0]=4 3928 B6R0.4 CS(=O)OCCCl Amb27471823 [0,1,1,0,0,0|1,0,0]=3 3929 B6R0.4 CSC#CC(=O)O Amb33309663 [0,1,1,0,0,0|0,0,2]=4 3930 B6R0.4 CSCC=C(C)C Amb27594692 [0,1,1,0,0,0|2,0,0]=4 3931 B6R0.4 CSCCC(=N)N Amb19373501 [0,1,1,0,0,0|2,0,0]=4 3932 B6R0.4 CSCCC(=N)N Amb19516878 [0,1,1,0,0,0|2,0,0]=4 3933 B6R0.4 CSCCC(=O)O Amb3939879 [0,1,1,0,0,0|0,0,0]=2 3934 B6R0.4 CSCCC(C)=O Amb8392858 [0,1,1,0,0,0|1,0,0]=3 3935 B6R0.4 CSCCC(C)O Amb27860401 [0,1,1,0,0,0|1,0,1]=4 3936 B6R0.4 CSCCC(N)=S Amb17307559 [0,1,1,0,0,0|1,1,0]=4 3937 B6R0.4 CSCCN(=O)=O Amb24179458 [0,1,1,0,0,0|1,0,1]=4 3938 B6R0.4 CSCCN(C)O Amb33272058 [0,1,1,0,0,0|2,0,0]=4 3939 B6R0.4 CSCC[C@@H](C)O Amb33198759 [0,1,1,0,0,0|1,0,1]=4 3940 B6R0.4 CSCC[C@H](C)O Amb33198747 [0,1,1,0,0,0|1,0,1]=4 3941 B6R0.4 CSCSC(C)=O Amb27876851 [0,1,1,0,0,0|0,1,0]=3 3942 B6R0.4 CSSCC(=O)O Amb25378801 [0,1,1,0,0,0|1,0,0]=3 3943 B6R0.4 CS\C=C/C(C)=O Amb27471812 [0,1,1,0,0,0|1,0,1]=4 3944 B6R0.4 CS\C=C\C(=O)O Amb30584688 [0,1,1,0,0,0|0,0,2]=4 3945 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [0,1,1,0,0,0|1,0,1]=4 3946 B6R0.4 C[C@@H](O)CCCF Amb33376908 [0,1,1,0,0,0|1,0,1]=4 3947 B6R0.4 C[C@@H](O)CCCO Amb28047449 [0,1,1,0,0,0|1,0,1]=4 3948 B6R0.4 C[C@H](O)CCCF Amb33376887 [0,1,1,0,0,0|1,0,1]=4 3949 B6R0.4 C[PH](=O)OCCCl Amb28340992 [0,1,1,0,0,0|1,0,0]=3 3950 B6R0.4 C[SiH](C)OCCCl Amb27421085 [0,1,1,0,0,0|1,1,0]=4 3951 B6R0.4 C\C(Br)=C\CCCl Amb28054738 [0,1,1,0,0,0|2,0,0]=4 3952 B6R0.4 C\C(Br)=C\CCN Amb28060834 [0,1,1,0,0,0|2,0,0]=4 3953 B6R0.4 C\C(Cl)=C\CCCl Amb27786934 [0,1,1,0,0,0|2,0,0]=4 3954 B6R0.4 C\C(Cl)=C\CCO Amb27956430 [0,1,1,0,0,0|2,0,0]=4 3955 B6R0.4 C\C(N)=N\CCO Amb26857579 [0,1,1,0,0,0|2,0,0]=4 3956 B6R0.4 C\C=C\CC(=O)O Amb3941538 [0,1,1,0,0,0|0,0,1]=3 3957 B6R0.4 C\C=C\CC(N)=O Amb26589975 [0,1,1,0,0,0|1,0,1]=4 3958 B6R0.4 C\N=C\CC(C)=O Amb28202181 [0,1,1,0,0,0|1,0,1]=4 3959 B6R0.4 N#CCCC(=O)Cl Amb25106570 [0,1,1,0,0,0|1,0,1]=4 3960 B6R0.4 N#CCCC(=O)O Amb2694975 [0,1,1,0,0,0|0,0,1]=3 3961 B6R0.4 N#CCCC(N)=O Amb8841150 [0,1,1,0,0,0|1,0,1]=4 3962 B6R0.4 N=C(N)CCCBr Amb4297022 [0,1,1,0,0,0|2,0,0]=4 3963 B6R0.4 N=C(N)CCCCl Amb4297061 [0,1,1,0,0,0|2,0,0]=4 3964 B6R0.4 N=C(N)CCCF Amb27231400 [0,1,1,0,0,0|2,0,0]=4 3965 B6R0.4 N=C(N)CCCN Amb25888970 [0,1,1,0,0,0|2,0,0]=4 3966 B6R0.4 N=C(N)CCCN Amb33299271 [0,1,1,0,0,0|2,0,0]=4 3967 B6R0.4 N=C(N)CCCO Amb33038287 [0,1,1,0,0,0|2,0,0]=4 3968 B6R0.4 N=CNCC(=O)O Amb24670244 [0,1,1,0,0,0|1,0,1]=4 3969 B6R0.4 NC(=O)CCCCl Amb1138237 [0,1,1,0,0,0|1,0,0]=3 3970 B6R0.4 NC(=O)CCCF Amb28073400 [0,1,1,0,0,0|1,0,0]=3 3971 B6R0.4 NC(=O)CCCO Amb20623438 [0,1,1,0,0,0|1,0,0]=3 3972 B6R0.4 NC(=O)CCCS Amb27174778 [0,1,1,0,0,0|1,0,0]=3 3973 B6R0.4 NC(=O)NCCBr Amb28385599 [0,1,1,0,0,0|2,0,0]=4 3974 B6R0.4 NC(=O)NCCF Amb27446994 [0,1,1,0,0,0|2,0,0]=4 3975 B6R0.4 NC(=O)NCCI Amb27454955 [0,1,1,0,0,0|2,0,0]=4 3976 B6R0.4 NC(=O)NCCO Amb1146041 [0,1,1,0,0,0|2,0,0]=4 3977 B6R0.4 NC(=O)OCCCl Amb3940645 [0,1,1,0,0,0|1,0,0]=3 3978 B6R0.4 NC(=O)OCCO Amb20623788 [0,1,1,0,0,0|1,0,0]=3 3979 B6R0.4 NC(=O)SCCCl Amb27619850 [0,1,1,0,0,0|1,1,0]=4 3980 B6R0.4 NC(=S)CCCBr Amb33328371 [0,1,1,0,0,0|1,1,0]=4 3981 B6R0.4 NC(=S)CCCCl Amb33328364 [0,1,1,0,0,0|1,1,0]=4 3982 B6R0.4 NC(=S)CCCO Amb9215001 [0,1,1,0,0,0|1,1,0]=4 3983 B6R0.4 NCC#CC(=O)O Amb25703096 [0,1,1,0,0,0|0,0,2]=4 3984 B6R0.4 NCC#CC(=O)O Amb32666878 [0,1,1,0,0,0|0,0,2]=4 3985 B6R0.4 NCCCB(O)O Amb25878196 [0,1,1,0,0,0|1,0,1]=4 3986 B6R0.4 NCCCB(O)O Amb33339111 [0,1,1,0,0,0|1,0,1]=4 3987 B6R0.4 NCCCC(=O)Cl Amb1935063 [0,1,1,0,0,0|1,0,0]=3 3988 B6R0.4 NCCCC(=O)O Amb1935210 [0,1,1,0,0,0|0,0,0]=2 3989 B6R0.4 NCCCC(N)=O Amb2099583 [0,1,1,0,0,0|1,0,0]=3 3990 B6R0.4 NCCCC(N)=O Amb6543438 [0,1,1,0,0,0|1,0,0]=3 3991 B6R0.4 NCCCS(=O)O Amb25185942 [0,1,1,0,0,0|1,0,0]=3 3992 B6R0.4 NCCC[N+](=O)[O-] Amb18833132 [0,1,1,0,0,0|1,0,1]=4 3993 B6R0.4 NCCC[PH](=O)O Amb22370049 [0,1,1,0,0,0|1,0,0]=3 3994 B6R0.4 NCCNC(N)=O Amb19374121 [0,1,1,0,0,0|2,0,0]=4 3995 B6R0.4 NCCNC(N)=O Amb32665340 [0,1,1,0,0,0|2,0,0]=4 3996 B6R0.4 NCCNC(N)=O Amb6254968 [0,1,1,0,0,0|2,0,0]=4 3997 B6R0.4 NCCOC(N)=O Amb22059480 [0,1,1,0,0,0|1,0,0]=3 3998 B6R0.4 NCCOC(N)=O Amb24271076 [0,1,1,0,0,0|1,0,0]=3 3999 B6R0.4 NCCOS(=O)O Amb25843211 [0,1,1,0,0,0|2,0,0]=4 4000 B6R0.4 NCCO[PH](=O)O Amb28046334 [0,1,1,0,0,0|2,0,0]=4 4001 B6R0.4 NC\C=C/C(=O)O Amb24117018 [0,1,1,0,0,0|0,0,2]=4 4002 B6R0.4 NC\C=C\C(=O)O Amb33422010 [0,1,1,0,0,0|0,0,2]=4 4003 B6R0.4 NC\C=C\C(=O)O Amb33422035 [0,1,1,0,0,0|0,0,2]=4 4004 B6R0.4 NNCCC(=O)O Amb33756816 [0,1,1,0,0,0|1,0,0]=3 4005 B6R0.4 NOCCC(=O)O Amb17569891 [0,1,1,0,0,0|1,0,0]=3 4006 B6R0.4 NOCCC(=O)O Amb32693437 [0,1,1,0,0,0|1,0,0]=3 4007 B6R0.4 NOCCC(N)=O Amb27838275 [0,1,1,0,0,0|2,0,0]=4 4008 B6R0.4 NS(=O)CCCBr Amb32720400 [0,1,1,0,0,0|2,0,0]=4 4009 B6R0.4 NS(=O)CCCCl Amb32720303 [0,1,1,0,0,0|2,0,0]=4 4010 B6R0.4 NS(=O)CCCF Amb32720390 [0,1,1,0,0,0|2,0,0]=4 4011 B6R0.4 O=C(Br)CCCBr Amb25724818 [0,1,1,0,0,0|1,0,0]=3 4012 B6R0.4 O=C(Cl)CCCBr Amb3940241 [0,1,1,0,0,0|1,0,0]=3 4013 B6R0.4 O=C(Cl)CCCCl Amb6608638 [0,1,1,0,0,0|1,0,0]=3 4014 B6R0.4 O=C(Cl)NCCBr Amb28123956 [0,1,1,0,0,0|2,0,0]=4 4015 B6R0.4 O=C(Cl)NCCCl Amb24479815 [0,1,1,0,0,0|2,0,0]=4 4016 B6R0.4 O=C(Cl)NCCF Amb35633248 [0,1,1,0,0,0|2,0,0]=4 4017 B6R0.4 O=C(Cl)OCCBr Amb8514406 [0,1,1,0,0,0|1,0,0]=3 4018 B6R0.4 O=C(Cl)OCCCl Amb6608837 [0,1,1,0,0,0|1,0,0]=3 4019 B6R0.4 O=C(Cl)OCCF Amb21618836 [0,1,1,0,0,0|1,0,0]=3 4020 B6R0.4 O=C(O)C#CCCl Amb33544591 [0,1,1,0,0,0|0,0,2]=4 4021 B6R0.4 O=C(O)C#CCI Amb27860307 [0,1,1,0,0,0|0,0,2]=4 4022 B6R0.4 O=C(O)C#CCO Amb22002375 [0,1,1,0,0,0|0,0,2]=4 4023 B6R0.4 O=C(O)CCCBr Amb8393276 [0,1,1,0,0,0|0,0,0]=2 4024 B6R0.4 O=C(O)CCCCl Amb3940333 [0,1,1,0,0,0|0,0,0]=2 4025 B6R0.4 O=C(O)CCCF Amb17593104 [0,1,1,0,0,0|0,0,0]=2 4026 B6R0.4 O=C(O)CCCI Amb22295911 [0,1,1,0,0,0|0,0,0]=2 4027 B6R0.4 O=C(O)CCCO Amb18640332 [0,1,1,0,0,0|0,0,0]=2 4028 B6R0.4 O=C(O)CCCS Amb16185429 [0,1,1,0,0,0|0,0,0]=2 4029 B6R0.4 O=C(O)CCNO Amb28067767 [0,1,1,0,0,0|1,0,0]=3 4030 B6R0.4 O=C(O)CCSCl Amb28387511 [0,1,1,0,0,0|1,0,0]=3 4031 B6R0.4 O=C(O)COCF Amb33378705 [0,1,1,0,0,0|1,0,0]=3 4032 B6R0.4 O=C(O)CPCO Amb28340565 [0,1,1,0,0,0|1,0,0]=3 4033 B6R0.4 O=C(O)CSSCl Amb27477882 [0,1,1,0,0,0|2,0,0]=4 4034 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [0,1,1,0,0,0|0,0,2]=4 4035 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [0,1,1,0,0,0|0,0,2]=4 4036 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [0,1,1,0,0,0|0,0,2]=4 4037 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [0,1,1,0,0,0|0,0,2]=4 4038 B6R0.4 O=C(O)\C=C\CF Amb33470171 [0,1,1,0,0,0|0,0,2]=4 4039 B6R0.4 O=C(O)\C=C\CO Amb32662006 [0,1,1,0,0,0|0,0,2]=4 4040 B6R0.4 O=C(S)NCCO Amb27430045 [0,1,1,0,0,0|1,1,0]=4 4041 B6R0.4 O=C([O-])CCCO Amb3429667 [0,1,1,0,0,0|0,0,1]=3 4042 B6R0.4 O=C([O-])CNCO Amb8383630 [0,1,1,0,0,0|1,0,1]=4 4043 B6R0.4 O=CCCC(=O)O Amb17673897 [0,1,1,0,0,0|0,0,1]=3 4044 B6R0.4 O=CNCC(=O)O Amb1911508 [0,1,1,0,0,0|1,0,1]=4 4045 B6R0.4 O=COCC(=O)O Amb26624011 [0,1,1,0,0,0|1,0,1]=4 4046 B6R0.4 O=S(Br)OCCCl Amb28422386 [0,1,1,0,0,0|2,0,0]=4 4047 B6R0.4 O=S(Cl)CCCBr Amb32720399 [0,1,1,0,0,0|2,0,0]=4 4048 B6R0.4 O=S(Cl)CCCCl Amb25791632 [0,1,1,0,0,0|2,0,0]=4 4049 B6R0.4 O=S(Cl)CCCF Amb32720389 [0,1,1,0,0,0|2,0,0]=4 4050 B6R0.4 O=S(Cl)OCCCl Amb27975786 [0,1,1,0,0,0|2,0,0]=4 4051 B6R0.4 O=S(O)COCO Amb27410575 [0,1,1,0,0,0|2,0,0]=4 4052 B6R0.4 O=S(O)OCCCl Amb27786730 [0,1,1,0,0,0|2,0,0]=4 4053 B6R0.4 O=S([O-])CCCBr Amb32754123 [0,1,1,0,0,0|1,0,1]=4 4054 B6R0.4 O=S([O-])CCCCl Amb26370094 [0,1,1,0,0,0|1,0,1]=4 4055 B6R0.4 O=S([O-])CCCF Amb32754093 [0,1,1,0,0,0|1,0,1]=4 4056 B6R0.4 O=S([O-])CCCO Amb27221257 [0,1,1,0,0,0|1,0,1]=4 4057 B6R0.4 O=[N+]([O-])CCCCl Amb25267487 [0,1,1,0,0,0|1,0,1]=4 4058 B6R0.4 O=[N+]([O-])CCCF Amb25234942 [0,1,1,0,0,0|1,0,1]=4 4059 B6R0.4 O=[N+]([O-])CCCO Amb20247690 [0,1,1,0,0,0|1,0,1]=4 4060 B6R0.4 O=[N+]([O-])OCCCl Amb27963893 [0,1,1,0,0,0|2,0,0]=4 4061 B6R0.4 O=[PH](O)CCCO Amb28345330 [0,1,1,0,0,0|1,0,0]=3 4062 B6R0.4 O=[PH](S)OCCO Amb27981751 [0,1,1,0,0,0|2,0,0]=4 4063 B6R0.4 OB(O)CCCBr Amb24480413 [0,1,1,0,0,0|1,0,1]=4 4064 B6R0.4 OB(O)CCCCl Amb28347311 [0,1,1,0,0,0|1,0,1]=4 4065 B6R0.4 OCCCB(O)O Amb27391604 [0,1,1,0,0,0|1,0,1]=4 4066 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [0,1,1,0,0,0|2,0,0]=4 4067 B6R0.5 CCCC(C)(C)O Amb8516075 [0,1,1,0,0,0|1,0,1]=4 4068 B6R0.5 CCCP(=O)(O)O Amb22230045 [0,1,1,0,0,0|1,0,0]=3 4069 B6R0.5 CCCS(=N)(N)=O Amb35711007 [0,1,1,0,0,0|2,0,0]=4 4070 B6R0.5 CCCS(=O)(=O)Cl Amb3939748 [0,1,1,0,0,0|1,0,1]=4 4071 B6R0.5 CCCS(=O)(=O)F Amb10610150 [0,1,1,0,0,0|1,0,1]=4 4072 B6R0.5 CCCS(=O)(=O)[O-] Amb8515942 [0,1,1,0,0,0|1,0,1]=4 4073 B6R0.5 CCCS(=O)(=O)[O-] Amb8517045 [0,1,1,0,0,0|1,0,1]=4 4074 B6R0.5 CCCS(=O)(=O)[S-] Amb22369121 [0,1,1,0,0,0|1,0,1]=4 4075 B6R0.5 CCCS(C)(=N)=O Amb32671061 [0,1,1,0,0,0|2,0,0]=4 4076 B6R0.5 CCCS(N)(=O)=O Amb1139748 [0,1,1,0,0,0|1,0,1]=4 4077 B6R0.5 CCC[Si](C)(C)O Amb27624611 [0,1,1,0,0,0|1,1,0]=4 4078 B6R0.5 CCNS(=O)(=O)O Amb19650770 [0,1,1,0,0,0|2,0,0]=4 4079 B6R0.5 CCNS(C)(=N)=O Amb35688404 [0,1,1,0,0,0|2,0,0]=4 4080 B6R0.5 CCNS(C)(=O)=O Amb3367024 [0,1,1,0,0,0|2,0,0]=4 4081 B6R0.5 CCOC(C)(C)C Amb8516524 [0,1,1,0,0,0|1,0,1]=4 4082 B6R0.5 CCOCl(=O)(=O)=O Amb27628193 [0,1,1,0,0,0|2,0,0]=4 4083 B6R0.5 CCOP(=O)(Cl)Cl Amb4297439 [0,1,1,0,0,0|2,0,0]=4 4084 B6R0.5 CCOP(C)(=O)Cl Amb4297391 [0,1,1,0,0,0|1,0,0]=3 4085 B6R0.5 CCOP(C)(=O)F Amb4297377 [0,1,1,0,0,0|1,0,0]=3 4086 B6R0.5 CCOP(C)(O)=S Amb22366929 [0,1,1,0,0,0|1,0,1]=4 4087 B6R0.5 CCOS(=O)(=O)Cl Amb17940890 [0,1,1,0,0,0|2,0,0]=4 4088 B6R0.5 CCOS(=O)(=O)[O-] Amb2560788 [0,1,1,0,0,0|2,0,0]=4 4089 B6R0.5 CCOS(C)(=O)=O Amb2687884 [0,1,1,0,0,0|1,0,0]=3 4090 B6R0.5 CCOS(N)(=O)=O Amb33054149 [0,1,1,0,0,0|2,0,0]=4 4091 B6R0.5 CCO[Si](C)(C)C Amb8515440 [0,1,1,0,0,0|1,1,0]=4 4092 B6R0.5 CCSS(C)(=O)=O Amb17614102 [0,1,1,0,0,0|1,1,0]=4 4093 B6R0.5 CNCP(=O)(O)O Amb589043 [0,1,1,0,0,0|2,0,0]=4 4094 B6R0.5 CNCP(C)(=O)O Amb4300777 [0,1,1,0,0,0|2,0,0]=4 4095 B6R0.5 NCCP(=O)(O)O Amb4297144 [0,1,1,0,0,0|2,0,0]=4 4096 B6R0.5 NCCS(=O)(=O)O Amb2695361 [0,1,1,0,0,0|2,0,0]=4 4097 B6R0.5 NCC[PH](=O)(=O)O Amb28365875 [0,1,1,0,0,0|2,0,0]=4 4098 B6R0.5 O=P(O)(O)CCBr Amb8479835 [0,1,1,0,0,0|2,0,0]=4 4099 B6R0.5 O=P(O)(O)CCCl Amb6297766 [0,1,1,0,0,0|2,0,0]=4 4100 B6R0.5 O=P(O)(O)CCO Amb22388824 [0,1,1,0,0,0|2,0,0]=4 4101 B6R0.5 O=S(=O)(O)CCBr Amb17938633 [0,1,1,0,0,0|2,0,0]=4 4102 B6R0.5 O=S(=O)(O)CCCl Amb33513054 [0,1,1,0,0,0|2,0,0]=4 4103 B6R0.5 O=S(=O)(O)CCO Amb8383477 [0,1,1,0,0,0|2,0,0]=4 4104 B6R0.5 O=S(=O)(O)CCS Amb22337676 [0,1,1,0,0,0|2,0,0]=4 4105 B6R0.6 C#CCCCC=C Amb22227961 [0,1,1,0,0,0|2,0,0]=4 4106 B6R0.6 C#CCCCC=O Amb17593060 [0,1,1,0,0,0|1,0,0]=3 4107 B6R0.6 C#CCCCCO Amb6336500 [0,1,1,0,0,0|1,0,1]=4 4108 B6R0.6 C#CCCCOC Amb25694831 [0,1,1,0,0,0|1,0,1]=4 4109 B6R0.6 C#CCCCON Amb27879991 [0,1,1,0,0,0|1,0,1]=4 4110 B6R0.6 C#CCCNC=O Amb27447032 [0,1,1,0,0,0|1,0,1]=4 4111 B6R0.6 C#CCNCCO Amb19148766 [0,1,1,0,0,0|1,0,1]=4 4112 B6R0.6 C#CCNCCO Amb33527970 [0,1,1,0,0,0|1,0,1]=4 4113 B6R0.6 C#CCOCCO Amb16232584 [0,1,1,0,0,0|1,0,1]=4 4114 B6R0.6 C#CCSCCO Amb33531540 [0,1,1,0,0,0|1,0,1]=4 4115 B6R0.6 C#C\C=C\CCC Amb33424839 [0,1,1,0,0,0|2,0,0]=4 4116 B6R0.6 C=C=CCCC=O Amb28208489 [0,1,1,0,0,0|1,0,1]=4 4117 B6R0.6 C=C=CCCCCl Amb17939722 [0,1,1,0,0,0|2,0,0]=4 4118 B6R0.6 C=C=CCCCN Amb27222280 [0,1,1,0,0,0|2,0,0]=4 4119 B6R0.6 C=C=CCCCO Amb10605300 [0,1,1,0,0,0|1,0,0]=3 4120 B6R0.6 C=C=COCCO Amb25721997 [0,1,1,0,0,0|2,0,0]=4 4121 B6R0.6 C=CC#CCCC Amb17673843 [0,1,1,0,0,0|2,0,0]=4 4122 B6R0.6 C=CC#CCCO Amb17593058 [0,1,1,0,0,0|1,0,1]=4 4123 B6R0.6 C=CCC#CCO Amb24479025 [0,1,1,0,0,0|1,0,1]=4 4124 B6R0.6 C=CCCCC#N Amb6298890 [0,1,1,0,0,0|2,0,0]=4 4125 B6R0.6 C=CCCCC=C Amb22227760 [0,1,1,0,0,0|2,0,0]=4 4126 B6R0.6 C=CCCCC=O Amb13883672 [0,1,1,0,0,0|1,0,0]=3 4127 B6R0.6 C=CCCCCBr Amb3940222 [0,1,1,0,0,0|2,0,0]=4 4128 B6R0.6 C=CCCCCC Amb3940498 [0,1,1,0,0,0|2,0,0]=4 4129 B6R0.6 C=CCCCCCl Amb2692039 [0,1,1,0,0,0|2,0,0]=4 4130 B6R0.6 C=CCCCCF Amb24409527 [0,1,1,0,0,0|2,0,0]=4 4131 B6R0.6 C=CCCCCI Amb26858458 [0,1,1,0,0,0|2,0,0]=4 4132 B6R0.6 C=CCCCCN Amb18639514 [0,1,1,0,0,0|2,0,0]=4 4133 B6R0.6 C=CCCCCO Amb3940341 [0,1,1,0,0,0|1,0,0]=3 4134 B6R0.6 C=CCCCNC Amb18523846 [0,1,1,0,0,0|2,0,0]=4 4135 B6R0.6 C=CCCCNC Amb32651835 [0,1,1,0,0,0|2,0,0]=4 4136 B6R0.6 C=CCCCNO Amb27437399 [0,1,1,0,0,0|1,0,0]=3 4137 B6R0.6 C=CCCCOC Amb24432882 [0,1,1,0,0,0|1,0,0]=3 4138 B6R0.6 C=CCCOCCl Amb2696084 [0,1,1,0,0,0|2,0,0]=4 4139 B6R0.6 C=CCCSCC Amb27213772 [0,1,1,0,0,0|2,0,0]=4 4140 B6R0.6 C=CCNCCC Amb22587187 [0,1,1,0,0,0|2,0,0]=4 4141 B6R0.6 C=CCNCCC Amb6683949 [0,1,1,0,0,0|2,0,0]=4 4142 B6R0.6 C=CCNCCCl Amb17334072 [0,1,1,0,0,0|2,0,0]=4 4143 B6R0.6 C=CCNCCN Amb17091015 [0,1,1,0,0,0|2,0,0]=4 4144 B6R0.6 C=CCNCCO Amb6706545 [0,1,1,0,0,0|1,0,0]=3 4145 B6R0.6 C=CCNCOC Amb27973157 [0,1,1,0,0,0|2,0,0]=4 4146 B6R0.6 C=CCOCC=O Amb27402231 [0,1,1,0,0,0|0,0,2]=4 4147 B6R0.6 C=CCOCCBr Amb33531510 [0,1,1,0,0,0|2,0,0]=4 4148 B6R0.6 C=CCOCCC Amb3940491 [0,1,1,0,0,0|1,0,0]=3 4149 B6R0.6 C=CCOCCCl Amb2696085 [0,1,1,0,0,0|2,0,0]=4 4150 B6R0.6 C=CCOCCI Amb24739964 [0,1,1,0,0,0|2,0,0]=4 4151 B6R0.6 C=CCOCCN Amb32667523 [0,1,1,0,0,0|2,0,0]=4 4152 B6R0.6 C=CCOCCN Amb33530047 [0,1,1,0,0,0|2,0,0]=4 4153 B6R0.6 C=CCOCCO Amb3940609 [0,1,1,0,0,0|1,0,0]=3 4154 B6R0.6 C=CCOCOC Amb24385255 [0,1,1,0,0,0|2,0,0]=4 4155 B6R0.6 C=CCSCC=O Amb18641509 [0,1,1,0,0,0|1,0,1]=4 4156 B6R0.6 C=CCSCCCl Amb28042684 [0,1,1,0,0,0|2,0,0]=4 4157 B6R0.6 C=CCSCCN Amb13951462 [0,1,1,0,0,0|2,0,0]=4 4158 B6R0.6 C=CCSCCN Amb6273787 [0,1,1,0,0,0|2,0,0]=4 4159 B6R0.6 C=COCCCC Amb8513427 [0,1,1,0,0,0|1,0,0]=3 4160 B6R0.6 C=COCCCCl Amb27613489 [0,1,1,0,0,0|1,0,0]=3 4161 B6R0.6 C=COCCCF Amb22008255 [0,1,1,0,0,0|1,0,0]=3 4162 B6R0.6 C=COCCCN Amb3997182 [0,1,1,0,0,0|1,0,0]=3 4163 B6R0.6 C=COCCNN Amb28421647 [0,1,1,0,0,0|2,0,0]=4 4164 B6R0.6 C=COCCOC Amb21520356 [0,1,1,0,0,0|1,0,0]=3 4165 B6R0.6 C=COCCON Amb22001402 [0,1,1,0,0,0|2,0,0]=4 4166 B6R0.6 C=CSCCCN Amb27800121 [0,1,1,0,0,0|1,1,0]=4 4167 B6R0.6 C=C\C=C\CCC Amb33171502 [0,1,1,0,0,0|2,0,0]=4 4168 B6R0.6 C=C\C=C\CCO Amb34916666 [0,1,1,0,0,0|1,0,1]=4 4169 B6R0.6 CC#CCCCO Amb20242139 [0,1,1,0,0,0|1,0,1]=4 4170 B6R0.6 CC=C=CCCO Amb25888408 [0,1,1,0,0,0|1,0,1]=4 4171 B6R0.6 CCC#CCC=O Amb28396959 [0,1,1,0,0,0|1,0,1]=4 4172 B6R0.6 CCC=C=CC=O Amb27237589 [0,1,1,0,0,0|1,0,1]=4 4173 B6R0.6 CCCC#CC=O Amb27244852 [0,1,1,0,0,0|1,0,0]=3 4174 B6R0.6 CCCC=C=CBr Amb27477883 [0,1,1,0,0,0|2,0,0]=4 4175 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [0,1,1,0,0,0|2,0,0]=4 4176 B6R0.6 CCCCCC=O Amb3939522 [0,1,1,0,0,0|1,0,0]=3 4177 B6R0.6 CCCCCCO Amb3941500 [0,1,1,0,0,0|1,0,1]=4 4178 B6R0.6 CCCCCNO Amb25067859 [0,1,1,0,0,0|1,0,1]=4 4179 B6R0.6 CCCCCOC Amb9787609 [0,1,1,0,0,0|1,0,1]=4 4180 B6R0.6 CCCCCON Amb18122095 [0,1,1,0,0,0|1,0,1]=4 4181 B6R0.6 CCCCN=C=O Amb3939310 [0,1,1,0,0,0|1,0,1]=4 4182 B6R0.6 CCCCNC=O Amb4017838 [0,1,1,0,0,0|1,0,0]=3 4183 B6R0.6 CCCCOB=O Amb26900238 [0,1,1,0,0,0|1,0,0]=3 4184 B6R0.6 CCCCOC=O Amb6608882 [0,1,1,0,0,0|0,0,0]=2 4185 B6R0.6 CCCCOCC Amb2685642 [0,1,1,0,0,0|1,0,1]=4 4186 B6R0.6 CCCCOCO Amb24480826 [0,1,1,0,0,0|0,0,2]=4 4187 B6R0.6 CCCCON=O Amb8515227 [0,1,1,0,0,0|1,0,0]=3 4188 B6R0.6 CCCCSCO Amb27623932 [0,1,1,0,0,0|1,0,1]=4 4189 B6R0.6 CCCC\C=C\I Amb25173925 [0,1,1,0,0,0|2,0,0]=4 4190 B6R0.6 CCCNCCO Amb3939869 [0,1,1,0,0,0|1,0,1]=4 4191 B6R0.6 CCCN\C=N\N Amb28049932 [0,1,1,0,0,0|2,0,0]=4 4192 B6R0.6 CCCOCC#N Amb8874819 [0,1,1,0,0,0|1,0,1]=4 4193 B6R0.6 CCCOCCC Amb8513440 [0,1,1,0,0,0|1,0,1]=4 4194 B6R0.6 CCCOCCCl Amb8514866 [0,1,1,0,0,0|1,0,1]=4 4195 B6R0.6 CCCOCCI Amb27596856 [0,1,1,0,0,0|1,0,1]=4 4196 B6R0.6 CCCOCCN Amb3939563 [0,1,1,0,0,0|1,0,1]=4 4197 B6R0.6 CCCOCCO Amb3939227 [0,1,1,0,0,0|0,0,2]=4 4198 B6R0.6 CCC\C=C/C=O Amb25885814 [0,1,1,0,0,0|1,0,0]=3 4199 B6R0.6 CCC\C=C\C=O Amb3940431 [0,1,1,0,0,0|1,0,0]=3 4200 B6R0.6 CCC\C=C\CCl Amb27482813 [0,1,1,0,0,0|2,0,0]=4 4201 B6R0.6 CCC\C=C\CN Amb33475254 [0,1,1,0,0,0|2,0,0]=4 4202 B6R0.6 CCC\C=C\CO Amb32660968 [0,1,1,0,0,0|1,0,1]=4 4203 B6R0.6 CCC\C=C\CS Amb33373719 [0,1,1,0,0,0|1,1,0]=4 4204 B6R0.6 CCNCCCO Amb6733726 [0,1,1,0,0,0|1,0,1]=4 4205 B6R0.6 CCNCNC=O Amb27252409 [0,1,1,0,0,0|1,0,0]=3 4206 B6R0.6 CCNC\C=C/I Amb23539308 [0,1,1,0,0,0|2,0,0]=4 4207 B6R0.6 CCN\C=C/C=O Amb27793118 [0,1,1,0,0,0|1,0,1]=4 4208 B6R0.6 CCOCCC=O Amb25688261 [0,1,1,0,0,0|1,0,0]=3 4209 B6R0.6 CCOCCCBr Amb8828206 [0,1,1,0,0,0|1,0,1]=4 4210 B6R0.6 CCOCCCCl Amb6255304 [0,1,1,0,0,0|1,0,1]=4 4211 B6R0.6 CCOCCCN Amb3939347 [0,1,1,0,0,0|1,0,1]=4 4212 B6R0.6 CCOCCCO Amb3939322 [0,1,1,0,0,0|1,0,1]=4 4213 B6R0.6 CCOCCNC Amb19959934 [0,1,1,0,0,0|1,0,1]=4 4214 B6R0.6 CCOCCNC Amb33529221 [0,1,1,0,0,0|1,0,1]=4 4215 B6R0.6 CCOCCOC Amb22052684 [0,1,1,0,0,0|1,0,1]=4 4216 B6R0.6 CCOCNC=O Amb28252363 [0,1,1,0,0,0|1,0,0]=3 4217 B6R0.6 CCOCOCC Amb8515183 [0,1,1,0,0,0|1,0,1]=4 4218 B6R0.6 CCOC\C=C\Br Amb28244732 [0,1,1,0,0,0|2,0,0]=4 4219 B6R0.6 CCO\C=C/C=O Amb27423444 [0,1,1,0,0,0|1,0,1]=4 4220 B6R0.6 CCO\C=C\C=O Amb18639560 [0,1,1,0,0,0|1,0,1]=4 4221 B6R0.6 CCSCCC=O Amb27254551 [0,1,1,0,0,0|1,0,0]=3 4222 B6R0.6 CCSCCCO Amb3939588 [0,1,1,0,0,0|1,0,1]=4 4223 B6R0.6 CCSCNC=O Amb28315587 [0,1,1,0,0,0|1,0,0]=3 4224 B6R0.6 CC\C=C/CC=O Amb18639157 [0,1,1,0,0,0|1,0,1]=4 4225 B6R0.6 CC\C=C/CCC Amb26600858 [0,1,1,0,0,0|2,0,0]=4 4226 B6R0.6 CC\C=C/CCO Amb2720771 [0,1,1,0,0,0|1,0,1]=4 4227 B6R0.6 CC\C=C\CCC Amb19930065 [0,1,1,0,0,0|2,0,0]=4 4228 B6R0.6 CC\C=C\CCO Amb3940339 [0,1,1,0,0,0|1,0,1]=4 4229 B6R0.6 CNCCCCO Amb33539277 [0,1,1,0,0,0|1,0,1]=4 4230 B6R0.6 CNCCCOC Amb33801534 [0,1,1,0,0,0|2,0,0]=4 4231 B6R0.6 CNCCCOC Amb9204018 [0,1,1,0,0,0|2,0,0]=4 4232 B6R0.6 CNCCCON Amb27430260 [0,1,1,0,0,0|2,0,0]=4 4233 B6R0.6 CNCC\C=C\Cl Amb27605601 [0,1,1,0,0,0|2,0,0]=4 4234 B6R0.6 CNOCCOC Amb32412843 [0,1,1,0,0,0|2,0,0]=4 4235 B6R0.6 COCCCC#N Amb6258835 [0,1,1,0,0,0|1,0,1]=4 4236 B6R0.6 COCCCC=O Amb33530955 [0,1,1,0,0,0|0,0,0]=2 4237 B6R0.6 COCCCCBr Amb8855443 [0,1,1,0,0,0|1,0,1]=4 4238 B6R0.6 COCCCCCl Amb17942999 [0,1,1,0,0,0|1,0,1]=4 4239 B6R0.6 COCCCCI Amb25933499 [0,1,1,0,0,0|1,0,1]=4 4240 B6R0.6 COCCCCN Amb10610278 [0,1,1,0,0,0|1,0,1]=4 4241 B6R0.6 COCCCCN Amb6251056 [0,1,1,0,0,0|1,0,1]=4 4242 B6R0.6 COCCCCO Amb17666901 [0,1,1,0,0,0|0,0,2]=4 4243 B6R0.6 COCCCCS Amb24654696 [0,1,1,0,0,0|0,1,1]=4 4244 B6R0.6 COCCCNN Amb25887940 [0,1,1,0,0,0|2,0,0]=4 4245 B6R0.6 COCCCNN Amb33204509 [0,1,1,0,0,0|2,0,0]=4 4246 B6R0.6 COCCCNN Amb33553392 [0,1,1,0,0,0|2,0,0]=4 4247 B6R0.6 COCCCNO Amb33378127 [0,1,1,0,0,0|1,0,1]=4 4248 B6R0.6 COCCCOC Amb22168275 [0,1,1,0,0,0|2,0,0]=4 4249 B6R0.6 COCCCON Amb18559290 [0,1,1,0,0,0|2,0,0]=4 4250 B6R0.6 COCCCSC Amb28139052 [0,1,1,0,0,0|2,0,0]=4 4251 B6R0.6 COCCN=C=O Amb901883 [0,1,1,0,0,0|1,0,1]=4 4252 B6R0.6 COCCNC=O Amb24334241 [0,1,1,0,0,0|1,0,0]=3 4253 B6R0.6 COCCOCCl Amb6608984 [0,1,1,0,0,0|1,0,1]=4 4254 B6R0.6 COCCOCO Amb28281708 [0,1,1,0,0,0|0,0,2]=4 4255 B6R0.6 COCNCCO Amb18522071 [0,1,1,0,0,0|2,0,0]=4 4256 B6R0.6 COCOCC=O Amb27409311 [0,1,1,0,0,0|1,0,0]=3 4257 B6R0.6 COCOCCO Amb23590973 [0,1,1,0,0,0|2,0,0]=4 4258 B6R0.6 COC\C=C\C=O Amb33473884 [0,1,1,0,0,0|0,0,2]=4 4259 B6R0.6 CONCCCO Amb24479622 [0,1,1,0,0,0|1,0,1]=4 4260 B6R0.6 CONCCCO Amb33456216 [0,1,1,0,0,0|1,0,1]=4 4261 B6R0.6 CSCCCC=O Amb25992553 [0,1,1,0,0,0|0,1,0]=3 4262 B6R0.6 CSCCCCO Amb9825911 [0,1,1,0,0,0|0,1,1]=4 4263 B6R0.6 CSCCCNO Amb27948053 [0,1,1,0,0,0|2,0,0]=4 4264 B6R0.6 CSCCCON Amb27947150 [0,1,1,0,0,0|2,0,0]=4 4265 B6R0.6 CSCCN=C=O Amb19889355 [0,1,1,0,0,0|1,0,1]=4 4266 B6R0.6 CSCCNC=O Amb28437305 [0,1,1,0,0,0|1,0,0]=3 4267 B6R0.6 CSC\C=C\C=O Amb33271737 [0,1,1,0,0,0|1,0,1]=4 4268 B6R0.6 C\C=C/CCC=O Amb28202620 [0,1,1,0,0,0|1,0,1]=4 4269 B6R0.6 C\C=C/CCCC Amb24467666 [0,1,1,0,0,0|2,0,0]=4 4270 B6R0.6 C\C=C/CCCN Amb27658374 [0,1,1,0,0,0|2,0,0]=4 4271 B6R0.6 C\C=C/CCCO Amb17614951 [0,1,1,0,0,0|1,0,0]=3 4272 B6R0.6 C\C=C\CCC=O Amb17593074 [0,1,1,0,0,0|1,0,1]=4 4273 B6R0.6 C\C=C\CCCC Amb8515158 [0,1,1,0,0,0|2,0,0]=4 4274 B6R0.6 C\C=C\CCCI Amb25837122 [0,1,1,0,0,0|2,0,0]=4 4275 B6R0.6 C\C=C\CCCO Amb22347882 [0,1,1,0,0,0|1,0,0]=3 4276 B6R0.6 C\C=C\SCCC Amb22168314 [0,1,1,0,0,0|1,1,0]=4 4277 B6R0.6 C\C=N\NCCO Amb25888442 [0,1,1,0,0,0|2,0,0]=4 4278 B6R0.6 ClCCCOCBr Amb28458531 [0,1,1,0,0,0|1,0,1]=4 4279 B6R0.6 ClCCCOCCl Amb24479881 [0,1,1,0,0,0|1,0,1]=4 4280 B6R0.6 ClCOCCCBr Amb25889019 [0,1,1,0,0,0|1,0,1]=4 4281 B6R0.6 Cl\C=C/OCCCl Amb27843981 [0,1,1,0,0,0|2,0,0]=4 4282 B6R0.6 N#CCCCC=O Amb18120556 [0,1,1,0,0,0|1,0,0]=3 4283 B6R0.6 N#CCCCCO Amb33531864 [0,1,1,0,0,0|1,0,1]=4 4284 B6R0.6 NCCCCC=O Amb26627836 [0,1,1,0,0,0|1,0,0]=3 4285 B6R0.6 NCCCCCO Amb3939337 [0,1,1,0,0,0|1,0,1]=4 4286 B6R0.6 NCCCCNO Amb24117989 [0,1,1,0,0,0|1,0,1]=4 4287 B6R0.6 NCCCCNO Amb27668394 [0,1,1,0,0,0|1,0,1]=4 4288 B6R0.6 NCCCCON Amb28188672 [0,1,1,0,0,0|1,0,1]=4 4289 B6R0.6 NCCCNC=O Amb5723517 [0,1,1,0,0,0|1,0,0]=3 4290 B6R0.6 NCCCOCF Amb33224234 [0,1,1,0,0,0|1,0,1]=4 4291 B6R0.6 NCCC\C=C/I Amb28050291 [0,1,1,0,0,0|2,0,0]=4 4292 B6R0.6 NCCNCCO Amb6600573 [0,1,1,0,0,0|1,0,1]=4 4293 B6R0.6 NCCOCCO Amb3939011 [0,1,1,0,0,0|1,0,1]=4 4294 B6R0.6 NCCSCCO Amb2725559 [0,1,1,0,0,0|1,0,1]=4 4295 B6R0.6 NC\C=C\CCO Amb27969293 [0,1,1,0,0,0|1,0,1]=4 4296 B6R0.6 NNCCCCO Amb24692523 [0,1,1,0,0,0|1,0,1]=4 4297 B6R0.6 NOCCCCF Amb27160797 [0,1,1,0,0,0|1,0,1]=4 4298 B6R0.6 NOCCCON Amb24711828 [0,1,1,0,0,0|2,0,0]=4 4299 B6R0.6 O=C=NCCCBr Amb27859638 [0,1,1,0,0,0|1,0,1]=4 4300 B6R0.6 O=C=NCCCCl Amb3939153 [0,1,1,0,0,0|1,0,1]=4 4301 B6R0.6 O=C=NCCCF Amb27838244 [0,1,1,0,0,0|1,0,1]=4 4302 B6R0.6 O=CCCCC=O Amb6600455 [0,1,1,0,0,0|0,0,1]=3 4303 B6R0.6 O=CCCCCBr Amb18126353 [0,1,1,0,0,0|1,0,0]=3 4304 B6R0.6 O=CCCCCCl Amb18123550 [0,1,1,0,0,0|1,0,0]=3 4305 B6R0.6 O=CCCCCO Amb10603837 [0,1,1,0,0,0|0,0,0]=2 4306 B6R0.6 O=CCCCN=O Amb27838215 [0,1,1,0,0,0|0,0,1]=3 4307 B6R0.6 O=CCC\C=C/Br Amb27838206 [0,1,1,0,0,0|1,0,1]=4 4308 B6R0.6 O=CCC\C=C\Cl Amb27955198 [0,1,1,0,0,0|1,0,1]=4 4309 B6R0.6 O=CNCCCO Amb27248821 [0,1,1,0,0,0|0,0,0]=2 4310 B6R0.6 O=C\C=C/CCO Amb27235316 [0,1,1,0,0,0|0,0,1]=3 4311 B6R0.6 O=C\C=C\CCF Amb33429802 [0,1,1,0,0,0|1,0,1]=4 4312 B6R0.6 O=[PH2]OCCCO Amb27218913 [0,1,1,0,0,0|1,0,0]=3 4313 B6R0.6 OCCCC#CBr Amb28401370 [0,1,1,0,0,0|1,0,1]=4 4314 B6R0.6 OCCCC#CCl Amb27457965 [0,1,1,0,0,0|1,0,1]=4 4315 B6R0.6 OCCCCCBr Amb10603824 [0,1,1,0,0,0|1,0,1]=4 4316 B6R0.6 OCCCCCCl Amb8386939 [0,1,1,0,0,0|1,0,1]=4 4317 B6R0.6 OCCCCCF Amb24479828 [0,1,1,0,0,0|1,0,1]=4 4318 B6R0.6 OCCCCCO Amb6296608 [0,1,1,0,0,0|0,0,2]=4 4319 B6R0.6 OCCCCNO Amb27396013 [0,1,1,0,0,0|0,0,2]=4 4320 B6R0.6 OCCC\C=C\Br Amb27483322 [0,1,1,0,0,0|1,0,0]=3 4321 B6R0.6 OCCC\C=C\I Amb27879078 [0,1,1,0,0,0|1,0,0]=3 4322 B6R0.6 OCCNCCF Amb27468539 [0,1,1,0,0,0|1,0,1]=4 4323 B6R0.6 OCCNCCO Amb22035219 [0,1,1,0,0,0|0,0,2]=4 4324 B6R0.6 OCCNCCO Amb3997179 [0,1,1,0,0,0|0,0,2]=4 4325 B6R0.6 OCCNCCS Amb18522180 [0,1,1,0,0,0|0,1,1]=4 4326 B6R0.6 OCCOCCBr Amb24057456 [0,1,1,0,0,0|1,0,1]=4 4327 B6R0.6 OCCOCCCl Amb3940337 [0,1,1,0,0,0|1,0,1]=4 4328 B6R0.6 OCCOCCF Amb17593119 [0,1,1,0,0,0|1,0,1]=4 4329 B6R0.6 OCCOCCI Amb27602214 [0,1,1,0,0,0|1,0,1]=4 4330 B6R0.6 OCCOCCO Amb32671216 [0,1,1,0,0,0|0,0,2]=4 4331 B6R0.6 OCCOCCO Amb6608789 [0,1,1,0,0,0|0,0,2]=4 4332 B6R0.6 OCCOCCS Amb22008751 [0,1,1,0,0,0|0,1,1]=4 4333 B6R0.6 OCCPCCO Amb27185495 [0,1,1,0,0,0|0,0,2]=4 4334 B6R0.6 OCCSCCCl Amb27413860 [0,1,1,0,0,0|1,0,1]=4 4335 B6R0.6 OCCSCCO Amb6891967 [0,1,1,0,0,0|0,0,2]=4 4336 B6R0.6 OCCSCCS Amb27829564 [0,1,1,0,0,0|0,1,1]=4 4337 B6R0.6 OCC\C=C/CBr Amb27750410 [0,1,1,0,0,0|1,0,1]=4 4338 B6R0.6 OCC\C=C\CCl Amb27227431 [0,1,1,0,0,0|1,0,1]=4 4339 B6R0.6 OC\C=C\CCO Amb26017278 [0,1,1,0,0,0|0,0,2]=4 4340 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [0,1,1,0,0,0|2,0,0]=4 4341 B6R0.6 [N-]=[N+]=NCCC=O Amb28050185 [0,1,1,0,0,0|2,0,0]=4 4342 B6R0.6 [N-]=[N+]=NCCCO Amb33538391 [0,1,1,0,0,0|2,0,0]=4 4343 B6R0.8 BP(=O)(OC)OC Amb28411332 [0,1,1,0,0,0|2,0,0]=4 4344 B6R0.8 CCC(C)(C)OC Amb8513316 [0,1,1,0,0,0|1,0,1]=4 4345 B6R0.8 CCP(=O)(O)CC Amb22732881 [0,1,1,0,0,0|2,0,0]=4 4346 B6R0.8 CCS(=N)(=O)CC Amb22735220 [0,1,1,0,0,0|2,0,0]=4 4347 B6R0.8 CCS(=N)(=O)NC Amb29867415 [0,1,1,0,0,0|2,0,0]=4 4348 B6R0.8 CCS(=O)(=O)CC Amb17672874 [0,1,1,0,0,0|2,0,0]=4 4349 B6R0.8 CCS(=O)(=O)NC Amb1138409 [0,1,1,0,0,0|2,0,0]=4 4350 B6R0.8 CCS(=O)(=O)OC Amb22730356 [0,1,1,0,0,0|1,0,0]=3 4351 B6R0.8 CNP(=O)(O)OC Amb27643905 [0,1,1,0,0,0|2,0,0]=4 4352 B6R0.8 COP(=O)(Cl)OC Amb17613364 [0,1,1,0,0,0|2,0,0]=4 4353 B6R0.8 COP(=O)(O)OC Amb17671942 [0,1,1,0,0,0|2,0,0]=4 4354 B6R0.8 COP(=O)([O-])SC Amb25697020 [0,1,1,0,0,0|2,0,0]=4 4355 B6R0.8 COP(C)(=O)CCl Amb28203950 [0,1,1,0,0,0|2,0,0]=4 4356 B6R0.8 COP(C)(=O)CO Amb27757371 [0,1,1,0,0,0|2,0,0]=4 4357 B6R0.8 COP(C)(=O)OC Amb10068657 [0,1,1,0,0,0|2,0,0]=4 4358 B6R0.8 COP(C)(=O)SC Amb26005631 [0,1,1,0,0,0|2,0,0]=4 4359 B6R0.8 COP(N)(=O)OC Amb17939968 [0,1,1,0,0,0|2,0,0]=4 4360 B6R0.8 COP(N)(=O)SC Amb8385014 [0,1,1,0,0,0|2,0,0]=4 4361 B6R0.8 COS(=O)(=O)CBr Amb27983643 [0,1,1,0,0,0|2,0,0]=4 4362 B6R0.8 COS(=O)(=O)OC Amb2792995 [0,1,1,0,0,0|2,0,0]=4 4363 B6R0.9 C#CC(CC)OC Amb26428626 [0,1,1,0,0,0|1,0,1]=4 4364 B6R0.9 C=CC(CC)OC Amb28429197 [0,1,1,0,0,0|1,0,1]=4 4365 B6R0.9 CCB(CC)OC Amb17943015 [0,1,1,0,0,0|2,0,0]=4 4366 B6R0.9 CCC(C#N)OC Amb28057297 [0,1,1,0,0,0|1,0,1]=4 4367 B6R0.9 CCC(C=O)CC Amb3939947 [0,1,1,0,0,0|1,0,1]=4 4368 B6R0.9 CCC(C=O)OC Amb18121854 [0,1,1,0,0,0|0,0,1]=3 4369 B6R0.9 CCC(CBr)OC Amb27758620 [0,1,1,0,0,0|1,0,1]=4 4370 B6R0.9 CCC(CC)=NO Amb2782908 [0,1,1,0,0,0|1,0,1]=4 4371 B6R0.9 CCC(CCl)OC Amb24478961 [0,1,1,0,0,0|1,0,1]=4 4372 B6R0.9 CCC(CI)OC Amb27880436 [0,1,1,0,0,0|1,0,1]=4 4373 B6R0.9 CCC(CN)OC Amb2140565 [0,1,1,0,0,0|1,0,1]=4 4374 B6R0.9 CCC(CN)OC Amb927899 [0,1,1,0,0,0|1,0,1]=4 4375 B6R0.9 CCC(CO)OC Amb24323287 [0,1,1,0,0,0|0,0,2]=4 4376 B6R0.9 CCC(CS)OC Amb26588357 [0,1,1,0,0,0|0,1,1]=4 4377 B6R0.9 CCC(OC)OC Amb22731785 [0,1,1,0,0,0|0,0,2]=4 4378 B6R0.9 CCN(C=O)CC Amb8513815 [0,1,1,0,0,0|2,0,0]=4 4379 B6R0.9 CCN(CC)N=O Amb19878083 [0,1,1,0,0,0|2,0,0]=4 4380 B6R0.9 CCP(CC)OC Amb27403182 [0,1,1,0,0,0|2,0,0]=4 4381 B6R0.9 CCP(OC)OC Amb22730826 [0,1,1,0,0,0|1,0,1]=4 4382 B6R0.9 CC\C(=C/Cl)SC Amb28245041 [0,1,1,0,0,0|1,1,0]=4 4383 B6R0.9 CC\C(C=O)=C\Cl Amb27400355 [0,1,1,0,0,0|2,0,0]=4 4384 B6R0.9 CC\C(C=O)=C\N Amb28248353 [0,1,1,0,0,0|2,0,0]=4 4385 B6R0.9 COC(=CBr)OC Amb26552819 [0,1,1,0,0,0|2,0,0]=4 4386 B6R0.9 COC(C=O)OC Amb10071226 [0,1,1,0,0,0|1,0,1]=4 4387 B6R0.9 CO[C@@H](C=O)CO Amb27759414 [0,1,1,0,0,0|1,0,1]=4 4388 B6R0.9 CO\C(C=O)=C/N Amb28050517 [0,1,1,0,0,0|1,0,1]=4 4389 B6R0.9 CO\C(C=O)=C\Cl Amb27165654 [0,1,1,0,0,0|1,0,1]=4 4390 B6R0.9 C\C=C(/C#N)CC Amb18638703 [0,1,1,0,0,0|2,0,0]=4 4391 B6R0.9 C\C=C(/C=O)CC Amb27838269 [0,1,1,0,0,0|1,0,0]=3 4392 B6R0.9 C\C=C(\C#N)CC Amb26395981 [0,1,1,0,0,0|2,0,0]=4 4393 B6R0.9 C\C=C(\C=O)CC Amb10606406 [0,1,1,0,0,0|1,0,0]=3 4394 B6R0.9 C\C=C(\C=O)CCl Amb27424657 [0,1,1,0,0,0|2,0,0]=4 4395 B6R0.9 C\C=C(\C=O)CO Amb28388682 [0,1,1,0,0,0|2,0,0]=4 4396 B6R0.9 C\C=C(\CC)CBr Amb27491794 [0,1,1,0,0,0|2,0,0]=4 4397 B6R0.9 C\C=C(\CC)CN Amb27185641 [0,1,1,0,0,0|2,0,0]=4 4398 B6R0.9 C\C=C(\CC)CO Amb27637925 [0,1,1,0,0,0|1,0,1]=4 4399 B6R1.4 Br[C@@H]1CC[C@H]1Br Amb26580083 [0,1,0,0,1,0|1,0,1]=4 4400 B6R1.4 Br[C@H]1CC[C@@H]1Br Amb27844351 [0,1,0,0,1,0|1,0,1]=4 4401 B6R1.4 Br[C@H]1CC[C@H]1Br Amb27873287 [0,1,0,0,1,0|1,0,1]=4 4402 B6R1.4 C=C1CCC1C Amb27424508 [0,1,0,0,1,0|1,0,0]=3 4403 B6R1.4 C=C1CCC1Cl Amb27637701 [0,1,0,0,1,0|1,0,0]=3 4404 B6R1.4 CC1CCC1=O Amb17593022 [0,1,0,0,1,0|0,0,0]=2 4405 B6R1.4 CC1CCC1Br Amb27657001 [0,1,0,0,1,0|1,0,1]=4 4406 B6R1.4 CC1CCC1N Amb26081246 [0,1,0,0,1,0|1,0,1]=4 4407 B6R1.4 CC1CCC1N Amb33550388 [0,1,0,0,1,0|1,0,1]=4 4408 B6R1.4 CC1CCC1O Amb33546533 [0,1,0,0,1,0|0,0,2]=4 4409 B6R1.4 CC1CCC1S Amb26562257 [0,1,0,0,1,0|0,1,1]=4 4410 B6R1.4 CC1CNC1=O Amb24444140 [0,1,0,0,1,0|1,0,0]=3 4411 B6R1.4 CC1COC1=O Amb25794274 [0,1,0,0,1,0|0,0,0]=2 4412 B6R1.4 CC1NNC1=O Amb35751853 [0,1,0,0,1,0|2,0,0]=4 4413 B6R1.4 CC1OCC1=O Amb23456088 [0,1,0,0,1,0|1,0,0]=3 4414 B6R1.4 CC1OCC1O Amb25917442 [0,1,0,0,1,0|1,0,1]=4 4415 B6R1.4 C[C@@H]1CC[C@H]1N Amb27461478 [0,1,0,0,1,0|1,0,1]=4 4416 B6R1.4 C[C@@H]1CC[C@H]1N Amb31030976 [0,1,0,0,1,0|1,0,1]=4 4417 B6R1.4 C[C@@H]1CC[C@H]1O Amb28053300 [0,1,0,0,1,0|0,0,2]=4 4418 B6R1.4 C[C@@H]1OC[C@@H]1O Amb25988882 [0,1,0,0,1,0|1,0,1]=4 4419 B6R1.4 C[C@@H]1OC[C@H]1O Amb25913383 [0,1,0,0,1,0|1,0,1]=4 4420 B6R1.4 C[C@H]1CC[C@H]1Br Amb28141451 [0,1,0,0,1,0|1,0,1]=4 4421 B6R1.4 C[C@H]1CNC1=O Amb27620602 [0,1,0,0,1,0|1,0,0]=3 4422 B6R1.4 ClC1CCC1Cl Amb26599495 [0,1,0,0,1,0|1,0,1]=4 4423 B6R1.4 Cl[C@H]1CC[C@H]1Cl Amb24635621 [0,1,0,0,1,0|1,0,1]=4 4424 B6R1.4 F[C@@H]1CC[C@H]1Br Amb35752252 [0,1,0,0,1,0|1,0,1]=4 4425 B6R1.4 N=C1CNC1=O Amb27255646 [0,1,0,0,1,0|1,0,1]=4 4426 B6R1.4 NC1CCC1=O Amb22896568 [0,1,0,0,1,0|0,0,0]=2 4427 B6R1.4 NC1CCC1=O Amb25887804 [0,1,0,0,1,0|0,0,0]=2 4428 B6R1.4 NC1CCC1F Amb33715804 [0,1,0,0,1,0|1,0,1]=4 4429 B6R1.4 NC1CCC1N Amb27872038 [0,1,0,0,1,0|1,0,1]=4 4430 B6R1.4 NC1CCC1O Amb19148610 [0,1,0,0,1,0|0,0,2]=4 4431 B6R1.4 NC1CCC1O Amb31291441 [0,1,0,0,1,0|0,0,2]=4 4432 B6R1.4 NC1CNC1=O Amb18832512 [0,1,0,0,1,0|1,0,0]=3 4433 B6R1.4 NC1CNC1=O Amb32671465 [0,1,0,0,1,0|1,0,0]=3 4434 B6R1.4 NN1CCC1=O Amb27860475 [0,1,0,0,1,0|1,0,0]=3 4435 B6R1.4 NN1CCC1=O Amb30625658 [0,1,0,0,1,0|1,0,0]=3 4436 B6R1.4 N[C@@H]1CC[C@@H]1F Amb33620889 [0,1,0,0,1,0|1,0,1]=4 4437 B6R1.4 N[C@@H]1CC[C@@H]1F Amb33747380 [0,1,0,0,1,0|1,0,1]=4 4438 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22757952 [0,1,0,0,1,0|0,0,2]=4 4439 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22823228 [0,1,0,0,1,0|0,0,2]=4 4440 B6R1.4 N[C@@H]1CC[C@H]1O Amb22757953 [0,1,0,0,1,0|0,0,2]=4 4441 B6R1.4 N[C@@H]1CC[C@H]1O Amb22823232 [0,1,0,0,1,0|0,0,2]=4 4442 B6R1.4 N[C@@H]1CC[C@H]1O Amb33719048 [0,1,0,0,1,0|0,0,2]=4 4443 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [0,1,0,0,1,0|1,0,0]=3 4444 B6R1.4 N[C@@H]1CNC1=O Amb30982058 [0,1,0,0,1,0|1,0,0]=3 4445 B6R1.4 N[C@@H]1COC1=O Amb22748014 [0,1,0,0,1,0|0,0,0]=2 4446 B6R1.4 N[C@H]1CC[C@@H]1O Amb24579886 [0,1,0,0,1,0|0,0,2]=4 4447 B6R1.4 N[C@H]1CC[C@H]1N Amb25067470 [0,1,0,0,1,0|1,0,1]=4 4448 B6R1.4 N[C@H]1CC[C@H]1O Amb24580190 [0,1,0,0,1,0|0,0,2]=4 4449 B6R1.4 N[C@H]1CNC1=O Amb25811302 [0,1,0,0,1,0|1,0,0]=3 4450 B6R1.4 N[C@H]1CNC1=O Amb31291144 [0,1,0,0,1,0|1,0,0]=3 4451 B6R1.4 N[C@H]1COC1=O Amb28315731 [0,1,0,0,1,0|0,0,0]=2 4452 B6R1.4 N[C@H]1CSC1=O Amb27391192 [0,1,0,0,1,0|0,1,0]=3 4453 B6R1.4 O=C1CCC1=O Amb4036402 [0,1,0,0,1,0|0,0,1]=3 4454 B6R1.4 O=C1CCC1Br Amb21964157 [0,1,0,0,1,0|0,0,0]=2 4455 B6R1.4 O=C1CCC1Cl Amb33544158 [0,1,0,0,1,0|0,0,0]=2 4456 B6R1.4 O=C1CCC1O Amb17593027 [0,1,0,0,1,0|0,0,0]=2 4457 B6R1.4 O=C1CNC1=O Amb27973276 [0,1,0,0,1,0|1,0,1]=4 4458 B6R1.4 O=C1NCC1O Amb24689689 [0,1,0,0,1,0|1,0,0]=3 4459 B6R1.4 OC1CCC1F Amb34138084 [0,1,0,0,1,0|0,0,2]=4 4460 B6R1.4 OC1CCC1O Amb27647204 [0,1,0,0,1,0|0,0,2]=4 4461 B6R1.4 O[C@@H]1CC[C@H]1O Amb28053810 [0,1,0,0,1,0|0,0,2]=4 4462 B6R1.4 O[C@@H]1CC[C@H]1S Amb27420494 [0,1,0,0,1,0|0,0,2]=4 4463 B6R1.4 O[C@H]1CC[C@H]1O Amb24505810 [0,1,0,0,1,0|0,0,2]=4 4464 B6R1.5 C=C1CC(C)C1 Amb27242578 [0,1,0,0,1,0|1,0,0]=3 4465 B6R1.5 C=C1CC(Cl)C1 Amb27863443 [0,1,0,0,1,0|1,0,0]=3 4466 B6R1.5 C=C1CC(N)C1 Amb19929922 [0,1,0,0,1,0|1,0,0]=3 4467 B6R1.5 C=C1CC(N)C1 Amb28464229 [0,1,0,0,1,0|1,0,0]=3 4468 B6R1.5 C=C1CC(O)C1 Amb28126950 [0,1,0,0,1,0|1,0,0]=3 4469 B6R1.5 CC1=CC(=O)C1 Amb27451158 [0,1,0,0,1,0|0,0,2]=4 4470 B6R1.5 CC1CC(=O)C1 Amb22284831 [0,1,0,0,1,0|0,0,0]=2 4471 B6R1.5 CC1CC(=O)N1 Amb28383498 [0,1,0,0,1,0|1,0,0]=3 4472 B6R1.5 CC1CC(=O)O1 Amb13777279 [0,1,0,0,1,0|0,0,0]=2 4473 B6R1.5 CC1CC(=O)S1 Amb27424521 [0,1,0,0,1,0|0,1,0]=3 4474 B6R1.5 CC1CC(C)O1 Amb22737240 [0,1,0,0,1,0|1,0,1]=4 4475 B6R1.5 CC1CC(Cl)C1 Amb27985854 [0,1,0,0,1,0|1,0,1]=4 4476 B6R1.5 CC1CC(N)C1 Amb20623633 [0,1,0,0,1,0|1,0,1]=4 4477 B6R1.5 CC1CC(N)C1 Amb22058941 [0,1,0,0,1,0|1,0,1]=4 4478 B6R1.5 CC1CC(O)C1 Amb22235436 [0,1,0,0,1,0|0,0,2]=4 4479 B6R1.5 CC1CC(S)C1 Amb27222229 [0,1,0,0,1,0|0,1,1]=4 4480 B6R1.5 CN1CC(=O)C1 Amb22292462 [0,1,0,0,1,0|1,0,0]=3 4481 B6R1.5 CN1CC(=O)C1 Amb30869395 [0,1,0,0,1,0|1,0,0]=3 4482 B6R1.5 CN1CC(Cl)C1 Amb24355400 [0,1,0,0,1,0|2,0,0]=4 4483 B6R1.5 CN1CC(N)C1 Amb21857825 [0,1,0,0,1,0|2,0,0]=4 4484 B6R1.5 CN1CC(N)C1 Amb8631601 [0,1,0,0,1,0|2,0,0]=4 4485 B6R1.5 CN1CC(O)C1 Amb21960698 [0,1,0,0,1,0|2,0,0]=4 4486 B6R1.5 CN1CC(O)C1 Amb22034404 [0,1,0,0,1,0|2,0,0]=4 4487 B6R1.5 CN1CC(O)C1 Amb32646073 [0,1,0,0,1,0|2,0,0]=4 4488 B6R1.5 C[C@@H]1CC(=O)N1 Amb26611068 [0,1,0,0,1,0|1,0,0]=3 4489 B6R1.5 C[C@@H]1C[C@@H](C)O1 Amb24332806 [0,1,0,0,1,0|1,0,1]=4 4490 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [0,1,0,0,1,0|0,0,0]=2 4491 B6R1.5 C[C@H]1C[C@@H](C)O1 Amb24333814 [0,1,0,0,1,0|1,0,1]=4 4492 B6R1.5 C[C@H]1C[C@@H](Cl)C1 Amb27955840 [0,1,0,0,1,0|1,0,1]=4 4493 B6R1.5 C[C@H]1C[C@@H](N)C1 Amb22746992 [0,1,0,0,1,0|1,0,1]=4 4494 B6R1.5 C[C@H]1C[C@@H](N)C1 Amb26464238 [0,1,0,0,1,0|1,0,1]=4 4495 B6R1.5 C[C@H]1C[C@@H](O)C1 Amb27472789 [0,1,0,0,1,0|0,0,2]=4 4496 B6R1.5 C[C@H]1C[C@H](N)C1 Amb24665814 [0,1,0,0,1,0|1,0,1]=4 4497 B6R1.5 C[C@H]1C[C@H](N)C1 Amb34152650 [0,1,0,0,1,0|1,0,1]=4 4498 B6R1.5 C[C@H]1C[C@H](O)C1 Amb26010738 [0,1,0,0,1,0|0,0,2]=4 4499 B6R1.5 ClC1CC(Cl)C1 Amb27185636 [0,1,0,0,1,0|1,0,1]=4 4500 B6R1.5 Cl[C@H]1C[C@H](Br)C1 Amb27433818 [0,1,0,0,1,0|1,0,1]=4 4501 B6R1.5 Cl[C@H]1C[C@H](Cl)C1 Amb27233571 [0,1,0,0,1,0|1,0,1]=4 4502 B6R1.5 NC1CC(=O)C1 Amb20241928 [0,1,0,0,1,0|0,0,0]=2 4503 B6R1.5 NC1CC(=O)C1 Amb23439093 [0,1,0,0,1,0|0,0,0]=2 4504 B6R1.5 NC1CC(Br)C1 Amb33483370 [0,1,0,0,1,0|1,0,1]=4 4505 B6R1.5 NC1CC(Br)C1 Amb33483371 [0,1,0,0,1,0|1,0,1]=4 4506 B6R1.5 NC1CC(F)C1 Amb19515443 [0,1,0,0,1,0|1,0,1]=4 4507 B6R1.5 NC1CC(F)C1 Amb22055291 [0,1,0,0,1,0|1,0,1]=4 4508 B6R1.5 NC1CC(N)C1 Amb19516078 [0,1,0,0,1,0|1,0,1]=4 4509 B6R1.5 NC1CC(N)C1 Amb8389497 [0,1,0,0,1,0|1,0,1]=4 4510 B6R1.5 NC1CC(O)C1 Amb20670971 [0,1,0,0,1,0|0,0,2]=4 4511 B6R1.5 NC1CC(O)C1 Amb8011533 [0,1,0,0,1,0|0,0,2]=4 4512 B6R1.5 NC1CC(S)C1 Amb32788611 [0,1,0,0,1,0|0,1,1]=4 4513 B6R1.5 NC1CS(=O)C1 Amb25757983 [0,1,0,0,1,0|1,0,0]=3 4514 B6R1.5 NC1CS(=O)C1 Amb32655803 [0,1,0,0,1,0|1,0,0]=3 4515 B6R1.5 NN1CC(O)C1 Amb26591778 [0,1,0,0,1,0|2,0,0]=4 4516 B6R1.5 NN1CC(O)C1 Amb30627773 [0,1,0,0,1,0|2,0,0]=4 4517 B6R1.5 N[C@H]1C[C@@H](Br)C1 Amb34142242 [0,1,0,0,1,0|1,0,1]=4 4518 B6R1.5 N[C@H]1C[C@@H](F)C1 Amb22757506 [0,1,0,0,1,0|1,0,1]=4 4519 B6R1.5 N[C@H]1C[C@@H](F)C1 Amb24053524 [0,1,0,0,1,0|1,0,1]=4 4520 B6R1.5 N[C@H]1C[C@@H](N)C1 Amb22737491 [0,1,0,0,1,0|1,0,1]=4 4521 B6R1.5 N[C@H]1C[C@@H](N)C1 Amb23440098 [0,1,0,0,1,0|1,0,1]=4 4522 B6R1.5 N[C@H]1C[C@@H](O)C1 Amb10603190 [0,1,0,0,1,0|0,0,2]=4 4523 B6R1.5 N[C@H]1C[C@@H](O)C1 Amb22230425 [0,1,0,0,1,0|0,0,2]=4 4524 B6R1.5 N[C@H]1C[C@H](F)C1 Amb23440227 [0,1,0,0,1,0|1,0,1]=4 4525 B6R1.5 N[C@H]1C[C@H](F)C1 Amb24053525 [0,1,0,0,1,0|1,0,1]=4 4526 B6R1.5 N[C@H]1C[C@H](N)C1 Amb23440099 [0,1,0,0,1,0|1,0,1]=4 4527 B6R1.5 N[C@H]1C[C@H](N)C1 Amb23440100 [0,1,0,0,1,0|1,0,1]=4 4528 B6R1.5 N[C@H]1C[C@H](O)C1 Amb10604103 [0,1,0,0,1,0|0,0,2]=4 4529 B6R1.5 N[C@H]1C[C@H](O)C1 Amb33523572 [0,1,0,0,1,0|0,0,2]=4 4530 B6R1.5 O=C1CC(=O)C1 Amb27832187 [0,1,0,0,1,0|0,0,1]=3 4531 B6R1.5 O=C1CC(=O)N1 Amb27402706 [0,1,0,0,1,0|1,0,1]=4 4532 B6R1.5 O=C1CC(=S)N1 Amb27815147 [0,1,0,0,1,0|1,0,1]=4 4533 B6R1.5 O=C1CC(Br)C1 Amb33548005 [0,1,0,0,1,0|0,0,0]=2 4534 B6R1.5 O=C1CC(F)C1 Amb27260513 [0,1,0,0,1,0|0,0,0]=2 4535 B6R1.5 O=C1CC(F)N1 Amb24588463 [0,1,0,0,1,0|1,0,0]=3 4536 B6R1.5 O=C1CC(O)C1 Amb22235480 [0,1,0,0,1,0|0,0,0]=2 4537 B6R1.5 O=C1C[C@@H](Br)N1 Amb26634817 [0,1,0,0,1,0|1,0,0]=3 4538 B6R1.5 O=S1CC(Cl)C1 Amb27483106 [0,1,0,0,1,0|1,0,0]=3 4539 B6R1.5 OC1CC(Br)C1 Amb24544946 [0,1,0,0,1,0|0,0,2]=4 4540 B6R1.5 OC1CC(Cl)C1 Amb27234478 [0,1,0,0,1,0|0,0,2]=4 4541 B6R1.5 OC1CC(F)C1 Amb23439374 [0,1,0,0,1,0|0,0,2]=4 4542 B6R1.5 OC1CC(O)C1 Amb33550902 [0,1,0,0,1,0|0,0,2]=4 4543 B6R1.5 O[C@H]1C[C@@H](Br)C1 Amb33299478 [0,1,0,0,1,0|0,0,2]=4 4544 B6R1.5 O[C@H]1C[C@@H](F)C1 Amb24183986 [0,1,0,0,1,0|0,0,2]=4 4545 B6R1.5 O[C@H]1C[C@@H](O)C1 Amb26562258 [0,1,0,0,1,0|0,0,2]=4 4546 B6R1.5 O[C@H]1C[C@@H](S)C1 Amb27461463 [0,1,0,0,1,0|0,0,2]=4 4547 B6R1.5 O[C@H]1C[C@H](Br)C1 Amb26636996 [0,1,0,0,1,0|0,0,2]=4 4548 B6R1.5 O[C@H]1C[C@H](Cl)C1 Amb26427512 [0,1,0,0,1,0|0,0,2]=4 4549 B6R1.5 O[C@H]1C[C@H](F)C1 Amb23440228 [0,1,0,0,1,0|0,0,2]=4 4550 B6R1.5 O[C@H]1C[C@H](O)C1 Amb26657998 [0,1,0,0,1,0|0,0,2]=4 4551 B6R1.5 O[C@H]1C[C@H](S)C1 Amb28065373 [0,1,0,0,1,0|0,0,2]=4 4552 B6R1.6 BrC=C1COC1 Amb33483065 [0,1,0,0,1,0|2,0,0]=4 4553 B6R1.6 BrCC1CCC1 Amb3940157 [0,1,0,0,1,0|1,0,1]=4 4554 B6R1.6 BrCC1CCO1 Amb2383525 [0,1,0,0,1,0|1,0,1]=4 4555 B6R1.6 C#CC1CCC1 Amb25184959 [0,1,0,0,1,0|1,0,1]=4 4556 B6R1.6 C=CC1CCC1 Amb27254044 [0,1,0,0,1,0|1,0,1]=4 4557 B6R1.6 CC=C1CCC1 Amb27960500 [0,1,0,0,1,0|1,0,0]=3 4558 B6R1.6 CCC1CCC1 Amb24394555 [0,1,0,0,1,0|1,0,1]=4 4559 B6R1.6 CNC1CCC1 Amb18946245 [0,1,0,0,1,0|1,0,1]=4 4560 B6R1.6 CNC1CCC1 Amb19303706 [0,1,0,0,1,0|1,0,1]=4 4561 B6R1.6 CSC1CCC1 Amb27875235 [0,1,0,0,1,0|0,1,1]=4 4562 B6R1.6 ClCC1=CCC1 Amb27815042 [0,1,0,0,1,0|1,0,1]=4 4563 B6R1.6 ClCC1CCC1 Amb8860570 [0,1,0,0,1,0|1,0,1]=4 4564 B6R1.6 ClCC1CCO1 Amb22495451 [0,1,0,0,1,0|1,0,1]=4 4565 B6R1.6 ICC1CCC1 Amb27831605 [0,1,0,0,1,0|1,0,1]=4 4566 B6R1.6 ICC1CCO1 Amb13883581 [0,1,0,0,1,0|1,0,1]=4 4567 B6R1.6 N#CC1CCC1 Amb16232994 [0,1,0,0,1,0|1,0,1]=4 4568 B6R1.6 N#CN1CCC1 Amb27980503 [0,1,0,0,1,0|2,0,0]=4 4569 B6R1.6 NCC1CCC1 Amb6255393 [0,1,0,0,1,0|1,0,1]=4 4570 B6R1.6 NCC1CCC1 Amb7969499 [0,1,0,0,1,0|1,0,1]=4 4571 B6R1.6 NCC1CCO1 Amb19895255 [0,1,0,0,1,0|1,0,1]=4 4572 B6R1.6 NC[C@@H]1CCO1 Amb34141504 [0,1,0,0,1,0|1,0,1]=4 4573 B6R1.6 NC[C@H]1CCO1 Amb33805341 [0,1,0,0,1,0|1,0,1]=4 4574 B6R1.6 NN=C1COC1 Amb23560173 [0,1,0,0,1,0|2,0,0]=4 4575 B6R1.6 NNC1CCC1 Amb21936692 [0,1,0,0,1,0|1,0,1]=4 4576 B6R1.6 NNC1CCC1 Amb33533268 [0,1,0,0,1,0|1,0,1]=4 4577 B6R1.6 NNC1CCC1 Amb6892241 [0,1,0,0,1,0|1,0,1]=4 4578 B6R1.6 NOC1CCC1 Amb10975959 [0,1,0,0,1,0|0,0,2]=4 4579 B6R1.6 NOC1CCC1 Amb25118834 [0,1,0,0,1,0|0,0,2]=4 4580 B6R1.6 O=CC1CCC1 Amb8009552 [0,1,0,0,1,0|0,0,1]=3 4581 B6R1.6 O=CC1CCN1 Amb25757222 [0,1,0,0,1,0|1,0,1]=4 4582 B6R1.6 O=CC1CCS1 Amb27644631 [0,1,0,0,1,0|0,1,1]=4 4583 B6R1.6 O=CC1CNC1 Amb25919428 [0,1,0,0,1,0|1,0,1]=4 4584 B6R1.6 O=CC1COC1 Amb21857829 [0,1,0,0,1,0|1,0,1]=4 4585 B6R1.6 O=NN1CCC1 Amb24407378 [0,1,0,0,1,0|1,0,0]=3 4586 B6R1.6 OCC1CCC1 Amb2686620 [0,1,0,0,1,0|0,0,2]=4 4587 B6R1.6 OCC1CCO1 Amb21960943 [0,1,0,0,1,0|0,0,2]=4 4588 B6R1.6 OC[C@H]1CCO1 Amb24559274 [0,1,0,0,1,0|0,0,2]=4 4589 B6R1.6 ON=C1CCC1 Amb2782887 [0,1,0,0,1,0|0,0,1]=3 4590 B6R1.6 ON=C1CSC1 Amb27789710 [0,1,0,0,1,0|1,0,1]=4 4591 B6R1.6 SCC1CCC1 Amb26511279 [0,1,0,0,1,0|0,1,1]=4 4592 B6R1.6 [C-]#[N+]C1CCC1 Amb19892422 [0,1,0,0,1,0|1,0,1]=4 4593 B6R1.10 CC1(Br)CCC1 Amb25951784 [0,1,0,0,1,0|1,0,1]=4 4594 B6R1.10 CC1(C)CCO1 Amb22737237 [0,1,0,0,1,0|1,0,1]=4 4595 B6R1.10 CC1(I)CCC1 Amb34137823 [0,1,0,0,1,0|1,0,1]=4 4596 B6R1.10 CC1(N)CCC1 Amb19888627 [0,1,0,0,1,0|1,0,1]=4 4597 B6R1.10 CC1(N)CCC1 Amb2786532 [0,1,0,0,1,0|1,0,1]=4 4598 B6R1.10 CC1(O)CCC1 Amb17940165 [0,1,0,0,1,0|0,0,2]=4 4599 B6R1.10 C[Si]1(C)CCC1 Amb19893737 [0,1,0,0,1,0|1,1,0]=4 4600 B6R1.10 C[Si]1(Cl)CCC1 Amb22001053 [0,1,0,0,1,0|1,1,0]=4 4601 B6R1.10 ClC1(Br)CCC1 Amb28057578 [0,1,0,0,1,0|1,0,1]=4 4602 B6R1.10 ClC1(Cl)CCC1 Amb25773991 [0,1,0,0,1,0|1,0,1]=4 4603 B6R1.10 N=S1(=O)CCC1 Amb31308363 [0,1,0,0,1,0|1,0,0]=3 4604 B6R1.10 O=S1(=O)CCC1 Amb13883572 [0,1,0,0,1,0|1,0,0]=3 4605 B6R1.10 O=S1(=O)CCN1 Amb9196967 [0,1,0,0,1,0|2,0,0]=4 4606 B8R1.2 BrC=C1CCCCC1 Amb22337534 [0,1,0,0,0,1|2,0,0]=4 4607 B8R1.2 BrCC1=CCCCC1 Amb23439167 [0,1,0,0,0,1|2,0,0]=4 4608 B8R1.2 BrCC1=CCOCC1 Amb24483111 [0,1,0,0,0,1|2,0,0]=4 4609 B8R1.2 BrCC1=COCCC1 Amb33335785 [0,1,0,0,0,1|1,0,0]=3 4610 B8R1.2 BrCC1=COCCO1 Amb29866238 [0,1,0,0,0,1|1,0,1]=4 4611 B8R1.2 BrCC1=NOCCO1 Amb27984826 [0,1,0,0,0,1|2,0,0]=4 4612 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,1,0,0,0,1|1,0,1]=4 4613 B8R1.2 BrCC1CCCOC1 Amb18178619 [0,1,0,0,0,1|1,0,1]=4 4614 B8R1.2 BrCC1CCOCO1 Amb28382346 [0,1,0,0,0,1|1,0,1]=4 4615 B8R1.2 BrCC1CNCCO1 Amb28205537 [0,1,0,0,0,1|1,0,1]=4 4616 B8R1.2 BrCC1CNCCO1 Amb32652610 [0,1,0,0,0,1|1,0,1]=4 4617 B8R1.2 BrCC1COCCO1 Amb18796390 [0,1,0,0,0,1|1,0,1]=4 4618 B8R1.2 BrCC1OCCCO1 Amb10576216 [0,1,0,0,0,1|1,0,1]=4 4619 B8R1.2 BrC[C@@H]1CCCCO1 Amb27793586 [0,1,0,0,0,1|1,0,1]=4 4620 B8R1.2 Br\C=C1\CCCOC1 Amb32656912 [0,1,0,0,0,1|1,0,0]=3 4621 B8R1.2 C#CC1=CCCCC1 Amb1102053 [0,1,0,0,0,1|2,0,0]=4 4622 B8R1.2 C#CC1=COCCC1 Amb33414889 [0,1,0,0,0,1|1,0,0]=3 4623 B8R1.2 C#CC1CCCCO1 Amb17673286 [0,1,0,0,0,1|1,0,1]=4 4624 B8R1.2 C#CC1CCCOC1 Amb33547093 [0,1,0,0,0,1|1,0,1]=4 4625 B8R1.2 C#CC1CNCCO1 Amb33169103 [0,1,0,0,0,1|1,0,1]=4 4626 B8R1.2 C=CC1=CCCCC1 Amb24387238 [0,1,0,0,0,1|2,0,0]=4 4627 B8R1.2 C=CC1=CCCNC1 Amb27173273 [0,1,0,0,0,1|2,0,0]=4 4628 B8R1.2 C=CC1=COCCC1 Amb25204352 [0,1,0,0,0,1|1,0,0]=3 4629 B8R1.2 C=CC1CCCCO1 Amb35672708 [0,1,0,0,0,1|1,0,1]=4 4630 B8R1.2 C=CC1CCCOC1 Amb25100920 [0,1,0,0,0,1|1,0,1]=4 4631 B8R1.2 C=CC1OCCCO1 Amb24725153 [0,1,0,0,0,1|1,0,1]=4 4632 B8R1.2 CC=C1CCCCC1 Amb8513433 [0,1,0,0,0,1|2,0,0]=4 4633 B8R1.2 CC=C1CCNCC1 Amb27188889 [0,1,0,0,0,1|2,0,0]=4 4634 B8R1.2 CC=C1CCOCC1 Amb27604314 [0,1,0,0,0,1|2,0,0]=4 4635 B8R1.2 CCC1=CCCCC1 Amb25337001 [0,1,0,0,0,1|2,0,0]=4 4636 B8R1.2 CCC1=CNCCC1 Amb27404529 [0,1,0,0,0,1|2,0,0]=4 4637 B8R1.2 CCC1=NCCCN1 Amb17670475 [0,1,0,0,0,1|2,0,0]=4 4638 B8R1.2 CCC1=NCCCS1 Amb26526830 [0,1,0,0,0,1|1,1,0]=4 4639 B8R1.2 CCC1CCCCO1 Amb2703732 [0,1,0,0,0,1|1,0,1]=4 4640 B8R1.2 CCC1CNCCO1 Amb13951287 [0,1,0,0,0,1|1,0,1]=4 4641 B8R1.2 CCC1CNCCO1 Amb6892218 [0,1,0,0,0,1|1,0,1]=4 4642 B8R1.2 CCC1NCCCO1 Amb17506192 [0,1,0,0,0,1|1,0,1]=4 4643 B8R1.2 CC[C@@H]1CNCCO1 Amb22736874 [0,1,0,0,0,1|1,0,1]=4 4644 B8R1.2 CC[C@@H]1CNCCO1 Amb34144519 [0,1,0,0,0,1|1,0,1]=4 4645 B8R1.2 CC[C@H]1CNCCO1 Amb20242973 [0,1,0,0,0,1|1,0,1]=4 4646 B8R1.2 CC[C@H]1CNCCO1 Amb22226505 [0,1,0,0,0,1|1,0,1]=4 4647 B8R1.2 CN=C1CCCCC1 Amb27838980 [0,1,0,0,0,1|2,0,0]=4 4648 B8R1.2 CNC1=NCCCC1 Amb23570622 [0,1,0,0,0,1|2,0,0]=4 4649 B8R1.2 CNC1=NCCCC1 Amb28934861 [0,1,0,0,0,1|2,0,0]=4 4650 B8R1.2 CNC1=NCCCN1 Amb27219635 [0,1,0,0,0,1|2,0,0]=4 4651 B8R1.2 CNC1=NCCCS1 Amb7762035 [0,1,0,0,0,1|1,1,0]=4 4652 B8R1.2 CNC1=NOCCC1 Amb27839021 [0,1,0,0,0,1|1,0,0]=3 4653 B8R1.2 CNC1CCCCO1 Amb26068497 [0,1,0,0,0,1|1,0,1]=4 4654 B8R1.2 CNC1CCCOC1 Amb18641845 [0,1,0,0,0,1|1,0,1]=4 4655 B8R1.2 CN[C@H]1CCCOC1 Amb26014588 [0,1,0,0,0,1|1,0,1]=4 4656 B8R1.2 COC1=CCCCC1 Amb10601667 [0,1,0,0,0,1|1,0,1]=4 4657 B8R1.2 COC1=CCNCC1 Amb27174213 [0,1,0,0,0,1|1,0,1]=4 4658 B8R1.2 COC1=CCOCC1 Amb21927983 [0,1,0,0,0,1|1,0,1]=4 4659 B8R1.2 COC1=NCCCC1 Amb2689803 [0,1,0,0,0,1|1,0,1]=4 4660 B8R1.2 COC1=NCCCN1 Amb27838826 [0,1,0,0,0,1|1,0,1]=4 4661 B8R1.2 COC1=NCCNC1 Amb33218461 [0,1,0,0,0,1|1,0,1]=4 4662 B8R1.2 COC1=NCCOC1 Amb25304653 [0,1,0,0,0,1|1,0,1]=4 4663 B8R1.2 COC1CCCCO1 Amb21955138 [0,1,0,0,0,1|0,0,2]=4 4664 B8R1.2 COC1CNCCO1 Amb20669241 [0,1,0,0,0,1|0,0,2]=4 4665 B8R1.2 CSC1=CCCCC1 Amb28316123 [0,1,0,0,0,1|1,1,0]=4 4666 B8R1.2 CSC1=NCCCN1 Amb1154745 [0,1,0,0,0,1|1,1,0]=4 4667 B8R1.2 CSC1=NCCCN1 Amb8490167 [0,1,0,0,0,1|1,1,0]=4 4668 B8R1.2 CSC1=NCCCS1 Amb2724845 [0,1,0,0,0,1|0,2,0]=4 4669 B8R1.2 CSC1=NCCSC1 Amb13883826 [0,1,0,0,0,1|1,1,0]=4 4670 B8R1.2 C\C=C1/CCCNC1 Amb31161500 [0,1,0,0,0,1|2,0,0]=4 4671 B8R1.2 C\N=C1/NCCCO1 Amb28282697 [0,1,0,0,0,1|1,0,0]=3 4672 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,1,0,0,0,1|1,0,0]=3 4673 B8R1.2 ClCC1=COCCO1 Amb28199866 [0,1,0,0,0,1|1,0,1]=4 4674 B8R1.2 ClCC1=CSCCO1 Amb27254189 [0,1,0,0,0,1|1,0,1]=4 4675 B8R1.2 ClCC1=NCCCN1 Amb27265563 [0,1,0,0,0,1|2,0,0]=4 4676 B8R1.2 ClCC1=NCCCN1 Amb32686526 [0,1,0,0,0,1|2,0,0]=4 4677 B8R1.2 ClCC1CCCCO1 Amb2723692 [0,1,0,0,0,1|1,0,1]=4 4678 B8R1.2 ClCC1CCCOC1 Amb1102676 [0,1,0,0,0,1|1,0,1]=4 4679 B8R1.2 ClCC1CCOCO1 Amb386984 [0,1,0,0,0,1|1,0,1]=4 4680 B8R1.2 ClCC1CNCCO1 Amb20668892 [0,1,0,0,0,1|1,0,1]=4 4681 B8R1.2 ClCC1CNCCO1 Amb26509697 [0,1,0,0,0,1|1,0,1]=4 4682 B8R1.2 ClCC1COCCO1 Amb6600554 [0,1,0,0,0,1|1,0,1]=4 4683 B8R1.2 ClCC1OCCCO1 Amb4035387 [0,1,0,0,0,1|1,0,1]=4 4684 B8R1.2 ClC[C@H]1CCCCO1 Amb27879106 [0,1,0,0,0,1|1,0,1]=4 4685 B8R1.2 ClC[C@H]1CNCCO1 Amb27642085 [0,1,0,0,0,1|1,0,1]=4 4686 B8R1.2 ClN=C1CCCCC1 Amb25069376 [0,1,0,0,0,1|2,0,0]=4 4687 B8R1.2 Cl\C=C1\CCOCO1 Amb26566005 [0,1,0,0,0,1|1,0,0]=3 4688 B8R1.2 FCC1CNCCO1 Amb27806605 [0,1,0,0,0,1|1,0,1]=4 4689 B8R1.2 FCC1CNCCO1 Amb28934920 [0,1,0,0,0,1|1,0,1]=4 4690 B8R1.2 ICC1CCCCO1 Amb24060887 [0,1,0,0,0,1|1,0,1]=4 4691 B8R1.2 ICC1CCOCO1 Amb19373646 [0,1,0,0,0,1|1,0,1]=4 4692 B8R1.2 ICC1COCCO1 Amb24061260 [0,1,0,0,0,1|1,0,1]=4 4693 B8R1.2 N#CC1=CCCCC1 Amb2720853 [0,1,0,0,0,1|2,0,0]=4 4694 B8R1.2 N#CC1=CCCCO1 Amb2700340 [0,1,0,0,0,1|1,0,0]=3 4695 B8R1.2 N#CC1=CCCNC1 Amb27838385 [0,1,0,0,0,1|2,0,0]=4 4696 B8R1.2 N#CC1=CCNCC1 Amb27220885 [0,1,0,0,0,1|2,0,0]=4 4697 B8R1.2 N#CC1=CCNCC1 Amb32701604 [0,1,0,0,0,1|2,0,0]=4 4698 B8R1.2 N#CC1=CCOCC1 Amb25277232 [0,1,0,0,0,1|2,0,0]=4 4699 B8R1.2 N#CC1=CNCCC1 Amb16191903 [0,1,0,0,0,1|2,0,0]=4 4700 B8R1.2 N#CC1=COCCC1 Amb19319238 [0,1,0,0,0,1|1,0,0]=3 4701 B8R1.2 N#CC1=COCCO1 Amb9677385 [0,1,0,0,0,1|1,0,1]=4 4702 B8R1.2 N#CC1CCCCO1 Amb26630839 [0,1,0,0,0,1|1,0,1]=4 4703 B8R1.2 N#CC1CCCOC1 Amb19148306 [0,1,0,0,0,1|1,0,1]=4 4704 B8R1.2 N#CC1CNCCO1 Amb10604011 [0,1,0,0,0,1|1,0,1]=4 4705 B8R1.2 N#CC1CNCCO1 Amb19373292 [0,1,0,0,0,1|1,0,1]=4 4706 B8R1.2 N#CC1COCCO1 Amb22002145 [0,1,0,0,0,1|1,0,1]=4 4707 B8R1.2 N#CC1CSCCO1 Amb20622840 [0,1,0,0,0,1|1,0,1]=4 4708 B8R1.2 N#C[C@@H]1CNCCO1 Amb33801913 [0,1,0,0,0,1|1,0,1]=4 4709 B8R1.2 N#C[C@H]1CNCCO1 Amb27445442 [0,1,0,0,0,1|1,0,1]=4 4710 B8R1.2 NCC1=CCCCC1 Amb10607847 [0,1,0,0,0,1|2,0,0]=4 4711 B8R1.2 NCC1=CCCCC1 Amb22587029 [0,1,0,0,0,1|2,0,0]=4 4712 B8R1.2 NCC1=CCCCO1 Amb33457505 [0,1,0,0,0,1|1,0,0]=3 4713 B8R1.2 NCC1=CCCCO1 Amb8009853 [0,1,0,0,0,1|1,0,0]=3 4714 B8R1.2 NCC1=CCCOC1 Amb24329061 [0,1,0,0,0,1|1,0,1]=4 4715 B8R1.2 NCC1=CCCOC1 Amb28934826 [0,1,0,0,0,1|1,0,1]=4 4716 B8R1.2 NCC1=CCNCC1 Amb26942552 [0,1,0,0,0,1|2,0,0]=4 4717 B8R1.2 NCC1=CCNCC1 Amb33483617 [0,1,0,0,0,1|2,0,0]=4 4718 B8R1.2 NCC1=CCOCC1 Amb24608110 [0,1,0,0,0,1|2,0,0]=4 4719 B8R1.2 NCC1=CCOCC1 Amb28934924 [0,1,0,0,0,1|2,0,0]=4 4720 B8R1.2 NCC1=COCCC1 Amb27202637 [0,1,0,0,0,1|1,0,0]=3 4721 B8R1.2 NCC1=COCCO1 Amb9677510 [0,1,0,0,0,1|1,0,1]=4 4722 B8R1.2 NCC1=NCCCN1 Amb13952559 [0,1,0,0,0,1|2,0,0]=4 4723 B8R1.2 NCC1=NCCCN1 Amb26861317 [0,1,0,0,0,1|2,0,0]=4 4724 B8R1.2 NCC1CCCCO1 Amb19372867 [0,1,0,0,0,1|1,0,1]=4 4725 B8R1.2 NCC1CCCCO1 Amb2723691 [0,1,0,0,0,1|1,0,1]=4 4726 B8R1.2 NCC1CCCOC1 Amb10603286 [0,1,0,0,0,1|1,0,1]=4 4727 B8R1.2 NCC1CCCOC1 Amb1092537 [0,1,0,0,0,1|1,0,1]=4 4728 B8R1.2 NCC1CCCOC1 Amb22492350 [0,1,0,0,0,1|1,0,1]=4 4729 B8R1.2 NCC1CCOCO1 Amb20669541 [0,1,0,0,0,1|1,0,1]=4 4730 B8R1.2 NCC1CCOCO1 Amb22157235 [0,1,0,0,0,1|1,0,1]=4 4731 B8R1.2 NCC1CNCCO1 Amb33538849 [0,1,0,0,0,1|1,0,1]=4 4732 B8R1.2 NCC1CNCCO1 Amb34912956 [0,1,0,0,0,1|1,0,1]=4 4733 B8R1.2 NCC1COCCO1 Amb1087841 [0,1,0,0,0,1|1,0,1]=4 4734 B8R1.2 NCC1COCCO1 Amb8503476 [0,1,0,0,0,1|1,0,1]=4 4735 B8R1.2 NCC1CSCCO1 Amb27852369 [0,1,0,0,0,1|1,0,1]=4 4736 B8R1.2 NCC1OCCCO1 Amb17226711 [0,1,0,0,0,1|1,0,1]=4 4737 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,1,0,0,0,1|1,0,1]=4 4738 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,1,0,0,0,1|1,0,1]=4 4739 B8R1.2 NC[C@@H]1CCCOC1 Amb25849361 [0,1,0,0,0,1|1,0,1]=4 4740 B8R1.2 NC[C@@H]1CCCOC1 Amb31028901 [0,1,0,0,0,1|1,0,1]=4 4741 B8R1.2 NC[C@@H]1COCCO1 Amb22406261 [0,1,0,0,0,1|1,0,1]=4 4742 B8R1.2 NC[C@@H]1COCCO1 Amb24704288 [0,1,0,0,0,1|1,0,1]=4 4743 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,1,0,0,0,1|1,0,1]=4 4744 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,1,0,0,0,1|1,0,1]=4 4745 B8R1.2 NC[C@H]1CCCOC1 Amb24483141 [0,1,0,0,0,1|1,0,1]=4 4746 B8R1.2 NC[C@H]1CCCOC1 Amb31028900 [0,1,0,0,0,1|1,0,1]=4 4747 B8R1.2 NC[C@H]1CNCCO1 Amb25197821 [0,1,0,0,0,1|1,0,1]=4 4748 B8R1.2 NC[C@H]1COCCO1 Amb22406262 [0,1,0,0,0,1|1,0,1]=4 4749 B8R1.2 NC[C@H]1COCCO1 Amb24686998 [0,1,0,0,0,1|1,0,1]=4 4750 B8R1.2 NN=C1CCCCC1 Amb26080931 [0,1,0,0,0,1|2,0,0]=4 4751 B8R1.2 NN=C1CCSCC1 Amb27852358 [0,1,0,0,0,1|2,0,0]=4 4752 B8R1.2 NNC1=CCCCC1 Amb27880817 [0,1,0,0,0,1|2,0,0]=4 4753 B8R1.2 NNC1=CCCCO1 Amb28125675 [0,1,0,0,0,1|1,0,0]=3 4754 B8R1.2 NNC1=NCCCN1 Amb10844744 [0,1,0,0,0,1|2,0,0]=4 4755 B8R1.2 NNC1=NCCCN1 Amb16231365 [0,1,0,0,0,1|2,0,0]=4 4756 B8R1.2 NNC1=NCCCN1 Amb3428877 [0,1,0,0,0,1|2,0,0]=4 4757 B8R1.2 NNC1=NCCCS1 Amb27839407 [0,1,0,0,0,1|1,1,0]=4 4758 B8R1.2 NNC1CCCOC1 Amb23412249 [0,1,0,0,0,1|1,0,1]=4 4759 B8R1.2 NNC1CCCOC1 Amb23412255 [0,1,0,0,0,1|1,0,1]=4 4760 B8R1.2 NOC1CCCCO1 Amb10975936 [0,1,0,0,0,1|0,0,2]=4 4761 B8R1.2 NOC1CCCOC1 Amb28134643 [0,1,0,0,0,1|0,0,2]=4 4762 B8R1.2 N\N=C1/COCCN1 Amb20667881 [0,1,0,0,0,1|2,0,0]=4 4763 B8R1.2 N\N=C1\CCCOC1 Amb27479462 [0,1,0,0,0,1|1,0,0]=3 4764 B8R1.2 N\N=C1\CCCSC1 Amb27407928 [0,1,0,0,0,1|1,1,0]=4 4765 B8R1.2 O=CC1=CCC=CO1 Amb27437201 [0,1,0,0,0,1|0,0,2]=4 4766 B8R1.2 O=CC1=CCCCC1 Amb33545149 [0,1,0,0,0,1|1,0,0]=3 4767 B8R1.2 O=CC1=CCCNC1 Amb27833007 [0,1,0,0,0,1|1,0,0]=3 4768 B8R1.2 O=CC1=CCCOC1 Amb1102766 [0,1,0,0,0,1|0,0,1]=3 4769 B8R1.2 O=CC1=CCCSC1 Amb18642670 [0,1,0,0,0,1|1,0,0]=3 4770 B8R1.2 O=CC1=CCOCC1 Amb18641683 [0,1,0,0,0,1|1,0,0]=3 4771 B8R1.2 O=CC1=COCCC1 Amb2433566 [0,1,0,0,0,1|0,0,0]=2 4772 B8R1.2 O=CC1=COCCO1 Amb2786548 [0,1,0,0,0,1|0,0,1]=3 4773 B8R1.2 O=CC1=CSCCC1 Amb28316147 [0,1,0,0,0,1|0,1,0]=3 4774 B8R1.2 O=CC1C=CCCC1 Amb18641614 [0,1,0,0,0,1|1,0,1]=4 4775 B8R1.2 O=CC1CCC=CO1 Amb3939141 [0,1,0,0,0,1|0,0,2]=4 4776 B8R1.2 O=CC1CCCCC1 Amb3939850 [0,1,0,0,0,1|1,0,1]=4 4777 B8R1.2 O=CC1CCCCN1 Amb20242687 [0,1,0,0,0,1|1,0,1]=4 4778 B8R1.2 O=CC1CCCCN1 Amb8384317 [0,1,0,0,0,1|1,0,1]=4 4779 B8R1.2 O=CC1CCCCO1 Amb8009759 [0,1,0,0,0,1|0,0,1]=3 4780 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,1,0,0,0,1|0,1,1]=4 4781 B8R1.2 O=CC1CCCNC1 Amb18833063 [0,1,0,0,0,1|1,0,1]=4 4782 B8R1.2 O=CC1CCCOC1 Amb8009553 [0,1,0,0,0,1|0,0,1]=3 4783 B8R1.2 O=CC1CCCSC1 Amb18642817 [0,1,0,0,0,1|0,1,1]=4 4784 B8R1.2 O=CC1CCNCC1 Amb16232416 [0,1,0,0,0,1|1,0,1]=4 4785 B8R1.2 O=CC1CCNCC1 Amb8630349 [0,1,0,0,0,1|1,0,1]=4 4786 B8R1.2 O=CC1CCOCC1 Amb2683355 [0,1,0,0,0,1|1,0,1]=4 4787 B8R1.2 O=CC1CCSCC1 Amb2683357 [0,1,0,0,0,1|1,0,1]=4 4788 B8R1.2 O=CC1COCCN1 Amb18833023 [0,1,0,0,0,1|1,0,1]=4 4789 B8R1.2 O=CC1COCCO1 Amb8011456 [0,1,0,0,0,1|0,0,1]=3 4790 B8R1.2 O=CN1C=CCCC1 Amb22371093 [0,1,0,0,0,1|2,0,0]=4 4791 B8R1.2 O=CN1CCCCC1 Amb2720341 [0,1,0,0,0,1|2,0,0]=4 4792 B8R1.2 O=CN1CCNCC1 Amb1663437 [0,1,0,0,0,1|2,0,0]=4 4793 B8R1.2 O=CN1CCOCC1 Amb2720735 [0,1,0,0,0,1|2,0,0]=4 4794 B8R1.2 O=CN1CCSCC1 Amb28254656 [0,1,0,0,0,1|2,0,0]=4 4795 B8R1.2 O=C[C@@H]1CCC=CO1 Amb28284610 [0,1,0,0,0,1|0,0,2]=4 4796 B8R1.2 O=C[C@@H]1CCCCN1 Amb27468660 [0,1,0,0,0,1|1,0,1]=4 4797 B8R1.2 O=C[C@@H]1CCCOC1 Amb27843270 [0,1,0,0,0,1|0,0,1]=3 4798 B8R1.2 O=C[C@H]1CCCCN1 Amb27203300 [0,1,0,0,0,1|1,0,1]=4 4799 B8R1.2 O=NN1CCCCC1 Amb10604043 [0,1,0,0,0,1|2,0,0]=4 4800 B8R1.2 O=NN1CCCCO1 Amb27472845 [0,1,0,0,0,1|1,0,0]=3 4801 B8R1.2 O=NN1CCCOC1 Amb26515732 [0,1,0,0,0,1|1,0,0]=3 4802 B8R1.2 O=NN1CCNCC1 Amb10976905 [0,1,0,0,0,1|2,0,0]=4 4803 B8R1.2 O=NN1CCOCC1 Amb8630843 [0,1,0,0,0,1|2,0,0]=4 4804 B8R1.2 O=NN1CCSCC1 Amb28340927 [0,1,0,0,0,1|2,0,0]=4 4805 B8R1.2 OCC1=CCCCC1 Amb24122911 [0,1,0,0,0,1|1,0,1]=4 4806 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,1,0,0,0,1|0,0,1]=3 4807 B8R1.2 OCC1=CCCOC1 Amb24329074 [0,1,0,0,0,1|0,0,2]=4 4808 B8R1.2 OCC1=CCOCC1 Amb27394889 [0,1,0,0,0,1|1,0,1]=4 4809 B8R1.2 OCC1=CCSCC1 Amb28189541 [0,1,0,0,0,1|1,0,1]=4 4810 B8R1.2 OCC1=COCCC1 Amb24426430 [0,1,0,0,0,1|0,0,1]=3 4811 B8R1.2 OCC1=COCCO1 Amb19319714 [0,1,0,0,0,1|0,0,2]=4 4812 B8R1.2 OCC1=NCCCN1 Amb28326118 [0,1,0,0,0,1|1,0,1]=4 4813 B8R1.2 OCC1=NOCCC1 Amb25675358 [0,1,0,0,0,1|0,0,1]=3 4814 B8R1.2 OCC1CCCCO1 Amb9703167 [0,1,0,0,0,1|0,0,2]=4 4815 B8R1.2 OCC1CCCOC1 Amb1093253 [0,1,0,0,0,1|0,0,2]=4 4816 B8R1.2 OCC1CNCCO1 Amb19957720 [0,1,0,0,0,1|0,0,2]=4 4817 B8R1.2 OCC1CNCCO1 Amb33546015 [0,1,0,0,0,1|0,0,2]=4 4818 B8R1.2 OCC1COCCO1 Amb10607696 [0,1,0,0,0,1|0,0,2]=4 4819 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,1,0,0,0,1|0,0,2]=4 4820 B8R1.2 OC[C@@H]1CCCOC1 Amb27236984 [0,1,0,0,0,1|0,0,2]=4 4821 B8R1.2 OC[C@@H]1CNCCO1 Amb10067152 [0,1,0,0,0,1|0,0,2]=4 4822 B8R1.2 OC[C@@H]1CNCCO1 Amb17933818 [0,1,0,0,0,1|0,0,2]=4 4823 B8R1.2 OC[C@@H]1COCCO1 Amb22752848 [0,1,0,0,0,1|0,0,2]=4 4824 B8R1.2 OC[C@H]1CCCCO1 Amb25873825 [0,1,0,0,0,1|0,0,2]=4 4825 B8R1.2 OC[C@H]1CCCOC1 Amb24413844 [0,1,0,0,0,1|0,0,2]=4 4826 B8R1.2 OC[C@H]1CNCCO1 Amb10067151 [0,1,0,0,0,1|0,0,2]=4 4827 B8R1.2 OC[C@H]1CNCCO1 Amb8630630 [0,1,0,0,0,1|0,0,2]=4 4828 B8R1.2 OC[C@H]1COCCO1 Amb25724377 [0,1,0,0,0,1|0,0,2]=4 4829 B8R1.2 ON=C1CCCCC1 Amb6364727 [0,1,0,0,0,1|1,0,1]=4 4830 B8R1.2 ON=C1CCNCC1 Amb16226328 [0,1,0,0,0,1|1,0,1]=4 4831 B8R1.2 ON=C1CCOCC1 Amb9173664 [0,1,0,0,0,1|1,0,1]=4 4832 B8R1.2 ON=C1CCSCC1 Amb2445012 [0,1,0,0,0,1|1,0,1]=4 4833 B8R1.2 ONC1=NCCOC1 Amb27962415 [0,1,0,0,0,1|1,0,1]=4 4834 B8R1.2 ONC1=NCCOC1 Amb33309983 [0,1,0,0,0,1|1,0,1]=4 4835 B8R1.2 ONC1CCCCO1 Amb27428911 [0,1,0,0,0,1|0,0,2]=4 4836 B8R1.2 O\N=C1/C=CCCC1 Amb28316146 [0,1,0,0,0,1|1,0,1]=4 4837 B8R1.2 O\N=C1/CNCCS1 Amb27838324 [0,1,0,0,0,1|0,1,1]=4 4838 B8R1.2 O\N=C1\CCCCN1 Amb4136429 [0,1,0,0,0,1|1,0,1]=4 4839 B8R1.2 SCC1=CCCOC1 Amb32788343 [0,1,0,0,0,1|0,1,1]=4 4840 B8R1.2 SCC1=COCCC1 Amb33319974 [0,1,0,0,0,1|0,1,0]=3 4841 B8R1.2 SCC1CCCCO1 Amb23585661 [0,1,0,0,0,1|0,1,1]=4 4842 B8R1.2 SCC1CCCOC1 Amb26590340 [0,1,0,0,0,1|0,1,1]=4 4843 B8R1.2 SCC1CNCCO1 Amb29855425 [0,1,0,0,0,1|0,1,1]=4 4844 B8R1.2 [C-]#[N+]C1=CCCCC1 Amb10603087 [0,1,0,0,0,1|2,0,0]=4 4845 B8R1.2 [C-]#[N+]C1CCCOC1 Amb33323212 [0,1,0,0,0,1|1,0,1]=4 4846 B8R1.3 C=C1CCC(=C)CC1 Amb22227744 [0,1,0,0,0,1|2,0,0]=4 4847 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,1,0,0,0,1|1,0,0]=3 4848 B8R1.3 C=C1CCC(C)CC1 Amb24058250 [0,1,0,0,0,1|2,0,0]=4 4849 B8R1.3 C=C1CCC(C)NC1 Amb27626150 [0,1,0,0,0,1|2,0,0]=4 4850 B8R1.3 C=C1CCC(C)OC1 Amb30011003 [0,1,0,0,0,1|1,0,0]=3 4851 B8R1.3 C=C1CCC(C)SC1 Amb35611382 [0,1,0,0,0,1|1,1,0]=4 4852 B8R1.3 C=C1CCC(N)CC1 Amb23599023 [0,1,0,0,0,1|2,0,0]=4 4853 B8R1.3 C=C1CCC(N)CC1 Amb33537570 [0,1,0,0,0,1|2,0,0]=4 4854 B8R1.3 C=C1CCC(O)CC1 Amb27603595 [0,1,0,0,0,1|2,0,0]=4 4855 B8R1.3 C=C1CCN(C)CC1 Amb19514532 [0,1,0,0,0,1|2,0,0]=4 4856 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,1,0,0,0,1|1,0,1]=4 4857 B8R1.3 CC1=CCC(C)CC1 Amb26354597 [0,1,0,0,0,1|2,0,0]=4 4858 B8R1.3 CC1=CC[C@@H](N)CC1 Amb27493017 [0,1,0,0,0,1|2,0,0]=4 4859 B8R1.3 CC1=CC[C@H](N)CC1 Amb28365931 [0,1,0,0,0,1|2,0,0]=4 4860 B8R1.3 CC1=NCC(C)CN1 Amb29877830 [0,1,0,0,0,1|2,0,0]=4 4861 B8R1.3 CC1=NNC(=O)CC1 Amb2606146 [0,1,0,0,0,1|1,0,1]=4 4862 B8R1.3 CC1C=CC(=O)CC1 Amb24556470 [0,1,0,0,0,1|1,0,0]=3 4863 B8R1.3 CC1CC=C(Cl)CC1 Amb27783557 [0,1,0,0,0,1|2,0,0]=4 4864 B8R1.3 CC1CCC(=O)CC1 Amb6608654 [0,1,0,0,0,1|1,0,0]=3 4865 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [0,1,0,0,0,1|1,0,0]=3 4866 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [0,1,0,0,0,1|1,0,0]=3 4867 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,1,0,0,0,1|0,0,0]=2 4868 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,1,0,0,0,1|0,1,0]=3 4869 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,1,0,0,0,1|1,0,0]=3 4870 B8R1.3 CC1CCC(=O)NN1 Amb27443930 [0,1,0,0,0,1|1,0,0]=3 4871 B8R1.3 CC1CCC(=O)OC1 Amb27667524 [0,1,0,0,0,1|0,0,0]=2 4872 B8R1.3 CC1CCC(N)CO1 Amb35709402 [0,1,0,0,0,1|1,0,1]=4 4873 B8R1.3 CC1CCC(O)CO1 Amb26381886 [0,1,0,0,0,1|0,0,2]=4 4874 B8R1.3 CC1CCC(O)OC1 Amb27835928 [0,1,0,0,0,1|0,0,2]=4 4875 B8R1.3 CC1CCC(S)CO1 Amb32788236 [0,1,0,0,0,1|0,1,1]=4 4876 B8R1.3 CC1CN=C(N)NC1 Amb24685625 [0,1,0,0,0,1|2,0,0]=4 4877 B8R1.3 CC1CN=C(N)NC1 Amb35747465 [0,1,0,0,0,1|2,0,0]=4 4878 B8R1.3 CC1CN=C(N)SC1 Amb25169567 [0,1,0,0,0,1|1,1,0]=4 4879 B8R1.3 CC1CN=C(O)NC1 Amb25268854 [0,1,0,0,0,1|1,0,1]=4 4880 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,1,0,0,0,1|1,0,0]=3 4881 B8R1.3 CC1CNC(=O)CN1 Amb34912937 [0,1,0,0,0,1|1,0,0]=3 4882 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,1,0,0,0,1|1,0,0]=3 4883 B8R1.3 CC1COC(C)CN1 Amb22751384 [0,1,0,0,0,1|1,0,1]=4 4884 B8R1.3 CC1COC(C)CN1 Amb6892608 [0,1,0,0,0,1|1,0,1]=4 4885 B8R1.3 CC1COC(C)CO1 Amb25738098 [0,1,0,0,0,1|1,0,1]=4 4886 B8R1.3 CC1COS(=O)OC1 Amb27785765 [0,1,0,0,0,1|1,0,0]=3 4887 B8R1.3 CC1OCC(=O)CO1 Amb28316125 [0,1,0,0,0,1|1,0,0]=3 4888 B8R1.3 CC1OCC(Cl)CO1 Amb26013356 [0,1,0,0,0,1|1,0,1]=4 4889 B8R1.3 CN1C=CC(=O)CC1 Amb17593148 [0,1,0,0,0,1|1,0,1]=4 4890 B8R1.3 CN1CC=C(Br)CC1 Amb22728686 [0,1,0,0,0,1|2,0,0]=4 4891 B8R1.3 CN1CC=C(I)CC1 Amb27879736 [0,1,0,0,0,1|2,0,0]=4 4892 B8R1.3 CN1CCC(=O)CC1 Amb2725656 [0,1,0,0,0,1|1,0,0]=3 4893 B8R1.3 CN1CCC(=S)CC1 Amb27830961 [0,1,0,0,0,1|1,1,0]=4 4894 B8R1.3 C[C@@H]1C=CC(=O)CC1 Amb28144188 [0,1,0,0,0,1|1,0,0]=3 4895 B8R1.3 C[C@@H]1CCC(=N)NC1 Amb27429397 [0,1,0,0,0,1|2,0,0]=4 4896 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,1,0,0,0,1|1,0,0]=3 4897 B8R1.3 C[C@@H]1CCC(=O)OC1 Amb26004046 [0,1,0,0,0,1|0,0,0]=2 4898 B8R1.3 C[C@@H]1CC[C@H](Br)CO1 Amb27656949 [0,1,0,0,0,1|1,0,1]=4 4899 B8R1.3 C[C@@H]1CC[C@H](Cl)CO1 Amb28076706 [0,1,0,0,0,1|1,0,1]=4 4900 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,1,0,0,0,1|1,0,0]=3 4901 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,1,0,0,0,1|1,0,0]=3 4902 B8R1.3 C[C@@H]1CNC(=O)CO1 Amb27470503 [0,1,0,0,0,1|1,0,0]=3 4903 B8R1.3 C[C@@H]1CO[C@H](C)CN1 Amb22745542 [0,1,0,0,0,1|1,0,1]=4 4904 B8R1.3 C[C@@H]1CO[C@H](C)CN1 Amb22747293 [0,1,0,0,0,1|1,0,1]=4 4905 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [0,1,0,0,0,1|1,0,0]=3 4906 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,1,0,0,0,1|1,0,0]=3 4907 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,1,0,0,0,1|1,0,0]=3 4908 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,1,0,0,0,1|1,0,0]=3 4909 B8R1.3 C[C@H]1CN[C@H](C)CO1 Amb26023229 [0,1,0,0,0,1|1,0,1]=4 4910 B8R1.3 C[C@H]1CO[C@@H](C)CN1 Amb24087467 [0,1,0,0,0,1|1,0,1]=4 4911 B8R1.3 C[C@H]1CO[C@@H](C)CN1 Amb27881537 [0,1,0,0,0,1|1,0,1]=4 4912 B8R1.3 C[C@H]1CO[C@H](C)CN1 Amb22745541 [0,1,0,0,0,1|1,0,1]=4 4913 B8R1.3 C[C@H]1OC[C@@H](O)CO1 Amb28350273 [0,1,0,0,0,1|1,0,1]=4 4914 B8R1.3 C[C@H]1OC[C@H](Br)CO1 Amb27983765 [0,1,0,0,0,1|1,0,1]=4 4915 B8R1.3 C[C@H]1OC[C@H](N)CO1 Amb28133674 [0,1,0,0,0,1|1,0,1]=4 4916 B8R1.3 NC1=NCC(O)CS1 Amb27630651 [0,1,0,0,0,1|1,1,0]=4 4917 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,1,0,0,0,1|1,0,0]=3 4918 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,1,0,0,0,1|1,0,0]=3 4919 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,1,0,0,0,1|1,0,0]=3 4920 B8R1.3 NC1CCC(=O)NC1 Amb18833034 [0,1,0,0,0,1|1,0,0]=3 4921 B8R1.3 NC1CCS(=O)CC1 Amb18943776 [0,1,0,0,0,1|2,0,0]=4 4922 B8R1.3 NC1CCS(=O)CC1 Amb21988665 [0,1,0,0,0,1|2,0,0]=4 4923 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb2699221 [0,1,0,0,0,1|1,0,0]=3 4924 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb27432343 [0,1,0,0,0,1|1,0,0]=3 4925 B8R1.3 N[C@H]1CCC(=O)NC1 Amb22748949 [0,1,0,0,0,1|1,0,0]=3 4926 B8R1.3 N[C@H]1CCC(=O)NC1 Amb2699220 [0,1,0,0,0,1|1,0,0]=3 4927 B8R1.3 O=C1C=CC(O)CC1 Amb28048996 [0,1,0,0,0,1|1,0,0]=3 4928 B8R1.3 O=C1C=CC(O)OC1 Amb17593180 [0,1,0,0,0,1|0,0,2]=4 4929 B8R1.3 O=C1C=CS(=O)CC1 Amb27948688 [0,1,0,0,0,1|1,0,1]=4 4930 B8R1.3 O=C1CCC(=O)CC1 Amb6471902 [0,1,0,0,0,1|1,0,0]=3 4931 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [0,1,0,0,0,1|1,0,0]=3 4932 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [0,1,0,0,0,1|1,0,1]=4 4933 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [0,1,0,0,0,1|0,0,0]=2 4934 B8R1.3 O=C1CCC(Br)CC1 Amb28342260 [0,1,0,0,0,1|1,0,0]=3 4935 B8R1.3 O=C1CCC(Cl)CC1 Amb26585218 [0,1,0,0,0,1|1,0,0]=3 4936 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,1,0,0,0,1|1,0,0]=3 4937 B8R1.3 O=C1CCC(I)CC1 Amb27232393 [0,1,0,0,0,1|1,0,0]=3 4938 B8R1.3 O=C1CCC(O)CC1 Amb2699831 [0,1,0,0,0,1|1,0,0]=3 4939 B8R1.3 O=C1CCC(O)CN1 Amb10066907 [0,1,0,0,0,1|1,0,0]=3 4940 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [0,1,0,0,0,1|0,0,0]=2 4941 B8R1.3 O=C1CCN(Cl)CC1 Amb27430526 [0,1,0,0,0,1|1,0,0]=3 4942 B8R1.3 O=C1CCS(=O)CC1 Amb2612398 [0,1,0,0,0,1|1,0,0]=3 4943 B8R1.3 O=C1CC[C@@H](O)CN1 Amb2698033 [0,1,0,0,0,1|1,0,0]=3 4944 B8R1.3 O=C1CC[C@H](O)CN1 Amb2698032 [0,1,0,0,0,1|1,0,0]=3 4945 B8R1.3 O=C1CNC(=O)CN1 Amb1011605 [0,1,0,0,0,1|1,0,1]=4 4946 B8R1.3 O=C1COC(=O)CN1 Amb2612815 [0,1,0,0,0,1|0,0,1]=3 4947 B8R1.3 O=C1COC(=O)CO1 Amb2725557 [0,1,0,0,0,1|0,0,1]=3 4948 B8R1.3 O=C1CSC(=O)SC1 Amb28074747 [0,1,0,0,0,1|0,1,1]=4 4949 B8R1.3 O=C1NCC(O)CN1 Amb19516674 [0,1,0,0,0,1|1,0,0]=3 4950 B8R1.3 O=C1NCC(O)CO1 Amb27210928 [0,1,0,0,0,1|0,0,0]=2 4951 B8R1.3 O=S1CCC(Cl)CC1 Amb21988466 [0,1,0,0,0,1|2,0,0]=4 4952 B8R1.3 O=S1CCC(O)CC1 Amb21988465 [0,1,0,0,0,1|2,0,0]=4 4953 B8R1.3 O=S1CCC(S)CC1 Amb32788878 [0,1,0,0,0,1|2,0,0]=4 4954 B8R1.3 OC1=NCC(O)CN1 Amb20001781 [0,1,0,0,0,1|1,0,1]=4 4955 B8R1.3 OC1CCC(Cl)CO1 Amb27232820 [0,1,0,0,0,1|0,0,2]=4 4956 B8R1.3 OC1CCC(O)OC1 Amb28349930 [0,1,0,0,0,1|0,0,2]=4 4957 B8R1.3 OC1CN=C(S)NC1 Amb28128371 [0,1,0,0,0,1|1,1,0]=4 4958 B8R1.3 OC1COC(O)CO1 Amb15691939 [0,1,0,0,0,1|0,0,2]=4 4959 B8R1.3 OC1CO[C@H](O)CO1 Amb28140398 [0,1,0,0,0,1|0,0,2]=4 4960 B8R1.3 S=C1NCC(Cl)CS1 Amb27758671 [0,1,0,0,0,1|0,2,0]=4 4961 B8R1.4 C=C1CCCC(=C)C1 Amb17940138 [0,1,0,0,0,1|2,0,0]=4 4962 B8R1.4 C=C1CCCC(=O)C1 Amb28132034 [0,1,0,0,0,1|1,0,0]=3 4963 B8R1.4 C=C1CCNC(C)C1 Amb29849450 [0,1,0,0,0,1|2,0,0]=4 4964 B8R1.4 C=C1CCOC(C)C1 Amb25235098 [0,1,0,0,0,1|1,0,1]=4 4965 B8R1.4 C=C1CNCC(C)C1 Amb35719512 [0,1,0,0,0,1|2,0,0]=4 4966 B8R1.4 C=C1COCC(O)C1 Amb27484750 [0,1,0,0,0,1|1,0,0]=3 4967 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,1,0,0,0,1|1,0,0]=3 4968 B8R1.4 CC1=CC(=O)CSC1 Amb28316129 [0,1,0,0,0,1|1,0,1]=4 4969 B8R1.4 CC1=CC(=O)NCC1 Amb27170325 [0,1,0,0,0,1|1,0,1]=4 4970 B8R1.4 CC1=CC(C)CCC1 Amb26410159 [0,1,0,0,0,1|2,0,0]=4 4971 B8R1.4 CC1=CC(C)CNC1 Amb25757457 [0,1,0,0,0,1|2,0,0]=4 4972 B8R1.4 CC1=CC(C)CNC1 Amb28934871 [0,1,0,0,0,1|2,0,0]=4 4973 B8R1.4 CC1=CC(C)OCC1 Amb17689157 [0,1,0,0,0,1|2,0,0]=4 4974 B8R1.4 CC1=CC(Cl)CCC1 Amb27860262 [0,1,0,0,0,1|2,0,0]=4 4975 B8R1.4 CC1=CC(Cl)CNC1 Amb32989055 [0,1,0,0,0,1|2,0,0]=4 4976 B8R1.4 CC1=CC(N)CNC1 Amb32989560 [0,1,0,0,0,1|2,0,0]=4 4977 B8R1.4 CC1=CC(O)CCC1 Amb10844732 [0,1,0,0,0,1|2,0,0]=4 4978 B8R1.4 CC1=CC(O)CNC1 Amb32989170 [0,1,0,0,0,1|2,0,0]=4 4979 B8R1.4 CC1=CCCC(=O)C1 Amb27661853 [0,1,0,0,0,1|1,0,1]=4 4980 B8R1.4 CC1=CCCC(=O)N1 Amb27949580 [0,1,0,0,0,1|1,0,1]=4 4981 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,1,0,0,0,1|0,0,1]=3 4982 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,1,0,0,0,1|0,0,2]=4 4983 B8R1.4 CC1=C[C@@H](O)CCC1 Amb27466476 [0,1,0,0,0,1|2,0,0]=4 4984 B8R1.4 CC1=NC(=O)CCC1 Amb28239945 [0,1,0,0,0,1|1,0,0]=3 4985 B8R1.4 CC1=NC(C)CCC1 Amb27589065 [0,1,0,0,0,1|2,0,0]=4 4986 B8R1.4 CC1CC(=O)C=CN1 Amb28423365 [0,1,0,0,0,1|1,0,1]=4 4987 B8R1.4 CC1CC(=O)C=CO1 Amb25173826 [0,1,0,0,0,1|1,0,1]=4 4988 B8R1.4 CC1CC(=O)CCN1 Amb1087926 [0,1,0,0,0,1|1,0,0]=3 4989 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,1,0,0,0,1|1,0,0]=3 4990 B8R1.4 CC1CC(=O)CCN1 Amb30585094 [0,1,0,0,0,1|1,0,0]=3 4991 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,1,0,0,0,1|1,0,0]=3 4992 B8R1.4 CC1CC(=O)CCS1 Amb27256424 [0,1,0,0,0,1|1,0,0]=3 4993 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [0,1,0,0,0,1|1,0,1]=4 4994 B8R1.4 CC1CC(Cl)CCO1 Amb26046391 [0,1,0,0,0,1|1,0,1]=4 4995 B8R1.4 CC1CC(N)CCO1 Amb22059408 [0,1,0,0,0,1|1,0,1]=4 4996 B8R1.4 CC1CC(N)CCO1 Amb33715162 [0,1,0,0,0,1|1,0,1]=4 4997 B8R1.4 CC1CC(O)CCO1 Amb22757197 [0,1,0,0,0,1|1,0,1]=4 4998 B8R1.4 CC1CC(S)CCO1 Amb26515745 [0,1,0,0,0,1|1,0,1]=4 4999 B8R1.4 CC1CC=CC(=O)C1 Amb4034490 [0,1,0,0,0,1|1,0,0]=3 5000 B8R1.4 CC1CC=CC(=O)N1 Amb27788159 [0,1,0,0,0,1|1,0,1]=4 5001 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,1,0,0,0,1|0,0,1]=3 5002 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,1,0,0,0,1|1,0,0]=3 5003 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,1,0,0,0,1|1,0,0]=3 5004 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,1,0,0,0,1|0,0,0]=2 5005 B8R1.4 CC1CCN=C(N)S1 Amb22228568 [0,1,0,0,0,1|1,1,0]=4 5006 B8R1.4 CC1CCNC(=O)C1 Amb20668125 [0,1,0,0,0,1|1,0,0]=3 5007 B8R1.4 CC1CCNC(=O)N1 Amb27193730 [0,1,0,0,0,1|1,0,0]=3 5008 B8R1.4 CC1CCNC(=S)N1 Amb27838373 [0,1,0,0,0,1|1,1,0]=4 5009 B8R1.4 CC1CCNC(C)O1 Amb33193276 [0,1,0,0,0,1|1,0,1]=4 5010 B8R1.4 CC1CCNC(N)=N1 Amb25879219 [0,1,0,0,0,1|2,0,0]=4 5011 B8R1.4 CC1CCNC(N)=N1 Amb35747071 [0,1,0,0,0,1|2,0,0]=4 5012 B8R1.4 CC1CCOC(=O)N1 Amb27655650 [0,1,0,0,0,1|0,0,0]=2 5013 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [0,1,0,0,0,1|0,0,0]=2 5014 B8R1.4 CC1CCOC(C)N1 Amb33194285 [0,1,0,0,0,1|1,0,1]=4 5015 B8R1.4 CC1CCOC(C)O1 Amb4017488 [0,1,0,0,0,1|1,0,1]=4 5016 B8R1.4 CC1CCOC(I)C1 Amb32419164 [0,1,0,0,0,1|1,0,1]=4 5017 B8R1.4 CC1CCOS(=O)O1 Amb4010773 [0,1,0,0,0,1|1,0,0]=3 5018 B8R1.4 CC1CN(N)CCO1 Amb18559327 [0,1,0,0,0,1|1,0,1]=4 5019 B8R1.4 CC1CNCC(=O)C1 Amb26048394 [0,1,0,0,0,1|1,0,0]=3 5020 B8R1.4 CC1CNCC(=O)C1 Amb33494302 [0,1,0,0,0,1|1,0,0]=3 5021 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,1,0,0,0,1|1,0,0]=3 5022 B8R1.4 CC1CNCC(=O)N1 Amb32410668 [0,1,0,0,0,1|1,0,0]=3 5023 B8R1.4 CC1CNCC(C)O1 Amb5716863 [0,1,0,0,0,1|1,0,1]=4 5024 B8R1.4 CC1CNNC(=O)C1 Amb27800916 [0,1,0,0,0,1|1,0,0]=3 5025 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,1,0,0,0,1|1,0,0]=3 5026 B8R1.4 CC1COCC(C)O1 Amb26515760 [0,1,0,0,0,1|1,0,1]=4 5027 B8R1.4 CC1CS(=O)CCN1 Amb18124392 [0,1,0,0,0,1|2,0,0]=4 5028 B8R1.4 CC1CSCC(C)O1 Amb4016354 [0,1,0,0,0,1|1,0,1]=4 5029 B8R1.4 CC1NCCC(=O)N1 Amb32418334 [0,1,0,0,0,1|1,0,0]=3 5030 B8R1.4 CN1CC=CC(=O)C1 Amb27186211 [0,1,0,0,0,1|1,0,1]=4 5031 B8R1.4 CN1CCC=C(Br)C1 Amb10975875 [0,1,0,0,0,1|2,0,0]=4 5032 B8R1.4 CN1CCC=C(Br)C1 Amb13888761 [0,1,0,0,0,1|2,0,0]=4 5033 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,1,0,0,0,1|1,0,0]=3 5034 B8R1.4 CN1CCCC(=O)C1 Amb22304741 [0,1,0,0,0,1|1,0,0]=3 5035 B8R1.4 CN1CCCC(=O)C1 Amb31204623 [0,1,0,0,0,1|1,0,0]=3 5036 B8R1.4 CN1CCNC(=O)C1 Amb19958159 [0,1,0,0,0,1|1,0,0]=3 5037 B8R1.4 CN1CCOC(=O)C1 Amb21963307 [0,1,0,0,0,1|0,0,0]=2 5038 B8R1.4 CN1CCOC(=O)C1 Amb22491652 [0,1,0,0,0,1|0,0,0]=2 5039 B8R1.4 C[C@@H]1CC(=O)C=CO1 Amb22748948 [0,1,0,0,0,1|1,0,1]=4 5040 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,1,0,0,0,1|1,0,0]=3 5041 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,1,0,0,0,1|1,0,0]=3 5042 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb27593729 [0,1,0,0,0,1|1,0,0]=3 5043 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,1,0,0,0,1|1,0,0]=3 5044 B8R1.4 C[C@@H]1CC=CC(=O)C1 Amb27762503 [0,1,0,0,0,1|1,0,0]=3 5045 B8R1.4 C[C@@H]1CCCC(=O)C1 Amb21618704 [0,1,0,0,0,1|1,0,0]=3 5046 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,1,0,0,0,1|1,0,0]=3 5047 B8R1.4 C[C@@H]1CCCC(=O)O1 Amb4166295 [0,1,0,0,0,1|0,0,0]=2 5048 B8R1.4 C[C@@H]1CCO[C@@H](O)C1 Amb27854200 [0,1,0,0,0,1|0,0,2]=4 5049 B8R1.4 C[C@@H]1CCO[C@H](O)C1 Amb27484825 [0,1,0,0,0,1|0,0,2]=4 5050 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,1,0,0,0,1|1,0,0]=3 5051 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,1,0,0,0,1|1,0,0]=3 5052 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22745550 [0,1,0,0,0,1|1,0,1]=4 5053 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,1,0,0,0,1|1,0,0]=3 5054 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [0,1,0,0,0,1|1,0,1]=4 5055 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [0,1,0,0,0,1|1,0,1]=4 5056 B8R1.4 C[C@H]1CC(=O)C=CO1 Amb24483279 [0,1,0,0,0,1|1,0,1]=4 5057 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,1,0,0,0,1|1,0,0]=3 5058 B8R1.4 C[C@H]1CC(=O)CCN1 Amb28072876 [0,1,0,0,0,1|1,0,0]=3 5059 B8R1.4 C[C@H]1CC(=O)CCN1 Amb33801725 [0,1,0,0,0,1|1,0,0]=3 5060 B8R1.4 C[C@H]1CC(=O)CCO1 Amb27969730 [0,1,0,0,0,1|1,0,0]=3 5061 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,1,0,0,0,1|0,0,1]=3 5062 B8R1.4 C[C@H]1CCCC(=O)C1 Amb22799724 [0,1,0,0,0,1|1,0,0]=3 5063 B8R1.4 C[C@H]1CCCC(=O)O1 Amb26865751 [0,1,0,0,0,1|0,0,0]=2 5064 B8R1.4 C[C@H]1CCCC(O)O1 Amb28206458 [0,1,0,0,0,1|0,0,2]=4 5065 B8R1.4 C[C@H]1CCNC(=O)C1 Amb25739591 [0,1,0,0,0,1|1,0,0]=3 5066 B8R1.4 C[C@H]1CCO[C@@H](O)C1 Amb28197437 [0,1,0,0,0,1|0,0,2]=4 5067 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,1,0,0,0,1|1,0,0]=3 5068 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,1,0,0,0,1|1,0,0]=3 5069 B8R1.4 C[C@H]1CNC[C@@H](C)O1 Amb33719087 [0,1,0,0,0,1|1,0,1]=4 5070 B8R1.4 C[C@H]1CNC[C@@H](C)O1 Amb3939625 [0,1,0,0,0,1|1,0,1]=4 5071 B8R1.4 C[C@H]1CNC[C@H](C)O1 Amb22406103 [0,1,0,0,0,1|1,0,1]=4 5072 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,1,0,0,0,1|1,0,0]=3 5073 B8R1.4 C[C@H]1CS(=O)CCN1 Amb27866032 [0,1,0,0,0,1|2,0,0]=4 5074 B8R1.4 C[C@H]1C[C@@H](O)CCO1 Amb26549571 [0,1,0,0,0,1|1,0,1]=4 5075 B8R1.4 C[C@H]1C[C@H](O)CCO1 Amb26891979 [0,1,0,0,0,1|1,0,1]=4 5076 B8R1.4 ClC1COCC(Cl)O1 Amb27956060 [0,1,0,0,0,1|1,0,1]=4 5077 B8R1.4 Cl[C@H]1CSC[C@@H](Cl)O1 Amb27650655 [0,1,0,0,0,1|1,0,1]=4 5078 B8R1.4 N=C1CCSC(=O)N1 Amb28434696 [0,1,0,0,0,1|0,1,1]=4 5079 B8R1.4 N=C1NC(=O)CCS1 Amb24666714 [0,1,0,0,0,1|1,0,1]=4 5080 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,1,0,0,0,1|1,0,0]=3 5081 B8R1.4 NC1=CC(=O)COC1 Amb25785409 [0,1,0,0,0,1|0,0,2]=4 5082 B8R1.4 NC1=CC(=O)CSC1 Amb28066865 [0,1,0,0,0,1|1,0,1]=4 5083 B8R1.4 NC1=CC(=O)NCC1 Amb22229455 [0,1,0,0,0,1|1,0,1]=4 5084 B8R1.4 NC1=CC(=S)CCC1 Amb27839581 [0,1,0,0,0,1|1,1,0]=4 5085 B8R1.4 NC1=CC(O)CCC1 Amb28127332 [0,1,0,0,0,1|2,0,0]=4 5086 B8R1.4 NC1=NC(O)CCS1 Amb27838375 [0,1,0,0,0,1|1,1,0]=4 5087 B8R1.4 NC1CCCC(=O)C1 Amb23440459 [0,1,0,0,0,1|1,0,0]=3 5088 B8R1.4 NC1CCCC(=O)C1 Amb8387391 [0,1,0,0,0,1|1,0,0]=3 5089 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,1,0,0,0,1|1,0,0]=3 5090 B8R1.4 NC1CCNC(=O)C1 Amb19957631 [0,1,0,0,0,1|1,0,0]=3 5091 B8R1.4 NC1CCNC(=O)C1 Amb21960626 [0,1,0,0,0,1|1,0,0]=3 5092 B8R1.4 NC1COCC(=O)C1 Amb33623050 [0,1,0,0,0,1|0,0,0]=2 5093 B8R1.4 NC1COCC(=O)C1 Amb33716160 [0,1,0,0,0,1|0,0,0]=2 5094 B8R1.4 NC1COCC(F)C1 Amb33716161 [0,1,0,0,0,1|1,0,1]=4 5095 B8R1.4 NC1COCC(O)C1 Amb24526934 [0,1,0,0,0,1|0,0,2]=4 5096 B8R1.4 NC1COCC(O)C1 Amb31291238 [0,1,0,0,0,1|0,0,2]=4 5097 B8R1.4 N[C@@H]1CCCS(=O)C1 Amb25168909 [0,1,0,0,0,1|2,0,0]=4 5098 B8R1.4 N[C@@H]1CCNC(=O)C1 Amb27489147 [0,1,0,0,0,1|1,0,0]=3 5099 B8R1.4 N[C@H]1CCCS(=O)C1 Amb27838286 [0,1,0,0,0,1|2,0,0]=4 5100 B8R1.4 N[C@H]1CCNC(=O)C1 Amb25168718 [0,1,0,0,0,1|1,0,0]=3 5101 B8R1.4 N[C@H]1COC[C@H](O)C1 Amb26008196 [0,1,0,0,0,1|0,0,2]=4 5102 B8R1.4 O=C1C=C(Br)CCC1 Amb33542768 [0,1,0,0,0,1|1,0,0]=3 5103 B8R1.4 O=C1C=C(Br)CCN1 Amb23402186 [0,1,0,0,0,1|1,0,1]=4 5104 B8R1.4 O=C1C=C(Cl)CCC1 Amb2697044 [0,1,0,0,0,1|1,0,0]=3 5105 B8R1.4 O=C1C=C(I)CCC1 Amb25706767 [0,1,0,0,0,1|1,0,0]=3 5106 B8R1.4 O=C1C=C(O)CCC1 Amb17844413 [0,1,0,0,0,1|1,0,0]=3 5107 B8R1.4 O=C1C=C(O)COC1 Amb28048998 [0,1,0,0,0,1|0,0,2]=4 5108 B8R1.4 O=C1C=CCC(=O)O1 Amb453190 [0,1,0,0,0,1|0,0,2]=4 5109 B8R1.4 O=C1C=CCC(O)C1 Amb27227199 [0,1,0,0,0,1|1,0,0]=3 5110 B8R1.4 O=C1C=COC(=O)C1 Amb25358147 [0,1,0,0,0,1|0,0,2]=4 5111 B8R1.4 O=C1C=[N+]([O-])CCC1 Amb27751417 [0,1,0,0,0,1|1,0,0]=3 5112 B8R1.4 O=C1CC(=O)NCN1 Amb27949946 [0,1,0,0,0,1|1,0,1]=4 5113 B8R1.4 O=C1CC(F)CCN1 Amb27459538 [0,1,0,0,0,1|1,0,0]=3 5114 B8R1.4 O=C1CC(O)CCN1 Amb10602744 [0,1,0,0,0,1|1,0,0]=3 5115 B8R1.4 O=C1CC(S)NCN1 Amb28245543 [0,1,0,0,0,1|1,0,0]=3 5116 B8R1.4 O=C1CCCC(=O)C1 Amb932798 [0,1,0,0,0,1|1,0,0]=3 5117 B8R1.4 O=C1CCCC(=O)N1 Amb8386485 [0,1,0,0,0,1|1,0,0]=3 5118 B8R1.4 O=C1CCCC(=O)O1 Amb6608952 [0,1,0,0,0,1|0,0,0]=2 5119 B8R1.4 O=C1CCCC(=O)S1 Amb27849467 [0,1,0,0,0,1|0,1,0]=3 5120 B8R1.4 O=C1CCCC(Br)C1 Amb27850962 [0,1,0,0,0,1|1,0,0]=3 5121 B8R1.4 O=C1CCCC(Cl)C1 Amb26946112 [0,1,0,0,0,1|1,0,0]=3 5122 B8R1.4 O=C1CCCC(Cl)N1 Amb28423467 [0,1,0,0,0,1|1,0,0]=3 5123 B8R1.4 O=C1CCCC(F)C1 Amb24578309 [0,1,0,0,0,1|1,0,0]=3 5124 B8R1.4 O=C1CCCC(I)C1 Amb24436778 [0,1,0,0,0,1|1,0,0]=3 5125 B8R1.4 O=C1CCCC(O)C1 Amb22754759 [0,1,0,0,0,1|1,0,0]=3 5126 B8R1.4 O=C1CCCC(O)N1 Amb26394230 [0,1,0,0,0,1|1,0,0]=3 5127 B8R1.4 O=C1CCC[C@@H](O)C1 Amb25320136 [0,1,0,0,0,1|1,0,0]=3 5128 B8R1.4 O=C1CCC[C@H](O)C1 Amb27432456 [0,1,0,0,0,1|1,0,0]=3 5129 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,1,0,0,0,1|1,0,0]=3 5130 B8R1.4 O=C1CCNC(=O)N1 Amb1042477 [0,1,0,0,0,1|1,0,1]=4 5131 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,1,0,0,0,1|0,0,1]=3 5132 B8R1.4 O=C1CCNC(=O)S1 Amb27786235 [0,1,0,0,0,1|0,1,1]=4 5133 B8R1.4 O=C1CCOC(=O)C1 Amb26459895 [0,1,0,0,0,1|0,0,0]=2 5134 B8R1.4 O=C1CCSC(=O)N1 Amb1150323 [0,1,0,0,0,1|0,1,1]=4 5135 B8R1.4 O=C1CNCC(=O)C1 Amb26464137 [0,1,0,0,0,1|1,0,1]=4 5136 B8R1.4 O=C1CNCC(=O)N1 Amb18641768 [0,1,0,0,0,1|1,0,1]=4 5137 B8R1.4 O=C1CNCC(=O)N1 Amb19148314 [0,1,0,0,0,1|1,0,1]=4 5138 B8R1.4 O=C1CNCC(=O)S1 Amb27390859 [0,1,0,0,0,1|0,1,1]=4 5139 B8R1.4 O=C1COCC(=O)C1 Amb8392404 [0,1,0,0,0,1|0,0,1]=3 5140 B8R1.4 O=C1COCC(=O)N1 Amb10808497 [0,1,0,0,0,1|1,0,1]=4 5141 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,1,0,0,0,1|0,0,1]=3 5142 B8R1.4 O=C1CS(=O)CCN1 Amb27184590 [0,1,0,0,0,1|1,0,0]=3 5143 B8R1.4 O=C1CSCC(=O)C1 Amb2499999 [0,1,0,0,0,1|0,1,1]=4 5144 B8R1.4 O=C1CSCC(=O)N1 Amb7173003 [0,1,0,0,0,1|1,0,1]=4 5145 B8R1.4 O=C1CSCC(=O)O1 Amb2725405 [0,1,0,0,0,1|0,0,1]=3 5146 B8R1.4 O=C1C[C@@H](O)CCN1 Amb22744924 [0,1,0,0,0,1|1,0,0]=3 5147 B8R1.4 O=C1C[C@H](O)CCN1 Amb17845212 [0,1,0,0,0,1|1,0,0]=3 5148 B8R1.4 O=C1NC(=S)CCS1 Amb2470197 [0,1,0,0,0,1|0,1,1]=4 5149 B8R1.4 O=S1CCCC(Br)C1 Amb26370333 [0,1,0,0,0,1|2,0,0]=4 5150 B8R1.4 O=S1CCCC(Cl)C1 Amb27876412 [0,1,0,0,0,1|2,0,0]=4 5151 B8R1.4 O=S1CCCC(O)C1 Amb26354128 [0,1,0,0,0,1|2,0,0]=4 5152 B8R1.4 O=S1CCCS(=O)C1 Amb22363746 [0,1,0,0,0,1|1,1,0]=4 5153 B8R1.4 O=S1CCC[C@H](O)C1 Amb28206445 [0,1,0,0,0,1|2,0,0]=4 5154 B8R1.4 OC1C=C(Cl)CCC1 Amb28138656 [0,1,0,0,0,1|2,0,0]=4 5155 B8R1.4 OC1CSCC(O)O1 Amb27853179 [0,1,0,0,0,1|0,0,2]=4 5156 B8R1.4 OC1C[C@H](O)CCO1 Amb27261550 [0,1,0,0,0,1|0,0,2]=4 5157 B8R1.4 O[C@@H]1CCC[C@H](O)O1 Amb27166854 [0,1,0,0,0,1|0,0,2]=4 5158 B8R1.4 O[C@H]1C=C(Br)CCC1 Amb27980419 [0,1,0,0,0,1|2,0,0]=4 5159 B8R1.5 BrC1=CCCCC1Br Amb25255682 [0,1,0,0,0,1|2,0,0]=4 5160 B8R1.5 BrC1CCCOC1Br Amb17940346 [0,1,0,0,0,1|1,0,1]=4 5161 B8R1.5 BrC1CCOCC1Br Amb29848082 [0,1,0,0,0,1|1,0,1]=4 5162 B8R1.5 C=C1CCCCC1=C Amb8392110 [0,1,0,0,0,1|2,0,0]=4 5163 B8R1.5 C=C1CCCCC1=O Amb18561347 [0,1,0,0,0,1|1,0,0]=3 5164 B8R1.5 C=C1CCCCC1C Amb25203919 [0,1,0,0,0,1|2,0,0]=4 5165 B8R1.5 C=C1CCCCC1Cl Amb27858823 [0,1,0,0,0,1|2,0,0]=4 5166 B8R1.5 C=C1CCCCC1O Amb28316215 [0,1,0,0,0,1|2,0,0]=4 5167 B8R1.5 C=C1CCCC[C@@H]1N Amb27252272 [0,1,0,0,0,1|2,0,0]=4 5168 B8R1.5 C=C1COCCC1=O Amb18063600 [0,1,0,0,0,1|1,0,0]=3 5169 B8R1.5 C=C1NCCCC1F Amb28384341 [0,1,0,0,0,1|2,0,0]=4 5170 B8R1.5 CC1=C(Br)CNCC1 Amb25046045 [0,1,0,0,0,1|2,0,0]=4 5171 B8R1.5 CC1=C(Br)CNCC1 Amb33473572 [0,1,0,0,0,1|2,0,0]=4 5172 B8R1.5 CC1=C(C)CCCC1 Amb4019565 [0,1,0,0,0,1|2,0,0]=4 5173 B8R1.5 CC1=C(C)CNCC1 Amb18641667 [0,1,0,0,0,1|2,0,0]=4 5174 B8R1.5 CC1=C(C)CNCC1 Amb28934860 [0,1,0,0,0,1|2,0,0]=4 5175 B8R1.5 CC1=C(C)NCCC1 Amb27489342 [0,1,0,0,0,1|2,0,0]=4 5176 B8R1.5 CC1=CCCCC1=O Amb15693479 [0,1,0,0,0,1|1,0,0]=3 5177 B8R1.5 CC1=CCCCC1Br Amb27856502 [0,1,0,0,0,1|2,0,0]=4 5178 B8R1.5 CC1=CCCCC1C Amb22489910 [0,1,0,0,0,1|2,0,0]=4 5179 B8R1.5 CC1=CCCCC1Cl Amb28207840 [0,1,0,0,0,1|2,0,0]=4 5180 B8R1.5 CC1=CCCCC1O Amb22365276 [0,1,0,0,0,1|2,0,0]=4 5181 B8R1.5 CC1=CCOCC1O Amb28411303 [0,1,0,0,0,1|2,0,0]=4 5182 B8R1.5 CC1=COCCC1=O Amb28048981 [0,1,0,0,0,1|1,0,1]=4 5183 B8R1.5 CC1=NCCCC1=O Amb27803670 [0,1,0,0,0,1|1,0,0]=3 5184 B8R1.5 CC1=NCCCN1C Amb1035887 [0,1,0,0,0,1|2,0,0]=4 5185 B8R1.5 CC1=NCCOC1=O Amb27623377 [0,1,0,0,0,1|0,0,1]=3 5186 B8R1.5 CC1CC=CCC1=O Amb17593140 [0,1,0,0,0,1|1,0,1]=4 5187 B8R1.5 CC1CC=NNC1=O Amb22752103 [0,1,0,0,0,1|1,0,1]=4 5188 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,1,0,0,0,1|1,0,0]=3 5189 B8R1.5 CC1CCCCC1=O Amb6608749 [0,1,0,0,0,1|1,0,0]=3 5190 B8R1.5 CC1CCCN=C1N Amb26551145 [0,1,0,0,0,1|2,0,0]=4 5191 B8R1.5 CC1CCCNC1=O Amb2778949 [0,1,0,0,0,1|1,0,0]=3 5192 B8R1.5 CC1CCCOC1=O Amb26933974 [0,1,0,0,0,1|0,0,0]=2 5193 B8R1.5 CC1CCCOC1O Amb28207170 [0,1,0,0,0,1|0,0,2]=4 5194 B8R1.5 CC1CCNCC1=O Amb28990014 [0,1,0,0,0,1|1,0,0]=3 5195 B8R1.5 CC1CCNCC1=O Amb8388554 [0,1,0,0,0,1|1,0,0]=3 5196 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,0,0,1|0,0,0]=2 5197 B8R1.5 CC1CNCCC1=O Amb19888361 [0,1,0,0,0,1|1,0,0]=3 5198 B8R1.5 CC1CNCCC1=O Amb8393082 [0,1,0,0,0,1|1,0,0]=3 5199 B8R1.5 CC1CNCCS1=O Amb19515549 [0,1,0,0,0,1|2,0,0]=4 5200 B8R1.5 CC1COC=CC1=O Amb28124249 [0,1,0,0,0,1|1,0,1]=4 5201 B8R1.5 CC1COCCC1=O Amb21856147 [0,1,0,0,0,1|1,0,0]=3 5202 B8R1.5 CC1COCCC1Br Amb27242904 [0,1,0,0,0,1|1,0,1]=4 5203 B8R1.5 CC1COCCC1N Amb18833016 [0,1,0,0,0,1|1,0,1]=4 5204 B8R1.5 CC1COCCC1N Amb28934837 [0,1,0,0,0,1|1,0,1]=4 5205 B8R1.5 CC1COCCC1O Amb22299437 [0,1,0,0,0,1|1,0,1]=4 5206 B8R1.5 CC1COCCC1S Amb22299438 [0,1,0,0,0,1|1,0,1]=4 5207 B8R1.5 CC1COCOC1C Amb25829514 [0,1,0,0,0,1|1,0,1]=4 5208 B8R1.5 CC1CSCCC1=O Amb26404796 [0,1,0,0,0,1|1,0,0]=3 5209 B8R1.5 CC1NCCCC1=O Amb26633057 [0,1,0,0,0,1|1,0,0]=3 5210 B8R1.5 CC1NCCCC1=O Amb32695440 [0,1,0,0,0,1|1,0,0]=3 5211 B8R1.5 CC1NCCNC1=O Amb5846691 [0,1,0,0,0,1|1,0,0]=3 5212 B8R1.5 CC1NCCNC1=O Amb9778910 [0,1,0,0,0,1|1,0,0]=3 5213 B8R1.5 CC1NCCOC1C Amb17470363 [0,1,0,0,0,1|1,0,1]=4 5214 B8R1.5 CC1NCCOC1O Amb25031508 [0,1,0,0,0,1|0,0,2]=4 5215 B8R1.5 CC1NCCSC1=O Amb27489291 [0,1,0,0,0,1|0,1,0]=3 5216 B8R1.5 CC1OCC=CC1=O Amb28316168 [0,1,0,0,0,1|0,0,2]=4 5217 B8R1.5 CC1OCCCC1=O Amb28048940 [0,1,0,0,0,1|0,0,0]=2 5218 B8R1.5 CC1OCCCC1Br Amb22500038 [0,1,0,0,0,1|1,0,1]=4 5219 B8R1.5 CC1OCCNC1=O Amb19517095 [0,1,0,0,0,1|1,0,0]=3 5220 B8R1.5 CC1SCCCC1=O Amb25989585 [0,1,0,0,0,1|0,1,0]=3 5221 B8R1.5 CC1SCCNC1=O Amb4009235 [0,1,0,0,0,1|1,0,0]=3 5222 B8R1.5 CN1CCC=CC1=O Amb22500738 [0,1,0,0,0,1|1,0,1]=4 5223 B8R1.5 CN1CCCN=C1N Amb27838391 [0,1,0,0,0,1|2,0,0]=4 5224 B8R1.5 CN1CCCNC1=O Amb10608416 [0,1,0,0,0,1|1,0,0]=3 5225 B8R1.5 CN1CCCNC1=O Amb32665804 [0,1,0,0,0,1|1,0,0]=3 5226 B8R1.5 CN1CCCNC1=S Amb4012380 [0,1,0,0,0,1|1,1,0]=4 5227 B8R1.5 CN1CCC[NH+]=C1N Amb4006104 [0,1,0,0,0,1|2,0,0]=4 5228 B8R1.5 CN1CCNCC1=O Amb1834069 [0,1,0,0,0,1|1,0,0]=3 5229 B8R1.5 CN1CCNCC1=O Amb6540859 [0,1,0,0,0,1|1,0,0]=3 5230 B8R1.5 CN1CCOCC1=O Amb22301593 [0,1,0,0,0,1|1,0,0]=3 5231 B8R1.5 CN1CNCCC1=O Amb27409650 [0,1,0,0,0,1|1,0,0]=3 5232 B8R1.5 CN1NCCCC1=O Amb18559232 [0,1,0,0,0,1|1,0,0]=3 5233 B8R1.5 C[C@@H]1CCC=CC1=O Amb28316223 [0,1,0,0,0,1|1,0,0]=3 5234 B8R1.5 C[C@@H]1CCCO[C@@H]1O Amb27452063 [0,1,0,0,0,1|0,0,2]=4 5235 B8R1.5 C[C@@H]1CCOC[C@H]1O Amb28345042 [0,1,0,0,0,1|0,0,2]=4 5236 B8R1.5 C[C@@H]1COCC[C@@H]1N Amb22745852 [0,1,0,0,0,1|1,0,1]=4 5237 B8R1.5 C[C@@H]1COCC[C@H]1N Amb23440138 [0,1,0,0,0,1|1,0,1]=4 5238 B8R1.5 C[C@@H]1COCC[C@H]1N Amb25929881 [0,1,0,0,0,1|1,0,1]=4 5239 B8R1.5 C[C@@H]1NCCNC1=O Amb18203363 [0,1,0,0,0,1|1,0,0]=3 5240 B8R1.5 C[C@@H]1OCCCC1=O Amb28202118 [0,1,0,0,0,1|0,0,0]=2 5241 B8R1.5 C[C@@H]1OCCC[C@H]1Br Amb27444138 [0,1,0,0,0,1|1,0,1]=4 5242 B8R1.5 C[C@@H]1OCCC[C@H]1Cl Amb27453022 [0,1,0,0,0,1|1,0,1]=4 5243 B8R1.5 C[C@@H]1OCCN[C@@H]1C Amb28132429 [0,1,0,0,0,1|1,0,1]=4 5244 B8R1.5 C[C@@H]1SCCNC1=O Amb34915743 [0,1,0,0,0,1|1,0,0]=3 5245 B8R1.5 C[C@H]1CCC=CC1=O Amb28316171 [0,1,0,0,0,1|1,0,0]=3 5246 B8R1.5 C[C@H]1CCCNC1=O Amb27648584 [0,1,0,0,0,1|1,0,0]=3 5247 B8R1.5 C[C@H]1CCCO[C@@H]1O Amb27452053 [0,1,0,0,0,1|0,0,2]=4 5248 B8R1.5 C[C@H]1CCOC[C@H]1O Amb27484771 [0,1,0,0,0,1|0,0,2]=4 5249 B8R1.5 C[C@H]1COCC[C@@H]1N Amb27440842 [0,1,0,0,0,1|1,0,1]=4 5250 B8R1.5 C[C@H]1COCC[C@@H]1N Amb33726124 [0,1,0,0,0,1|1,0,1]=4 5251 B8R1.5 C[C@H]1COCC[C@H]1N Amb22736636 [0,1,0,0,0,1|1,0,1]=4 5252 B8R1.5 C[C@H]1COCC[C@H]1N Amb32409393 [0,1,0,0,0,1|1,0,1]=4 5253 B8R1.5 C[C@H]1NCCNC1=O Amb22336965 [0,1,0,0,0,1|1,0,0]=3 5254 B8R1.5 C[C@H]1SCCNC1=O Amb27810802 [0,1,0,0,0,1|1,0,0]=3 5255 B8R1.5 ClC1=C(Cl)CNCC1 Amb24467867 [0,1,0,0,0,1|2,0,0]=4 5256 B8R1.5 ClC1=C(Cl)CNCC1 Amb33291346 [0,1,0,0,0,1|2,0,0]=4 5257 B8R1.5 ClC1CCCOC1Cl Amb25101518 [0,1,0,0,0,1|1,0,1]=4 5258 B8R1.5 ClC1CCOCC1Cl Amb28384990 [0,1,0,0,0,1|1,0,1]=4 5259 B8R1.5 ClC1OCCOC1Cl Amb17674085 [0,1,0,0,0,1|1,0,1]=4 5260 B8R1.5 ClC1OCCO[C@H]1Cl Amb27858530 [0,1,0,0,0,1|1,0,1]=4 5261 B8R1.5 Cl[C@@H]1CCOC[C@H]1Cl Amb27797196 [0,1,0,0,0,1|1,0,1]=4 5262 B8R1.5 Cl[C@@H]1OCCC[C@H]1Cl Amb27865663 [0,1,0,0,0,1|1,0,1]=4 5263 B8R1.5 Cl[C@@H]1OCCO[C@H]1Cl Amb22231660 [0,1,0,0,0,1|1,0,1]=4 5264 B8R1.5 Cl[C@H]1OCCO[C@@H]1Cl Amb28144704 [0,1,0,0,0,1|1,0,1]=4 5265 B8R1.5 FC1=CCCCC1Br Amb28325638 [0,1,0,0,0,1|2,0,0]=4 5266 B8R1.5 F[C@@H]1OCCC[C@@H]1Cl Amb27253582 [0,1,0,0,0,1|1,0,1]=4 5267 B8R1.5 F[C@@H]1OCCC[C@H]1Br Amb27434707 [0,1,0,0,0,1|1,0,1]=4 5268 B8R1.5 NC1=NCCCC1=O Amb28399329 [0,1,0,0,0,1|1,0,0]=3 5269 B8R1.5 NC1=NCCCC1Cl Amb27391114 [0,1,0,0,0,1|2,0,0]=4 5270 B8R1.5 NC1=NCCCC1O Amb27985373 [0,1,0,0,0,1|2,0,0]=4 5271 B8R1.5 NC1CCCC=C1Br Amb27974263 [0,1,0,0,0,1|2,0,0]=4 5272 B8R1.5 NC1CCCC=C1Br Amb33338965 [0,1,0,0,0,1|2,0,0]=4 5273 B8R1.5 NC1CCCC=C1Cl Amb18124341 [0,1,0,0,0,1|2,0,0]=4 5274 B8R1.5 NC1CCCCC1=O Amb17939051 [0,1,0,0,0,1|1,0,0]=3 5275 B8R1.5 NC1CCCCC1=O Amb22001819 [0,1,0,0,0,1|1,0,0]=3 5276 B8R1.5 NC1CCCNC1=O Amb1088746 [0,1,0,0,0,1|1,0,0]=3 5277 B8R1.5 NC1CCCNC1=O Amb8428208 [0,1,0,0,0,1|1,0,0]=3 5278 B8R1.5 NC1CCCOB1O Amb24681060 [0,1,0,0,0,1|1,0,1]=4 5279 B8R1.5 NC1CCCOB1O Amb32668036 [0,1,0,0,0,1|1,0,1]=4 5280 B8R1.5 NC1CCOCC1Br Amb32657381 [0,1,0,0,0,1|1,0,1]=4 5281 B8R1.5 NC1CCOCC1F Amb22436824 [0,1,0,0,0,1|1,0,1]=4 5282 B8R1.5 NC1CCOCC1O Amb18198453 [0,1,0,0,0,1|0,0,2]=4 5283 B8R1.5 NC1CCOCC1O Amb28934888 [0,1,0,0,0,1|0,0,2]=4 5284 B8R1.5 NC1CCONC1=O Amb22295935 [0,1,0,0,0,1|0,0,0]=2 5285 B8R1.5 NC1CNCCC1=O Amb27635311 [0,1,0,0,0,1|1,0,0]=3 5286 B8R1.5 NC1COCCC1=O Amb18833021 [0,1,0,0,0,1|1,0,0]=3 5287 B8R1.5 NC1COCCC1=O Amb32670691 [0,1,0,0,0,1|1,0,0]=3 5288 B8R1.5 NC1COCCC1O Amb18198755 [0,1,0,0,0,1|1,0,1]=4 5289 B8R1.5 NC1COCCC1O Amb32753157 [0,1,0,0,0,1|1,0,1]=4 5290 B8R1.5 NC1CSCCC1=O Amb4296938 [0,1,0,0,0,1|1,0,0]=3 5291 B8R1.5 NN1CCCCC1=O Amb13952152 [0,1,0,0,0,1|1,0,0]=3 5292 B8R1.5 NN1CCCCC1=O Amb22275946 [0,1,0,0,0,1|1,0,0]=3 5293 B8R1.5 NN1CCCNC1=O Amb25343173 [0,1,0,0,0,1|1,0,0]=3 5294 B8R1.5 NN1CCCOC1=O Amb17608306 [0,1,0,0,0,1|0,0,0]=2 5295 B8R1.5 NN1CCOCC1=O Amb27238452 [0,1,0,0,0,1|1,0,0]=3 5296 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,1,0,0,0,1|1,0,0]=3 5297 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,1,0,0,0,1|1,0,0]=3 5298 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb23439434 [0,1,0,0,0,1|1,0,1]=4 5299 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb25780287 [0,1,0,0,0,1|1,0,1]=4 5300 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb22406155 [0,1,0,0,0,1|0,0,2]=4 5301 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb23385312 [0,1,0,0,0,1|0,0,2]=4 5302 B8R1.5 N[C@@H]1CCOC[C@H]1F Amb23439433 [0,1,0,0,0,1|1,0,1]=4 5303 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb22406158 [0,1,0,0,0,1|0,0,2]=4 5304 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb23385253 [0,1,0,0,0,1|0,0,2]=4 5305 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb23385320 [0,1,0,0,0,1|1,0,1]=4 5306 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb26888092 [0,1,0,0,0,1|1,0,1]=4 5307 B8R1.5 N[C@@H]1COCC[C@H]1F Amb27435652 [0,1,0,0,0,1|1,0,1]=4 5308 B8R1.5 N[C@@H]1COCC[C@H]1N Amb24120364 [0,1,0,0,0,1|1,0,1]=4 5309 B8R1.5 N[C@@H]1COCC[C@H]1O Amb22748653 [0,1,0,0,0,1|1,0,1]=4 5310 B8R1.5 N[C@@H]1COCC[C@H]1O Amb23385302 [0,1,0,0,0,1|1,0,1]=4 5311 B8R1.5 N[C@H]1CCCNC1=O Amb10603272 [0,1,0,0,0,1|1,0,0]=3 5312 B8R1.5 N[C@H]1CCCNC1=O Amb8631316 [0,1,0,0,0,1|1,0,0]=3 5313 B8R1.5 N[C@H]1CCOC[C@@H]1F Amb33726121 [0,1,0,0,0,1|1,0,1]=4 5314 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb25970035 [0,1,0,0,0,1|0,0,2]=4 5315 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb33725444 [0,1,0,0,0,1|0,0,2]=4 5316 B8R1.5 N[C@H]1CCOC[C@H]1F Amb26532518 [0,1,0,0,0,1|1,0,1]=4 5317 B8R1.5 N[C@H]1CCOC[C@H]1F Amb31291469 [0,1,0,0,0,1|1,0,1]=4 5318 B8R1.5 N[C@H]1CCOC[C@H]1O Amb26407654 [0,1,0,0,0,1|0,0,2]=4 5319 B8R1.5 N[C@H]1CCOC[C@H]1O Amb33801116 [0,1,0,0,0,1|0,0,2]=4 5320 B8R1.5 N[C@H]1COCC[C@@H]1O Amb25231772 [0,1,0,0,0,1|1,0,1]=4 5321 B8R1.5 N[C@H]1COCC[C@H]1O Amb24617518 [0,1,0,0,0,1|1,0,1]=4 5322 B8R1.5 N[C@H]1COCC[C@H]1O Amb33872533 [0,1,0,0,0,1|1,0,1]=4 5323 B8R1.5 O=C1C=CCCC1=O Amb28049024 [0,1,0,0,0,1|1,0,1]=4 5324 B8R1.5 O=C1C=CCCC1Br Amb27477843 [0,1,0,0,0,1|1,0,0]=3 5325 B8R1.5 O=C1C=CCCC1O Amb27165534 [0,1,0,0,0,1|1,0,0]=3 5326 B8R1.5 O=C1CC=CCC1Cl Amb27471139 [0,1,0,0,0,1|1,0,1]=4 5327 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,1,0,0,0,1|1,0,0]=3 5328 B8R1.5 O=C1CCCC=C1F Amb28253992 [0,1,0,0,0,1|1,0,0]=3 5329 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,1,0,0,0,1|1,0,0]=3 5330 B8R1.5 O=C1CCCC=C1O Amb2699837 [0,1,0,0,0,1|1,0,0]=3 5331 B8R1.5 O=C1CCCCC1=O Amb1154131 [0,1,0,0,0,1|1,0,0]=3 5332 B8R1.5 O=C1CCCCC1Br Amb8394127 [0,1,0,0,0,1|1,0,0]=3 5333 B8R1.5 O=C1CCCCC1Cl Amb1154371 [0,1,0,0,0,1|1,0,0]=3 5334 B8R1.5 O=C1CCCCC1F Amb10605769 [0,1,0,0,0,1|1,0,0]=3 5335 B8R1.5 O=C1CCCCC1I Amb28239314 [0,1,0,0,0,1|1,0,0]=3 5336 B8R1.5 O=C1CCCCC1O Amb8390042 [0,1,0,0,0,1|1,0,0]=3 5337 B8R1.5 O=C1CCCCC1S Amb25839265 [0,1,0,0,0,1|1,0,0]=3 5338 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,1,0,0,0,1|1,0,0]=3 5339 B8R1.5 O=C1CCCC[C@@H]1O Amb28316212 [0,1,0,0,0,1|1,0,0]=3 5340 B8R1.5 O=C1CCCC[C@H]1Cl Amb28119800 [0,1,0,0,0,1|1,0,0]=3 5341 B8R1.5 O=C1CCCNC1=O Amb2445649 [0,1,0,0,0,1|1,0,0]=3 5342 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,1,0,0,0,1|0,0,0]=2 5343 B8R1.5 O=C1CCCSC1Cl Amb26534671 [0,1,0,0,0,1|0,1,0]=3 5344 B8R1.5 O=C1CCNCC1Br Amb21520330 [0,1,0,0,0,1|1,0,0]=3 5345 B8R1.5 O=C1CCNCC1F Amb13885958 [0,1,0,0,0,1|1,0,0]=3 5346 B8R1.5 O=C1CCNCC1F Amb22002662 [0,1,0,0,0,1|1,0,0]=3 5347 B8R1.5 O=C1CCNCC1O Amb24075970 [0,1,0,0,0,1|1,0,0]=3 5348 B8R1.5 O=C1CCNCC1O Amb27230548 [0,1,0,0,0,1|1,0,0]=3 5349 B8R1.5 O=C1CCNCN1O Amb24120639 [0,1,0,0,0,1|1,0,0]=3 5350 B8R1.5 O=C1CCNC[C@H]1F Amb27467922 [0,1,0,0,0,1|1,0,0]=3 5351 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,1,0,0,0,1|1,0,0]=3 5352 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,1,0,0,0,1|1,0,0]=3 5353 B8R1.5 O=C1CCOCC1F Amb19958536 [0,1,0,0,0,1|1,0,0]=3 5354 B8R1.5 O=C1CCOCC1O Amb26966688 [0,1,0,0,0,1|1,0,0]=3 5355 B8R1.5 O=C1CCOC[C@@H]1Br Amb26936362 [0,1,0,0,0,1|1,0,0]=3 5356 B8R1.5 O=C1CCOC[C@@H]1F Amb27813369 [0,1,0,0,0,1|1,0,0]=3 5357 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,1,0,0,0,1|1,0,0]=3 5358 B8R1.5 O=C1CCSC=C1Cl Amb27856607 [0,1,0,0,0,1|1,0,1]=4 5359 B8R1.5 O=C1CCSCC1Br Amb22493812 [0,1,0,0,0,1|1,0,0]=3 5360 B8R1.5 O=C1CCSCC1O Amb27762936 [0,1,0,0,0,1|1,0,0]=3 5361 B8R1.5 O=C1CCSC[C@@H]1O Amb28316128 [0,1,0,0,0,1|1,0,0]=3 5362 B8R1.5 O=C1COC=C[C@H]1F Amb28292426 [0,1,0,0,0,1|0,0,2]=4 5363 B8R1.5 O=C1COCCC1Br Amb24416092 [0,1,0,0,0,1|0,0,0]=2 5364 B8R1.5 O=C1COCCC1F Amb28048950 [0,1,0,0,0,1|0,0,0]=2 5365 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [0,1,0,0,0,1|0,0,0]=2 5366 B8R1.5 O=C1NCCC=C1Cl Amb26349713 [0,1,0,0,0,1|1,0,1]=4 5367 B8R1.5 O=C1NCCCC1Br Amb33543864 [0,1,0,0,0,1|1,0,0]=3 5368 B8R1.5 O=C1NCCCC1F Amb13888988 [0,1,0,0,0,1|1,0,0]=3 5369 B8R1.5 O=C1NCCCC1O Amb10602315 [0,1,0,0,0,1|1,0,0]=3 5370 B8R1.5 O=C1NCCC[C@@H]1O Amb22226682 [0,1,0,0,0,1|1,0,0]=3 5371 B8R1.5 O=C1NCCC[C@H]1O Amb22225342 [0,1,0,0,0,1|1,0,0]=3 5372 B8R1.5 O=C1NCCNC1=O Amb4005151 [0,1,0,0,0,1|1,0,1]=4 5373 B8R1.5 O=C1NCCOC1=O Amb24120265 [0,1,0,0,0,1|0,0,1]=3 5374 B8R1.5 O=C1NCNCC1Br Amb28060398 [0,1,0,0,0,1|1,0,0]=3 5375 B8R1.5 O=C1NNCCC1Cl Amb26453975 [0,1,0,0,0,1|1,0,0]=3 5376 B8R1.5 O=C1OCC=CC1O Amb27795928 [0,1,0,0,0,1|0,0,1]=3 5377 B8R1.5 O=C1OCCC=C1Br Amb27838412 [0,1,0,0,0,1|0,0,1]=3 5378 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,1,0,0,0,1|0,0,0]=2 5379 B8R1.5 O=C1OCCCC1Cl Amb28195106 [0,1,0,0,0,1|0,0,0]=2 5380 B8R1.5 O=C1OCCCC1O Amb19959000 [0,1,0,0,0,1|0,0,0]=2 5381 B8R1.5 O=C1OCCOC1=O Amb4010211 [0,1,0,0,0,1|0,0,1]=3 5382 B8R1.5 O=C1OCCSC1Br Amb27776793 [0,1,0,0,0,1|0,0,0]=2 5383 B8R1.5 O=C1SCCSC1Cl Amb25026142 [0,1,0,0,0,1|0,1,0]=3 5384 B8R1.5 O=S1CCCCC1Cl Amb27669604 [0,1,0,0,0,1|2,0,0]=4 5385 B8R1.5 O=S1CCCC[C@H]1Cl Amb28343131 [0,1,0,0,0,1|2,0,0]=4 5386 B8R1.5 OC1CCCC=C1Br Amb17594500 [0,1,0,0,0,1|2,0,0]=4 5387 B8R1.5 OC1CCCC=C1Cl Amb27970979 [0,1,0,0,0,1|2,0,0]=4 5388 B8R1.5 OC1CCCOC1O Amb27594250 [0,1,0,0,0,1|0,0,2]=4 5389 B8R1.5 OC1CCOCC1F Amb28079111 [0,1,0,0,0,1|1,0,1]=4 5390 B8R1.5 OC1COCCC1Br Amb27607882 [0,1,0,0,0,1|0,0,2]=4 5391 B8R1.5 OC1COCCC1Cl Amb27483869 [0,1,0,0,0,1|0,0,2]=4 5392 B8R1.5 OC1OCCOC1O Amb1199104 [0,1,0,0,0,1|0,0,2]=4 5393 B8R1.5 O[C@@H]1CCCC=C1Br Amb25687871 [0,1,0,0,0,1|2,0,0]=4 5394 B8R1.5 O[C@@H]1CCCC=C1Cl Amb28067316 [0,1,0,0,0,1|2,0,0]=4 5395 B8R1.5 O[C@@H]1CCCO[C@H]1O Amb27659639 [0,1,0,0,0,1|0,0,2]=4 5396 B8R1.5 O[C@@H]1CCOC[C@@H]1F Amb26443063 [0,1,0,0,0,1|1,0,1]=4 5397 B8R1.5 O[C@@H]1CCOC[C@H]1F Amb25054496 [0,1,0,0,0,1|1,0,1]=4 5398 B8R1.5 O[C@@H]1COCC[C@H]1Br Amb32686594 [0,1,0,0,0,1|0,0,2]=4 5399 B8R1.5 O[C@@H]1COCC[C@H]1Cl Amb27791772 [0,1,0,0,0,1|0,0,2]=4 5400 B8R1.5 O[C@@H]1OCCC[C@@H]1Cl Amb27788417 [0,1,0,0,0,1|0,0,2]=4 5401 B8R1.5 O[C@H]1CCCC=C1Br Amb24505024 [0,1,0,0,0,1|2,0,0]=4 5402 B8R1.5 O[C@H]1CCOC[C@@H]1F Amb34160539 [0,1,0,0,0,1|1,0,1]=4 5403 B8R1.5 O[C@H]1CCOC[C@H]1F Amb26389608 [0,1,0,0,0,1|1,0,1]=4 5404 B8R1.72 CC1(C)CCCCO1 Amb28048681 [0,1,0,0,0,1|1,0,1]=4 5405 B8R1.72 CC1(C)CNCCO1 Amb21960709 [0,1,0,0,0,1|1,0,1]=4 5406 B8R1.72 CC1(C)CNCCO1 Amb7969595 [0,1,0,0,0,1|1,0,1]=4 5407 B8R1.72 CC1(C)NCCCO1 Amb24562039 [0,1,0,0,0,1|1,0,1]=4 5408 B8R1.72 CC1(N)CCCOC1 Amb18833019 [0,1,0,0,0,1|1,0,1]=4 5409 B8R1.72 CC1(N)CCCOC1 Amb30585103 [0,1,0,0,0,1|1,0,1]=4 5410 B8R1.72 CC1(O)CCCOC1 Amb20668932 [0,1,0,0,0,1|0,0,2]=4 5411 B8R1.72 CP1(=O)CCNCC1 Amb24715796 [0,1,0,0,0,1|2,0,0]=4 5412 B8R1.72 CP1(=O)CCNCC1 Amb32675162 [0,1,0,0,0,1|2,0,0]=4 5413 B8R1.72 C[Si]1(C)CNCCO1 Amb27620214 [0,1,0,0,0,1|1,1,0]=4 5414 B8R1.72 C[Si]1(C)COCCO1 Amb27816593 [0,1,0,0,0,1|1,1,0]=4 5415 B8R1.72 FC1(F)CNCCO1 Amb25135765 [0,1,0,0,0,1|1,0,1]=4 5416 B8R1.72 FC1(F)CNCCO1 Amb32661467 [0,1,0,0,0,1|1,0,1]=4 5417 B8R1.72 N=S1(=O)CCCCC1 Amb25258608 [0,1,0,0,0,1|2,0,0]=4 5418 B8R1.72 N=S1(=O)CCNCC1 Amb27652837 [0,1,0,0,0,1|2,0,0]=4 5419 B8R1.72 N=S1(=O)CCNCC1 Amb31308374 [0,1,0,0,0,1|2,0,0]=4 5420 B8R1.72 N=S1(=O)CCOCC1 Amb33543895 [0,1,0,0,0,1|2,0,0]=4 5421 B8R1.72 O=P1(O)CCNCC1 Amb28398023 [0,1,0,0,0,1|2,0,0]=4 5422 B8R1.72 O=P1(O)OCCCO1 Amb27881859 [0,1,0,0,0,1|1,0,0]=3 5423 B8R1.72 O=S1(=O)C=CCCC1 Amb25058323 [0,1,0,0,0,1|2,0,0]=4 5424 B8R1.72 O=S1(=O)CCCCN1 Amb10068561 [0,1,0,0,0,1|2,0,0]=4 5425 B8R1.72 O=S1(=O)CCCCO1 Amb6608747 [0,1,0,0,0,1|1,0,0]=3 5426 B8R1.72 O=S1(=O)CCCNC1 Amb27838312 [0,1,0,0,0,1|2,0,0]=4 5427 B8R1.72 O=S1(=O)CCCNC1 Amb32670599 [0,1,0,0,0,1|2,0,0]=4 5428 B8R1.72 O=S1(=O)CCNCC1 Amb1102302 [0,1,0,0,0,1|2,0,0]=4 5429 B8R1.72 O=S1(=O)CCNCC1 Amb6307180 [0,1,0,0,0,1|2,0,0]=4 5430 B8R1.72 O=S1(=O)CCNCN1 Amb15691496 [0,1,0,0,0,1|2,0,0]=4 5431 B8R1.72 O=S1(=O)CCOCC1 Amb2779436 [0,1,0,0,0,1|2,0,0]=4 5432 B8R1.72 O=S1(=O)COCCN1 Amb19516827 [0,1,0,0,0,1|2,0,0]=4 5433 B8R1.72 O=S1(=O)NCCCN1 Amb21857783 [0,1,0,0,0,1|2,0,0]=4 5434 B8R1.72 O=S1(=O)NCCCO1 Amb33098585 [0,1,0,0,0,1|1,0,0]=3 5435 B8R1.72 O=S1(=O)OCCCO1 Amb22233116 [0,1,0,0,0,1|1,0,0]=3 5436 B8R1.1 C#CC1CCC(C)O1 Amb28048959 [0,2,0,0,0,0|1,0,1]=4 5437 B8R1.1 C#CC1CC[C@@H](C)O1 Amb33226112 [0,2,0,0,0,0|1,0,1]=4 5438 B8R1.1 C#CC1COC(=O)N1 Amb27202758 [0,2,0,0,0,0|1,0,0]=3 5439 B8R1.1 C#C[C@@H]1COC(=O)N1 Amb23401461 [0,2,0,0,0,0|1,0,0]=3 5440 B8R1.1 C#C[C@H]1COC(=O)N1 Amb26513200 [0,2,0,0,0,0|1,0,0]=3 5441 B8R1.1 C=C1CCC(C#N)C1 Amb18641604 [0,2,0,0,0,0|2,0,0]=4 5442 B8R1.1 C=C1CCC(CO)C1 Amb27869714 [0,2,0,0,0,0|2,0,0]=4 5443 B8R1.1 C=C1CC[C@H](CO)C1 Amb28430210 [0,2,0,0,0,0|2,0,0]=4 5444 B8R1.1 C=CC1=CC(=O)CC1 Amb28455401 [0,2,0,0,0,0|1,0,1]=4 5445 B8R1.1 C=CC1=C[C@H](O)CC1 Amb27218887 [0,2,0,0,0,0|2,0,0]=4 5446 B8R1.1 C=CC1CCC(=O)C1 Amb26592031 [0,2,0,0,0,0|1,0,0]=3 5447 B8R1.1 C=CC1CCC(=O)N1 Amb20622087 [0,2,0,0,0,0|1,0,0]=3 5448 B8R1.1 C=CC1CCC(=O)O1 Amb33249669 [0,2,0,0,0,0|0,0,0]=2 5449 B8R1.1 C=CC1CCC(C)O1 Amb27181113 [0,2,0,0,0,0|1,0,1]=4 5450 B8R1.1 C=CC1CCC(O)O1 Amb22752546 [0,2,0,0,0,0|0,0,2]=4 5451 B8R1.1 C=CC1CC[C@@H](C)O1 Amb33448079 [0,2,0,0,0,0|1,0,1]=4 5452 B8R1.1 C=CC1CNC(=O)O1 Amb25064259 [0,2,0,0,0,0|1,0,0]=3 5453 B8R1.1 C=CC1CNC(=O)S1 Amb26026754 [0,2,0,0,0,0|1,1,0]=4 5454 B8R1.1 C=CC1CNC(=S)O1 Amb20622116 [0,2,0,0,0,0|1,1,0]=4 5455 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,2,0,0,0,0|0,0,0]=2 5456 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,2,0,0,0,0|1,0,0]=3 5457 B8R1.1 C=CC1COC(O)C1 Amb28061049 [0,2,0,0,0,0|0,0,2]=4 5458 B8R1.1 C=C[C@@H]1C=CC(=O)C1 Amb28202331 [0,2,0,0,0,0|1,0,1]=4 5459 B8R1.1 C=C[C@@H]1CCC(=O)N1 Amb27838334 [0,2,0,0,0,0|1,0,0]=3 5460 B8R1.1 C=C[C@@H]1CNC(=S)O1 Amb22169199 [0,2,0,0,0,0|1,1,0]=4 5461 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,2,0,0,0,0|0,0,0]=2 5462 B8R1.1 C=C[C@@H]1COC(=O)N1 Amb27461297 [0,2,0,0,0,0|1,0,0]=3 5463 B8R1.1 C=C[C@@H]1COC(=O)O1 Amb25946828 [0,2,0,0,0,0|1,0,0]=3 5464 B8R1.1 C=C[C@H]1CCC(=O)N1 Amb27459295 [0,2,0,0,0,0|1,0,0]=3 5465 B8R1.1 C=C[C@H]1CNC(=S)O1 Amb27838399 [0,2,0,0,0,0|1,1,0]=4 5466 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,2,0,0,0,0|0,0,0]=2 5467 B8R1.1 C=C[C@H]1COC(=O)N1 Amb27174193 [0,2,0,0,0,0|1,0,0]=3 5468 B8R1.1 C=C[C@H]1COC(=O)O1 Amb26588639 [0,2,0,0,0,0|1,0,0]=3 5469 B8R1.1 CC1=CCC(C=O)C1 Amb28186881 [0,2,0,0,0,0|2,0,0]=4 5470 B8R1.1 CC1=CC[C@@H](CO)C1 Amb24481425 [0,2,0,0,0,0|2,0,0]=4 5471 B8R1.1 CC1=NC(CCl)CO1 Amb27809665 [0,2,0,0,0,0|2,0,0]=4 5472 B8R1.1 CC1=NC(CF)CO1 Amb27491686 [0,2,0,0,0,0|2,0,0]=4 5473 B8R1.1 CC1CC(C#N)CO1 Amb28206580 [0,2,0,0,0,0|1,0,1]=4 5474 B8R1.1 CC1CC(C=O)=NO1 Amb35750026 [0,2,0,0,0,0|2,0,0]=4 5475 B8R1.1 CC1CC(CN)CO1 Amb28193268 [0,2,0,0,0,0|1,0,1]=4 5476 B8R1.1 CC1CC(CO)CO1 Amb28401256 [0,2,0,0,0,0|1,0,1]=4 5477 B8R1.1 CC1CC(NN)CO1 Amb29859263 [0,2,0,0,0,0|1,0,1]=4 5478 B8R1.1 CC1CC(NO)CO1 Amb30011410 [0,2,0,0,0,0|1,0,1]=4 5479 B8R1.1 CC1CC=C(CO)O1 Amb28400924 [0,2,0,0,0,0|0,0,2]=4 5480 B8R1.1 CC1CCC(C#N)O1 Amb27809602 [0,2,0,0,0,0|1,0,1]=4 5481 B8R1.1 CC1CCC(C=O)C1 Amb33549452 [0,2,0,0,0,0|1,0,1]=4 5482 B8R1.1 CC1CCC(CI)O1 Amb28386366 [0,2,0,0,0,0|1,0,1]=4 5483 B8R1.1 CC1CCC(CN)O1 Amb33551292 [0,2,0,0,0,0|1,0,1]=4 5484 B8R1.1 CC1CCC(CS)O1 Amb24524291 [0,2,0,0,0,0|0,1,1]=4 5485 B8R1.1 CC1CC\C(=N/N)C1 Amb28137031 [0,2,0,0,0,0|2,0,0]=4 5486 B8R1.1 CC1CN=C(CCl)O1 Amb29845386 [0,2,0,0,0,0|2,0,0]=4 5487 B8R1.1 CC1CN=C(CN)O1 Amb29845388 [0,2,0,0,0,0|2,0,0]=4 5488 B8R1.1 CC1COC(C=O)C1 Amb28285207 [0,2,0,0,0,0|0,0,1]=3 5489 B8R1.1 CC1COC(CBr)C1 Amb32660774 [0,2,0,0,0,0|1,0,1]=4 5490 B8R1.1 CC1COC(CCl)C1 Amb32688120 [0,2,0,0,0,0|1,0,1]=4 5491 B8R1.1 CC1COC(CI)C1 Amb32660827 [0,2,0,0,0,0|1,0,1]=4 5492 B8R1.1 CC1COC(CN)C1 Amb32660866 [0,2,0,0,0,0|1,0,1]=4 5493 B8R1.1 CC1COC(CO)C1 Amb25856417 [0,2,0,0,0,0|0,0,2]=4 5494 B8R1.1 CCC1=CC(=O)CC1 Amb25889297 [0,2,0,0,0,0|1,0,1]=4 5495 B8R1.1 CCC1=CC(C)CC1 Amb25810526 [0,2,0,0,0,0|2,0,0]=4 5496 B8R1.1 CCC1=CC(Cl)CC1 Amb27214172 [0,2,0,0,0,0|2,0,0]=4 5497 B8R1.1 CCC1=CC(O)CC1 Amb28399443 [0,2,0,0,0,0|2,0,0]=4 5498 B8R1.1 CCC1=CCC(=O)O1 Amb27974572 [0,2,0,0,0,0|0,0,2]=4 5499 B8R1.1 CCC1=NOC(=O)C1 Amb26614539 [0,2,0,0,0,0|1,0,1]=4 5500 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,2,0,0,0,0|0,0,2]=4 5501 B8R1.1 CCC1CC(=O)CO1 Amb27856666 [0,2,0,0,0,0|2,0,0]=4 5502 B8R1.1 CCC1CC(=O)NN1 Amb29862365 [0,2,0,0,0,0|2,0,0]=4 5503 B8R1.1 CCC1CC(Br)CO1 Amb27657725 [0,2,0,0,0,0|1,0,1]=4 5504 B8R1.1 CCC1CC(Cl)CO1 Amb29870833 [0,2,0,0,0,0|1,0,1]=4 5505 B8R1.1 CCC1CC(N)CO1 Amb29866234 [0,2,0,0,0,0|1,0,1]=4 5506 B8R1.1 CCC1CC(S)CO1 Amb32788423 [0,2,0,0,0,0|1,0,1]=4 5507 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,2,0,0,0,0|1,0,0]=3 5508 B8R1.1 CCC1CCC(=O)O1 Amb3941505 [0,2,0,0,0,0|0,0,0]=2 5509 B8R1.1 CCC1CCC(O)O1 Amb27804358 [0,2,0,0,0,0|0,0,2]=4 5510 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,2,0,0,0,0|1,0,0]=3 5511 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,2,0,0,0,0|2,0,0]=4 5512 B8R1.1 CCC1CNC(=O)O1 Amb27237218 [0,2,0,0,0,0|1,0,0]=3 5513 B8R1.1 CCC1COC(=O)C1 Amb27854064 [0,2,0,0,0,0|0,0,0]=2 5514 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,2,0,0,0,0|1,0,0]=3 5515 B8R1.1 CCC1COC(=O)O1 Amb2721339 [0,2,0,0,0,0|1,0,0]=3 5516 B8R1.1 CCC1COC(=S)N1 Amb27264047 [0,2,0,0,0,0|1,1,0]=4 5517 B8R1.1 CC[C@@H]1C=CC(=O)O1 Amb27954643 [0,2,0,0,0,0|0,0,2]=4 5518 B8R1.1 CC[C@@H]1CCC(=O)O1 Amb26626757 [0,2,0,0,0,0|0,0,0]=2 5519 B8R1.1 CC[C@@H]1COC(=S)N1 Amb27838333 [0,2,0,0,0,0|1,1,0]=4 5520 B8R1.1 CC[C@H]1C=CC(=O)O1 Amb28195329 [0,2,0,0,0,0|0,0,2]=4 5521 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,2,0,0,0,0|0,0,0]=2 5522 B8R1.1 CC[C@H]1CNC(=O)O1 Amb27954656 [0,2,0,0,0,0|1,0,0]=3 5523 B8R1.1 CC[C@H]1COC(=O)N1 Amb27411564 [0,2,0,0,0,0|1,0,0]=3 5524 B8R1.1 CC[C@H]1COC(=S)N1 Amb27596053 [0,2,0,0,0,0|1,1,0]=4 5525 B8R1.1 CNC1=CC(=O)OC1 Amb27168193 [0,2,0,0,0,0|0,0,2]=4 5526 B8R1.1 CNC1=NCC(C)O1 Amb27202732 [0,2,0,0,0,0|2,0,0]=4 5527 B8R1.1 CNC1CCC(=O)C1 Amb28316112 [0,2,0,0,0,0|1,0,0]=3 5528 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,2,0,0,0,0|1,0,0]=3 5529 B8R1.1 CNC1COC(=O)C1 Amb26505382 [0,2,0,0,0,0|0,0,0]=2 5530 B8R1.1 CNC1COC(C)C1 Amb35677486 [0,2,0,0,0,0|1,0,1]=4 5531 B8R1.1 COC1=CC(=O)CC1 Amb21864758 [0,2,0,0,0,0|1,0,1]=4 5532 B8R1.1 COC1=CC(=O)OC1 Amb6366827 [0,2,0,0,0,0|0,0,2]=4 5533 B8R1.1 COC1C=CC(=O)O1 Amb22490509 [0,2,0,0,0,0|0,0,2]=4 5534 B8R1.1 COC1CC(=O)CO1 Amb27409395 [0,2,0,0,0,0|2,0,0]=4 5535 B8R1.1 COC1CCC(=O)C1 Amb24483163 [0,2,0,0,0,0|1,0,0]=3 5536 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,2,0,0,0,0|1,0,0]=3 5537 B8R1.1 COC1CNC(=O)C1 Amb24683870 [0,2,0,0,0,0|1,0,0]=3 5538 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,2,0,0,0,0|1,0,0]=3 5539 B8R1.1 CSC1CCC(=O)C1 Amb28184431 [0,2,0,0,0,0|1,0,0]=3 5540 B8R1.1 CSC1COC(=O)O1 Amb27395888 [0,2,0,0,0,0|1,0,0]=3 5541 B8R1.1 C[C@@H]1C=C(C=O)CC1 Amb25760068 [0,2,0,0,0,0|1,0,0]=3 5542 B8R1.1 C[C@@H]1CCC(CBr)O1 Amb33331125 [0,2,0,0,0,0|1,0,1]=4 5543 B8R1.1 C[C@@H]1CCC(CN)O1 Amb33423847 [0,2,0,0,0,0|1,0,1]=4 5544 B8R1.1 C[C@@H]1CCC(CO)O1 Amb24524279 [0,2,0,0,0,0|0,0,2]=4 5545 B8R1.1 C[C@@H]1CCC(CS)O1 Amb32730401 [0,2,0,0,0,0|0,1,1]=4 5546 B8R1.1 C[C@@H]1CC[C@H](CO)O1 Amb22886849 [0,2,0,0,0,0|0,0,2]=4 5547 B8R1.1 C[C@@H]1CO[C@@H](CO)C1 Amb27776409 [0,2,0,0,0,0|0,0,2]=4 5548 B8R1.1 C[C@H]1C=C(C=O)CC1 Amb25839230 [0,2,0,0,0,0|1,0,0]=3 5549 B8R1.1 C[C@H]1C=C(CO)CC1 Amb27452870 [0,2,0,0,0,0|1,0,1]=4 5550 B8R1.1 C[C@H]1CCC(CCl)O1 Amb27874116 [0,2,0,0,0,0|1,0,1]=4 5551 B8R1.1 C[C@H]1CC[C@@H](CO)O1 Amb27640536 [0,2,0,0,0,0|0,0,2]=4 5552 B8R1.1 C[C@H]1CC[C@H](CO)O1 Amb27484806 [0,2,0,0,0,0|0,0,2]=4 5553 B8R1.1 C[C@H]1C[C@H](CO)CO1 Amb27849658 [0,2,0,0,0,0|1,0,1]=4 5554 B8R1.1 C\C=C1\CCC(=O)O1 Amb27421031 [0,2,0,0,0,0|0,0,1]=3 5555 B8R1.1 C\N=C1/CCC(=O)N1 Amb26457426 [0,2,0,0,0,0|1,0,1]=4 5556 B8R1.1 N#CC1=CC(=O)CC1 Amb18122621 [0,2,0,0,0,0|1,0,1]=4 5557 B8R1.1 N#CC1=CC(Br)CC1 Amb18126842 [0,2,0,0,0,0|2,0,0]=4 5558 B8R1.1 N#CC1=CC(Cl)CC1 Amb28195820 [0,2,0,0,0,0|2,0,0]=4 5559 B8R1.1 N#CC1=CC(N)CC1 Amb24524262 [0,2,0,0,0,0|2,0,0]=4 5560 B8R1.1 N#CC1=C[C@@H](O)CC1 Amb26923160 [0,2,0,0,0,0|2,0,0]=4 5561 B8R1.1 N#CC1=C[C@H](O)CC1 Amb25936900 [0,2,0,0,0,0|2,0,0]=4 5562 B8R1.1 N#CC1CCC(=O)C1 Amb22886979 [0,2,0,0,0,0|1,0,0]=3 5563 B8R1.1 N#CC1CCC(=O)N1 Amb26361514 [0,2,0,0,0,0|1,0,0]=3 5564 B8R1.1 N#CC1CNC(=O)C1 Amb25873600 [0,2,0,0,0,0|1,0,0]=3 5565 B8R1.1 N#CC1CNC(=O)O1 Amb26984953 [0,2,0,0,0,0|1,0,0]=3 5566 B8R1.1 N#CC1COC(=O)O1 Amb35788458 [0,2,0,0,0,0|1,0,0]=3 5567 B8R1.1 N#C[C@H]1CCC(=O)C1 Amb26562820 [0,2,0,0,0,0|1,0,0]=3 5568 B8R1.1 N#C[C@H]1CCC(=O)N1 Amb27404492 [0,2,0,0,0,0|1,0,0]=3 5569 B8R1.1 N=C1CC[C@H](CO)N1 Amb27431528 [0,2,0,0,0,0|2,0,0]=4 5570 B8R1.1 NC1=NCC(CBr)O1 Amb2721921 [0,2,0,0,0,0|2,0,0]=4 5571 B8R1.1 NC1=NCC(CBr)O1 Amb33328591 [0,2,0,0,0,0|2,0,0]=4 5572 B8R1.1 NC1=NCC(CCl)O1 Amb26392039 [0,2,0,0,0,0|2,0,0]=4 5573 B8R1.1 NC1=NCC(CO)O1 Amb27596592 [0,2,0,0,0,0|2,0,0]=4 5574 B8R1.1 NC1=NC[C@@H](CCl)O1 Amb27839394 [0,2,0,0,0,0|2,0,0]=4 5575 B8R1.1 NC1CC=C(CO)C1 Amb28136321 [0,2,0,0,0,0|1,0,1]=4 5576 B8R1.1 NCC1=CCC(N)C1 Amb35741415 [0,2,0,0,0,0|2,0,0]=4 5577 B8R1.1 NCC1=NOC(=O)C1 Amb18833041 [0,2,0,0,0,0|1,0,1]=4 5578 B8R1.1 NCC1C=CC(=O)O1 Amb27842373 [0,2,0,0,0,0|0,0,2]=4 5579 B8R1.1 NCC1CCC(=O)C1 Amb24644946 [0,2,0,0,0,0|1,0,0]=3 5580 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,2,0,0,0,0|1,0,0]=3 5581 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,2,0,0,0,0|1,0,0]=3 5582 B8R1.1 NCC1CCC(=O)N1 Amb2699145 [0,2,0,0,0,0|1,0,0]=3 5583 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,2,0,0,0,0|0,0,0]=2 5584 B8R1.1 NCC1CCC(=O)O1 Amb28934914 [0,2,0,0,0,0|0,0,0]=2 5585 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,2,0,0,0,0|1,0,0]=3 5586 B8R1.1 NCC1CNC(=O)C1 Amb32434789 [0,2,0,0,0,0|1,0,0]=3 5587 B8R1.1 NCC1CNC(=O)C1 Amb8009790 [0,2,0,0,0,0|1,0,0]=3 5588 B8R1.1 NCC1CNC(=O)N1 Amb32666643 [0,2,0,0,0,0|2,0,0]=4 5589 B8R1.1 NCC1CNC(=O)N1 Amb33339243 [0,2,0,0,0,0|2,0,0]=4 5590 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,2,0,0,0,0|1,0,0]=3 5591 B8R1.1 NCC1CNC(=O)O1 Amb33527727 [0,2,0,0,0,0|1,0,0]=3 5592 B8R1.1 NCC1COC(=O)N1 Amb27852206 [0,2,0,0,0,0|1,0,0]=3 5593 B8R1.1 NCC1COC(=O)N1 Amb28934922 [0,2,0,0,0,0|1,0,0]=3 5594 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,2,0,0,0,0|1,0,0]=3 5595 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb2699146 [0,2,0,0,0,0|1,0,0]=3 5596 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,2,0,0,0,0|1,0,0]=3 5597 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,2,0,0,0,0|1,0,0]=3 5598 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,2,0,0,0,0|1,0,0]=3 5599 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,2,0,0,0,0|1,0,0]=3 5600 B8R1.1 NC[C@H]1CCC(=O)N1 Amb2699147 [0,2,0,0,0,0|1,0,0]=3 5601 B8R1.1 NC[C@H]1CCC(=O)N1 Amb32721612 [0,2,0,0,0,0|1,0,0]=3 5602 B8R1.1 NC[C@H]1CNC(=O)C1 Amb27797276 [0,2,0,0,0,0|1,0,0]=3 5603 B8R1.1 NC[C@H]1CNC(=O)C1 Amb31204575 [0,2,0,0,0,0|1,0,0]=3 5604 B8R1.1 NC[C@H]1CNC(=O)O1 Amb27403470 [0,2,0,0,0,0|1,0,0]=3 5605 B8R1.1 NC[C@H]1CNC(=O)O1 Amb30869777 [0,2,0,0,0,0|1,0,0]=3 5606 B8R1.1 N[C@@H]1CC=C(CO)C1 Amb27839180 [0,2,0,0,0,0|1,0,1]=4 5607 B8R1.1 N[C@H]1CO[C@@H](CO)C1 Amb26397441 [0,2,0,0,0,0|0,0,2]=4 5608 B8R1.1 N[C@H]1CO[C@H](CO)C1 Amb27638129 [0,2,0,0,0,0|0,0,2]=4 5609 B8R1.1 O=C1C=C(CBr)CO1 Amb17935686 [0,2,0,0,0,0|0,0,2]=4 5610 B8R1.1 O=C1C=C(CCl)CO1 Amb24481317 [0,2,0,0,0,0|0,0,2]=4 5611 B8R1.1 O=C1C=C(CI)CO1 Amb27613248 [0,2,0,0,0,0|0,0,2]=4 5612 B8R1.1 O=C1C=C(CO)CO1 Amb23557062 [0,2,0,0,0,0|0,0,2]=4 5613 B8R1.1 O=C1C=C(CS)CO1 Amb28316054 [0,2,0,0,0,0|0,0,2]=4 5614 B8R1.1 O=C1C=CC(CBr)O1 Amb24423424 [0,2,0,0,0,0|0,0,2]=4 5615 B8R1.1 O=C1C=C[C@@H](CBr)O1 Amb28128549 [0,2,0,0,0,0|0,0,2]=4 5616 B8R1.1 O=C1C=C[C@@H](CO)O1 Amb3939187 [0,2,0,0,0,0|0,0,2]=4 5617 B8R1.1 O=C1C=C[C@H](CO)O1 Amb2699833 [0,2,0,0,0,0|0,0,2]=4 5618 B8R1.1 O=C1CC(CBr)CN1 Amb33548071 [0,2,0,0,0,0|1,0,0]=3 5619 B8R1.1 O=C1CC(CCl)CN1 Amb27259904 [0,2,0,0,0,0|1,0,0]=3 5620 B8R1.1 O=C1CC(CF)CN1 Amb33379247 [0,2,0,0,0,0|1,0,0]=3 5621 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,2,0,0,0,0|0,0,0]=2 5622 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,2,0,0,0,0|1,0,0]=3 5623 B8R1.1 O=C1CC(CO)CN1 Amb9902173 [0,2,0,0,0,0|1,0,0]=3 5624 B8R1.1 O=C1CC(CO)CO1 Amb22886806 [0,2,0,0,0,0|0,0,0]=2 5625 B8R1.1 O=C1CC(CO)NN1 Amb35686080 [0,2,0,0,0,0|2,0,0]=4 5626 B8R1.1 O=C1CC(CS)CN1 Amb27850787 [0,2,0,0,0,0|1,0,0]=3 5627 B8R1.1 O=C1CC=C(CO)O1 Amb26977633 [0,2,0,0,0,0|0,0,2]=4 5628 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,2,0,0,0,0|1,0,0]=3 5629 B8R1.1 O=C1CCC(CBr)N1 Amb32752580 [0,2,0,0,0,0|1,0,0]=3 5630 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,2,0,0,0,0|0,0,0]=2 5631 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,2,0,0,0,0|1,0,0]=3 5632 B8R1.1 O=C1CCC(CCl)O1 Amb10608418 [0,2,0,0,0,0|0,0,0]=2 5633 B8R1.1 O=C1CCC(CF)N1 Amb27838313 [0,2,0,0,0,0|1,0,0]=3 5634 B8R1.1 O=C1CCC(CI)C1 Amb27481152 [0,2,0,0,0,0|1,0,0]=3 5635 B8R1.1 O=C1CCC(CI)N1 Amb25955610 [0,2,0,0,0,0|1,0,0]=3 5636 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,2,0,0,0,0|0,0,0]=2 5637 B8R1.1 O=C1CCC(CO)C1 Amb22168734 [0,2,0,0,0,0|1,0,0]=3 5638 B8R1.1 O=C1CCC(CO)N1 Amb33544815 [0,2,0,0,0,0|1,0,0]=3 5639 B8R1.1 O=C1CCC(CO)O1 Amb20240701 [0,2,0,0,0,0|0,0,0]=2 5640 B8R1.1 O=C1CCC(CO)S1 Amb28202904 [0,2,0,0,0,0|0,1,0]=3 5641 B8R1.1 O=C1CCC(CS)C1 Amb27828867 [0,2,0,0,0,0|1,0,0]=3 5642 B8R1.1 O=C1CCC(CS)N1 Amb32788463 [0,2,0,0,0,0|1,0,0]=3 5643 B8R1.1 O=C1CC[C@@H](CBr)N1 Amb2694702 [0,2,0,0,0,0|1,0,0]=3 5644 B8R1.1 O=C1CC[C@@H](CBr)N1 Amb32664923 [0,2,0,0,0,0|1,0,0]=3 5645 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,2,0,0,0,0|0,0,0]=2 5646 B8R1.1 O=C1CC[C@@H](CI)O1 Amb27175447 [0,2,0,0,0,0|0,0,0]=2 5647 B8R1.1 O=C1CC[C@@H](CO)N1 Amb2371840 [0,2,0,0,0,0|1,0,0]=3 5648 B8R1.1 O=C1CC[C@@H](CO)O1 Amb8515911 [0,2,0,0,0,0|0,0,0]=2 5649 B8R1.1 O=C1CC[C@H](CBr)C1 Amb26032409 [0,2,0,0,0,0|1,0,0]=3 5650 B8R1.1 O=C1CC[C@H](CBr)N1 Amb2695539 [0,2,0,0,0,0|1,0,0]=3 5651 B8R1.1 O=C1CC[C@H](CCl)N1 Amb26508557 [0,2,0,0,0,0|1,0,0]=3 5652 B8R1.1 O=C1CC[C@H](CO)N1 Amb2694795 [0,2,0,0,0,0|1,0,0]=3 5653 B8R1.1 O=C1CC[C@H](CO)O1 Amb4037005 [0,2,0,0,0,0|0,0,0]=2 5654 B8R1.1 O=C1CNC(CCl)C1 Amb27864068 [0,2,0,0,0,0|2,0,0]=4 5655 B8R1.1 O=C1COC(CO)C1 Amb24117838 [0,2,0,0,0,0|2,0,0]=4 5656 B8R1.1 O=C1COC(CO)N1 Amb27789986 [0,2,0,0,0,0|2,0,0]=4 5657 B8R1.1 O=C1C[C@@H](CBr)CO1 Amb27590526 [0,2,0,0,0,0|0,0,0]=2 5658 B8R1.1 O=C1C[C@@H](CO)CN1 Amb24515579 [0,2,0,0,0,0|1,0,0]=3 5659 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,2,0,0,0,0|0,0,0]=2 5660 B8R1.1 O=C1C[C@H](CO)CN1 Amb25745471 [0,2,0,0,0,0|1,0,0]=3 5661 B8R1.1 O=C1NC(CCl)CO1 Amb28282690 [0,2,0,0,0,0|1,0,0]=3 5662 B8R1.1 O=C1NC(CF)CO1 Amb33358226 [0,2,0,0,0,0|1,0,0]=3 5663 B8R1.1 O=C1NC(CO)CO1 Amb22410779 [0,2,0,0,0,0|1,0,0]=3 5664 B8R1.1 O=C1NC(CO)CS1 Amb27170689 [0,2,0,0,0,0|1,1,0]=4 5665 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,2,0,0,0,0|1,0,0]=3 5666 B8R1.1 O=C1NCC(CBr)S1 Amb7968758 [0,2,0,0,0,0|1,1,0]=4 5667 B8R1.1 O=C1NCC(CCl)O1 Amb1152954 [0,2,0,0,0,0|1,0,0]=3 5668 B8R1.1 O=C1NCC(CF)O1 Amb33379234 [0,2,0,0,0,0|1,0,0]=3 5669 B8R1.1 O=C1NCC(CI)O1 Amb28282085 [0,2,0,0,0,0|1,0,0]=3 5670 B8R1.1 O=C1NCC(CO)O1 Amb9421413 [0,2,0,0,0,0|1,0,0]=3 5671 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,2,0,0,0,0|1,0,0]=3 5672 B8R1.1 O=C1NC[C@@H](CBr)O1 Amb27401944 [0,2,0,0,0,0|1,0,0]=3 5673 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,2,0,0,0,0|1,0,0]=3 5674 B8R1.1 O=C1NC[C@@H](CO)N1 Amb33482781 [0,2,0,0,0,0|2,0,0]=4 5675 B8R1.1 O=C1NC[C@@H](CO)O1 Amb24183552 [0,2,0,0,0,0|1,0,0]=3 5676 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,2,0,0,0,0|1,0,0]=3 5677 B8R1.1 O=C1NC[C@H](CO)N1 Amb33620311 [0,2,0,0,0,0|2,0,0]=4 5678 B8R1.1 O=C1NC[C@H](CO)O1 Amb22737250 [0,2,0,0,0,0|1,0,0]=3 5679 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,2,0,0,0,0|1,0,0]=3 5680 B8R1.1 O=C1N[C@@H](CO)CO1 Amb26396455 [0,2,0,0,0,0|1,0,0]=3 5681 B8R1.1 O=C1N[C@H](CI)CO1 Amb28048135 [0,2,0,0,0,0|1,0,0]=3 5682 B8R1.1 O=C1N[C@H](CO)CO1 Amb26653948 [0,2,0,0,0,0|1,0,0]=3 5683 B8R1.1 O=C1N[C@H](CO)CS1 Amb27655608 [0,2,0,0,0,0|1,1,0]=4 5684 B8R1.1 O=C1OCC(CCl)O1 Amb3940630 [0,2,0,0,0,0|1,0,0]=3 5685 B8R1.1 O=C1OCC(CF)O1 Amb28348445 [0,2,0,0,0,0|1,0,0]=3 5686 B8R1.1 O=C1OCC(CO)O1 Amb3939438 [0,2,0,0,0,0|1,0,0]=3 5687 B8R1.1 O=C1OCC(CS)O1 Amb32650873 [0,2,0,0,0,0|1,0,0]=3 5688 B8R1.1 O=C1SCC(CCl)S1 Amb27975820 [0,2,0,0,0,0|1,1,0]=4 5689 B8R1.1 O=C1SCC(CO)S1 Amb27394779 [0,2,0,0,0,0|1,1,0]=4 5690 B8R1.1 O=CC1=NOC(=O)C1 Amb27209562 [0,2,0,0,0,0|1,0,1]=4 5691 B8R1.1 O=CC1CCC(=O)C1 Amb18124240 [0,2,0,0,0,0|1,0,0]=3 5692 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [0,2,0,0,0,0|1,0,0]=3 5693 B8R1.1 O=CC1CCC(F)C1 Amb25938998 [0,2,0,0,0,0|1,0,1]=4 5694 B8R1.1 O=CC1CCC(O)C1 Amb18641801 [0,2,0,0,0,0|1,0,1]=4 5695 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [0,2,0,0,0,0|1,0,0]=3 5696 B8R1.1 O=CC1COC(=O)C1 Amb26428572 [0,2,0,0,0,0|0,0,0]=2 5697 B8R1.1 O=CC1COC(=O)O1 Amb27446683 [0,2,0,0,0,0|1,0,0]=3 5698 B8R1.1 O=CN1CC(O)CO1 Amb28368023 [0,2,0,0,0,0|1,0,0]=3 5699 B8R1.1 O=CN1CC(S)CN1 Amb20621388 [0,2,0,0,0,0|2,0,0]=4 5700 B8R1.1 O=CN1CCC(F)C1 Amb35614291 [0,2,0,0,0,0|2,0,0]=4 5701 B8R1.1 O=CN1CC[C@H](O)C1 Amb27459549 [0,2,0,0,0,0|2,0,0]=4 5702 B8R1.1 O=CN1CC[C@H](S)C1 Amb26490592 [0,2,0,0,0,0|2,0,0]=4 5703 B8R1.1 O=C[C@@H]1CCC(=O)N1 Amb27390986 [0,2,0,0,0,0|1,0,0]=3 5704 B8R1.1 O=C[C@H]1CCC(=O)O1 Amb27964499 [0,2,0,0,0,0|0,0,0]=2 5705 B8R1.1 O=C[C@H]1CCC(=O)S1 Amb27792268 [0,2,0,0,0,0|0,1,0]=3 5706 B8R1.1 O=NN1CCC(=O)N1 Amb2417179 [0,2,0,0,0,0|2,0,0]=4 5707 B8R1.1 O=NN1CCC(O)C1 Amb25781793 [0,2,0,0,0,0|2,0,0]=4 5708 B8R1.1 O=S1CCC(CO)C1 Amb27763052 [0,2,0,0,0,0|2,0,0]=4 5709 B8R1.1 O=S1OCC(CBr)O1 Amb27873947 [0,2,0,0,0,0|2,0,0]=4 5710 B8R1.1 O=S1OCC(CCl)O1 Amb24624110 [0,2,0,0,0,0|2,0,0]=4 5711 B8R1.1 O=S1OCC(CF)O1 Amb21951909 [0,2,0,0,0,0|2,0,0]=4 5712 B8R1.1 O=S1OCC(CO)O1 Amb25802802 [0,2,0,0,0,0|2,0,0]=4 5713 B8R1.1 O=[PH]1OCC(CCl)O1 Amb27984375 [0,2,0,0,0,0|2,0,0]=4 5714 B8R1.1 OC1COC(CCl)C1 Amb28208531 [0,2,0,0,0,0|1,0,1]=4 5715 B8R1.1 OC1COC(CI)C1 Amb22229903 [0,2,0,0,0,0|1,0,1]=4 5716 B8R1.1 OCC1CCC(=S)N1 Amb28076783 [0,2,0,0,0,0|1,1,0]=4 5717 B8R1.1 OCC1CCC(O)O1 Amb22492783 [0,2,0,0,0,0|0,0,2]=4 5718 B8R1.1 OCC1CN=C(S)O1 Amb25092005 [0,2,0,0,0,0|1,1,0]=4 5719 B8R1.1 OCC1COC(=S)N1 Amb27168182 [0,2,0,0,0,0|1,1,0]=4 5720 B8R1.1 OCC1CSC(=S)O1 Amb28190348 [0,2,0,0,0,0|1,1,0]=4 5721 B8R1.1 OC[C@@H]1CCC(=S)N1 Amb27205006 [0,2,0,0,0,0|1,1,0]=4 5722 B8R1.1 OC[C@@H]1CCC(O)O1 Amb27642087 [0,2,0,0,0,0|0,0,2]=4 5723 B8R1.1 OC[C@@H]1CC[C@@H](O)O1 Amb27220239 [0,2,0,0,0,0|0,0,2]=4 5724 B8R1.1 OC[C@@H]1CC[C@H](O)O1 Amb27664169 [0,2,0,0,0,0|0,0,2]=4 5725 B8R1.1 OC[C@@H]1C[C@@H](O)CO1 Amb22224988 [0,2,0,0,0,0|0,0,2]=4 5726 B8R1.1 OC[C@@H]1C[C@H](O)CO1 Amb22224993 [0,2,0,0,0,0|0,0,2]=4 5727 B8R1.1 OC[C@H]1C[C@@H](O)CO1 Amb22224987 [0,2,0,0,0,0|0,0,2]=4 5728 B8R1.1 OC[C@H]1C[C@H](Br)CO1 Amb27491768 [0,2,0,0,0,0|0,0,2]=4 5729 B8R1.1 O[C@@H]1CC[C@H](CCl)O1 Amb27778464 [0,2,0,0,0,0|0,0,2]=4 5730 B8R1.1 O[C@H]1CC[C@H](CCl)O1 Amb27879445 [0,2,0,0,0,0|0,0,2]=4 5731 B8R1.1 S=C1CCC(CCl)N1 Amb27605868 [0,2,0,0,0,0|1,1,0]=4 5732 B8R1.1 S=C1OC(CCl)CS1 Amb27461326 [0,2,0,0,0,0|1,1,0]=4 5733 B8R1.1 [NH3+]C[C@@H]1CCC(=O)O1 Amb28464028 [0,2,0,0,0,0|0,0,0]=2 5734 B8R1.7 C=C(C)C1=NCCO1 Amb17772215 [0,2,0,0,0,0|2,0,0]=4 5735 B8R1.7 CC(=O)C1=CCCC1 Amb22338190 [0,2,0,0,0,0|1,0,0]=3 5736 B8R1.7 CC(=O)C1=CCCN1 Amb27880337 [0,2,0,0,0,0|1,0,1]=4 5737 B8R1.7 CC(=O)C1=CCCO1 Amb25759909 [0,2,0,0,0,0|0,0,1]=3 5738 B8R1.7 CC(=O)C1=CNCC1 Amb27455189 [0,2,0,0,0,0|2,0,0]=4 5739 B8R1.7 CC(=O)C1=NCCO1 Amb24481446 [0,2,0,0,0,0|1,0,0]=3 5740 B8R1.7 CC(=O)C1=NCCS1 Amb8384455 [0,2,0,0,0,0|1,1,0]=4 5741 B8R1.7 CC(=O)C1=NCSC1 Amb27985534 [0,2,0,0,0,0|2,0,0]=4 5742 B8R1.7 CC(=O)C1CCCC1 Amb2612425 [0,2,0,0,0,0|1,0,1]=4 5743 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,2,0,0,0,0|1,0,1]=4 5744 B8R1.7 CC(=O)C1CCCN1 Amb33870768 [0,2,0,0,0,0|1,0,1]=4 5745 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [0,2,0,0,0,0|0,0,1]=3 5746 B8R1.7 CC(=O)C1CCCS1 Amb27838322 [0,2,0,0,0,0|0,1,1]=4 5747 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [0,2,0,0,0,0|1,0,1]=4 5748 B8R1.7 CC(=O)C1OCCS1 Amb27262730 [0,2,0,0,0,0|1,0,1]=4 5749 B8R1.7 CC(=O)N1CCCC1 Amb3358093 [0,2,0,0,0,0|2,0,0]=4 5750 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb27170693 [0,2,0,0,0,0|1,0,1]=4 5751 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb31291120 [0,2,0,0,0,0|1,0,1]=4 5752 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [0,2,0,0,0,0|0,0,1]=3 5753 B8R1.7 CC(=O)[C@H]1CCCN1 Amb27453624 [0,2,0,0,0,0|1,0,1]=4 5754 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [0,2,0,0,0,0|0,0,1]=3 5755 B8R1.7 CC(Br)C1CCCO1 Amb28396581 [0,2,0,0,0,0|1,0,1]=4 5756 B8R1.7 CC(C)C1=CCCC1 Amb24333121 [0,2,0,0,0,0|2,0,0]=4 5757 B8R1.7 CC(C)C1=NCCC1 Amb24053778 [0,2,0,0,0,0|2,0,0]=4 5758 B8R1.7 CC(C)C1=NCCO1 Amb24057543 [0,2,0,0,0,0|2,0,0]=4 5759 B8R1.7 CC(Cl)C1=NCCO1 Amb28249749 [0,2,0,0,0,0|2,0,0]=4 5760 B8R1.7 CC(N)C1CCCO1 Amb21955382 [0,2,0,0,0,0|1,0,1]=4 5761 B8R1.7 CC(N)C1CCCO1 Amb6888490 [0,2,0,0,0,0|1,0,1]=4 5762 B8R1.7 CC(O)C1=CCCO1 Amb28369933 [0,2,0,0,0,0|0,0,2]=4 5763 B8R1.7 CC(O)C1CCCO1 Amb26319231 [0,2,0,0,0,0|0,0,2]=4 5764 B8R1.7 CC(S)C1CCCO1 Amb28284983 [0,2,0,0,0,0|0,1,1]=4 5765 B8R1.7 CS(=O)C1CCCC1 Amb28049298 [0,2,0,0,0,0|1,0,1]=4 5766 B8R1.7 C[C@@H](N)C1=CCCC1 Amb27165501 [0,2,0,0,0,0|2,0,0]=4 5767 B8R1.7 C[C@@H](N)C1CCCO1 Amb19514591 [0,2,0,0,0,0|1,0,1]=4 5768 B8R1.7 C[C@@H](N)C1CCCO1 Amb29838275 [0,2,0,0,0,0|1,0,1]=4 5769 B8R1.7 C[C@@H](O)C1CCCO1 Amb26854223 [0,2,0,0,0,0|0,0,2]=4 5770 B8R1.7 C[C@H](Br)[C@@H]1CCCO1 Amb27844359 [0,2,0,0,0,0|1,0,1]=4 5771 B8R1.7 C[C@H](N)C1CCCO1 Amb26872609 [0,2,0,0,0,0|1,0,1]=4 5772 B8R1.7 C[C@H](O)C1=CCCC1 Amb27781375 [0,2,0,0,0,0|1,0,1]=4 5773 B8R1.7 C[C@H](O)C1CCCO1 Amb25985121 [0,2,0,0,0,0|0,0,2]=4 5774 B8R1.7 C[C@H](O)[C@H]1CCCO1 Amb26563465 [0,2,0,0,0,0|0,0,2]=4 5775 B8R1.7 C[N+](C)=C1CCCC1 Amb2779779 [0,2,0,0,0,0|2,0,0]=4 5776 B8R1.7 ClC(Cl)=C1OCCO1 Amb27397380 [0,2,0,0,0,0|2,0,0]=4 5777 B8R1.7 FC(Br)=C1CCCC1 Amb32993482 [0,2,0,0,0,0|2,0,0]=4 5778 B8R1.7 N=C(N)C1CCCO1 Amb22059430 [0,2,0,0,0,0|1,0,1]=4 5779 B8R1.7 N=C(N)C1CCCO1 Amb28934896 [0,2,0,0,0,0|1,0,1]=4 5780 B8R1.7 NC(=O)C1=CCCC1 Amb20622488 [0,2,0,0,0,0|1,0,0]=3 5781 B8R1.7 NC(=O)C1=COCC1 Amb27837543 [0,2,0,0,0,0|2,0,0]=4 5782 B8R1.7 NC(=O)C1=NCCN1 Amb1068371 [0,2,0,0,0,0|2,0,0]=4 5783 B8R1.7 NC(=O)C1CCCC1 Amb8858372 [0,2,0,0,0,0|1,0,1]=4 5784 B8R1.7 NC(=O)C1CCCN1 Amb2720282 [0,2,0,0,0,0|1,0,1]=4 5785 B8R1.7 NC(=O)C1CCCN1 Amb9724672 [0,2,0,0,0,0|1,0,1]=4 5786 B8R1.7 NC(=O)C1CCCO1 Amb33545693 [0,2,0,0,0,0|0,0,1]=3 5787 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [0,2,0,0,0,0|2,0,0]=4 5788 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,2,0,0,0,0|1,0,1]=4 5789 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb2690398 [0,2,0,0,0,0|1,0,1]=4 5790 B8R1.7 NC(=O)[C@@H]1CCCO1 Amb4166303 [0,2,0,0,0,0|0,0,1]=3 5791 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,2,0,0,0,0|1,0,1]=4 5792 B8R1.7 NC(=O)[C@H]1CCCN1 Amb2690397 [0,2,0,0,0,0|1,0,1]=4 5793 B8R1.7 NC(=O)[C@H]1CNCO1 Amb27838356 [0,2,0,0,0,0|1,0,1]=4 5794 B8R1.7 NC(=S)C1CCCO1 Amb18108094 [0,2,0,0,0,0|0,1,1]=4 5795 B8R1.7 NS(=O)C1CCCC1 Amb26405101 [0,2,0,0,0,0|1,0,1]=4 5796 B8R1.7 O=C(Br)C1CCCC1 Amb27793826 [0,2,0,0,0,0|1,0,1]=4 5797 B8R1.7 O=C(Cl)C1=CCCC1 Amb25870845 [0,2,0,0,0,0|1,0,0]=3 5798 B8R1.7 O=C(Cl)C1CCCC1 Amb3939172 [0,2,0,0,0,0|1,0,1]=4 5799 B8R1.7 O=C(Cl)C1CCCN1 Amb27258805 [0,2,0,0,0,0|1,0,1]=4 5800 B8R1.7 O=C(Cl)C1CCCO1 Amb5747111 [0,2,0,0,0,0|0,0,1]=3 5801 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [0,2,0,0,0,0|0,1,1]=4 5802 B8R1.7 O=C(Cl)N1CCCC1 Amb8516771 [0,2,0,0,0,0|2,0,0]=4 5803 B8R1.7 O=C(Cl)[C@@H]1CCCN1 Amb28313801 [0,2,0,0,0,0|1,0,1]=4 5804 B8R1.7 O=C(O)C1=CCCC1 Amb3940288 [0,2,0,0,0,0|1,0,0]=3 5805 B8R1.7 O=C(O)C1=CCCN1 Amb17593173 [0,2,0,0,0,0|1,0,1]=4 5806 B8R1.7 O=C(O)C1=CCCO1 Amb19148920 [0,2,0,0,0,0|0,0,1]=3 5807 B8R1.7 O=C(O)C1=CCCS1 Amb18642795 [0,2,0,0,0,0|0,1,1]=4 5808 B8R1.7 O=C(O)C1=CCNC1 Amb26017269 [0,2,0,0,0,0|2,0,0]=4 5809 B8R1.7 O=C(O)C1=CCOC1 Amb24434391 [0,2,0,0,0,0|2,0,0]=4 5810 B8R1.7 O=C(O)C1=CCSC1 Amb18642797 [0,2,0,0,0,0|2,0,0]=4 5811 B8R1.7 O=C(O)C1=COCC1 Amb18124248 [0,2,0,0,0,0|2,0,0]=4 5812 B8R1.7 O=C(O)C1=NCCN1 Amb27787520 [0,2,0,0,0,0|2,0,0]=4 5813 B8R1.7 O=C(O)C1=NOCC1 Amb24353499 [0,2,0,0,0,0|2,0,0]=4 5814 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [0,2,0,0,0,0|1,0,1]=4 5815 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [0,2,0,0,0,0|1,0,1]=4 5816 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [0,2,0,0,0,0|1,0,1]=4 5817 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [0,2,0,0,0,0|0,0,1]=3 5818 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [0,2,0,0,0,0|0,1,1]=4 5819 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [0,2,0,0,0,0|1,0,1]=4 5820 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [0,2,0,0,0,0|1,0,1]=4 5821 B8R1.7 O=C(O)C1COCO1 Amb27810510 [0,2,0,0,0,0|1,0,1]=4 5822 B8R1.7 O=C(O)C1OCCO1 Amb24349582 [0,2,0,0,0,0|1,0,1]=4 5823 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [0,2,0,0,0,0|1,0,1]=4 5824 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [0,2,0,0,0,0|1,0,1]=4 5825 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [0,2,0,0,0,0|0,0,1]=3 5826 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [0,2,0,0,0,0|1,0,1]=4 5827 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [0,2,0,0,0,0|0,0,1]=3 5828 B8R1.7 O=C(S)C1CCCO1 Amb27827519 [0,2,0,0,0,0|0,0,1]=3 5829 B8R1.7 O=C(S)[C@@H]1CCCN1 Amb27468669 [0,2,0,0,0,0|1,0,1]=4 5830 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [0,2,0,0,0,0|0,0,1]=3 5831 B8R1.7 O=C([O-])[C@@H]1CCCN1 Amb34160472 [0,2,0,0,0,0|1,0,1]=4 5832 B8R1.7 O=S(Cl)C1CCCC1 Amb25914787 [0,2,0,0,0,0|1,0,1]=4 5833 B8R1.7 O=S([O-])C1CCCC1 Amb26419894 [0,2,0,0,0,0|1,0,1]=4 5834 B8R1.7 O=[N+]([O-])C1=CCCC1 Amb27874503 [0,2,0,0,0,0|1,0,0]=3 5835 B8R1.7 O=[N+]([O-])C1=NOCC1 Amb22234959 [0,2,0,0,0,0|2,0,0]=4 5836 B8R1.7 O=[N+]([O-])C1CCCC1 Amb8517343 [0,2,0,0,0,0|1,0,1]=4 5837 B8R1.7 O=[PH](O)C1CCCN1 Amb27450678 [0,2,0,0,0,0|1,0,1]=4 5838 B8R1.7 OB(O)C1=CCCC1 Amb10068948 [0,2,0,0,0,0|1,0,1]=4 5839 B8R1.7 OB(O)C1=CCCO1 Amb22168857 [0,2,0,0,0,0|0,0,2]=4 5840 B8R1.7 OB(O)C1CCCO1 Amb24317356 [0,2,0,0,0,0|0,0,2]=4 5841 B8R1.8 BrCC=C1CCCC1 Amb28458294 [0,2,0,0,0,0|2,0,0]=4 5842 B8R1.8 BrCCC1CCCO1 Amb33547829 [0,2,0,0,0,0|1,0,1]=4 5843 B8R1.8 C#CCC1=CCCC1 Amb27436315 [0,2,0,0,0,0|2,0,0]=4 5844 B8R1.8 C#CCC1CCCO1 Amb33318708 [0,2,0,0,0,0|1,0,1]=4 5845 B8R1.8 C#CCN1CCCO1 Amb27980234 [0,2,0,0,0,0|2,0,0]=4 5846 B8R1.8 C=CCC1=CCCC1 Amb27969624 [0,2,0,0,0,0|2,0,0]=4 5847 B8R1.8 C=CCC1CCCO1 Amb33484168 [0,2,0,0,0,0|1,0,1]=4 5848 B8R1.8 CCCC1=NCCO1 Amb4034543 [0,2,0,0,0,0|2,0,0]=4 5849 B8R1.8 CCCN1CCCO1 Amb27589395 [0,2,0,0,0,0|2,0,0]=4 5850 B8R1.8 CCOC1=CCCC1 Amb22490985 [0,2,0,0,0,0|1,0,1]=4 5851 B8R1.8 CCOC1=NCCC1 Amb19943923 [0,2,0,0,0,0|1,0,1]=4 5852 B8R1.8 CCOC1CCCO1 Amb22228805 [0,2,0,0,0,0|0,0,2]=4 5853 B8R1.8 CNCC1=CCCC1 Amb28143077 [0,2,0,0,0,0|2,0,0]=4 5854 B8R1.8 CNCC1=CCCO1 Amb28048914 [0,2,0,0,0,0|1,0,1]=4 5855 B8R1.8 CNCC1CCCO1 Amb33483486 [0,2,0,0,0,0|1,0,1]=4 5856 B8R1.8 CNCC1CCCO1 Amb9714028 [0,2,0,0,0,0|1,0,1]=4 5857 B8R1.8 CNC[C@@H]1CCCO1 Amb27153906 [0,2,0,0,0,0|1,0,1]=4 5858 B8R1.8 CNC[C@H]1CCCO1 Amb24526936 [0,2,0,0,0,0|1,0,1]=4 5859 B8R1.8 CONC1=NCCC1 Amb28341138 [0,2,0,0,0,0|1,0,1]=4 5860 B8R1.8 CSCC1CCCO1 Amb26894759 [0,2,0,0,0,0|0,1,1]=4 5861 B8R1.8 C\C=C\C1=CCCC1 Amb27460268 [0,2,0,0,0,0|2,0,0]=4 5862 B8R1.8 ClCCC1=NCCO1 Amb28399375 [0,2,0,0,0,0|2,0,0]=4 5863 B8R1.8 ClCCC1CCCO1 Amb25888267 [0,2,0,0,0,0|1,0,1]=4 5864 B8R1.8 ICCC1CCCO1 Amb27860272 [0,2,0,0,0,0|1,0,1]=4 5865 B8R1.8 N#CC=C1CCCC1 Amb17672923 [0,2,0,0,0,0|2,0,0]=4 5866 B8R1.8 N#CC=C1OCCO1 Amb17593143 [0,2,0,0,0,0|2,0,0]=4 5867 B8R1.8 N#CCC1=CCCC1 Amb6608720 [0,2,0,0,0,0|2,0,0]=4 5868 B8R1.8 N#CCC1CCCO1 Amb9702955 [0,2,0,0,0,0|1,0,1]=4 5869 B8R1.8 N#CCN1CCCO1 Amb28049308 [0,2,0,0,0,0|2,0,0]=4 5870 B8R1.8 N#CNC1=NCCC1 Amb22436020 [0,2,0,0,0,0|2,0,0]=4 5871 B8R1.8 N#C\C=C1/CCCN1 Amb18123359 [0,2,0,0,0,0|2,0,0]=4 5872 B8R1.8 N#C\C=C1\CCCO1 Amb28316221 [0,2,0,0,0,0|1,0,0]=3 5873 B8R1.8 N#C\N=C1/CCCN1 Amb19514565 [0,2,0,0,0,0|2,0,0]=4 5874 B8R1.8 N#C\N=C1\NCCO1 Amb24309375 [0,2,0,0,0,0|2,0,0]=4 5875 B8R1.8 NCCC1=CCCC1 Amb18641665 [0,2,0,0,0,0|2,0,0]=4 5876 B8R1.8 NCCC1=CCCC1 Amb32681165 [0,2,0,0,0,0|2,0,0]=4 5877 B8R1.8 NCCC1=NCCO1 Amb27665941 [0,2,0,0,0,0|2,0,0]=4 5878 B8R1.8 NCCC1CCCO1 Amb13952618 [0,2,0,0,0,0|1,0,1]=4 5879 B8R1.8 NCCC1CCCO1 Amb9708331 [0,2,0,0,0,0|1,0,1]=4 5880 B8R1.8 NCCN1CCCO1 Amb27629498 [0,2,0,0,0,0|2,0,0]=4 5881 B8R1.8 NCC[C@H]1CCCO1 Amb32664981 [0,2,0,0,0,0|1,0,1]=4 5882 B8R1.8 NCC[C@H]1CCCO1 Amb32670639 [0,2,0,0,0,0|1,0,1]=4 5883 B8R1.8 NC\C=C1/CCCS1 Amb27469674 [0,2,0,0,0,0|1,1,0]=4 5884 B8R1.8 NC\C=C1\CCCS1 Amb28059808 [0,2,0,0,0,0|1,1,0]=4 5885 B8R1.8 NNCC1CCCO1 Amb10610188 [0,2,0,0,0,0|1,0,1]=4 5886 B8R1.8 NNCC1CCCO1 Amb10610215 [0,2,0,0,0,0|1,0,1]=4 5887 B8R1.8 NNCC1CCCO1 Amb6250908 [0,2,0,0,0,0|1,0,1]=4 5888 B8R1.8 NNC[C@@H]1CCCO1 Amb28396855 [0,2,0,0,0,0|1,0,1]=4 5889 B8R1.8 NNC[C@H]1CCCO1 Amb28057953 [0,2,0,0,0,0|1,0,1]=4 5890 B8R1.8 NOCC1CCCO1 Amb17231830 [0,2,0,0,0,0|0,0,2]=4 5891 B8R1.8 N\N=C\C1CCCO1 Amb27409222 [0,2,0,0,0,0|1,0,1]=4 5892 B8R1.8 O=C=CC1CCCC1 Amb27184572 [0,2,0,0,0,0|1,0,1]=4 5893 B8R1.8 O=C=NC1CCCC1 Amb901882 [0,2,0,0,0,0|1,0,1]=4 5894 B8R1.8 O=C=NC1CCCN1 Amb28126852 [0,2,0,0,0,0|1,0,1]=4 5895 B8R1.8 O=C=NC1CCCO1 Amb6257879 [0,2,0,0,0,0|0,0,1]=3 5896 B8R1.8 O=C=NP1OCCO1 Amb27803130 [0,2,0,0,0,0|2,0,0]=4 5897 B8R1.8 O=CCC1CCCC1 Amb17672924 [0,2,0,0,0,0|1,0,1]=4 5898 B8R1.8 O=CCC1CCCO1 Amb18641800 [0,2,0,0,0,0|0,0,1]=3 5899 B8R1.8 O=CCC1CCCS1 Amb25195330 [0,2,0,0,0,0|0,1,1]=4 5900 B8R1.8 O=CCC1OCCO1 Amb18831794 [0,2,0,0,0,0|1,0,1]=4 5901 B8R1.8 O=CCN1CCCC1 Amb33801466 [0,2,0,0,0,0|2,0,0]=4 5902 B8R1.8 O=CCN1CCCO1 Amb28198674 [0,2,0,0,0,0|1,0,0]=3 5903 B8R1.8 O=CNC1CCCC1 Amb26611065 [0,2,0,0,0,0|1,0,1]=4 5904 B8R1.8 O=C\C=C1\CCCO1 Amb26868026 [0,2,0,0,0,0|0,0,0]=2 5905 B8R1.8 OCCC1CCCO1 Amb20622383 [0,2,0,0,0,0|0,0,2]=4 5906 B8R1.8 OCC[C@@H]1CCCO1 Amb27836253 [0,2,0,0,0,0|0,0,2]=4 5907 B8R1.8 OCC[C@H]1CCCO1 Amb27431469 [0,2,0,0,0,0|0,0,2]=4 5908 B8R1.8 ONCC1CCCO1 Amb25684501 [0,2,0,0,0,0|0,0,2]=4 5909 B8R1.8 O\N=C\C1CCCO1 Amb27251474 [0,2,0,0,0,0|0,0,2]=4 5910 B8R1.8 S=C=NC1CCCO1 Amb22330495 [0,2,0,0,0,0|0,1,1]=4 5911 B8R1.8 SCCC1CCCO1 Amb27220272 [0,2,0,0,0,0|0,1,1]=4 5912 B8R1.8 [C-]#[N+]CC1CCCO1 Amb3973129 [0,2,0,0,0,0|1,0,1]=4 5913 B8R1.11 C#CC1CCOC1C Amb33169153 [0,2,0,0,0,0|1,0,1]=4 5914 B8R1.11 C#C[C@@H]1OCC[C@@H]1Cl Amb24520205 [0,2,0,0,0,0|1,0,1]=4 5915 B8R1.11 C#C[C@@H]1OCC[C@H]1Cl Amb33295212 [0,2,0,0,0,0|1,0,1]=4 5916 B8R1.11 C#C[C@H]1OCC[C@H]1Cl Amb24624692 [0,2,0,0,0,0|1,0,1]=4 5917 B8R1.11 C=C1CCC[C@@H]1CO Amb27775869 [0,2,0,0,0,0|2,0,0]=4 5918 B8R1.11 C=CC1=CCCC1=O Amb27854964 [0,2,0,0,0,0|1,0,1]=4 5919 B8R1.11 C=CC1=CCCC1O Amb28429765 [0,2,0,0,0,0|2,0,0]=4 5920 B8R1.11 C=CC1CCNC1=O Amb27459841 [0,2,0,0,0,0|1,0,0]=3 5921 B8R1.11 C=CC1CCOC1C Amb33427133 [0,2,0,0,0,0|1,0,1]=4 5922 B8R1.11 C=CC1NCCC1=O Amb28073414 [0,2,0,0,0,0|2,0,0]=4 5923 B8R1.11 C=CC1OCCC1N Amb25080525 [0,2,0,0,0,0|1,0,1]=4 5924 B8R1.11 C=CC1OCCC1N Amb32661547 [0,2,0,0,0,0|1,0,1]=4 5925 B8R1.11 C=CN1CCCC1=O Amb15691738 [0,2,0,0,0,0|1,0,0]=3 5926 B8R1.11 C=CN1CCCC1=O Amb6608815 [0,2,0,0,0,0|1,0,0]=3 5927 B8R1.11 C=CN1CCCC1=O Amb8627756 [0,2,0,0,0,0|1,0,0]=3 5928 B8R1.11 C=CN1CCOC1=O Amb24595910 [0,2,0,0,0,0|1,0,0]=3 5929 B8R1.11 C=C[C@@H]1OCC[C@@H]1Cl Amb27959188 [0,2,0,0,0,0|1,0,1]=4 5930 B8R1.11 C=C[C@@H]1OCC[C@@H]1O Amb27215074 [0,2,0,0,0,0|1,0,1]=4 5931 B8R1.11 C=C[C@@H]1OCC[C@H]1N Amb27250501 [0,2,0,0,0,0|1,0,1]=4 5932 B8R1.11 C=C[C@@H]1OCC[C@H]1N Amb32661830 [0,2,0,0,0,0|1,0,1]=4 5933 B8R1.11 C=C[C@@H]1OCC[C@H]1O Amb28053797 [0,2,0,0,0,0|1,0,1]=4 5934 B8R1.11 C=C[C@H]1OCC[C@@H]1N Amb28283159 [0,2,0,0,0,0|1,0,1]=4 5935 B8R1.11 C=C[C@H]1OCC[C@H]1O Amb27210232 [0,2,0,0,0,0|1,0,1]=4 5936 B8R1.11 CC1=C(C#N)CCC1 Amb17593114 [0,2,0,0,0,0|2,0,0]=4 5937 B8R1.11 CC1=C(C=O)CCO1 Amb28320103 [0,2,0,0,0,0|1,0,1]=4 5938 B8R1.11 CC1=C(C=O)SCC1 Amb18642671 [0,2,0,0,0,0|0,1,1]=4 5939 B8R1.11 CC1=C(CO)CCO1 Amb8392376 [0,2,0,0,0,0|1,0,1]=4 5940 B8R1.11 CC1CCC=C1C#N Amb28286175 [0,2,0,0,0,0|2,0,0]=4 5941 B8R1.11 CC1CCC=C1CCl Amb27816584 [0,2,0,0,0,0|2,0,0]=4 5942 B8R1.11 CC1CCCC1C=O Amb18124243 [0,2,0,0,0,0|1,0,1]=4 5943 B8R1.11 CC1CCC\C1=N/N Amb27457539 [0,2,0,0,0,0|2,0,0]=4 5944 B8R1.11 CC1CCOC1C=O Amb28068828 [0,2,0,0,0,0|0,0,1]=3 5945 B8R1.11 CC1CCOC1CCl Amb27780309 [0,2,0,0,0,0|1,0,1]=4 5946 B8R1.11 CC1CCOC1CI Amb28287052 [0,2,0,0,0,0|1,0,1]=4 5947 B8R1.11 CC1OCCC1C=O Amb18641773 [0,2,0,0,0,0|1,0,1]=4 5948 B8R1.11 CC1OCCC1CBr Amb33550567 [0,2,0,0,0,0|1,0,1]=4 5949 B8R1.11 CC1OCCC1CCl Amb25882789 [0,2,0,0,0,0|1,0,1]=4 5950 B8R1.11 CC1OCCC1CO Amb26515717 [0,2,0,0,0,0|1,0,1]=4 5951 B8R1.11 CC1OCCC1CS Amb33426771 [0,2,0,0,0,0|1,0,1]=4 5952 B8R1.11 CC1OCCC1NN Amb25696875 [0,2,0,0,0,0|1,0,1]=4 5953 B8R1.11 CCC1=C(C)CCC1 Amb22227944 [0,2,0,0,0,0|2,0,0]=4 5954 B8R1.11 CCC1=C(S)CCO1 Amb28253028 [0,2,0,0,0,0|1,0,1]=4 5955 B8R1.11 CCC1=CCCC1=O Amb17778667 [0,2,0,0,0,0|1,0,1]=4 5956 B8R1.11 CCC1=CCCC1C Amb26515704 [0,2,0,0,0,0|2,0,0]=4 5957 B8R1.11 CCC1=NCCC1C Amb26621065 [0,2,0,0,0,0|2,0,0]=4 5958 B8R1.11 CCC1CCCC1=O Amb16187019 [0,2,0,0,0,0|1,0,0]=3 5959 B8R1.11 CCC1CCNC1=O Amb19516780 [0,2,0,0,0,0|1,0,0]=3 5960 B8R1.11 CCC1CCOC1=O Amb23538353 [0,2,0,0,0,0|0,0,0]=2 5961 B8R1.11 CCC1CCSC1=O Amb27420755 [0,2,0,0,0,0|0,1,0]=3 5962 B8R1.11 CCC1COCC1=O Amb29866231 [0,2,0,0,0,0|2,0,0]=4 5963 B8R1.11 CCC1NCCC1=O Amb18833066 [0,2,0,0,0,0|2,0,0]=4 5964 B8R1.11 CCC1OCCC1=O Amb28324362 [0,2,0,0,0,0|2,0,0]=4 5965 B8R1.11 CCC1OCCC1N Amb25702085 [0,2,0,0,0,0|1,0,1]=4 5966 B8R1.11 CCC1OCCC1O Amb27197541 [0,2,0,0,0,0|1,0,1]=4 5967 B8R1.11 CCC1SCCC1=O Amb27825839 [0,2,0,0,0,0|2,0,0]=4 5968 B8R1.11 CCC1SCNC1=O Amb27838311 [0,2,0,0,0,0|2,0,0]=4 5969 B8R1.11 CCN1CCCC1=O Amb8390680 [0,2,0,0,0,0|1,0,0]=3 5970 B8R1.11 CCN1CCNC1=O Amb19333131 [0,2,0,0,0,0|2,0,0]=4 5971 B8R1.11 CCN1CNCC1=O Amb24391792 [0,2,0,0,0,0|2,0,0]=4 5972 B8R1.11 CCN1OCCC1=O Amb28197287 [0,2,0,0,0,0|2,0,0]=4 5973 B8R1.11 CC[C@@H]1CCCC1=O Amb27164677 [0,2,0,0,0,0|1,0,0]=3 5974 B8R1.11 CC[C@@H]1OCC[C@H]1Br Amb27634877 [0,2,0,0,0,0|1,0,1]=4 5975 B8R1.11 CC[C@@H]1OCC[C@H]1N Amb24401717 [0,2,0,0,0,0|1,0,1]=4 5976 B8R1.11 CC[C@H]1CCCC1=O Amb27256510 [0,2,0,0,0,0|1,0,0]=3 5977 B8R1.11 CC[C@H]1OCC[C@H]1O Amb28435763 [0,2,0,0,0,0|1,0,1]=4 5978 B8R1.11 CN1CCC[C@H]1C=O Amb22225407 [0,2,0,0,0,0|1,0,1]=4 5979 B8R1.11 CN1CCC\C1=N/N Amb27440513 [0,2,0,0,0,0|2,0,0]=4 5980 B8R1.11 CNC1=CCCC1=O Amb28457232 [0,2,0,0,0,0|1,0,1]=4 5981 B8R1.11 CNC1CCNC1=O Amb22059501 [0,2,0,0,0,0|1,0,0]=3 5982 B8R1.11 CNC1CCNC1=O Amb28990981 [0,2,0,0,0,0|1,0,0]=3 5983 B8R1.11 CNC1CCSC1=O Amb27234396 [0,2,0,0,0,0|0,1,0]=3 5984 B8R1.11 CN[C@H]1CCNC1=O Amb28042561 [0,2,0,0,0,0|1,0,0]=3 5985 B8R1.11 CN[C@H]1CCOC1=O Amb28288608 [0,2,0,0,0,0|0,0,0]=2 5986 B8R1.11 COC1=CCCC1=O Amb28316240 [0,2,0,0,0,0|1,0,1]=4 5987 B8R1.11 COC1=CCOC1=O Amb28129835 [0,2,0,0,0,0|0,0,2]=4 5988 B8R1.11 COC1=NCCC1C Amb4136376 [0,2,0,0,0,0|1,0,1]=4 5989 B8R1.11 COC1CCCC1=O Amb24573567 [0,2,0,0,0,0|1,0,0]=3 5990 B8R1.11 COC1CCOC1=O Amb28127714 [0,2,0,0,0,0|0,0,0]=2 5991 B8R1.11 COC1OCCC1Br Amb27865593 [0,2,0,0,0,0|0,0,2]=4 5992 B8R1.11 COC1OCCC1Cl Amb27875300 [0,2,0,0,0,0|0,0,2]=4 5993 B8R1.11 CON1CCOC1=O Amb25769302 [0,2,0,0,0,0|1,0,0]=3 5994 B8R1.11 CO[C@@H]1CC=CC1=O Amb27260476 [0,2,0,0,0,0|1,0,1]=4 5995 B8R1.11 CO[C@@H]1OCC[C@@H]1Br Amb27192193 [0,2,0,0,0,0|0,0,2]=4 5996 B8R1.11 CO[C@H]1CC=CC1=O Amb27262725 [0,2,0,0,0,0|1,0,1]=4 5997 B8R1.11 CO[C@H]1OCC[C@H]1Cl Amb27985879 [0,2,0,0,0,0|0,0,2]=4 5998 B8R1.11 CSC1=CCCC1=O Amb28351431 [0,2,0,0,0,0|1,0,1]=4 5999 B8R1.11 CSC1CCOC1C Amb25763217 [0,2,0,0,0,0|1,0,1]=4 6000 B8R1.11 C[C@@H]1CCC[C@H]1C=O Amb28146820 [0,2,0,0,0,0|1,0,1]=4 6001 B8R1.11 C[C@@H]1CCO[C@@H]1CBr Amb33328854 [0,2,0,0,0,0|1,0,1]=4 6002 B8R1.11 C[C@@H]1CCO[C@@H]1CN Amb33329080 [0,2,0,0,0,0|1,0,1]=4 6003 B8R1.11 C[C@@H]1CCO[C@@H]1CN Amb33331033 [0,2,0,0,0,0|1,0,1]=4 6004 B8R1.11 C[C@@H]1CCO[C@@H]1CO Amb33328615 [0,2,0,0,0,0|0,0,2]=4 6005 B8R1.11 C[C@@H]1OCC[C@@H]1CN Amb22886286 [0,2,0,0,0,0|1,0,1]=4 6006 B8R1.11 C[C@@H]1OCC[C@@H]1CO Amb22886851 [0,2,0,0,0,0|1,0,1]=4 6007 B8R1.11 C[C@H]1CCC=C1C=O Amb28251104 [0,2,0,0,0,0|1,0,0]=3 6008 B8R1.11 C[C@H]1OCC[C@@H]1CO Amb34915718 [0,2,0,0,0,0|1,0,1]=4 6009 B8R1.11 C[C@H]1OCC[C@H]1CO Amb25328798 [0,2,0,0,0,0|1,0,1]=4 6010 B8R1.11 C\C=C1\CCCC1=O Amb25205820 [0,2,0,0,0,0|1,0,0]=3 6011 B8R1.11 C\C=C1\CCCN1C Amb28133589 [0,2,0,0,0,0|2,0,0]=4 6012 B8R1.11 C\C=C1\CCNC1=O Amb28397116 [0,2,0,0,0,0|1,0,1]=4 6013 B8R1.11 ClCC1=C(Cl)CCC1 Amb27807649 [0,2,0,0,0,0|2,0,0]=4 6014 B8R1.11 N#CC1=C(N)CCC1 Amb6315906 [0,2,0,0,0,0|2,0,0]=4 6015 B8R1.11 N#CC1=C(N)OCC1 Amb23513634 [0,2,0,0,0,0|1,0,1]=4 6016 B8R1.11 N#CC1=C([NH-])CCC1 Amb6892987 [0,2,0,0,0,0|2,0,0]=4 6017 B8R1.11 N#CC1=CCCC1=O Amb28253685 [0,2,0,0,0,0|1,0,1]=4 6018 B8R1.11 N#CC1CCCC1=N Amb4036622 [0,2,0,0,0,0|2,0,0]=4 6019 B8R1.11 N#CC1CCCC1=O Amb9774970 [0,2,0,0,0,0|1,0,0]=3 6020 B8R1.11 N#CC1CCNC1=O Amb24053097 [0,2,0,0,0,0|1,0,0]=3 6021 B8R1.11 N#CC1CCOC1=O Amb6669560 [0,2,0,0,0,0|0,0,0]=2 6022 B8R1.11 N#CC1CCSC1=O Amb28206797 [0,2,0,0,0,0|0,1,0]=3 6023 B8R1.11 N#CC1CNCC1=O Amb22297522 [0,2,0,0,0,0|2,0,0]=4 6024 B8R1.11 N#CC1COCC1=O Amb24183529 [0,2,0,0,0,0|2,0,0]=4 6025 B8R1.11 N#CC1CSCC1=O Amb597776 [0,2,0,0,0,0|2,0,0]=4 6026 B8R1.11 N#CN1CCCC1=O Amb27784093 [0,2,0,0,0,0|1,0,0]=3 6027 B8R1.11 N#C[C@@H]1OCC[C@@H]1Cl Amb33038504 [0,2,0,0,0,0|1,0,1]=4 6028 B8R1.11 N#C[C@@H]1OCC[C@H]1Br Amb33299279 [0,2,0,0,0,0|1,0,1]=4 6029 B8R1.11 N#C[C@@H]1OCC[C@H]1Cl Amb27228676 [0,2,0,0,0,0|1,0,1]=4 6030 B8R1.11 N#C[C@H]1CCCC1=O Amb25979444 [0,2,0,0,0,0|1,0,0]=3 6031 B8R1.11 NCC1CCCC1=O Amb18833069 [0,2,0,0,0,0|1,0,0]=3 6032 B8R1.11 NCC1CCCC1=O Amb28934823 [0,2,0,0,0,0|1,0,0]=3 6033 B8R1.11 NCC1CCCS1=O Amb27872352 [0,2,0,0,0,0|2,0,0]=4 6034 B8R1.11 NCC1CCNC1=O Amb18833033 [0,2,0,0,0,0|1,0,0]=3 6035 B8R1.11 NCC1CCOC1=O Amb28398456 [0,2,0,0,0,0|0,0,0]=2 6036 B8R1.11 NCC1CCOC1=O Amb32653583 [0,2,0,0,0,0|0,0,0]=2 6037 B8R1.11 NCC1CSCC1=O Amb24529601 [0,2,0,0,0,0|2,0,0]=4 6038 B8R1.11 NCC1OCCC1S Amb27201418 [0,2,0,0,0,0|1,0,1]=4 6039 B8R1.11 NNC1CNNC1=O Amb28057143 [0,2,0,0,0,0|2,0,0]=4 6040 B8R1.11 N\C=C1/CCCC1=O Amb28324124 [0,2,0,0,0,0|1,0,0]=3 6041 B8R1.11 N\C=C1\CCOC1=O Amb24575038 [0,2,0,0,0,0|0,0,1]=3 6042 B8R1.11 O=C1C=CCC1CO Amb27802494 [0,2,0,0,0,0|1,0,1]=4 6043 B8R1.11 O=C1CCC=C1CBr Amb27232822 [0,2,0,0,0,0|1,0,1]=4 6044 B8R1.11 O=C1CCCC1CCl Amb25111572 [0,2,0,0,0,0|1,0,0]=3 6045 B8R1.11 O=C1CCCC1CO Amb22491993 [0,2,0,0,0,0|1,0,0]=3 6046 B8R1.11 O=C1CCCN1CBr Amb24082678 [0,2,0,0,0,0|1,0,0]=3 6047 B8R1.11 O=C1CCCN1CCl Amb2793504 [0,2,0,0,0,0|1,0,0]=3 6048 B8R1.11 O=C1CCCN1CO Amb33552754 [0,2,0,0,0,0|1,0,0]=3 6049 B8R1.11 O=C1CCC[C@@H]1CO Amb28049022 [0,2,0,0,0,0|1,0,0]=3 6050 B8R1.11 O=C1CCC\C1=C/[O-] Amb19515665 [0,2,0,0,0,0|1,0,0]=3 6051 B8R1.11 O=C1CCC\C1=C\O Amb32439040 [0,2,0,0,0,0|1,0,0]=3 6052 B8R1.11 O=C1CCO\C1=C\O Amb25929807 [0,2,0,0,0,0|0,0,2]=4 6053 B8R1.11 O=C1CCSN1CCl Amb27197784 [0,2,0,0,0,0|2,0,0]=4 6054 B8R1.11 O=C1NCCC1CO Amb33531235 [0,2,0,0,0,0|1,0,0]=3 6055 B8R1.11 O=C1NCCN1CO Amb24761511 [0,2,0,0,0,0|2,0,0]=4 6056 B8R1.11 O=C1NCC\C1=N/O Amb27838387 [0,2,0,0,0,0|1,0,1]=4 6057 B8R1.11 O=C1OC=CC1CO Amb28129883 [0,2,0,0,0,0|0,0,2]=4 6058 B8R1.11 O=C1OCC=C1CBr Amb27632284 [0,2,0,0,0,0|0,0,2]=4 6059 B8R1.11 O=C1OCCC1CO Amb26431337 [0,2,0,0,0,0|0,0,0]=2 6060 B8R1.11 O=C1OCC\C1=N\O Amb2610304 [0,2,0,0,0,0|0,0,1]=3 6061 B8R1.11 O=C1OCOC1CCl Amb28367648 [0,2,0,0,0,0|1,0,0]=3 6062 B8R1.11 O=C1OCO\C1=C\Cl Amb28194356 [0,2,0,0,0,0|1,0,1]=4 6063 B8R1.11 O=C1SCCC1CO Amb17593391 [0,2,0,0,0,0|0,1,0]=3 6064 B8R1.11 O=C1SCCN1CO Amb25135741 [0,2,0,0,0,0|1,1,0]=4 6065 B8R1.11 O=CC1=C(Cl)CCC1 Amb17593382 [0,2,0,0,0,0|1,0,0]=3 6066 B8R1.11 O=CC1CCCC1=O Amb24480732 [0,2,0,0,0,0|1,0,0]=3 6067 B8R1.11 O=CC1CCCC1O Amb28048922 [0,2,0,0,0,0|1,0,1]=4 6068 B8R1.11 O=CC1CCOC1=O Amb17593177 [0,2,0,0,0,0|0,0,0]=2 6069 B8R1.11 O=CC1COCC1=O Amb27165171 [0,2,0,0,0,0|2,0,0]=4 6070 B8R1.11 O=CN1CCCC1=O Amb28293371 [0,2,0,0,0,0|1,0,0]=3 6071 B8R1.11 O=CN1CCCC1O Amb27857600 [0,2,0,0,0,0|2,0,0]=4 6072 B8R1.11 O=CN1CCNC1=O Amb27643561 [0,2,0,0,0,0|2,0,0]=4 6073 B8R1.11 O=NN1CCCC1=O Amb27837848 [0,2,0,0,0,0|1,0,0]=3 6074 B8R1.11 OCC1=C(Br)CCC1 Amb28316143 [0,2,0,0,0,0|1,0,1]=4 6075 B8R1.11 OCC1=C(Cl)CCC1 Amb28138779 [0,2,0,0,0,0|1,0,1]=4 6076 B8R1.11 OCC1OCCC1F Amb25808078 [0,2,0,0,0,0|0,0,2]=4 6077 B8R1.11 OCC1OCCC1O Amb26993579 [0,2,0,0,0,0|0,0,2]=4 6078 B8R1.11 OC[C@H]1OCCC1O Amb27594751 [0,2,0,0,0,0|0,0,2]=4 6079 B8R1.11 OC[C@H]1OCC[C@@H]1O Amb27194035 [0,2,0,0,0,0|0,0,2]=4 6080 B8R1.11 OC[C@H]1OCC[C@H]1F Amb27789566 [0,2,0,0,0,0|0,0,2]=4 6081 B8R1.11 OC[C@H]1OCC[C@H]1O Amb27423676 [0,2,0,0,0,0|0,0,2]=4 6082 B8R1.11 O\N=C1/CCCC1O Amb28069662 [0,2,0,0,0,0|1,0,1]=4 6083 B8R1.11 [C-]#[N+]C1CCOC1C Amb33427242 [0,2,0,0,0,0|1,0,1]=4 6084 B8R1.52 C#CC1(C)CCCO1 Amb33457286 [0,2,0,0,0,0|1,0,1]=4 6085 B8R1.52 CC1(C#N)CCCO1 Amb9173667 [0,2,0,0,0,0|1,0,1]=4 6086 B8R1.52 CC1(C=O)CCCC1 Amb18641706 [0,2,0,0,0,0|1,0,1]=4 6087 B8R1.52 CC1(C=O)CCCO1 Amb18641803 [0,2,0,0,0,0|0,0,1]=3 6088 B8R1.52 CC1(C=O)CCCS1 Amb33532748 [0,2,0,0,0,0|0,1,1]=4 6089 B8R1.52 CC1(C=O)OCCS1 Amb28315729 [0,2,0,0,0,0|1,0,1]=4 6090 B8R1.52 CC1(CBr)CCCO1 Amb25063926 [0,2,0,0,0,0|1,0,1]=4 6091 B8R1.52 CC1(CCl)CCCO1 Amb27195988 [0,2,0,0,0,0|1,0,1]=4 6092 B8R1.52 CC1(CI)CCCO1 Amb28285232 [0,2,0,0,0,0|1,0,1]=4 6093 B8R1.52 CC1(CN)CCCO1 Amb1102373 [0,2,0,0,0,0|1,0,1]=4 6094 B8R1.52 CC1(CN)CCCO1 Amb32643909 [0,2,0,0,0,0|1,0,1]=4 6095 B8R1.52 CC1(CO)CCCO1 Amb20668849 [0,2,0,0,0,0|0,0,2]=4 6096 B8R1.52 CNC1(C)CCCO1 Amb27839551 [0,2,0,0,0,0|1,0,1]=4 6097 B8R1.52 COC1(C)CCCO1 Amb28253139 [0,2,0,0,0,0|0,0,2]=4 6098 B8R1.52 COP1(=O)NCCO1 Amb27184925 [0,2,0,0,0,0|2,0,0]=4 6099 B8R1.52 C[C@]1(CN)CCCO1 Amb25698277 [0,2,0,0,0,0|1,0,1]=4 6100 B8R1.52 O=CC1(Br)CCCC1 Amb25758600 [0,2,0,0,0,0|1,0,1]=4 6101 B8R1.52 O=CC1(Cl)CCCC1 Amb35788343 [0,2,0,0,0,0|1,0,1]=4 6102 B8R1.52 O=CC1(F)CCCC1 Amb27948601 [0,2,0,0,0,0|1,0,1]=4 6103 B8R1.52 O=CC1(O)CCCC1 Amb18124253 [0,2,0,0,0,0|1,0,1]=4 6104 B8R1.18 C=C1CC(=O)OC1=O Amb3940408 [0,2,0,0,0,0|0,0,2]=4 6105 B8R1.18 C=C1CC(C)NC1=O Amb27201887 [0,2,0,0,0,0|1,0,1]=4 6106 B8R1.18 C=C1CC(C)OC1=O Amb8389608 [0,2,0,0,0,0|0,0,1]=3 6107 B8R1.18 CC1=C(C)CC(Cl)C1 Amb28046095 [0,2,0,0,0,0|2,0,0]=4 6108 B8R1.18 CC1=C(F)CC(O)C1 Amb28345465 [0,2,0,0,0,0|2,0,0]=4 6109 B8R1.18 CC1=CC(=O)C(Br)C1 Amb28284387 [0,2,0,0,0,0|1,0,1]=4 6110 B8R1.18 CC1=CC(=O)C(C)C1 Amb24647798 [0,2,0,0,0,0|1,0,1]=4 6111 B8R1.18 CC1=CC(=O)C(Cl)C1 Amb27750318 [0,2,0,0,0,0|1,0,1]=4 6112 B8R1.18 CC1=CC(=O)CC1C Amb16191977 [0,2,0,0,0,0|1,0,1]=4 6113 B8R1.18 CC1=CC(=O)C[C@@H]1C Amb28316193 [0,2,0,0,0,0|1,0,1]=4 6114 B8R1.18 CC1=CC(=O)C[C@H]1C Amb28316192 [0,2,0,0,0,0|1,0,1]=4 6115 B8R1.18 CC1=CC(=O)OC1Br Amb25144076 [0,2,0,0,0,0|0,0,2]=4 6116 B8R1.18 CC1=CC(=O)OC1O Amb8389484 [0,2,0,0,0,0|0,0,2]=4 6117 B8R1.18 CC1=CC(Cl)C(=O)O1 Amb24349720 [0,2,0,0,0,0|0,0,2]=4 6118 B8R1.18 CC1=CC(O)OC1=O Amb24589666 [0,2,0,0,0,0|0,0,2]=4 6119 B8R1.18 CC1=C[C@H](O)CC1=O Amb28316153 [0,2,0,0,0,0|1,0,1]=4 6120 B8R1.18 CC1=NC(C)OC1=O Amb27429121 [0,2,0,0,0,0|1,0,1]=4 6121 B8R1.18 CC1C=C(O)C(=O)O1 Amb24332982 [0,2,0,0,0,0|0,0,2]=4 6122 B8R1.18 CC1CC(=N)NC1C Amb27655587 [0,2,0,0,0,0|2,0,0]=4 6123 B8R1.18 CC1CC(=O)C(=O)C1 Amb27256511 [0,2,0,0,0,0|1,0,0]=3 6124 B8R1.18 CC1CC(=O)C(C)C1 Amb26510571 [0,2,0,0,0,0|1,0,0]=3 6125 B8R1.18 CC1CC(=O)C(C)O1 Amb26869093 [0,2,0,0,0,0|2,0,0]=4 6126 B8R1.18 CC1CC(=O)CC1C Amb25933629 [0,2,0,0,0,0|1,0,0]=3 6127 B8R1.18 CC1CC(=O)CN1C Amb20669273 [0,2,0,0,0,0|2,0,0]=4 6128 B8R1.18 CC1CC(=O)N(C)C1 Amb10068268 [0,2,0,0,0,0|1,0,0]=3 6129 B8R1.18 CC1CC(=O)N(C)N1 Amb16233050 [0,2,0,0,0,0|2,0,0]=4 6130 B8R1.18 CC1CC(=O)NC1=O Amb10609734 [0,2,0,0,0,0|1,0,1]=4 6131 B8R1.18 CC1CC(=O)NC1C Amb20623595 [0,2,0,0,0,0|1,0,0]=3 6132 B8R1.18 CC1CC(=O)NC1O Amb27975748 [0,2,0,0,0,0|1,0,0]=3 6133 B8R1.18 CC1CC(=O)OC1=O Amb3940407 [0,2,0,0,0,0|0,0,1]=3 6134 B8R1.18 CC1CC(=O)OC1C Amb27873473 [0,2,0,0,0,0|0,0,0]=2 6135 B8R1.18 CC1CC(=O)OC1O Amb26536810 [0,2,0,0,0,0|0,0,0]=2 6136 B8R1.18 CC1CC(Br)C(=O)O1 Amb6608903 [0,2,0,0,0,0|0,0,0]=2 6137 B8R1.18 CC1CC(Br)C(C)O1 Amb27476404 [0,2,0,0,0,0|1,0,1]=4 6138 B8R1.18 CC1CC(C)C(=O)N1 Amb24698782 [0,2,0,0,0,0|1,0,0]=3 6139 B8R1.18 CC1CC(C)C(=O)O1 Amb4017434 [0,2,0,0,0,0|0,0,0]=2 6140 B8R1.18 CC1CC(N)C(=O)O1 Amb32653104 [0,2,0,0,0,0|0,0,0]=2 6141 B8R1.18 CC1CC(N)C(=O)O1 Amb448594 [0,2,0,0,0,0|0,0,0]=2 6142 B8R1.18 CC1CC(N)C(C)O1 Amb24619349 [0,2,0,0,0,0|1,0,1]=4 6143 B8R1.18 CC1CC(N)C(C)O1 Amb30585143 [0,2,0,0,0,0|1,0,1]=4 6144 B8R1.18 CC1CC(O)C(=O)N1 Amb27784846 [0,2,0,0,0,0|1,0,0]=3 6145 B8R1.18 CC1CC(O)C(=O)O1 Amb27451083 [0,2,0,0,0,0|0,0,0]=2 6146 B8R1.18 CC1CC(O)ON1C Amb27472587 [0,2,0,0,0,0|2,0,0]=4 6147 B8R1.18 CC1CC(S)C(C)O1 Amb22234723 [0,2,0,0,0,0|1,0,1]=4 6148 B8R1.18 CC1CN(C)CC1=O Amb20622328 [0,2,0,0,0,0|2,0,0]=4 6149 B8R1.18 CC1C[C@@H](C)CC1=O Amb27424916 [0,2,0,0,0,0|1,0,0]=3 6150 B8R1.18 CC1C[C@H](N)C(=O)O1 Amb27844768 [0,2,0,0,0,0|0,0,0]=2 6151 B8R1.18 CC1C[C@H](O)[C@H](C)O1 Amb27855467 [0,2,0,0,0,0|1,0,1]=4 6152 B8R1.18 CC1NC(=O)C(C)N1 Amb24481399 [0,2,0,0,0,0|2,0,0]=4 6153 B8R1.18 CC1NC(=O)C(C)S1 Amb27784375 [0,2,0,0,0,0|2,0,0]=4 6154 B8R1.18 CC1NC(=O)CC1=O Amb23598276 [0,2,0,0,0,0|1,0,1]=4 6155 B8R1.18 CC1NC(=O)CC1O Amb27792924 [0,2,0,0,0,0|1,0,0]=3 6156 B8R1.18 CC1NC(=O)OC1=O Amb22236022 [0,2,0,0,0,0|1,0,1]=4 6157 B8R1.18 CC1NC(=O)OC1C Amb25747248 [0,2,0,0,0,0|1,0,0]=3 6158 B8R1.18 CC1NC(=O)[C@H](C)N1 Amb28284134 [0,2,0,0,0,0|2,0,0]=4 6159 B8R1.18 CC1NC(=S)OC1=O Amb27410191 [0,2,0,0,0,0|1,0,1]=4 6160 B8R1.18 CC1NC(=S)OC1C Amb28123435 [0,2,0,0,0,0|1,1,0]=4 6161 B8R1.18 CC1OC(=O)C=C1N Amb27838294 [0,2,0,0,0,0|0,0,2]=4 6162 B8R1.18 CC1OC(=O)CC1=O Amb28290899 [0,2,0,0,0,0|0,0,1]=3 6163 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,2,0,0,0,0|1,0,1]=4 6164 B8R1.18 CC1OC(=O)OC1=O Amb28315579 [0,2,0,0,0,0|1,0,1]=4 6165 B8R1.18 CC1OC(=O)OC1C Amb27485944 [0,2,0,0,0,0|1,0,0]=3 6166 B8R1.18 CC1OS(=O)OC1C Amb25997586 [0,2,0,0,0,0|2,0,0]=4 6167 B8R1.18 CN1CC(=O)CC1=O Amb33543710 [0,2,0,0,0,0|1,0,1]=4 6168 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [0,2,0,0,0,0|1,0,1]=4 6169 B8R1.18 CN1CC(N)C(=O)N1 Amb25872890 [0,2,0,0,0,0|2,0,0]=4 6170 B8R1.18 CN1CC(N)CC1=O Amb19373494 [0,2,0,0,0,0|1,0,0]=3 6171 B8R1.18 CN1CC(N)CC1=O Amb8010271 [0,2,0,0,0,0|1,0,0]=3 6172 B8R1.18 CN1CC(O)CC1=O Amb22059466 [0,2,0,0,0,0|1,0,0]=3 6173 B8R1.18 CN1CC(S)CC1=O Amb26845504 [0,2,0,0,0,0|1,0,0]=3 6174 B8R1.18 CN1CS(=O)CC1=O Amb24579772 [0,2,0,0,0,0|2,0,0]=4 6175 B8R1.18 CN1C[C@@H](N)CC1=O Amb24401527 [0,2,0,0,0,0|1,0,0]=3 6176 B8R1.18 CN1C[C@@H](O)CC1=O Amb27806160 [0,2,0,0,0,0|1,0,0]=3 6177 B8R1.18 CN1C[C@H](N)CC1=O Amb33295339 [0,2,0,0,0,0|1,0,0]=3 6178 B8R1.18 CN1C[C@H](O)CC1=O Amb25762416 [0,2,0,0,0,0|1,0,0]=3 6179 B8R1.18 CN1SC(Cl)CC1=O Amb27786768 [0,2,0,0,0,0|2,0,0]=4 6180 B8R1.18 C[C@@H]1C=C(Br)C(=O)C1 Amb28318219 [0,2,0,0,0,0|1,0,1]=4 6181 B8R1.18 C[C@@H]1CC(=O)C[C@H]1C Amb24470272 [0,2,0,0,0,0|1,0,0]=3 6182 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,2,0,0,0,0|0,0,1]=3 6183 B8R1.18 C[C@@H]1C[C@@H](C)C(O)O1 Amb27430981 [0,2,0,0,0,0|0,0,2]=4 6184 B8R1.18 C[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25288126 [0,2,0,0,0,0|0,0,0]=2 6185 B8R1.18 C[C@@H]1C[C@@H](O)C(=S)N1 Amb28133564 [0,2,0,0,0,0|1,1,0]=4 6186 B8R1.18 C[C@@H]1NC(=O)CC1=O Amb18833079 [0,2,0,0,0,0|1,0,1]=4 6187 B8R1.18 C[C@@H]1NC(=O)OC1=O Amb2689575 [0,2,0,0,0,0|1,0,1]=4 6188 B8R1.18 C[C@@H]1NC(=O)O[C@@H]1C Amb28132650 [0,2,0,0,0,0|1,0,0]=3 6189 B8R1.18 C[C@@H]1NC(=O)S[C@H]1C Amb27420158 [0,2,0,0,0,0|1,1,0]=4 6190 B8R1.18 C[C@@H]1OC(=O)C[C@H]1Cl Amb27252234 [0,2,0,0,0,0|0,0,0]=2 6191 B8R1.18 C[C@@H]1OC(O)C[C@H]1C Amb27432218 [0,2,0,0,0,0|0,0,2]=4 6192 B8R1.18 C[C@@H]1O[C@H](O)C[C@H]1C Amb27215270 [0,2,0,0,0,0|0,0,2]=4 6193 B8R1.18 C[C@@H]1S[C@H](C)NC1=O Amb27857156 [0,2,0,0,0,0|2,0,0]=4 6194 B8R1.18 C[C@H]1C=C(Br)C(=O)O1 Amb27244767 [0,2,0,0,0,0|0,0,2]=4 6195 B8R1.18 C[C@H]1CC(=O)C[C@H]1C Amb22230244 [0,2,0,0,0,0|1,0,0]=3 6196 B8R1.18 C[C@H]1CC(=O)NC1=O Amb28119095 [0,2,0,0,0,0|1,0,1]=4 6197 B8R1.18 C[C@H]1CC(=O)OC1=O Amb2609932 [0,2,0,0,0,0|0,0,1]=3 6198 B8R1.18 C[C@H]1CC(=O)O[C@H]1C Amb27471867 [0,2,0,0,0,0|0,0,0]=2 6199 B8R1.18 C[C@H]1CC(=O)[C@H](C)C1 Amb28429622 [0,2,0,0,0,0|1,0,0]=3 6200 B8R1.18 C[C@H]1CC(=O)[C@H](C)O1 Amb28246509 [0,2,0,0,0,0|2,0,0]=4 6201 B8R1.18 C[C@H]1CC(O)O[C@H]1C Amb28321291 [0,2,0,0,0,0|0,0,2]=4 6202 B8R1.18 C[C@H]1C[C@@H](C)C(=O)O1 Amb28060142 [0,2,0,0,0,0|0,0,0]=2 6203 B8R1.18 C[C@H]1C[C@@H](C)NC1=O Amb27619178 [0,2,0,0,0,0|1,0,0]=3 6204 B8R1.18 C[C@H]1C[C@H](O)C(=O)O1 Amb27852763 [0,2,0,0,0,0|0,0,0]=2 6205 B8R1.18 C[C@H]1NC(=N)O[C@@H]1C Amb27420136 [0,2,0,0,0,0|2,0,0]=4 6206 B8R1.18 C[C@H]1NC(=O)C[C@@H]1O Amb28128239 [0,2,0,0,0,0|1,0,0]=3 6207 B8R1.18 C[C@H]1NC(=O)C[C@@H]1S Amb28388503 [0,2,0,0,0,0|1,0,0]=3 6208 B8R1.18 C[C@H]1NC(=O)C[C@H]1O Amb28131156 [0,2,0,0,0,0|1,0,0]=3 6209 B8R1.18 C[C@H]1NC(=O)C[C@H]1S Amb27621424 [0,2,0,0,0,0|1,0,0]=3 6210 B8R1.18 C[C@H]1NC(=O)OC1=O Amb2689574 [0,2,0,0,0,0|1,0,1]=4 6211 B8R1.18 C[C@H]1OC(=O)C[C@@H]1N Amb27973900 [0,2,0,0,0,0|0,0,0]=2 6212 B8R1.18 C[C@H]1OC(=O)C[C@H]1O Amb27775518 [0,2,0,0,0,0|0,0,0]=2 6213 B8R1.18 Cl[C@@H]1O[C@H](Cl)C[C@H]1Cl Amb28131437 [0,2,0,0,0,0|1,0,1]=4 6214 B8R1.18 Cl[C@H]1C[C@@H](Cl)[C@H](Cl)O1 Amb27204829 [0,2,0,0,0,0|1,0,1]=4 6215 B8R1.18 NC1CC(=O)CC1N Amb27486601 [0,2,0,0,0,0|1,0,0]=3 6216 B8R1.18 NC1CC(=O)NC1=O Amb30585083 [0,2,0,0,0,0|1,0,1]=4 6217 B8R1.18 NC1CC(=O)NC1=O Amb9502460 [0,2,0,0,0,0|1,0,1]=4 6218 B8R1.18 NC1CC(=O)OC1=O Amb27216215 [0,2,0,0,0,0|0,0,1]=3 6219 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb25992097 [0,2,0,0,0,0|0,0,1]=3 6220 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb8631355 [0,2,0,0,0,0|0,0,1]=3 6221 B8R1.18 N[C@H]1CC(=O)NC1=O Amb17134612 [0,2,0,0,0,0|1,0,1]=4 6222 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,2,0,0,0,0|0,0,1]=3 6223 B8R1.18 N[C@H]1CC(=O)O[C@H]1O Amb28196677 [0,2,0,0,0,0|0,0,0]=2 6224 B8R1.18 O=C1C=C(Cl)C(Cl)O1 Amb27954144 [0,2,0,0,0,0|0,0,2]=4 6225 B8R1.18 O=C1C=C(Cl)C(O)O1 Amb25889252 [0,2,0,0,0,0|0,0,2]=4 6226 B8R1.18 O=C1CC(=O)C(=O)C1 Amb28126773 [0,2,0,0,0,0|1,0,1]=4 6227 B8R1.18 O=C1CC(=O)C(O)C1 Amb24330382 [0,2,0,0,0,0|1,0,1]=4 6228 B8R1.18 O=C1CC(Cl)C(=O)O1 Amb24677749 [0,2,0,0,0,0|0,0,1]=3 6229 B8R1.18 O=C1CC(O)C(=O)O1 Amb27399619 [0,2,0,0,0,0|0,0,1]=3 6230 B8R1.18 O=C1CC(O)C=C1Br Amb27211868 [0,2,0,0,0,0|1,0,1]=4 6231 B8R1.18 O=C1CC(O)C=C1Cl Amb28048923 [0,2,0,0,0,0|1,0,1]=4 6232 B8R1.18 O=C1CC(O)NC1=O Amb27596054 [0,2,0,0,0,0|1,0,1]=4 6233 B8R1.18 O=C1C[C@@H](F)C(=O)O1 Amb28286140 [0,2,0,0,0,0|0,0,1]=3 6234 B8R1.18 O=C1C[C@@H](O)C=C1Br Amb27256534 [0,2,0,0,0,0|1,0,1]=4 6235 B8R1.18 O=C1C[C@@H](O)C=C1Cl Amb28144065 [0,2,0,0,0,0|1,0,1]=4 6236 B8R1.18 O=C1C[C@@H](O)[C@H](O)C1 Amb27841798 [0,2,0,0,0,0|1,0,0]=3 6237 B8R1.18 O=C1C[C@H](F)C(=O)O1 Amb27406936 [0,2,0,0,0,0|0,0,1]=3 6238 B8R1.18 O=C1NC(O)C(O)N1 Amb6342569 [0,2,0,0,0,0|2,0,0]=4 6239 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,2,0,0,0,0|1,0,0]=3 6240 B8R1.18 O=C1OC(O)C=C1Cl Amb28139781 [0,2,0,0,0,0|0,0,2]=4 6241 B8R1.18 O=C1OC(O)C=C1F Amb32655004 [0,2,0,0,0,0|0,0,2]=4 6242 B8R1.18 O=C1OC(O)CC1O Amb27761542 [0,2,0,0,0,0|0,0,0]=2 6243 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,2,0,0,0,0|1,0,0]=3 6244 B8R1.18 O=S1CC(O)C(O)C1 Amb27954779 [0,2,0,0,0,0|2,0,0]=4 6245 B8R1.50 C=C1C(=O)CCC1C Amb27199153 [0,2,0,0,0,0|1,0,0]=3 6246 B8R1.50 C=C1C(=O)OCC1N Amb18641720 [0,2,0,0,0,0|0,0,1]=3 6247 B8R1.50 C=C1C(=O)OCC1O Amb27768713 [0,2,0,0,0,0|0,0,1]=3 6248 B8R1.50 C=C1C(=O)OC[C@H]1O Amb27945232 [0,2,0,0,0,0|0,0,1]=3 6249 B8R1.50 C=C1C(O)CCC1O Amb27205750 [0,2,0,0,0,0|2,0,0]=4 6250 B8R1.50 C=C1CCC(O)C1C Amb27858013 [0,2,0,0,0,0|2,0,0]=4 6251 B8R1.50 C=C1CCN(C)C1=O Amb24457267 [0,2,0,0,0,0|1,0,1]=4 6252 B8R1.50 CC1=C(Br)C(=O)CC1 Amb10067495 [0,2,0,0,0,0|1,0,1]=4 6253 B8R1.50 CC1=C(Br)C(O)CC1 Amb27225613 [0,2,0,0,0,0|2,0,0]=4 6254 B8R1.50 CC1=C(Br)COC1=O Amb27854509 [0,2,0,0,0,0|0,0,2]=4 6255 B8R1.50 CC1=C(C)C(=O)CC1 Amb22351730 [0,2,0,0,0,0|1,0,1]=4 6256 B8R1.50 CC1=C(C)C(C)CC1 Amb25725570 [0,2,0,0,0,0|2,0,0]=4 6257 B8R1.50 CC1=C(C)[C@H](O)CC1 Amb27785280 [0,2,0,0,0,0|2,0,0]=4 6258 B8R1.50 CC1=C(Cl)C(=O)OC1 Amb26020563 [0,2,0,0,0,0|0,0,2]=4 6259 B8R1.50 CC1=C(Cl)CCC1=O Amb27972997 [0,2,0,0,0,0|1,0,1]=4 6260 B8R1.50 CC1=C(Cl)CC[C@@H]1O Amb27650530 [0,2,0,0,0,0|2,0,0]=4 6261 B8R1.50 CC1=C(Cl)CC[C@H]1O Amb28138741 [0,2,0,0,0,0|2,0,0]=4 6262 B8R1.50 CC1=C(O)C(=O)CC1 Amb4004294 [0,2,0,0,0,0|1,0,1]=4 6263 B8R1.50 CC1=C(O)C(=O)OC1 Amb23571854 [0,2,0,0,0,0|0,0,2]=4 6264 B8R1.50 CC1=C(O)COC1=O Amb2611869 [0,2,0,0,0,0|0,0,2]=4 6265 B8R1.50 CC1=CCC(C)C1=O Amb17778666 [0,2,0,0,0,0|1,0,1]=4 6266 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,2,0,0,0,0|1,0,1]=4 6267 B8R1.50 CC1C(=O)CCC1=O Amb974862 [0,2,0,0,0,0|1,0,1]=4 6268 B8R1.50 CC1C(=O)CCN1C Amb24453852 [0,2,0,0,0,0|2,0,0]=4 6269 B8R1.50 CC1C(=O)COC1=O Amb4035239 [0,2,0,0,0,0|0,0,1]=3 6270 B8R1.50 CC1C(=O)NCN1C Amb28128324 [0,2,0,0,0,0|2,0,0]=4 6271 B8R1.50 CC1C(=O)NCS1=O Amb27630693 [0,2,0,0,0,0|2,0,0]=4 6272 B8R1.50 CC1C(=O)OC[C@@H]1O Amb27208229 [0,2,0,0,0,0|0,0,0]=2 6273 B8R1.50 CC1C(=O)OC[C@H]1O Amb27484790 [0,2,0,0,0,0|0,0,0]=2 6274 B8R1.50 CC1CCC(=O)C1=O Amb4477353 [0,2,0,0,0,0|1,0,0]=3 6275 B8R1.50 CC1CCC(=O)C1C Amb27485174 [0,2,0,0,0,0|1,0,0]=3 6276 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,2,0,0,0,0|1,0,0]=3 6277 B8R1.50 CC1CCC(=O)N1C Amb15693449 [0,2,0,0,0,0|1,0,0]=3 6278 B8R1.50 CC1CCC(C)C1=O Amb27198252 [0,2,0,0,0,0|1,0,0]=3 6279 B8R1.50 CC1CCC(F)C1=O Amb32656355 [0,2,0,0,0,0|1,0,0]=3 6280 B8R1.50 CC1CCN(C)C1=O Amb10068267 [0,2,0,0,0,0|1,0,0]=3 6281 B8R1.50 CC1CNC(=O)C1C Amb24334186 [0,2,0,0,0,0|1,0,0]=3 6282 B8R1.50 CC1CNC(=O)N1Cl Amb27759555 [0,2,0,0,0,0|2,0,0]=4 6283 B8R1.50 CC1COC(=O)C1=O Amb27262699 [0,2,0,0,0,0|0,0,1]=3 6284 B8R1.50 CC1COC(=O)C1Br Amb27401963 [0,2,0,0,0,0|0,0,0]=2 6285 B8R1.50 CC1COC(=S)N1C Amb24524261 [0,2,0,0,0,0|1,1,0]=4 6286 B8R1.50 CC1NCC(=O)N1C Amb24742108 [0,2,0,0,0,0|2,0,0]=4 6287 B8R1.50 CC1NCN(C)C1=O Amb18641804 [0,2,0,0,0,0|2,0,0]=4 6288 B8R1.50 CC1NCN(C)C1=O Amb32664413 [0,2,0,0,0,0|2,0,0]=4 6289 B8R1.50 CC1NCN(O)C1=O Amb28251778 [0,2,0,0,0,0|2,0,0]=4 6290 B8R1.50 CC1NNC(=O)C1C Amb35693716 [0,2,0,0,0,0|2,0,0]=4 6291 B8R1.50 CC1OCC(=O)C1C Amb29866230 [0,2,0,0,0,0|2,0,0]=4 6292 B8R1.50 CC1OCC(=O)C1O Amb28131956 [0,2,0,0,0,0|2,0,0]=4 6293 B8R1.50 CC1OCC(Br)C1C Amb29865898 [0,2,0,0,0,0|1,0,1]=4 6294 B8R1.50 CC1OCC(Cl)C1C Amb29865752 [0,2,0,0,0,0|1,0,1]=4 6295 B8R1.50 CC1OCC(N)C1C Amb35725145 [0,2,0,0,0,0|1,0,1]=4 6296 B8R1.50 CC1OCC(N)C1N Amb27230142 [0,2,0,0,0,0|1,0,1]=4 6297 B8R1.50 CC1OCC(O)C1=O Amb28048942 [0,2,0,0,0,0|2,0,0]=4 6298 B8R1.50 CC1OCC(O)C1C Amb35730974 [0,2,0,0,0,0|1,0,1]=4 6299 B8R1.50 CC1OCC(S)C1C Amb32788141 [0,2,0,0,0,0|1,0,1]=4 6300 B8R1.50 CN1C(=O)CCC1=O Amb6368854 [0,2,0,0,0,0|1,0,1]=4 6301 B8R1.50 CN1C(=O)CCC1O Amb17615583 [0,2,0,0,0,0|1,0,0]=3 6302 B8R1.50 CN1C(=O)COC1=O Amb21927685 [0,2,0,0,0,0|1,0,1]=4 6303 B8R1.50 CN1CCC(=O)C1=O Amb24183817 [0,2,0,0,0,0|1,0,1]=4 6304 B8R1.50 CN1CCC(Br)C1=O Amb19514590 [0,2,0,0,0,0|1,0,0]=3 6305 B8R1.50 CN1CCC(Cl)C1=O Amb26433662 [0,2,0,0,0,0|1,0,0]=3 6306 B8R1.50 CN1CCC(N)C1=O Amb22491599 [0,2,0,0,0,0|1,0,0]=3 6307 B8R1.50 CN1CCC(N)C1=O Amb33538759 [0,2,0,0,0,0|1,0,0]=3 6308 B8R1.50 CN1CCC(O)C1=O Amb20622738 [0,2,0,0,0,0|1,0,0]=3 6309 B8R1.50 CN1CCC(S)C1=N Amb28061196 [0,2,0,0,0,0|2,0,0]=4 6310 B8R1.50 CN1CCN(C)C1=O Amb1195982 [0,2,0,0,0,0|2,0,0]=4 6311 B8R1.50 CN1CCN(N)C1=O Amb24643625 [0,2,0,0,0,0|2,0,0]=4 6312 B8R1.50 CN1CC[C@@H](N)C1=O Amb25303747 [0,2,0,0,0,0|1,0,0]=3 6313 B8R1.50 CN1CC[C@H](N)C1=O Amb25889201 [0,2,0,0,0,0|1,0,0]=3 6314 B8R1.50 CN1OCC(Br)C1=O Amb28396643 [0,2,0,0,0,0|2,0,0]=4 6315 B8R1.50 CN1OCC(N)C1=O Amb25867269 [0,2,0,0,0,0|2,0,0]=4 6316 B8R1.50 C[C@@H]1C(=O)C=C[C@H]1O Amb27785473 [0,2,0,0,0,0|1,0,1]=4 6317 B8R1.50 C[C@@H]1C(=O)CCN1C Amb18833064 [0,2,0,0,0,0|2,0,0]=4 6318 B8R1.50 C[C@@H]1C(=O)CC[C@@H]1O Amb28253966 [0,2,0,0,0,0|1,0,0]=3 6319 B8R1.50 C[C@@H]1C(=O)NC[C@H]1O Amb27881742 [0,2,0,0,0,0|1,0,0]=3 6320 B8R1.50 C[C@@H]1C(=O)OC[C@@H]1N Amb28055949 [0,2,0,0,0,0|0,0,0]=2 6321 B8R1.50 C[C@@H]1CNC(=O)[C@@H]1N Amb27488737 [0,2,0,0,0,0|1,0,0]=3 6322 B8R1.50 C[C@@H]1CNC(=O)[C@H]1C Amb27437481 [0,2,0,0,0,0|1,0,0]=3 6323 B8R1.50 C[C@@H]1CNC(=S)[C@H]1O Amb27494768 [0,2,0,0,0,0|1,1,0]=4 6324 B8R1.50 C[C@@H]1COC(=O)[C@@H]1C Amb28411565 [0,2,0,0,0,0|0,0,0]=2 6325 B8R1.50 C[C@@H]1NCN(C)C1=O Amb27882405 [0,2,0,0,0,0|2,0,0]=4 6326 B8R1.50 C[C@H]1C(=O)OC[C@H]1N Amb27635064 [0,2,0,0,0,0|0,0,0]=2 6327 B8R1.50 C[C@H]1C=CC(=O)[C@@H]1Cl Amb27881804 [0,2,0,0,0,0|1,0,1]=4 6328 B8R1.50 C[C@H]1CC[C@H](C)C1=O Amb27434148 [0,2,0,0,0,0|1,0,0]=3 6329 B8R1.50 C[C@H]1CNC(=O)[C@@H]1C Amb27783966 [0,2,0,0,0,0|1,0,0]=3 6330 B8R1.50 N=C1COC(=O)C1N Amb27839054 [0,2,0,0,0,0|0,0,1]=3 6331 B8R1.50 NC1=C(O)CCC1=O Amb27203866 [0,2,0,0,0,0|1,0,1]=4 6332 B8R1.50 NC1=C(O)COC1=O Amb27830449 [0,2,0,0,0,0|0,0,2]=4 6333 B8R1.50 NC1C(=O)CCC1=O Amb27409660 [0,2,0,0,0,0|1,0,1]=4 6334 B8R1.50 NC1CCN(O)C1=O Amb8631273 [0,2,0,0,0,0|1,0,0]=3 6335 B8R1.50 NC1CNC(=O)C1N Amb18641832 [0,2,0,0,0,0|1,0,0]=3 6336 B8R1.50 NN1C(=O)CCC1=O Amb24323275 [0,2,0,0,0,0|1,0,1]=4 6337 B8R1.50 N[C@@H]1C(=O)NC[C@@H]1O Amb27420900 [0,2,0,0,0,0|1,0,0]=3 6338 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O Amb28289413 [0,2,0,0,0,0|1,0,0]=3 6339 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb24697759 [0,2,0,0,0,0|0,0,0]=2 6340 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb32751750 [0,2,0,0,0,0|0,0,0]=2 6341 B8R1.50 N[C@@H]1C(=O)OC[C@H]1O Amb27202409 [0,2,0,0,0,0|0,0,0]=2 6342 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,2,0,0,0,0|1,0,0]=3 6343 B8R1.50 N[C@H]1C(=O)NC[C@H]1O Amb28346232 [0,2,0,0,0,0|1,0,0]=3 6344 B8R1.50 N[C@H]1C(=O)OC[C@@H]1O Amb27620425 [0,2,0,0,0,0|0,0,0]=2 6345 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,2,0,0,0,0|1,0,0]=3 6346 B8R1.50 O=C1C(F)CCC1F Amb28316127 [0,2,0,0,0,0|1,0,0]=3 6347 B8R1.50 O=C1C=CC(O)C1Cl Amb27863645 [0,2,0,0,0,0|1,0,1]=4 6348 B8R1.50 O=C1C=C[C@@H](O)[C@@H]1Cl Amb28324060 [0,2,0,0,0,0|1,0,1]=4 6349 B8R1.50 O=C1CCC(=O)C1Br Amb10975590 [0,2,0,0,0,0|1,0,1]=4 6350 B8R1.50 O=C1CCC(=O)C1Cl Amb27471835 [0,2,0,0,0,0|1,0,1]=4 6351 B8R1.50 O=C1CCC(=O)C1O Amb24443990 [0,2,0,0,0,0|1,0,1]=4 6352 B8R1.50 O=C1CCC(=O)N1Br Amb2685488 [0,2,0,0,0,0|1,0,1]=4 6353 B8R1.50 O=C1CCC(=O)N1Cl Amb6609006 [0,2,0,0,0,0|1,0,1]=4 6354 B8R1.50 O=C1CCC(=O)N1I Amb2688884 [0,2,0,0,0,0|1,0,1]=4 6355 B8R1.50 O=C1CCC(=O)N1O Amb1152089 [0,2,0,0,0,0|1,0,1]=4 6356 B8R1.50 O=C1CCC(Br)=C1O Amb24677469 [0,2,0,0,0,0|1,0,1]=4 6357 B8R1.50 O=C1CCC(Cl)=C1Cl Amb27409520 [0,2,0,0,0,0|1,0,1]=4 6358 B8R1.50 O=C1CCC(Cl)=C1O Amb28316155 [0,2,0,0,0,0|1,0,1]=4 6359 B8R1.50 O=C1CCC(F)C1Br Amb27875964 [0,2,0,0,0,0|1,0,0]=3 6360 B8R1.50 O=C1CCC(O)=C1Br Amb25205766 [0,2,0,0,0,0|1,0,1]=4 6361 B8R1.50 O=C1CCC(O)=C1O Amb17593179 [0,2,0,0,0,0|1,0,1]=4 6362 B8R1.50 O=C1CCC(O)N1O Amb27214701 [0,2,0,0,0,0|1,0,0]=3 6363 B8R1.50 O=C1CC[C@H](O)[C@@H]1O Amb28253888 [0,2,0,0,0,0|1,0,0]=3 6364 B8R1.50 O=C1COC(=O)C1Br Amb17594578 [0,2,0,0,0,0|0,0,1]=3 6365 B8R1.50 O=C1COC(=O)C1Cl Amb534802 [0,2,0,0,0,0|0,0,1]=3 6366 B8R1.50 O=C1NCC(O)C1O Amb27813982 [0,2,0,0,0,0|1,0,0]=3 6367 B8R1.50 O=C1OC=C(O)C1Cl Amb28396605 [0,2,0,0,0,0|0,0,2]=4 6368 B8R1.50 O=C1OCC(Br)=C1Br Amb10067289 [0,2,0,0,0,0|0,0,2]=4 6369 B8R1.50 O=C1OCC(Cl)=C1Cl Amb24551013 [0,2,0,0,0,0|0,0,2]=4 6370 B8R1.50 O=C1OCC(O)=C1Br Amb5751200 [0,2,0,0,0,0|0,0,2]=4 6371 B8R1.50 O=C1OCC(O)=C1F Amb27812981 [0,2,0,0,0,0|0,0,2]=4 6372 B8R1.50 O=C1OCC(O)=C1O Amb23505710 [0,2,0,0,0,0|0,0,2]=4 6373 B8R1.50 O=C1OCC(O)C1O Amb22730078 [0,2,0,0,0,0|0,0,0]=2 6374 B8R1.50 O=C1OC[C@@H](O)[C@@H]1O Amb24609731 [0,2,0,0,0,0|0,0,0]=2 6375 B8R1.50 O=C1OC[C@@H](O)[C@H]1Br Amb32414616 [0,2,0,0,0,0|0,0,0]=2 6376 B8R1.50 O=C1OC[C@@H](O)[C@H]1O Amb8515014 [0,2,0,0,0,0|0,0,0]=2 6377 B8R1.50 O=C1OC[C@H](O)[C@@H]1Br Amb10067848 [0,2,0,0,0,0|0,0,0]=2 6378 B8R1.50 O=C1OC[C@H](O)[C@@H]1O Amb27440225 [0,2,0,0,0,0|0,0,0]=2 6379 B8R1.50 O=C1OC[C@H](O)[C@H]1Br Amb27634828 [0,2,0,0,0,0|0,0,0]=2 6380 B8R1.50 O=C1OC[C@H](O)[C@H]1F Amb27775907 [0,2,0,0,0,0|0,0,0]=2 6381 B8R1.50 O=C1OC[C@H](O)[C@H]1O Amb15692412 [0,2,0,0,0,0|0,0,0]=2 6382 B8R1.50 O=C1ON=C(O)C1F Amb27193869 [0,2,0,0,0,0|1,0,1]=4 6383 B8R1.50 O=C1[C@@H](Cl)CC[C@H]1Cl Amb27858710 [0,2,0,0,0,0|1,0,0]=3 6384 B8R1.50 O=C1[C@H](Cl)CC[C@H]1Cl Amb28195652 [0,2,0,0,0,0|1,0,0]=3 6385 B8R1.50 OC1OC[C@H](O)[C@H]1O Amb24737731 [0,2,0,0,0,0|0,0,2]=4 6386 B8R1.50 O[C@@H]1CO[C@@H](O)[C@@H]1O Amb27968599 [0,2,0,0,0,0|0,0,2]=4 6387 B8R1.50 O[C@H]1CO[C@@H](O)[C@H]1O Amb28079143 [0,2,0,0,0,0|0,0,2]=4 6388 B8R1.51 C=C1CCC(C)(C)C1 Amb27471090 [0,2,0,0,0,0|2,0,0]=4 6389 B8R1.51 CC1(C)C=CC(=O)C1 Amb15693471 [0,2,0,0,0,0|1,0,1]=4 6390 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,2,0,0,0,0|2,0,0]=4 6391 B8R1.51 CC1(C)CC(=O)CN1 Amb32693438 [0,2,0,0,0,0|2,0,0]=4 6392 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,2,0,0,0,0|2,0,0]=4 6393 B8R1.51 CC1(C)CC(=O)NN1 Amb22289371 [0,2,0,0,0,0|2,0,0]=4 6394 B8R1.51 CC1(C)CC(=O)NO1 Amb26895186 [0,2,0,0,0,0|2,0,0]=4 6395 B8R1.51 CC1(C)CC(Br)CO1 Amb26874313 [0,2,0,0,0,0|1,0,1]=4 6396 B8R1.51 CC1(C)CC(N)CO1 Amb22434945 [0,2,0,0,0,0|1,0,1]=4 6397 B8R1.51 CC1(C)CC(N)CO1 Amb30585142 [0,2,0,0,0,0|1,0,1]=4 6398 B8R1.51 CC1(C)CC(O)CO1 Amb25296086 [0,2,0,0,0,0|1,0,1]=4 6399 B8R1.51 CC1(C)CC(S)CO1 Amb26589086 [0,2,0,0,0,0|1,0,1]=4 6400 B8R1.51 CC1(C)CC=C(Br)C1 Amb28315141 [0,2,0,0,0,0|2,0,0]=4 6401 B8R1.51 CC1(C)CCC(=N)N1 Amb25733497 [0,2,0,0,0,0|2,0,0]=4 6402 B8R1.51 CC1(C)CCC(=N)N1 Amb32662918 [0,2,0,0,0,0|2,0,0]=4 6403 B8R1.51 CC1(C)CCC(=O)C1 Amb19516867 [0,2,0,0,0,0|1,0,0]=3 6404 B8R1.51 CC1(C)CCC(=O)N1 Amb9173662 [0,2,0,0,0,0|1,0,0]=3 6405 B8R1.51 CC1(C)CCC(=O)O1 Amb8631207 [0,2,0,0,0,0|0,0,0]=2 6406 B8R1.51 CC1(C)CCC(O)O1 Amb26962652 [0,2,0,0,0,0|0,0,2]=4 6407 B8R1.51 CC1(C)CN=C(N)O1 Amb25720624 [0,2,0,0,0,0|2,0,0]=4 6408 B8R1.51 CC1(C)CNC(=O)C1 Amb6752004 [0,2,0,0,0,0|1,0,0]=3 6409 B8R1.51 CC1(C)CNC(=O)N1 Amb4022598 [0,2,0,0,0,0|2,0,0]=4 6410 B8R1.51 CC1(C)CNC(=O)O1 Amb16202554 [0,2,0,0,0,0|1,0,0]=3 6411 B8R1.51 CC1(C)CNC(=O)S1 Amb27655652 [0,2,0,0,0,0|1,1,0]=4 6412 B8R1.51 CC1(C)CNC(=S)O1 Amb27838912 [0,2,0,0,0,0|1,1,0]=4 6413 B8R1.51 CC1(C)COC(=O)C1 Amb22284870 [0,2,0,0,0,0|0,0,0]=2 6414 B8R1.51 CC1(C)COC(=O)N1 Amb19516997 [0,2,0,0,0,0|1,0,0]=3 6415 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,2,0,0,0,0|1,0,0]=3 6416 B8R1.51 CC1(C)COC(=S)N1 Amb2608889 [0,2,0,0,0,0|1,1,0]=4 6417 B8R1.51 CC1(C)COC(N)=N1 Amb22732038 [0,2,0,0,0,0|2,0,0]=4 6418 B8R1.51 CC1(C)CSC(=O)N1 Amb27173093 [0,2,0,0,0,0|1,1,0]=4 6419 B8R1.51 CC1(C)NCC(=N)O1 Amb27838287 [0,2,0,0,0,0|2,0,0]=4 6420 B8R1.51 CC1(C)NCC(=O)N1 Amb27770341 [0,2,0,0,0,0|2,0,0]=4 6421 B8R1.51 CC1(C)NCC(=O)O1 Amb27969182 [0,2,0,0,0,0|1,0,0]=3 6422 B8R1.51 CC1(C)OCC(=O)O1 Amb10601611 [0,2,0,0,0,0|1,0,0]=3 6423 B8R1.51 CC1(F)CCC(=O)O1 Amb27597762 [0,2,0,0,0,0|0,0,0]=2 6424 B8R1.51 CC1(F)COC(=O)O1 Amb27420932 [0,2,0,0,0,0|1,0,0]=3 6425 B8R1.51 CC1(O)C=CC(=O)C1 Amb28316243 [0,2,0,0,0,0|1,0,1]=4 6426 B8R1.51 CC1(O)C=CC(=O)O1 Amb26551626 [0,2,0,0,0,0|0,0,2]=4 6427 B8R1.51 CC1(O)CNC(=O)C1 Amb2722777 [0,2,0,0,0,0|1,0,0]=3 6428 B8R1.51 CC1=NC(C)(C)CO1 Amb4005048 [0,2,0,0,0,0|2,0,0]=4 6429 B8R1.51 CC1CC(C)(N)CO1 Amb32654941 [0,2,0,0,0,0|1,0,1]=4 6430 B8R1.51 CC1CC(C)(O)CO1 Amb35728712 [0,2,0,0,0,0|1,0,1]=4 6431 B8R1.51 CC1CCS(=O)(=O)C1 Amb2548451 [0,2,0,0,0,0|2,0,0]=4 6432 B8R1.51 CC1CCS(=O)(=O)N1 Amb24556783 [0,2,0,0,0,0|2,0,0]=4 6433 B8R1.51 CC1CCS(=O)(=O)O1 Amb26382065 [0,2,0,0,0,0|1,0,0]=3 6434 B8R1.51 CC1CNS(=O)(=O)C1 Amb24117862 [0,2,0,0,0,0|2,0,0]=4 6435 B8R1.51 CC1COS(=O)(=O)O1 Amb17772236 [0,2,0,0,0,0|2,0,0]=4 6436 B8R1.51 CS1(=O)=NC(=O)CC1 Amb33483218 [0,2,0,0,0,0|2,0,0]=4 6437 B8R1.51 C[C@@H]1COS(=O)(=O)N1 Amb33496149 [0,2,0,0,0,0|2,0,0]=4 6438 B8R1.51 C[C@@H]1COS(=O)(=O)O1 Amb22736783 [0,2,0,0,0,0|2,0,0]=4 6439 B8R1.51 C[C@H]1COS(=O)(=O)N1 Amb33496148 [0,2,0,0,0,0|2,0,0]=4 6440 B8R1.51 C[C@H]1COS(=O)(=O)O1 Amb28120271 [0,2,0,0,0,0|2,0,0]=4 6441 B8R1.51 C[C@]1(O)CNC(=O)C1 Amb28253160 [0,2,0,0,0,0|1,0,0]=3 6442 B8R1.51 C[Si]1(C)CCC(=O)C1 Amb29837969 [0,2,0,0,0,0|1,1,0]=4 6443 B8R1.51 FC1(F)CC=C(I)C1 Amb28315882 [0,2,0,0,0,0|2,0,0]=4 6444 B8R1.51 NC1=NC(F)(F)CC1 Amb27407974 [0,2,0,0,0,0|2,0,0]=4 6445 B8R1.51 NC1CCS(=O)(=O)C1 Amb1080886 [0,2,0,0,0,0|2,0,0]=4 6446 B8R1.51 NC1CCS(=O)(=O)C1 Amb1152771 [0,2,0,0,0,0|2,0,0]=4 6447 B8R1.51 NC1CCS(=O)(=O)C1 Amb8508170 [0,2,0,0,0,0|2,0,0]=4 6448 B8R1.51 NC1CC[S+](=O)([O-])C1 Amb17726901 [0,2,0,0,0,0|2,0,0]=4 6449 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 Amb33872364 [0,2,0,0,0,0|2,0,0]=4 6450 B8R1.51 N[C@H]1CCS(=O)(=O)C1 Amb30634357 [0,2,0,0,0,0|2,0,0]=4 6451 B8R1.51 O=C1C=CC(Cl)(Cl)O1 Amb25758877 [0,2,0,0,0,0|0,0,2]=4 6452 B8R1.51 O=C1CC(F)(F)CN1 Amb26403154 [0,2,0,0,0,0|1,0,0]=3 6453 B8R1.51 O=C1CCC(Cl)(Cl)C1 Amb28141254 [0,2,0,0,0,0|1,0,0]=3 6454 B8R1.51 O=C1CCC(F)(F)C1 Amb21963547 [0,2,0,0,0,0|1,0,0]=3 6455 B8R1.51 O=C1CCS(=O)(=O)C1 Amb2373731 [0,2,0,0,0,0|2,0,0]=4 6456 B8R1.51 O=C1CCS(=O)(=O)N1 Amb25763419 [0,2,0,0,0,0|2,0,0]=4 6457 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,2,0,0,0,0|1,0,0]=3 6458 B8R1.51 O=S1(=O)CC(Br)CO1 Amb2696973 [0,2,0,0,0,0|1,0,0]=3 6459 B8R1.51 O=S1(=O)CC(Cl)CO1 Amb27656970 [0,2,0,0,0,0|1,0,0]=3 6460 B8R1.51 O=S1(=O)CCC(Br)C1 Amb2813269 [0,2,0,0,0,0|2,0,0]=4 6461 B8R1.51 O=S1(=O)CCC(Cl)C1 Amb2598932 [0,2,0,0,0,0|2,0,0]=4 6462 B8R1.51 O=S1(=O)CCC(I)C1 Amb19517046 [0,2,0,0,0,0|2,0,0]=4 6463 B8R1.51 O=S1(=O)CCC(O)C1 Amb5716885 [0,2,0,0,0,0|2,0,0]=4 6464 B8R1.51 O=S1(=O)CCC(S)C1 Amb2796511 [0,2,0,0,0,0|2,0,0]=4 6465 B8R1.51 O=S1(=O)CCC([S-])C1 Amb18526895 [0,2,0,0,0,0|2,0,0]=4 6466 B8R1.51 O=S1(=O)CC[C@@H](O)C1 Amb27981301 [0,2,0,0,0,0|2,0,0]=4 6467 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb2793187 [0,2,0,0,0,0|2,0,0]=4 6468 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb3911968 [0,2,0,0,0,0|2,0,0]=4 6469 B8R1.19 C=C1CCCC1(C)C Amb27861829 [0,2,0,0,0,0|2,0,0]=4 6470 B8R1.19 C=C1CCCS1(=O)=O Amb32666709 [0,2,0,0,0,0|1,1,0]=4 6471 B8R1.19 C=C1OCCC1(C)C Amb27393810 [0,2,0,0,0,0|1,0,0]=3 6472 B8R1.19 CC1(Br)CCCC1=O Amb28316126 [0,2,0,0,0,0|1,0,0]=3 6473 B8R1.19 CC1(Br)CCOC1=O Amb3940887 [0,2,0,0,0,0|0,0,0]=2 6474 B8R1.19 CC1(C)CCC=N1=O Amb20621142 [0,2,0,0,0,0|2,0,0]=4 6475 B8R1.19 CC1(C)CCCC1=O Amb4605933 [0,2,0,0,0,0|1,0,0]=3 6476 B8R1.19 CC1(C)CCNC1=O Amb13882829 [0,2,0,0,0,0|1,0,0]=3 6477 B8R1.19 CC1(C)CCNC1=O Amb22757339 [0,2,0,0,0,0|1,0,0]=3 6478 B8R1.19 CC1(C)CCNC1=S Amb25265103 [0,2,0,0,0,0|1,1,0]=4 6479 B8R1.19 CC1(C)CCOC1=O Amb10603955 [0,2,0,0,0,0|0,0,0]=2 6480 B8R1.19 CC1(C)CCOC1O Amb24723620 [0,2,0,0,0,0|0,0,2]=4 6481 B8R1.19 CC1(C)CNCC1=O Amb28398062 [0,2,0,0,0,0|2,0,0]=4 6482 B8R1.19 CC1(C)COCC1=O Amb26970932 [0,2,0,0,0,0|2,0,0]=4 6483 B8R1.19 CC1(C)CONC1=O Amb21927202 [0,2,0,0,0,0|2,0,0]=4 6484 B8R1.19 CC1(C)NCCC1=O Amb18833065 [0,2,0,0,0,0|2,0,0]=4 6485 B8R1.19 CC1(C)NCCC1=O Amb22264757 [0,2,0,0,0,0|2,0,0]=4 6486 B8R1.19 CC1(C)OCCC1=O Amb28316242 [0,2,0,0,0,0|2,0,0]=4 6487 B8R1.19 CC1(C)OCCC1N Amb24459010 [0,2,0,0,0,0|1,0,1]=4 6488 B8R1.19 CC1(C)OCCC1N Amb32410408 [0,2,0,0,0,0|1,0,1]=4 6489 B8R1.19 CC1(C)OCCC1S Amb27196941 [0,2,0,0,0,0|1,0,1]=4 6490 B8R1.19 CC1(Cl)CCCC1=O Amb28315776 [0,2,0,0,0,0|1,0,0]=3 6491 B8R1.19 CC1(Cl)OCCC1Cl Amb27791826 [0,2,0,0,0,0|1,0,1]=4 6492 B8R1.19 CC1(N)CCNC1=O Amb18124254 [0,2,0,0,0,0|1,0,0]=3 6493 B8R1.19 CC1(N)CCOC1=O Amb28934923 [0,2,0,0,0,0|0,0,0]=2 6494 B8R1.19 CC1(N)CCSC1=O Amb27838410 [0,2,0,0,0,0|0,1,0]=3 6495 B8R1.19 CC1(O)CCCC1=O Amb27749790 [0,2,0,0,0,0|1,0,0]=3 6496 B8R1.19 CC1(O)OCCC1Cl Amb27645472 [0,2,0,0,0,0|0,0,2]=4 6497 B8R1.19 CC1CCCS1(=O)=O Amb2797231 [0,2,0,0,0,0|2,0,0]=4 6498 B8R1.19 CC1CCNS1(=O)=O Amb33298956 [0,2,0,0,0,0|2,0,0]=4 6499 B8R1.19 CC1OCCC1(C)N Amb24742098 [0,2,0,0,0,0|1,0,1]=4 6500 B8R1.19 CC1OCCC1(F)F Amb32654532 [0,2,0,0,0,0|1,0,1]=4 6501 B8R1.19 CN1CCCS1(=O)=O Amb19959571 [0,2,0,0,0,0|2,0,0]=4 6502 B8R1.19 CN1CCOS1(=O)=O Amb26848945 [0,2,0,0,0,0|2,0,0]=4 6503 B8R1.19 C[C@@]1(Cl)CC=CC1=O Amb28049021 [0,2,0,0,0,0|1,0,1]=4 6504 B8R1.19 C[C@@]1(N)CONC1=O Amb25929798 [0,2,0,0,0,0|2,0,0]=4 6505 B8R1.19 C[C@@]1(O)OCC[C@H]1Br Amb27865603 [0,2,0,0,0,0|0,0,2]=4 6506 B8R1.19 C[C@@]1(O)OCC[C@H]1Cl Amb27865591 [0,2,0,0,0,0|0,0,2]=4 6507 B8R1.19 C[C@]1(N)CCOC1=O Amb27629673 [0,2,0,0,0,0|0,0,0]=2 6508 B8R1.19 C[C@]1(N)CCSC1=O Amb27431520 [0,2,0,0,0,0|0,1,0]=3 6509 B8R1.19 C[C@]1(N)CONC1=O Amb25947476 [0,2,0,0,0,0|2,0,0]=4 6510 B8R1.19 ClC1OCCC1(Cl)Cl Amb6365636 [0,2,0,0,0,0|1,0,1]=4 6511 B8R1.19 NC1CCCS1(=O)=O Amb27421871 [0,2,0,0,0,0|2,0,0]=4 6512 B8R1.19 NN1CCCS1(=O)=O Amb27603099 [0,2,0,0,0,0|2,0,0]=4 6513 B8R1.19 O=C1CCCC1(F)F Amb32795002 [0,2,0,0,0,0|1,0,0]=3 6514 B8R1.19 O=C1CNCC1(F)F Amb32412689 [0,2,0,0,0,0|2,0,0]=4 6515 B8R1.19 O=C1NCCC1(F)F Amb25063682 [0,2,0,0,0,0|1,0,0]=3 6516 B8R1.19 O=C1OCCC1(Br)Br Amb25227692 [0,2,0,0,0,0|0,0,0]=2 6517 B8R1.19 OC1OCCC1(Cl)Cl Amb8515053 [0,2,0,0,0,0|0,0,2]=4 6518 B6R1.3 CCCC1CO1 Amb17771535 [0,0,1,1,0,0|1,0,1]=4 6519 B6R1.3 CCC[C@@H]1CO1 Amb25348803 [0,0,1,1,0,0|1,0,1]=4 6520 B6R1.3 CCC[C@H]1CO1 Amb10982593 [0,0,1,1,0,0|1,0,1]=4 6521 B6R1.3 CCOC1CC1 Amb27875275 [0,0,1,1,0,0|1,0,1]=4 6522 B6R1.8 CCC1=C(Br)C1 Amb26432179 [0,0,1,1,0,0|2,0,0]=4 6523 B6R1.8 CCC1=CC1=O Amb28284229 [0,0,1,1,0,0|1,0,1]=4 6524 B6R1.8 CCC1OC1C Amb1141391 [0,0,1,1,0,0|1,0,1]=4 6525 B6R1.9 CC1CC1(C)O Amb22157187 [0,0,1,1,0,0|1,0,1]=4 6526 B6R1.9 CC1OC1(C)C Amb8516113 [0,0,1,1,0,0|1,0,1]=4 6527 B6R1.11 C=C(Br)C1CC1 Amb22583737 [0,0,1,1,0,0|2,0,0]=4 6528 B6R1.11 C=C(C)C1CC1 Amb33542793 [0,0,1,1,0,0|2,0,0]=4 6529 B6R1.11 C=C(Cl)C1CC1 Amb28322133 [0,0,1,1,0,0|2,0,0]=4 6530 B6R1.11 CC(=O)C1CC1 Amb2686663 [0,0,1,1,0,0|1,0,0]=3 6531 B6R1.11 CC(=O)C1CO1 Amb4477044 [0,0,1,1,0,0|2,0,0]=4 6532 B6R1.11 CC(=S)C1CC1 Amb27424574 [0,0,1,1,0,0|1,1,0]=4 6533 B6R1.11 CC(O)C1CC1 Amb9748276 [0,0,1,1,0,0|1,0,1]=4 6534 B6R1.11 C[C@@H](O)C1CC1 Amb13952943 [0,0,1,1,0,0|1,0,1]=4 6535 B6R1.11 C[C@H](O)C1CC1 Amb13952945 [0,0,1,1,0,0|1,0,1]=4 6536 B6R1.11 N=C(N)C1CC1 Amb2686661 [0,0,1,1,0,0|2,0,0]=4 6537 B6R1.11 N=C(N)C1CC1 Amb2695053 [0,0,1,1,0,0|2,0,0]=4 6538 B6R1.11 NC(=O)C1CC1 Amb33546284 [0,0,1,1,0,0|1,0,0]=3 6539 B6R1.11 NC(=O)C1CO1 Amb6261241 [0,0,1,1,0,0|2,0,0]=4 6540 B6R1.11 NC(=O)C1CS1 Amb27217272 [0,0,1,1,0,0|2,0,0]=4 6541 B6R1.11 NC(=S)C1CC1 Amb6244950 [0,0,1,1,0,0|1,1,0]=4 6542 B6R1.11 NC(O)C1CC1 Amb22492754 [0,0,1,1,0,0|1,0,1]=4 6543 B6R1.11 NS(=O)C1CC1 Amb33071950 [0,0,1,1,0,0|2,0,0]=4 6544 B6R1.11 O=C(Br)C1CC1 Amb27457101 [0,0,1,1,0,0|1,0,0]=3 6545 B6R1.11 O=C(Cl)C1CC1 Amb3939317 [0,0,1,1,0,0|1,0,0]=3 6546 B6R1.11 O=C(I)C1CC1 Amb28315968 [0,0,1,1,0,0|1,0,0]=3 6547 B6R1.11 O=C(O)C1C=C1 Amb27185565 [0,0,1,1,0,0|0,0,2]=4 6548 B6R1.11 O=C(O)C1CC1 Amb2686655 [0,0,1,1,0,0|0,0,0]=2 6549 B6R1.11 O=C(O)C1CN1 Amb21864773 [0,0,1,1,0,0|1,0,0]=3 6550 B6R1.11 O=C(O)C1CO1 Amb8395277 [0,0,1,1,0,0|1,0,0]=3 6551 B6R1.11 O=C(O)C1NN1 Amb27949037 [0,0,1,1,0,0|2,0,0]=4 6552 B6R1.11 O=C(O)[C@@H]1CN1 Amb22745452 [0,0,1,1,0,0|1,0,0]=3 6553 B6R1.11 O=C(O)[C@@H]1CO1 Amb26994292 [0,0,1,1,0,0|1,0,0]=3 6554 B6R1.11 O=C(O)[C@@H]1CS1 Amb28396934 [0,0,1,1,0,0|1,0,0]=3 6555 B6R1.11 O=C(O)[C@H]1CS1 Amb27845518 [0,0,1,1,0,0|1,0,0]=3 6556 B6R1.11 O=C([O-])C1CO1 Amb22492453 [0,0,1,1,0,0|1,0,1]=4 6557 B6R1.11 O=S(Cl)C1CC1 Amb25662827 [0,0,1,1,0,0|2,0,0]=4 6558 B6R1.11 O=S(O)C1CC1 Amb24334290 [0,0,1,1,0,0|1,0,0]=3 6559 B6R1.11 O=S([O-])C1CC1 Amb2694437 [0,0,1,1,0,0|1,0,1]=4 6560 B6R1.11 O=[N+]([O-])C1CC1 Amb25768805 [0,0,1,1,0,0|1,0,1]=4 6561 B6R1.11 O=[PH](O)C1CC1 Amb8391285 [0,0,1,1,0,0|1,0,0]=3 6562 B6R1.11 OB(O)C1CC1 Amb2455832 [0,0,1,1,0,0|1,0,1]=4 6563 B6R1.11 OC(O)C1CC1 Amb28062492 [0,0,1,1,0,0|0,0,2]=4 6564 B6R1.1 C1=CCCCC1 Amb6608805 [0,0,1,1,0,0|2,0,0]=4 6565 B6R1.1 C1=CCOCC1 Amb16234261 [0,0,1,1,0,0|1,0,1]=4 6566 B6R1.1 C1=CNCCC1 Amb24389577 [0,0,1,1,0,0|2,0,0]=4 6567 B6R1.1 C1=COCCC1 Amb6609004 [0,0,1,1,0,0|1,0,0]=3 6568 B6R1.1 C1=COCCN1 Amb27413503 [0,0,1,1,0,0|2,0,0]=4 6569 B6R1.1 C1=COCCO1 Amb22043779 [0,0,1,1,0,0|2,0,0]=4 6570 B6R1.1 C1=NCCCC1 Amb27752613 [0,0,1,1,0,0|2,0,0]=4 6571 B6R1.1 C1=NCCCN1 Amb17620508 [0,0,1,1,0,0|2,0,0]=4 6572 B6R1.1 C1=NOCNC1 Amb27230102 [0,0,1,1,0,0|2,0,0]=4 6573 B6R1.1 C1=NSCCC1 Amb27266087 [0,0,1,1,0,0|1,1,0]=4 6574 B6R1.1 C1CCONC1 Amb22586922 [0,0,1,1,0,0|1,0,1]=4 6575 B6R1.1 C1CCONC1 Amb6365589 [0,0,1,1,0,0|1,0,1]=4 6576 B6R1.1 C1CNCOC1 Amb17506190 [0,0,1,1,0,0|1,0,1]=4 6577 B6R1.1 C1CNCOC1 Amb32652717 [0,0,1,1,0,0|1,0,1]=4 6578 B6R1.1 C1COCOC1 Amb8515936 [0,0,1,1,0,0|0,0,2]=4 6579 B6R1.7 CCC1(C)CO1 Amb8516114 [0,0,1,1,0,0|1,0,1]=4 6580 B6R1.7 COC1(N)CC1 Amb27390468 [0,0,1,1,0,0|1,0,1]=4 6581 B6R1.12 CC1=C(Br)C1C Amb28383475 [0,0,1,1,0,0|2,0,0]=4 6582 B6R1.12 CC1=C(C)C1=O Amb28285879 [0,0,1,1,0,0|1,0,1]=4 6583 B6R2.4 C1CC2OC12 Amb19148609 [1,0,0,1,0,0|0,0,1]=3 6584 B6R2.4 C1NC2CC12 Amb7808792 [1,0,0,1,0,0|1,0,1]=4 6585 B6R2.2 C1C2CC1N2 Amb26915551 [0,0,0,1,1,0|1,0,1]=4 6586 B8R2.2 CC12CCCC1O2 Amb22338783 [0,0,0,1,0,1|1,0,1]=4 6587 B8R2.2 NC12COCC1C2 Amb32674927 [0,0,0,1,0,1|1,0,1]=4 6588 B8R2.2 NC12COCC1C2 Amb32674928 [0,0,0,1,0,1|1,0,1]=4 6589 B8R2.2 N[C@@]12COC[C@@H]1C2 Amb32675187 [0,0,0,1,0,1|1,0,1]=4 6590 B8R2.2 N[C@@]12COC[C@@H]1C2 Amb32675188 [0,0,0,1,0,1|1,0,1]=4 6591 B8R2.5 O=C1NC2N=CC12 Amb28132681 [0,0,0,1,0,1|1,0,1]=4 6592 B8R2.5 O=C1N[C@@H]2C=C[C@H]12 Amb25174979 [0,0,0,1,0,1|1,0,1]=4 6593 B8R2.11 NC1C2CCOC12 Amb23448812 [0,0,0,1,0,1|1,0,1]=4 6594 B8R2.11 NC1[C@H]2CCO[C@@H]12 Amb27654238 [0,0,0,1,0,1|1,0,1]=4 6595 B8R2.11 O=C1C2CCCC12 Amb27838225 [0,0,0,1,0,1|1,0,0]=3 6596 B8R2.18 O=C1CC2CC2C1 Amb25750119 [0,0,0,1,0,1|1,0,0]=3 6597 B8R2.18 O=C1CC2OC2C1 Amb25050255 [0,0,0,1,0,1|1,0,0]=3 6598 B8R2.18 O=C1C[C@@H]2C[C@@H]2C1 Amb28350467 [0,0,0,1,0,1|1,0,0]=3 6599 B8R2.18 O=[Si]1CC2OC2C1 Amb25755778 [0,0,0,1,0,1|1,1,0]=4 6600 B8R2.23 C1CC2NC(C1)O2 Amb27831530 [0,0,0,1,0,1|1,0,1]=4 6601 B8R2.23 C1NCC2CC1O2 Amb19148434 [0,0,0,1,0,1|1,0,1]=4 6602 B8R2.23 C1NCC2CC1O2 Amb22491904 [0,0,0,1,0,1|1,0,1]=4 6603 B8R2.23 C1OCC2CC1N2 Amb19374737 [0,0,0,1,0,1|1,0,1]=4 6604 B8R2.23 C1OCC2CC1N2 Amb31307966 [0,0,0,1,0,1|1,0,1]=4 6605 B8R2.23 C1OCC2CC1N2 Amb33718914 [0,0,0,1,0,1|1,0,1]=4 6606 B8R2.25 C1CC2NC2CO1 Amb32666960 [0,0,0,1,0,1|1,0,1]=4 6607 B8R2.25 C1CC2OC2CO1 Amb9472941 [0,0,0,1,0,1|0,0,2]=4 6608 B8R2.25 C1COC2CC2C1 Amb28050658 [0,0,0,1,0,1|1,0,1]=4 6609 B8R2.25 C1COC2CC2N1 Amb19148700 [0,0,0,1,0,1|1,0,1]=4 6610 B8R2.25 C1COC2CC2N1 Amb19148862 [0,0,0,1,0,1|1,0,1]=4 6611 B8R2.25 C1COC2CC2O1 Amb28189800 [0,0,0,1,0,1|1,0,1]=4 6612 B8R2.34 C1=C2CCC(C1)C2 Amb28196687 [0,0,0,1,0,1|2,0,0]=4 6613 B8R2.34 C1N[C@@H]2COC1C2 Amb27800311 [0,0,0,1,0,1|1,0,1]=4 6614 B8R2.34 C1N[C@H]2CO[C@H]1C2 Amb31204607 [0,0,0,1,0,1|1,0,1]=4 6615 B8R2.34 C1N[C@H]2CO[C@H]1C2 Amb34915797 [0,0,0,1,0,1|1,0,1]=4 6616 B8R2.34 C1N[C@H]2CO[C@H]1C2 Amb34916478 [0,0,0,1,0,1|1,0,1]=4 6617 B8R2.34 C1OC2CNC1C2 Amb19515675 [0,0,0,1,0,1|1,0,1]=4 6618 B8R2.34 C1OC2CNC1C2 Amb23440287 [0,0,0,1,0,1|1,0,1]=4 6619 B8R2.34 C1OC2CNC1C2 Amb6366835 [0,0,0,1,0,1|1,0,1]=4 6620 B8R2.34 C1O[C@@H]2CN[C@H]1C2 Amb22274220 [0,0,0,1,0,1|1,0,1]=4 6621 B8R2.34 C1O[C@@H]2CN[C@H]1C2 Amb28057397 [0,0,0,1,0,1|1,0,1]=4 6622 B8R2.34 C1O[C@@H]2CN[C@H]1C2 Amb31204606 [0,0,0,1,0,1|1,0,1]=4 6623 B8R2.34 C1O[C@H]2CN[C@@H]1C2 Amb23440039 [0,0,0,1,0,1|1,0,1]=4 6624 B8R2.34 C1O[C@H]2CN[C@@H]1C2 Amb23440288 [0,0,0,1,0,1|1,0,1]=4 6625 B8R2.34 C1O[C@H]2CN[C@@H]1C2 Amb33524056 [0,0,0,1,0,1|1,0,1]=4 6626 B8R2.34 C1O[C@H]2CN[C@H]1C2 Amb34915280 [0,0,0,1,0,1|1,0,1]=4 6627 B8R2.34 C1O[C@H]2CN[C@H]1C2 Amb34916380 [0,0,0,1,0,1|1,0,1]=4 6628 B8R2.38 BrC1CCC2OC12 Amb27975415 [0,0,0,1,0,1|1,0,1]=4 6629 B8R2.38 C=C1CCC2CC12 Amb27836170 [0,0,0,1,0,1|2,0,0]=4 6630 B8R2.38 O=C1C=CC2OC12 Amb27775734 [0,0,0,1,0,1|0,0,2]=4 6631 B8R2.38 O=C1C=C[C@@H]2C[C@H]12 Amb28052364 [0,0,0,1,0,1|1,0,0]=3 6632 B8R2.38 O=C1CCC2CC12 Amb22736104 [0,0,0,1,0,1|1,0,0]=3 6633 B8R2.38 O=C1CCC2OC12 Amb28141441 [0,0,0,1,0,1|0,0,0]=2 6634 B8R2.38 O=C1CC[C@@H]2C[C@H]12 Amb24623125 [0,0,0,1,0,1|1,0,0]=3 6635 B8R2.38 O=C1CC[C@H]2C[C@@H]12 Amb27845572 [0,0,0,1,0,1|1,0,0]=3 6636 B8R2.38 O=C1CNC2CC12 Amb34142462 [0,0,0,1,0,1|1,0,0]=3 6637 B8R2.38 O=C1CN[C@@H]2C[C@H]12 Amb27630008 [0,0,0,1,0,1|1,0,0]=3 6638 B8R2.38 O=C1NCC2CC12 Amb22546330 [0,0,0,1,0,1|1,0,0]=3 6639 B8R2.38 O=C1NCC2OC12 Amb28143671 [0,0,0,1,0,1|1,0,0]=3 6640 B8R2.38 O=C1NC[C@@H]2C[C@H]12 Amb27961231 [0,0,0,1,0,1|1,0,0]=3 6641 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,1,0,1|0,0,0]=2 6642 B8R2.38 O=C1OC[C@H]2C[C@@H]12 Amb27421949 [0,0,0,1,0,1|0,0,0]=2 6643 B8R2.38 O[C@@H]1CC[C@@H]2O[C@@H]21 Amb27423249 [0,0,0,1,0,1|0,0,2]=4 6644 B8R2.38 O[C@H]1CC[C@H]2O[C@@H]12 Amb28321610 [0,0,0,1,0,1|0,0,2]=4 6645 B8R2.22 C1C[C@H]2NC[C@H]2O1 Amb32686527 [0,1,0,1,0,0|1,0,1]=4 6646 B8R2.22 C1C[C@H]2NC[C@H]2O1 Amb32686548 [0,1,0,1,0,0|1,0,1]=4 6647 B8R2.27 O=C1C2CCC1C2 Amb27794426 [0,1,0,1,0,0|1,0,0]=3 6648 B8R2.30 O=CC12CCC1C2 Amb32676112 [0,1,0,1,0,0|1,0,1]=4 6649 B8R2.33 O=C[C@H]1[C@H]2CC[C@@H]12 Amb27256481 [0,1,0,1,0,0|1,0,1]=4 6650 B8R2.4 O=C1CC2CC1C2 Amb24426322 [0,1,0,1,0,0|1,0,0]=3 6651 B8R2.4 O=C1NC2CC1C2 Amb27848619 [0,1,0,1,0,0|1,0,0]=3 6652 B8R2.7 NC12COC(C1)C2 Amb33743593 [0,1,0,1,0,0|1,0,1]=4 6653 B8R2.7 NC12COC(C1)C2 Amb33743826 [0,1,0,1,0,0|1,0,1]=4 6654 B4R1.1 C1=CCC1 Amb25870354 [1,0,0,0,1,0|0,0,1]=3 6655 B4R1.1 C1=CNC1 Amb25339223 [1,0,0,0,1,0|1,0,1]=4 6656 B4R1.1 C1CCC1 Amb17689121 [1,0,0,0,1,0|0,0,1]=3 6657 B4R1.1 C1CNC1 Amb3938974 [1,0,0,0,1,0|1,0,0]=3 6658 B4R1.1 C1CNC1 Amb8628117 [1,0,0,0,1,0|1,0,0]=3 6659 B4R1.1 C1CSC1 Amb22232204 [1,0,0,0,1,0|0,1,0]=3 6660 B4R1.2 BrC1CC1 Amb2686660 [0,0,0,0,2,0|1,0,1]=4 6661 B4R1.2 C=C1CC1 Amb22347889 [0,0,0,0,2,0|1,0,0]=3 6662 B4R1.2 CC1=CC1 Amb20240828 [0,0,0,0,2,0|1,0,1]=4 6663 B4R1.2 CC1CC1 Amb24425057 [0,0,0,0,2,0|1,0,1]=4 6664 B4R1.2 CC1CO1 Amb22411582 [0,0,0,0,2,0|1,0,1]=4 6665 B4R1.2 CC1CO1 Amb6608902 [0,0,0,0,2,0|1,0,1]=4 6666 B4R1.2 C[C@@H]1CO1 Amb8396601 [0,0,0,0,2,0|1,0,1]=4 6667 B4R1.2 C[C@H]1CO1 Amb8396600 [0,0,0,0,2,0|1,0,1]=4 6668 B4R1.2 FC1CC1 Amb25145254 [0,0,0,0,2,0|1,0,1]=4 6669 B4R1.2 IC1CC1 Amb22756596 [0,0,0,0,2,0|1,0,1]=4 6670 B4R1.2 ICl1CC1 Amb22411640 [0,0,0,0,2,0|2,0,0]=4 6671 B4R1.2 NC1CC1 Amb932818 [0,0,0,0,2,0|1,0,1]=4 6672 B4R1.2 O=C1C=C1 Amb22733856 [0,0,0,0,2,0|0,0,2]=4 6673 B4R1.2 OC1CC1 Amb33550020 [0,0,0,0,2,0|0,0,2]=4 6674 B4R1.2 SC1CC1 Amb19893337 [0,0,0,0,2,0|0,1,1]=4 6675 B8R1.22 BrC1=CCCCCC1 Amb10071167 [0,0,0,0,0,2|2,0,0]=4 6676 B8R1.22 BrC1=CCOCOC1 Amb24087656 [0,0,0,0,0,2|1,0,1]=4 6677 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,0,0,2|1,0,1]=4 6678 B8R1.22 BrC1CNCCOC1 Amb27785215 [0,0,0,0,0,2|1,0,1]=4 6679 B8R1.22 C=C1CCCNCC1 Amb30982578 [0,0,0,0,0,2|2,0,0]=4 6680 B8R1.22 C=C1CCCSCC1 Amb35674113 [0,0,0,0,0,2|1,1,0]=4 6681 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,0,0,0,0,2|1,0,0]=3 6682 B8R1.22 CC1=CCCCCC1 Amb22227978 [0,0,0,0,0,2|2,0,0]=4 6683 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,0,0,2|1,0,1]=4 6684 B8R1.22 CC1CCCOCO1 Amb28046311 [0,0,0,0,0,2|1,0,1]=4 6685 B8R1.22 CC1CCNCCO1 Amb26412871 [0,0,0,0,0,2|1,0,1]=4 6686 B8R1.22 CC1CCNCCO1 Amb30585117 [0,0,0,0,0,2|1,0,1]=4 6687 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,0,0,2|1,0,1]=4 6688 B8R1.22 CC1CNCCCO1 Amb9358449 [0,0,0,0,0,2|1,0,1]=4 6689 B8R1.22 CC1CNCCOC1 Amb22886318 [0,0,0,0,0,2|1,0,1]=4 6690 B8R1.22 CC1CNCCOC1 Amb33545514 [0,0,0,0,0,2|1,0,1]=4 6691 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,0,0,2|1,0,1]=4 6692 B8R1.22 CC1OCCCCO1 Amb22731719 [0,0,0,0,0,2|1,0,1]=4 6693 B8R1.22 CN1CCNCCO1 Amb27226764 [0,0,0,0,0,2|2,0,0]=4 6694 B8R1.22 C[C@@H]1CCNCCO1 Amb27624211 [0,0,0,0,0,2|1,0,1]=4 6695 B8R1.22 C[C@@H]1COCCCN1 Amb27881643 [0,0,0,0,0,2|1,0,1]=4 6696 B8R1.22 C[C@H]1CNCCCO1 Amb35752396 [0,0,0,0,0,2|1,0,1]=4 6697 B8R1.22 ClC1CCCCOC1 Amb27409037 [0,0,0,0,0,2|1,0,1]=4 6698 B8R1.22 ClC1CCCOCC1 Amb27471515 [0,0,0,0,0,2|1,0,1]=4 6699 B8R1.22 ClN1CCCOCC1 Amb27217968 [0,0,0,0,0,2|2,0,0]=4 6700 B8R1.22 IC1CCCOCC1 Amb26563301 [0,0,0,0,0,2|1,0,1]=4 6701 B8R1.22 NC1=NCCCCC1 Amb19514661 [0,0,0,0,0,2|2,0,0]=4 6702 B8R1.22 NC1=NCCCCC1 Amb4451463 [0,0,0,0,0,2|2,0,0]=4 6703 B8R1.22 NC1=NCCCCN1 Amb28119984 [0,0,0,0,0,2|2,0,0]=4 6704 B8R1.22 NC1=NCCCCS1 Amb27592425 [0,0,0,0,0,2|1,1,0]=4 6705 B8R1.22 NC1=NCCCSC1 Amb25688170 [0,0,0,0,0,2|1,1,0]=4 6706 B8R1.22 NC1CCCOCC1 Amb33547346 [0,0,0,0,0,2|1,0,1]=4 6707 B8R1.22 NC1COCCOC1 Amb20669196 [0,0,0,0,0,2|1,0,1]=4 6708 B8R1.22 NC1COCCOC1 Amb24452281 [0,0,0,0,0,2|1,0,1]=4 6709 B8R1.22 O=C1C=CC=CCC1 Amb17593120 [0,0,0,0,0,2|1,0,1]=4 6710 B8R1.22 O=C1C=CCC=CC1 Amb28316220 [0,0,0,0,0,2|1,0,1]=4 6711 B8R1.22 O=C1C=CCCC=C1 Amb22364722 [0,0,0,0,0,2|1,0,1]=4 6712 B8R1.22 O=C1C=CCCCC1 Amb10601704 [0,0,0,0,0,2|1,0,0]=3 6713 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,0,0,0,0,2|1,0,0]=3 6714 B8R1.22 O=C1C=CNCCS1 Amb27655609 [0,0,0,0,0,2|0,1,1]=4 6715 B8R1.22 O=C1C=CSCCN1 Amb27202061 [0,0,0,0,0,2|1,0,1]=4 6716 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,0,0,0,0,2|1,0,0]=3 6717 B8R1.22 O=C1CC=CCCN1 Amb27830230 [0,0,0,0,0,2|1,0,0]=3 6718 B8R1.22 O=C1CC=COCC1 Amb27835241 [0,0,0,0,0,2|0,0,2]=4 6719 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,0,0,0,0,2|1,0,0]=3 6720 B8R1.22 O=C1CCC=COC1 Amb27812549 [0,0,0,0,0,2|0,0,1]=3 6721 B8R1.22 O=C1CCCCCC1 Amb4135729 [0,0,0,0,0,2|1,0,0]=3 6722 B8R1.22 O=C1CCCCCN1 Amb6364991 [0,0,0,0,0,2|1,0,0]=3 6723 B8R1.22 O=C1CCCCCO1 Amb8513719 [0,0,0,0,0,2|0,0,0]=2 6724 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,0,0,0,0,2|0,1,0]=3 6725 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,0,0,0,0,2|1,0,0]=3 6726 B8R1.22 O=C1CCCCNC1 Amb22000936 [0,0,0,0,0,2|1,0,0]=3 6727 B8R1.22 O=C1CCCCNC1 Amb25922210 [0,0,0,0,0,2|1,0,0]=3 6728 B8R1.22 O=C1CCCNCC1 Amb8393630 [0,0,0,0,0,2|1,0,0]=3 6729 B8R1.22 O=C1CCCNCC1 Amb9174228 [0,0,0,0,0,2|1,0,0]=3 6730 B8R1.22 O=C1CCCOCC1 Amb25873789 [0,0,0,0,0,2|0,0,0]=2 6731 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,0,0,0,0,2|0,1,0]=3 6732 B8R1.22 O=C1CCCSCN1 Amb27879423 [0,0,0,0,0,2|0,1,0]=3 6733 B8R1.22 O=C1CCNCCN1 Amb10069937 [0,0,0,0,0,2|1,0,0]=3 6734 B8R1.22 O=C1CCNCCN1 Amb1107713 [0,0,0,0,0,2|1,0,0]=3 6735 B8R1.22 O=C1CCNCCN1 Amb483265 [0,0,0,0,0,2|1,0,0]=3 6736 B8R1.22 O=C1CCNCCO1 Amb27760600 [0,0,0,0,0,2|0,0,0]=2 6737 B8R1.22 O=C1CCNNCC1 Amb28421828 [0,0,0,0,0,2|1,0,0]=3 6738 B8R1.22 O=C1CCOCCN1 Amb13951193 [0,0,0,0,0,2|1,0,0]=3 6739 B8R1.22 O=C1CCOCOC1 Amb27434094 [0,0,0,0,0,2|0,0,0]=2 6740 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,0,0,0,0,2|1,0,0]=3 6741 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,0,0,0,0,2|1,0,0]=3 6742 B8R1.22 O=C1CNCCCN1 Amb6739889 [0,0,0,0,0,2|1,0,0]=3 6743 B8R1.22 O=C1CNCCNC1 Amb30867934 [0,0,0,0,0,2|1,0,0]=3 6744 B8R1.22 O=C1COCCCN1 Amb22371065 [0,0,0,0,0,2|0,0,0]=2 6745 B8R1.22 O=C1COCCOC1 Amb22284314 [0,0,0,0,0,2|0,0,0]=2 6746 B8R1.22 O=C1CSCCSC1 Amb8503291 [0,0,0,0,0,2|0,1,0]=3 6747 B8R1.22 O=C1NCCCCN1 Amb25960043 [0,0,0,0,0,2|1,0,0]=3 6748 B8R1.22 O=C1NCCCCO1 Amb27405440 [0,0,0,0,0,2|0,0,0]=2 6749 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,0,0,0,0,2|0,0,0]=2 6750 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,0,0,0,0,2|2,0,0]=4 6751 B8R1.22 O=S1OCC=CCO1 Amb25190031 [0,0,0,0,0,2|1,0,1]=4 6752 B8R1.22 O=S1OCCCCO1 Amb9787325 [0,0,0,0,0,2|1,0,0]=3 6753 B8R1.22 OC1CCC=CCO1 Amb28197000 [0,0,0,0,0,2|0,0,2]=4 6754 B8R1.22 OC1CCCCCO1 Amb4034492 [0,0,0,0,0,2|0,0,2]=4 6755 B8R1.22 OC1CCCCOC1 Amb27424901 [0,0,0,0,0,2|0,0,2]=4 6756 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,0,0,2|0,0,2]=4 6757 B8R1.22 OC1CNCCOC1 Amb22886365 [0,0,0,0,0,2|0,0,2]=4 6758 B8R1.22 OC1CNCCOC1 Amb27258663 [0,0,0,0,0,2|0,0,2]=4 6759 B8R1.22 OC1COCCOC1 Amb27478103 [0,0,0,0,0,2|0,0,2]=4 6760 B8R1.22 OC1OCCCCO1 Amb27197834 [0,0,0,0,0,2|0,0,2]=4 6761 B8R1.22 O[C@@H]1CCCCOC1 Amb28125793 [0,0,0,0,0,2|0,0,2]=4 6762 B8R1.22 O[C@@H]1CNCCOC1 Amb22325588 [0,0,0,0,0,2|0,0,2]=4 6763 B8R1.22 O[C@H]1CCCOCC1 Amb28058426 [0,0,0,0,0,2|0,0,2]=4 6764 B8R1.22 O[C@H]1CNCCOC1 Amb28074197 [0,0,0,0,0,2|0,0,2]=4 6765 B8R1.22 S=C1CCCCCN1 Amb1935077 [0,0,0,0,0,2|1,1,0]=4 6766 B8R1.22 S=C1NCCCCN1 Amb2724259 [0,0,0,0,0,2|1,1,0]=4 6767 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,0,0,2|0,1,1]=4 6768 B8R1.22 SC1COCCOC1 Amb26924486 [0,0,0,0,0,2|0,1,1]=4