0 B6R1.2 BrC1=CCC=N1 Amb25195406 [0,0,0,0,0,0|2,0,2]=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 BrC1CCC=C1 Amb21963910 [0,0,0,0,0,0|2,0,2]=4 4 B6R1.2 BrC1CCCN1 Amb25745600 [0,0,0,0,0,0|2,0,1]=3 5 B6R1.2 BrC1CCCO1 Amb24322808 [0,0,0,0,0,0|1,0,1]=2 6 B6R1.2 BrC1CCCS1 Amb24333010 [0,0,0,0,0,0|1,1,1]=3 7 B6R1.2 BrC1CCN=C1 Amb24322658 [0,0,0,0,0,0|3,0,1]=4 8 B6R1.2 BrC1CNCC1 Amb10608920 [0,0,0,0,0,0|3,0,1]=4 9 B6R1.2 BrC1CNCC1 Amb19958764 [0,0,0,0,0,0|3,0,1]=4 10 B6R1.2 BrC1CNCC1 Amb22229239 [0,0,0,0,0,0|3,0,1]=4 11 B6R1.2 BrC1COCC1 Amb19957943 [0,0,0,0,0,0|3,0,1]=4 12 B6R1.2 BrC1CSCC1 Amb20413646 [0,0,0,0,0,0|3,0,1]=4 13 B6R1.2 BrC=1CCNN1 Amb24638108 [0,0,0,0,0,0|3,0,0]=3 14 B6R1.2 BrC=1CCOC1 Amb24322594 [0,0,0,0,0,0|3,0,0]=3 15 B6R1.2 Br[C@@H]1CNCC1 Amb22226659 [0,0,0,0,0,0|3,0,1]=4 16 B6R1.2 Br[C@@H]1CNCC1 Amb22226660 [0,0,0,0,0,0|3,0,1]=4 17 B6R1.2 Br[C@@H]1CSCC1 Amb25232616 [0,0,0,0,0,0|3,0,1]=4 18 B6R1.2 Br[C@H]1CNCC1 Amb22225312 [0,0,0,0,0,0|3,0,1]=4 19 B6R1.2 Br[C@H]1CNCC1 Amb22225313 [0,0,0,0,0,0|3,0,1]=4 20 B6R1.2 Brc1[n]c[n]o1 Amb25376458 [0,0,0,0,0,0|3,0,1]=4 21 B6R1.2 Brc1[n]cco1 Amb19514894 [0,0,0,0,0,0|2,0,2]=4 22 B6R1.2 Brc1c[n]co1 Amb24058248 [0,0,0,0,0,0|2,0,2]=4 23 B6R1.2 Brc1cc[n]o1 Amb20242149 [0,0,0,0,0,0|2,0,2]=4 24 B6R1.2 Brc1ncco1 Amb10071482 [0,0,0,0,0,0|2,0,2]=4 25 B6R1.2 C1C[NH2+]NC1=O Amb2408363 [0,0,0,0,0,0|2,0,0]=2 26 B6R1.2 C=C1CC=CN1 Amb25745630 [0,0,0,0,0,0|2,0,2]=4 27 B6R1.2 C=C1CCCC1 Amb22337671 [0,0,0,0,0,0|2,0,0]=2 28 B6R1.2 C=C1CNCC1 Amb22490848 [0,0,0,0,0,0|3,0,0]=3 29 B6R1.2 C=C1COCC1 Amb24683386 [0,0,0,0,0,0|3,0,0]=3 30 B6R1.2 C=C1OCCO1 Amb24477046 [0,0,0,0,0,0|2,0,0]=2 31 B6R1.2 CC1=CCC=C1 Amb22410851 [0,0,0,0,0,0|2,0,2]=4 32 B6R1.2 CC1=CCCO1 Amb20621083 [0,0,0,0,0,0|1,0,1]=2 33 B6R1.2 CC1=NCCN1 Amb1294344 [0,0,0,0,0,0|3,0,0]=3 34 B6R1.2 CC1CCC=C1 Amb17674168 [0,0,0,0,0,0|2,0,2]=4 35 B6R1.2 CC1CNCC1 Amb15690616 [0,0,0,0,0,0|3,0,1]=4 36 B6R1.2 CC1COCN1 Amb17506155 [0,0,0,0,0,0|3,0,1]=4 37 B6R1.2 CC1CSCC1 Amb20621725 [0,0,0,0,0,0|3,0,1]=4 38 B6R1.2 CC1CSCN1 Amb24550471 [0,0,0,0,0,0|3,0,1]=4 39 B6R1.2 CC1NCCO1 Amb17506154 [0,0,0,0,0,0|2,0,1]=3 40 B6R1.2 CC1NCCS1 Amb10844849 [0,0,0,0,0,0|2,1,1]=4 41 B6R1.2 CC1OCC[OH+]1 Amb25369482 [0,0,0,0,0,0|2,0,1]=3 42 B6R1.2 CC=1C=NCN1 Amb24638349 [0,0,0,0,0,0|3,0,1]=4 43 B6R1.2 CC=1CN=CC1 Amb25810885 [0,0,0,0,0,0|3,0,1]=4 44 B6R1.2 CN1CCN=C1 Amb10565894 [0,0,0,0,0,0|4,0,0]=4 45 B6R1.2 CN1CNCC1 Amb25663131 [0,0,0,0,0,0|4,0,0]=4 46 B6R1.2 CN1COCC1 Amb25146749 [0,0,0,0,0,0|4,0,0]=4 47 B6R1.2 C[C@@H]1CCCN1 Amb10071006 [0,0,0,0,0,0|2,0,1]=3 48 B6R1.2 C[C@@H]1CNCC1 Amb19887708 [0,0,0,0,0,0|3,0,1]=4 49 B6R1.2 C[C@@H]1CNCC1 Amb22748675 [0,0,0,0,0,0|3,0,1]=4 50 B6R1.2 C[C@H]1CCCN1 Amb10071007 [0,0,0,0,0,0|2,0,1]=3 51 B6R1.2 C[C@H]1CNCC1 Amb19888329 [0,0,0,0,0,0|3,0,1]=4 52 B6R1.2 C[SiH]1CCCC1 Amb24676798 [0,0,0,0,0,0|2,1,0]=3 53 B6R1.2 Cc1[n][n]co1 Amb20171395 [0,0,0,0,0,0|3,0,1]=4 54 B6R1.2 Cc1[n]c[n]o1 Amb25684624 [0,0,0,0,0,0|3,0,1]=4 55 B6R1.2 Cc1[n]cco1 Amb22757206 [0,0,0,0,0,0|2,0,2]=4 56 B6R1.2 Cc1c[n]co1 Amb23403175 [0,0,0,0,0,0|2,0,2]=4 57 B6R1.2 Cc1ccco1 Amb2447070 [0,0,0,0,0,0|1,0,3]=4 58 B6R1.2 Cc1ncco1 Amb17399783 [0,0,0,0,0,0|2,0,2]=4 59 B6R1.2 ClB1OCCO1 Amb24478528 [0,0,0,0,0,0|3,0,0]=3 60 B6R1.2 ClC1=CCC=C1 Amb22584067 [0,0,0,0,0,0|2,0,2]=4 61 B6R1.2 ClC1=NCCN1 Amb16185487 [0,0,0,0,0,0|3,0,0]=3 62 B6R1.2 ClC1=NCCS1 Amb24621482 [0,0,0,0,0,0|2,1,0]=3 63 B6R1.2 ClC1CCC=C1 Amb17672585 [0,0,0,0,0,0|2,0,2]=4 64 B6R1.2 ClC1CCCO1 Amb24093635 [0,0,0,0,0,0|1,0,1]=2 65 B6R1.2 ClC1CNCC1 Amb18640558 [0,0,0,0,0,0|3,0,1]=4 66 B6R1.2 ClC1CNCC1 Amb22229273 [0,0,0,0,0,0|3,0,1]=4 67 B6R1.2 ClC1COCC1 Amb20623054 [0,0,0,0,0,0|3,0,1]=4 68 B6R1.2 ClC1NCCN1 Amb24688507 [0,0,0,0,0,0|3,0,1]=4 69 B6R1.2 ClC=1CCCC1 Amb22351980 [0,0,0,0,0,0|2,0,0]=2 70 B6R1.2 ClC=1CNCC1 Amb23594521 [0,0,0,0,0,0|3,0,0]=3 71 B6R1.2 Cl[C@@H]1CNCC1 Amb22226671 [0,0,0,0,0,0|3,0,1]=4 72 B6R1.2 Cl[C@@H]1CNCC1 Amb22226672 [0,0,0,0,0,0|3,0,1]=4 73 B6R1.2 Cl[C@H]1CNCC1 Amb22225329 [0,0,0,0,0,0|3,0,1]=4 74 B6R1.2 Cl[C@H]1CNCC1 Amb22225331 [0,0,0,0,0,0|3,0,1]=4 75 B6R1.2 Clc1[n]cco1 Amb22054705 [0,0,0,0,0,0|2,0,2]=4 76 B6R1.2 FC1=CCCO1 Amb24322815 [0,0,0,0,0,0|1,0,1]=2 77 B6R1.2 FC1CCCC1 Amb10839457 [0,0,0,0,0,0|2,0,1]=3 78 B6R1.2 FC1CNCC1 Amb19148522 [0,0,0,0,0,0|3,0,1]=4 79 B6R1.2 FC=1CCOC1 Amb24322813 [0,0,0,0,0,0|3,0,0]=3 80 B6R1.2 F[C@@H]1CCCN1 Amb25746687 [0,0,0,0,0,0|2,0,1]=3 81 B6R1.2 F[C@@H]1CNCC1 Amb10603273 [0,0,0,0,0,0|3,0,1]=4 82 B6R1.2 F[C@H]1CNCC1 Amb10603224 [0,0,0,0,0,0|3,0,1]=4 83 B6R1.2 Fc1c[n]co1 Amb25364574 [0,0,0,0,0,0|2,0,2]=4 84 B6R1.2 IC1=CCCO1 Amb24322816 [0,0,0,0,0,0|1,0,1]=2 85 B6R1.2 IC1CCCO1 Amb24692765 [0,0,0,0,0,0|1,0,1]=2 86 B6R1.2 IC1CNCC1 Amb20618595 [0,0,0,0,0,0|3,0,1]=4 87 B6R1.2 IC1CNCC1 Amb22229333 [0,0,0,0,0,0|3,0,1]=4 88 B6R1.2 IC=1CCCC1 Amb24332192 [0,0,0,0,0,0|2,0,0]=2 89 B6R1.2 IC=1CCOC1 Amb24322814 [0,0,0,0,0,0|3,0,0]=3 90 B6R1.2 IC=1COCC1 Amb25782753 [0,0,0,0,0,0|3,0,0]=3 91 B6R1.2 I[C@@H]1CNCC1 Amb22226685 [0,0,0,0,0,0|3,0,1]=4 92 B6R1.2 I[C@@H]1CNCC1 Amb22226686 [0,0,0,0,0,0|3,0,1]=4 93 B6R1.2 I[C@@H]1COCC1 Amb22405918 [0,0,0,0,0,0|3,0,1]=4 94 B6R1.2 I[C@H]1CNCC1 Amb22225347 [0,0,0,0,0,0|3,0,1]=4 95 B6R1.2 I[C@H]1CNCC1 Amb22225348 [0,0,0,0,0,0|3,0,1]=4 96 B6R1.2 I[C@H]1COCC1 Amb25337461 [0,0,0,0,0,0|3,0,1]=4 97 B6R1.2 Ic1[n]cco1 Amb23439118 [0,0,0,0,0,0|2,0,2]=4 98 B6R1.2 Ic1cc[n]o1 Amb25793636 [0,0,0,0,0,0|2,0,2]=4 99 B6R1.2 Ic1ccco1 Amb17672748 [0,0,0,0,0,0|1,0,3]=4 100 B6R1.2 N=C1CCCC1 Amb22274869 [0,0,0,0,0,0|2,0,0]=2 101 B6R1.2 N=C1CCCN1 Amb2371632 [0,0,0,0,0,0|2,0,0]=2 102 B6R1.2 N=C1CCCS1 Amb10072429 [0,0,0,0,0,0|1,1,0]=2 103 B6R1.2 N=C1CN=CS1 Amb24093710 [0,0,0,0,0,0|2,1,1]=4 104 B6R1.2 N=C1NCCN1 Amb21859025 [0,0,0,0,0,0|3,0,0]=3 105 B6R1.2 N=C1NCCO1 Amb20623979 [0,0,0,0,0,0|2,0,0]=2 106 B6R1.2 N=C1SCCS1 Amb22168117 [0,0,0,0,0,0|2,1,0]=3 107 B6R1.2 NC1=CCCS1 Amb22733687 [0,0,0,0,0,0|1,1,1]=3 108 B6R1.2 NC1=CCNN1 Amb22346141 [0,0,0,0,0,0|3,0,1]=4 109 B6R1.2 NC1=CCNN1 Amb24053526 [0,0,0,0,0,0|3,0,1]=4 110 B6R1.2 NC1=CCNN1 Amb24080576 [0,0,0,0,0,0|3,0,1]=4 111 B6R1.2 NC1=NCCC1 Amb10976565 [0,0,0,0,0,0|2,0,0]=2 112 B6R1.2 NC1=NCCN1 Amb10810372 [0,0,0,0,0,0|3,0,0]=3 113 B6R1.2 NC1=NCCN1 Amb17613776 [0,0,0,0,0,0|3,0,0]=3 114 B6R1.2 NC1=NCCO1 Amb24325166 [0,0,0,0,0,0|2,0,0]=2 115 B6R1.2 NC1=NCCS1 Amb1924859 [0,0,0,0,0,0|2,1,0]=3 116 B6R1.2 NC1=NNCN1 Amb2539481 [0,0,0,0,0,0|4,0,0]=4 117 B6R1.2 NC1CCC=C1 Amb23385329 [0,0,0,0,0,0|2,0,2]=4 118 B6R1.2 NC1CCCN1 Amb22739650 [0,0,0,0,0,0|2,0,1]=3 119 B6R1.2 NC1CCCN1 Amb25187729 [0,0,0,0,0,0|2,0,1]=3 120 B6R1.2 NC1CCCO1 Amb16233703 [0,0,0,0,0,0|1,0,1]=2 121 B6R1.2 NC1COCC1 Amb16233718 [0,0,0,0,0,0|3,0,1]=4 122 B6R1.2 NC1CSCC1 Amb1132244 [0,0,0,0,0,0|3,0,1]=4 123 B6R1.2 NC1CSCC1 Amb19149005 [0,0,0,0,0,0|3,0,1]=4 124 B6R1.2 NC1NCCS1 Amb24061374 [0,0,0,0,0,0|2,1,1]=4 125 B6R1.2 NC=1C=CCN1 Amb25208790 [0,0,0,0,0,0|2,0,2]=4 126 B6R1.2 NC=1C=NCN1 Amb24511394 [0,0,0,0,0,0|3,0,1]=4 127 B6R1.2 NC=1CCCC1 Amb25699912 [0,0,0,0,0,0|2,0,0]=2 128 B6R1.2 NC=1CCNN1 Amb22330617 [0,0,0,0,0,0|3,0,0]=3 129 B6R1.2 NC=1CN=CN1 Amb25745173 [0,0,0,0,0,0|3,0,1]=4 130 B6R1.2 NC=1CSCN1 Amb24099613 [0,0,0,0,0,0|3,0,0]=3 131 B6R1.2 NC=1NCCN1 Amb21954272 [0,0,0,0,0,0|3,0,0]=3 132 B6R1.2 N[C@@H]1CCCO1 Amb25146442 [0,0,0,0,0,0|1,0,1]=2 133 B6R1.2 N[C@@H]1COCC1 Amb10603285 [0,0,0,0,0,0|3,0,1]=4 134 B6R1.2 N[C@@H]1COCC1 Amb22748137 [0,0,0,0,0,0|3,0,1]=4 135 B6R1.2 N[C@@H]1CSCC1 Amb24611361 [0,0,0,0,0,0|3,0,1]=4 136 B6R1.2 N[C@H]1CCC=C1 Amb24383047 [0,0,0,0,0,0|2,0,2]=4 137 B6R1.2 N[C@H]1COCC1 Amb19515768 [0,0,0,0,0,0|3,0,1]=4 138 B6R1.2 Nc1[n][n][n]o1 Amb24060275 [0,0,0,0,0,0|4,0,0]=4 139 B6R1.2 Nc1[n][n]co1 Amb19516986 [0,0,0,0,0,0|3,0,1]=4 140 B6R1.2 Nc1[n]c[n]o1 Amb18943952 [0,0,0,0,0,0|3,0,1]=4 141 B6R1.2 Nc1c[n]co1 Amb21962026 [0,0,0,0,0,0|2,0,2]=4 142 B6R1.2 Nc1c[n]co1 Amb21963496 [0,0,0,0,0,0|2,0,2]=4 143 B6R1.2 Nc1ccco1 Amb18203215 [0,0,0,0,0,0|1,0,3]=4 144 B6R1.2 O=C1BCCN1 Amb25267191 [0,0,0,0,0,0|2,0,0]=2 145 B6R1.2 O=C1C=CCN1 Amb20241082 [0,0,0,0,0,0|1,0,2]=3 146 B6R1.2 O=C1C=CCS1 Amb22336458 [0,0,0,0,0,0|0,1,2]=3 147 B6R1.2 O=C1C=CN=N1 Amb22230022 [0,0,0,0,0,0|2,0,2]=4 148 B6R1.2 O=C1C=CNN1 Amb19958916 [0,0,0,0,0,0|2,0,2]=4 149 B6R1.2 O=C1C=CON1 Amb22055592 [0,0,0,0,0,0|2,0,2]=4 150 B6R1.2 O=C1C=CSN1 Amb19895016 [0,0,0,0,0,0|2,0,2]=4 151 B6R1.2 O=C1C=NC=C1 Amb25746212 [0,0,0,0,0,0|2,0,2]=4 152 B6R1.2 O=C1C=NC=N1 Amb25662161 [0,0,0,0,0,0|2,0,2]=4 153 B6R1.2 O=C1C=NCO1 Amb25786221 [0,0,0,0,0,0|1,0,1]=2 154 B6R1.2 O=C1CC=CN1 Amb22235167 [0,0,0,0,0,0|1,0,2]=3 155 B6R1.2 O=C1CCCN1 Amb20240633 [0,0,0,0,0,0|1,0,0]=1 156 B6R1.2 O=C1CCCN1 Amb22338202 [0,0,0,0,0,0|1,0,0]=1 157 B6R1.2 O=C1CCCN1 Amb22432663 [0,0,0,0,0,0|1,0,0]=1 158 B6R1.2 O=C1CCCS1 Amb22338102 [0,0,0,0,0,0|0,1,0]=1 159 B6R1.2 O=C1CCNN1 Amb22730624 [0,0,0,0,0,0|2,0,0]=2 160 B6R1.2 O=C1CCON1 Amb22235009 [0,0,0,0,0,0|2,0,0]=2 161 B6R1.2 O=C1CN=CO1 Amb24333834 [0,0,0,0,0,0|1,0,1]=2 162 B6R1.2 O=C1CNC=C1 Amb22234991 [0,0,0,0,0,0|2,0,1]=3 163 B6R1.2 O=C1CNCN1 Amb19957368 [0,0,0,0,0,0|2,0,0]=2 164 B6R1.2 O=C1CNCO1 Amb24661408 [0,0,0,0,0,0|1,0,0]=1 165 B6R1.2 O=C1COC=C1 Amb24107591 [0,0,0,0,0,0|2,0,1]=3 166 B6R1.2 O=C1CSC=C1 Amb22736500 [0,0,0,0,0,0|2,0,1]=3 167 B6R1.2 O=C1CS[Ca]O1 Amb22369695 [0,0,0,0,0,0|2,0,0]=2 168 B6R1.2 O=C1N=CC=N1 Amb25138138 [0,0,0,0,0,0|2,0,2]=4 169 B6R1.2 O=C1N=CCO1 Amb25024901 [0,0,0,0,0,0|1,0,1]=2 170 B6R1.2 O=C1NC=CN1 Amb19516737 [0,0,0,0,0,0|2,0,2]=4 171 B6R1.2 O=C1NC=CO1 Amb20671008 [0,0,0,0,0,0|1,0,2]=3 172 B6R1.2 O=C1NC=CS1 Amb19271596 [0,0,0,0,0,0|1,1,2]=4 173 B6R1.2 O=C1NC=NN1 Amb20243425 [0,0,0,0,0,0|3,0,1]=4 174 B6R1.2 O=C1NCN=N1 Amb22227695 [0,0,0,0,0,0|3,0,0]=3 175 B6R1.2 O=C1NN=CO1 Amb20667671 [0,0,0,0,0,0|2,0,1]=3 176 B6R1.2 O=C1NN=CS1 Amb22491285 [0,0,0,0,0,0|2,1,1]=4 177 B6R1.2 O=C1NNC=N1 Amb20239428 [0,0,0,0,0,0|3,0,1]=4 178 B6R1.2 O=C1OC=CO1 Amb20239430 [0,0,0,0,0,0|1,0,2]=3 179 B6R1.2 O=C1SCCS1 Amb24630172 [0,0,0,0,0,0|1,1,0]=2 180 B6R1.2 O=P1OCCO1 Amb22346149 [0,0,0,0,0,0|2,0,0]=2 181 B6R1.2 O=[13C]1CCCC1 Amb22353487 [0,0,0,0,0,0|1,0,0]=1 182 B6R1.2 O=[13C]1OCCO1 Amb22338878 [0,0,0,0,0,0|1,0,0]=1 183 B6R1.2 O=[13C]1O[13CH2][13CH2]O1 Amb22351705 [0,0,0,0,0,0|1,0,0]=1 184 B6R1.2 OC1=NNCC1 Amb2111955 [0,0,0,0,0,0|2,0,1]=3 185 B6R1.2 OC1CC=NO1 Amb25146255 [0,0,0,0,0,0|1,0,3]=4 186 B6R1.2 OC1CCC=C1 Amb17593023 [0,0,0,0,0,0|1,0,3]=4 187 B6R1.2 OC1CCCO1 Amb17615892 [0,0,0,0,0,0|0,0,2]=2 188 B6R1.2 OC1CNCC1 Amb22436788 [0,0,0,0,0,0|2,0,2]=4 189 B6R1.2 OC1CNCO1 Amb25731319 [0,0,0,0,0,0|1,0,2]=3 190 B6R1.2 OC1COCO1 Amb25333766 [0,0,0,0,0,0|1,0,2]=3 191 B6R1.2 OP1OCCO1 Amb24546968 [0,0,0,0,0,0|2,0,1]=3 192 B6R1.2 O[13CH]1CCCC1 Amb22367208 [0,0,0,0,0,0|1,0,2]=3 193 B6R1.2 O[C@@H]1CCCN1 Amb25662794 [0,0,0,0,0,0|1,0,2]=3 194 B6R1.2 O[C@@H]1CCCO1 Amb25146365 [0,0,0,0,0,0|0,0,2]=2 195 B6R1.2 O[C@H]1CCC=C1 Amb25146308 [0,0,0,0,0,0|1,0,3]=4 196 B6R1.2 O[C@H]1CCCN1 Amb25662512 [0,0,0,0,0,0|1,0,2]=3 197 B6R1.2 Oc1[n][n]co1 Amb22586631 [0,0,0,0,0,0|2,0,2]=4 198 B6R1.2 Oc1c[n]co1 Amb25301524 [0,0,0,0,0,0|1,0,3]=4 199 B6R1.2 Oc1cc[n]o1 Amb25807641 [0,0,0,0,0,0|1,0,3]=4 200 B6R1.2 Oc1ccco1 Amb22230736 [0,0,0,0,0,0|0,0,4]=4 201 B6R1.2 S=C1C=NCN1 Amb25268682 [0,0,0,0,0,0|2,1,1]=4 202 B6R1.2 S=C1CC=CO1 Amb25365370 [0,0,0,0,0,0|0,1,2]=3 203 B6R1.2 S=C1CCC=C1 Amb25147777 [0,0,0,0,0,0|1,1,1]=3 204 B6R1.2 S=C1CN=CN1 Amb24756951 [0,0,0,0,0,0|2,1,1]=4 205 B6R1.2 S=C1CN=CS1 Amb24093708 [0,0,0,0,0,0|1,2,1]=4 206 B6R1.2 S=C1NC=CO1 Amb21936248 [0,0,0,0,0,0|1,1,2]=4 207 B6R1.2 S=C1NCCO1 Amb2371644 [0,0,0,0,0,0|1,1,0]=2 208 B6R1.2 S=C1NCSS1 Amb24478531 [0,0,0,0,0,0|2,2,0]=4 209 B6R1.2 SC1CCCC1 Amb22045533 [0,0,0,0,0,0|1,1,1]=3 210 B6R1.2 SC1CNCC1 Amb10608919 [0,0,0,0,0,0|2,1,1]=4 211 B6R1.2 SC1COCC1 Amb22298444 [0,0,0,0,0,0|2,1,1]=4 212 B6R1.2 SC1NCCN1 Amb24333214 [0,0,0,0,0,0|2,1,1]=4 213 B6R1.2 SC1NCCS1 Amb25228452 [0,0,0,0,0,0|1,2,1]=4 214 B6R1.2 S[C@@H]1CNCC1 Amb24761461 [0,0,0,0,0,0|2,1,1]=4 215 B6R1.2 S[C@H]1CNCC1 Amb24557194 [0,0,0,0,0,0|2,1,1]=4 216 B6R1.2 [13CH3]c1ccco1 Amb22367321 [0,0,0,0,0,0|1,0,3]=4 217 B6R1.2 [BH3-]N1CCCC1 Amb22354020 [0,0,0,0,0,0|3,0,0]=3 218 B6R1.2 [BH3-][O+]1CCCC1 Amb22727926 [0,0,0,0,0,0|3,0,0]=3 219 B6R1.2 [Mg+]C1CCCC1 Amb22043959 [0,0,0,0,0,0|2,0,1]=3 220 B6R1.2 [Mg+]C1CCCC1 Amb22231917 [0,0,0,0,0,0|2,0,1]=3 221 B6R1.2 [Mn]C=1CC=CC1 Amb22169701 [0,0,0,0,0,0|2,0,2]=4 222 B6R1.2 [O-][C@@H]1CNCC1 Amb22748772 [0,0,0,0,0,0|2,0,2]=4 223 B6R1.2 [SiH3]C1CCCC1 Amb22229567 [0,0,0,0,0,0|2,0,1]=3 224 B6R1.2 [SiH3]N1CCCC1 Amb25109243 [0,0,0,0,0,0|3,0,0]=3 225 B6R1.2 [SiH3]c1ccco1 Amb24511582 [0,0,0,0,0,0|1,0,3]=4 226 B5R1.1 C1C=CC=C1 Amb17938994 [1,0,0,0,0,0|1,0,2]=4 227 B5R1.1 C1C=CCS1 Amb24476843 [1,0,0,0,0,0|2,0,0]=3 228 B5R1.1 C1C=CC[SiH2]1 Amb22734332 [1,0,0,0,0,0|1,1,0]=3 229 B5R1.1 C1C=NSS1 Amb24477400 [1,0,0,0,0,0|3,0,0]=4 230 B5R1.1 C1CCCC1 Amb19894713 [1,0,0,0,0,0|1,0,1]=3 231 B5R1.1 C1CCCO1 Amb22045513 [1,0,0,0,0,0|0,0,1]=2 232 B5R1.1 C1CCCO1 Amb22045541 [1,0,0,0,0,0|0,0,1]=2 233 B5R1.1 C1CCCO1 Amb22336497 [1,0,0,0,0,0|0,0,1]=2 234 B5R1.1 C1CCCO1 Amb22338101 [1,0,0,0,0,0|0,0,1]=2 235 B5R1.1 C1CCCO1 Amb22350297 [1,0,0,0,0,0|0,0,1]=2 236 B5R1.1 C1CCCO1 Amb22351447 [1,0,0,0,0,0|0,0,1]=2 237 B5R1.1 C1CCCO1 Amb22351655 [1,0,0,0,0,0|0,0,1]=2 238 B5R1.1 C1CCCO1 Amb22351959 [1,0,0,0,0,0|0,0,1]=2 239 B5R1.1 C1CCCO1 Amb22367069 [1,0,0,0,0,0|0,0,1]=2 240 B5R1.1 C1CCCO1 Amb22730414 [1,0,0,0,0,0|0,0,1]=2 241 B5R1.1 C1CCC[13CH2]1 Amb22351925 [1,0,0,0,0,0|1,0,1]=3 242 B5R1.1 C1CCC[SH+]1 Amb25324191 [1,0,0,0,0,0|0,1,1]=3 243 B5R1.1 C1CCNN1 Amb18061973 [1,0,0,0,0,0|2,0,0]=3 244 B5R1.1 C1CCNN1 Amb21964916 [1,0,0,0,0,0|2,0,0]=3 245 B5R1.1 C1CN=CN1 Amb25083166 [1,0,0,0,0,0|2,0,0]=3 246 B5R1.1 C1CNC=C1 Amb24476832 [1,0,0,0,0,0|1,0,1]=3 247 B5R1.1 C1CNN=C1 Amb21618957 [1,0,0,0,0,0|2,0,0]=3 248 B5R1.1 C1COC=N1 Amb16234259 [1,0,0,0,0,0|1,0,0]=2 249 B5R1.1 C1CON=C1 Amb24583471 [1,0,0,0,0,0|1,0,1]=3 250 B5R1.1 C1CSC=C1 Amb24065325 [1,0,0,0,0,0|0,1,1]=3 251 B5R1.1 C1NC=CN1 Amb25764659 [1,0,0,0,0,0|2,0,1]=4 252 B5R1.1 C1NC=CO1 Amb20242493 [1,0,0,0,0,0|1,0,1]=3 253 B5R1.1 C1NC=CS1 Amb24065324 [1,0,0,0,0,0|1,1,1]=4 254 B5R1.1 C1NC=NO1 Amb24117046 [1,0,0,0,0,0|2,0,1]=4 255 B5R1.1 C1NC=NS1 Amb24476934 [1,0,0,0,0,0|3,0,0]=4 256 B5R1.1 C1NCCN1 Amb22497691 [1,0,0,0,0,0|2,0,1]=4 257 B5R1.1 C1NCCO1 Amb17506153 [1,0,0,0,0,0|1,0,1]=3 258 B5R1.1 C1NCNO1 Amb24476989 [1,0,0,0,0,0|2,0,0]=3 259 B5R1.1 C1NNC=C1 Amb16218167 [1,0,0,0,0,0|2,0,1]=4 260 B5R1.1 C1NNCN1 Amb25225168 [1,0,0,0,0,0|3,0,0]=4 261 B5R1.1 C1NOCO1 Amb24410747 [1,0,0,0,0,0|2,0,0]=3 262 B5R1.1 C1SCCS1 Amb10071964 [1,0,0,0,0,0|1,1,1]=4 263 B5R1.1 [C-]=1CC=CC1 Amb22231445 [1,0,0,0,0,0|1,0,2]=4 264 B5R1.1 o1cnnc1 Amb10552366 [1,0,0,0,0,0|2,0,1]=4 265 B7R1.1 BrC=C1OCCO1 Amb25697137 [0,1,0,0,0,0|2,0,0]=3 266 B7R1.1 BrCC1CCCN1 Amb20618588 [0,1,0,0,0,0|2,0,1]=4 267 B7R1.1 BrCC1CCCN1 Amb21962027 [0,1,0,0,0,0|2,0,1]=4 268 B7R1.1 BrCC1COCO1 Amb25138742 [0,1,0,0,0,0|2,0,1]=4 269 B7R1.1 BrCC=1CCCC1 Amb23439168 [0,1,0,0,0,0|2,0,0]=3 270 B7R1.1 BrCC=1NCCN1 Amb25765654 [0,1,0,0,0,0|3,0,0]=4 271 B7R1.1 BrC[C@@H]1CCCN1 Amb22225950 [0,1,0,0,0,0|2,0,1]=4 272 B7R1.1 BrC[C@@H]1CCCN1 Amb25809414 [0,1,0,0,0,0|2,0,1]=4 273 B7R1.1 BrC[C@@H]1CCCO1 Amb24046261 [0,1,0,0,0,0|1,0,1]=3 274 B7R1.1 BrC[C@H]1CCCN1 Amb25355431 [0,1,0,0,0,0|2,0,1]=4 275 B7R1.1 C#CC1=CCCC1 Amb17689255 [0,1,0,0,0,0|2,0,0]=3 276 B7R1.1 C#CC1CCCN1 Amb23598273 [0,1,0,0,0,0|2,0,1]=4 277 B7R1.1 C#C[C@@H]1CCCN1 Amb24479840 [0,1,0,0,0,0|2,0,1]=4 278 B7R1.1 C=CC1CCCC1 Amb17934190 [0,1,0,0,0,0|2,0,1]=4 279 B7R1.1 C=CC1CCCN1 Amb23536605 [0,1,0,0,0,0|2,0,1]=4 280 B7R1.1 C=CC1CCCN1 Amb24082686 [0,1,0,0,0,0|2,0,1]=4 281 B7R1.1 C=CC1NCCO1 Amb25810198 [0,1,0,0,0,0|2,0,1]=4 282 B7R1.1 C=CN1CCCC1 Amb25133406 [0,1,0,0,0,0|3,0,0]=4 283 B7R1.1 C=C[C@H]1CCCN1 Amb24642810 [0,1,0,0,0,0|2,0,1]=4 284 B7R1.1 CCC1=NCCN1 Amb17670469 [0,1,0,0,0,0|3,0,0]=4 285 B7R1.1 CCC1CCCC1 Amb22053788 [0,1,0,0,0,0|2,0,1]=4 286 B7R1.1 CCC1CCCN1 Amb19515009 [0,1,0,0,0,0|2,0,1]=4 287 B7R1.1 CCC1CCCS1 Amb17939242 [0,1,0,0,0,0|1,1,1]=4 288 B7R1.1 CCC1COCO1 Amb24567580 [0,1,0,0,0,0|2,0,1]=4 289 B7R1.1 CCC1NCCO1 Amb17506183 [0,1,0,0,0,0|2,0,1]=4 290 B7R1.1 CCC1OCCO1 Amb19892413 [0,1,0,0,0,0|2,0,1]=4 291 B7R1.1 CCC=1CCCN1 Amb22055207 [0,1,0,0,0,0|2,0,0]=3 292 B7R1.1 CCN1CCCC1 Amb17938866 [0,1,0,0,0,0|3,0,0]=4 293 B7R1.1 CC[C@@H]1CCCN1 Amb22225172 [0,1,0,0,0,0|2,0,1]=4 294 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [0,1,0,0,0,0|2,0,1]=4 295 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [0,1,0,0,0,0|2,0,1]=4 296 B7R1.1 CNC1=NCCN1 Amb16202823 [0,1,0,0,0,0|3,0,0]=4 297 B7R1.1 CNC1=NCCS1 Amb10609697 [0,1,0,0,0,0|2,1,0]=4 298 B7R1.1 CNC1CCCC1 Amb1223228 [0,1,0,0,0,0|2,0,1]=4 299 B7R1.1 CNC=1CCON1 Amb25680138 [0,1,0,0,0,0|3,0,0]=4 300 B7R1.1 COC1=CCCN1 Amb19883801 [0,1,0,0,0,0|1,0,2]=4 301 B7R1.1 COC1=NCCC1 Amb1694184 [0,1,0,0,0,0|1,0,1]=3 302 B7R1.1 COC1=NCCN1 Amb15693394 [0,1,0,0,0,0|2,0,1]=4 303 B7R1.1 COC1CCCN1 Amb22493883 [0,1,0,0,0,0|1,0,2]=4 304 B7R1.1 COC1CCCO1 Amb22505257 [0,1,0,0,0,0|0,0,2]=3 305 B7R1.1 COC1OCCO1 Amb17939672 [0,1,0,0,0,0|1,0,2]=4 306 B7R1.1 COC1OCCS1 Amb25056247 [0,1,0,0,0,0|1,0,2]=4 307 B7R1.1 COC=1CCNC1 Amb24428695 [0,1,0,0,0,0|2,0,1]=4 308 B7R1.1 CSC1=CCCN1 Amb24689471 [0,1,0,0,0,0|1,1,1]=4 309 B7R1.1 CSC1=NCCN1 Amb1630604 [0,1,0,0,0,0|2,1,0]=4 310 B7R1.1 CSC1=NCCN1 Amb2137042 [0,1,0,0,0,0|2,1,0]=4 311 B7R1.1 CSC1CCCC1 Amb22230463 [0,1,0,0,0,0|1,1,1]=4 312 B7R1.1 CSC=1NCCN1 Amb22492600 [0,1,0,0,0,0|2,1,0]=4 313 B7R1.1 C\C=C\1/CNCC1 Amb24380188 [0,1,0,0,0,0|3,0,0]=4 314 B7R1.1 ClC=[N+]1CCCC1 Amb25210586 [0,1,0,0,0,0|3,0,0]=4 315 B7R1.1 ClCC1=CCCO1 Amb24747248 [0,1,0,0,0,0|1,0,1]=3 316 B7R1.1 ClCC1=NCCN1 Amb2372055 [0,1,0,0,0,0|3,0,0]=4 317 B7R1.1 ClCC1=NCCO1 Amb24599141 [0,1,0,0,0,0|2,0,0]=3 318 B7R1.1 ClCC1=NCCS1 Amb24557139 [0,1,0,0,0,0|2,1,0]=4 319 B7R1.1 ClCC1CCCN1 Amb1102532 [0,1,0,0,0,0|2,0,1]=4 320 B7R1.1 ClCC1CCCN1 Amb22228750 [0,1,0,0,0,0|2,0,1]=4 321 B7R1.1 ClCC1CCCO1 Amb2377520 [0,1,0,0,0,0|1,0,1]=3 322 B7R1.1 ClCC1CCCS1 Amb25339278 [0,1,0,0,0,0|1,1,1]=4 323 B7R1.1 ClCC1COCO1 Amb25147241 [0,1,0,0,0,0|2,0,1]=4 324 B7R1.1 ClCC1CSCO1 Amb24454663 [0,1,0,0,0,0|2,0,1]=4 325 B7R1.1 ClCC=1CCCC1 Amb24479493 [0,1,0,0,0,0|2,0,0]=3 326 B7R1.1 ClCC=1CCCN1 Amb25811239 [0,1,0,0,0,0|2,0,0]=3 327 B7R1.1 ClCC=1CNCN1 Amb20620720 [0,1,0,0,0,0|3,0,0]=4 328 B7R1.1 ClC[C@@H]1CCCN1 Amb22226498 [0,1,0,0,0,0|2,0,1]=4 329 B7R1.1 ClC[C@@H]1CCCN1 Amb22232498 [0,1,0,0,0,0|2,0,1]=4 330 B7R1.1 ClC[C@@H]1CCCO1 Amb25225942 [0,1,0,0,0,0|1,0,1]=3 331 B7R1.1 ClC[C@H]1CCCO1 Amb24406034 [0,1,0,0,0,0|1,0,1]=3 332 B7R1.1 Cl[Mg]C1CCCC1 Amb17689222 [0,1,0,0,0,0|2,0,1]=4 333 B7R1.1 Cl\C=C/1\COCO1 Amb25138746 [0,1,0,0,0,0|2,0,0]=3 334 B7R1.1 Cl\C=C\1/COCC1 Amb24333722 [0,1,0,0,0,0|3,0,0]=4 335 B7R1.1 FCC1CCCN1 Amb13953136 [0,1,0,0,0,0|2,0,1]=4 336 B7R1.1 FCC1CCCO1 Amb24456901 [0,1,0,0,0,0|1,0,1]=3 337 B7R1.1 FC[C@@H]1CCCN1 Amb22405982 [0,1,0,0,0,0|2,0,1]=4 338 B7R1.1 ICC1CCCN1 Amb21861199 [0,1,0,0,0,0|2,0,1]=4 339 B7R1.1 ICC1CCCN1 Amb22228742 [0,1,0,0,0,0|2,0,1]=4 340 B7R1.1 ICC1CCCO1 Amb24060886 [0,1,0,0,0,0|1,0,1]=3 341 B7R1.1 ICN1CCCC1 Amb24060254 [0,1,0,0,0,0|3,0,0]=4 342 B7R1.1 IC[C@@H]1CCCN1 Amb22226246 [0,1,0,0,0,0|2,0,1]=4 343 B7R1.1 IC[C@@H]1CCCN1 Amb24612062 [0,1,0,0,0,0|2,0,1]=4 344 B7R1.1 N#CC1=CCCO1 Amb19149010 [0,1,0,0,0,0|1,0,1]=3 345 B7R1.1 N#CC1CCCN1 Amb10069328 [0,1,0,0,0,0|2,0,1]=4 346 B7R1.1 N#CC1CCCN1 Amb18198112 [0,1,0,0,0,0|2,0,1]=4 347 B7R1.1 N#CC1CCCN1 Amb22405979 [0,1,0,0,0,0|2,0,1]=4 348 B7R1.1 N#CC1CCCO1 Amb17506326 [0,1,0,0,0,0|1,0,1]=3 349 B7R1.1 N#CC1CCCS1 Amb20171416 [0,1,0,0,0,0|1,1,1]=4 350 B7R1.1 N#CC=1CCON1 Amb24624782 [0,1,0,0,0,0|3,0,0]=4 351 B7R1.1 N#C[C@@H]1CCCN1 Amb17399785 [0,1,0,0,0,0|2,0,1]=4 352 B7R1.1 N#C[C@H]1CCCN1 Amb22225409 [0,1,0,0,0,0|2,0,1]=4 353 B7R1.1 NCC1CCCC1 Amb1127194 [0,1,0,0,0,0|2,0,1]=4 354 B7R1.1 NCC1CCCC1 Amb13951760 [0,1,0,0,0,0|2,0,1]=4 355 B7R1.1 NCC1CCCN1 Amb19516137 [0,1,0,0,0,0|2,0,1]=4 356 B7R1.1 NCC1CCCN1 Amb22504269 [0,1,0,0,0,0|2,0,1]=4 357 B7R1.1 NCC1CCCO1 Amb2568046 [0,1,0,0,0,0|1,0,1]=3 358 B7R1.1 NCC1CCCS1 Amb20668756 [0,1,0,0,0,0|1,1,1]=4 359 B7R1.1 NCC1COCO1 Amb25261501 [0,1,0,0,0,0|2,0,1]=4 360 B7R1.1 NCC1OCCS1 Amb23447046 [0,1,0,0,0,0|2,0,1]=4 361 B7R1.1 NCC=1CCCC1 Amb18120760 [0,1,0,0,0,0|2,0,0]=3 362 B7R1.1 NCC=1CCON1 Amb19148524 [0,1,0,0,0,0|3,0,0]=4 363 B7R1.1 NCC=1CNCC1 Amb24714742 [0,1,0,0,0,0|3,0,0]=4 364 B7R1.1 NCC=1NCCN1 Amb24479837 [0,1,0,0,0,0|3,0,0]=4 365 B7R1.1 NCN1CCCC1 Amb25368345 [0,1,0,0,0,0|3,0,0]=4 366 B7R1.1 NCN1CCCO1 Amb25091742 [0,1,0,0,0,0|2,0,0]=3 367 B7R1.1 NC[C@@H]1CCCN1 Amb10066983 [0,1,0,0,0,0|2,0,1]=4 368 B7R1.1 NC[C@@H]1CCCN1 Amb22405933 [0,1,0,0,0,0|2,0,1]=4 369 B7R1.1 NC[C@@H]1CCCN1 Amb22748399 [0,1,0,0,0,0|2,0,1]=4 370 B7R1.1 NN=C1CCCC1 Amb25852884 [0,1,0,0,0,0|2,0,0]=3 371 B7R1.1 NN=C1CNCC1 Amb24743017 [0,1,0,0,0,0|3,0,0]=4 372 B7R1.1 NN=C1COCC1 Amb24615453 [0,1,0,0,0,0|3,0,0]=4 373 B7R1.1 NN=C1CSCC1 Amb25315778 [0,1,0,0,0,0|3,0,0]=4 374 B7R1.1 NNC1=NCCS1 Amb1059846 [0,1,0,0,0,0|2,1,0]=4 375 B7R1.1 NNC1=NCCS1 Amb2417182 [0,1,0,0,0,0|2,1,0]=4 376 B7R1.1 NNC1CCCC1 Amb10071294 [0,1,0,0,0,0|2,0,1]=4 377 B7R1.1 NNC1CCCN1 Amb24525186 [0,1,0,0,0,0|2,0,1]=4 378 B7R1.1 NNC=1CCCN1 Amb24119297 [0,1,0,0,0,0|2,0,0]=3 379 B7R1.1 NNC=1NCCN1 Amb24056434 [0,1,0,0,0,0|3,0,0]=4 380 B7R1.1 NOC1CCCC1 Amb17101093 [0,1,0,0,0,0|1,0,2]=4 381 B7R1.1 NOC1CCCC1 Amb22750164 [0,1,0,0,0,0|1,0,2]=4 382 B7R1.1 N\N=C/1\CNCC1 Amb23586432 [0,1,0,0,0,0|3,0,0]=4 383 B7R1.1 O=C=C1CCCC1 Amb17673796 [0,1,0,0,0,0|1,0,0]=2 384 B7R1.1 O=CC1=CCC=C1 Amb24437176 [0,1,0,0,0,0|1,0,2]=4 385 B7R1.1 O=CC1=CCCC1 Amb17138358 [0,1,0,0,0,0|1,0,0]=2 386 B7R1.1 O=CC1=CCCO1 Amb18120782 [0,1,0,0,0,0|0,0,1]=2 387 B7R1.1 O=CC1C=CCO1 Amb25347483 [0,1,0,0,0,0|0,0,3]=4 388 B7R1.1 O=CC1CCCN1 Amb20618600 [0,1,0,0,0,0|1,0,1]=3 389 B7R1.1 O=CC1CCCN1 Amb22231416 [0,1,0,0,0,0|1,0,1]=3 390 B7R1.1 O=CC1CNCC1 Amb18197564 [0,1,0,0,0,0|2,0,1]=4 391 B7R1.1 O=CC1CNCC1 Amb22231419 [0,1,0,0,0,0|2,0,1]=4 392 B7R1.1 O=CC1COCO1 Amb25767896 [0,1,0,0,0,0|1,0,1]=3 393 B7R1.1 O=CC1CSCC1 Amb18199140 [0,1,0,0,0,0|2,0,1]=4 394 B7R1.1 O=CC1SCCS1 Amb25169582 [0,1,0,0,0,0|1,1,1]=4 395 B7R1.1 O=CC=1CC=CC1 Amb25799627 [0,1,0,0,0,0|1,0,2]=4 396 B7R1.1 O=CC=1CCOC1 Amb18120774 [0,1,0,0,0,0|2,0,0]=3 397 B7R1.1 O=CN1CCCO1 Amb24470900 [0,1,0,0,0,0|1,0,0]=2 398 B7R1.1 O=C[C@@H]1CCCN1 Amb22226769 [0,1,0,0,0,0|1,0,1]=3 399 B7R1.1 O=C[C@@H]1CCCO1 Amb25338193 [0,1,0,0,0,0|0,0,1]=2 400 B7R1.1 O=C[C@@H]1COCC1 Amb25123223 [0,1,0,0,0,0|2,0,1]=4 401 B7R1.1 O=C[C@H]1CCC=C1 Amb25116186 [0,1,0,0,0,0|1,0,2]=4 402 B7R1.1 O=C[C@H]1CCCN1 Amb25684302 [0,1,0,0,0,0|1,0,1]=3 403 B7R1.1 O=C[C@H]1CCCO1 Amb25216742 [0,1,0,0,0,0|0,0,1]=2 404 B7R1.1 O=Cc1[n][n]co1 Amb21856468 [0,1,0,0,0,0|2,0,1]=4 405 B7R1.1 O=NN1CSCC1 Amb25104685 [0,1,0,0,0,0|3,0,0]=4 406 B7R1.1 O=Nc1ccco1 Amb25746897 [0,1,0,0,0,0|0,0,3]=4 407 B7R1.1 O=S=C1NC=CO1 Amb24539442 [0,1,0,0,0,0|1,0,2]=4 408 B7R1.1 OCC1=CCCO1 Amb25045240 [0,1,0,0,0,0|0,0,2]=3 409 B7R1.1 OCC1=NCCO1 Amb22410786 [0,1,0,0,0,0|1,0,1]=3 410 B7R1.1 OCC1CCCN1 Amb2237182 [0,1,0,0,0,0|1,0,2]=4 411 B7R1.1 OCC1CCCO1 Amb22731176 [0,1,0,0,0,0|0,0,2]=3 412 B7R1.1 OCC1CCCS1 Amb19149313 [0,1,0,0,0,0|0,1,2]=4 413 B7R1.1 OCC1NCCO1 Amb25230305 [0,1,0,0,0,0|1,0,2]=4 414 B7R1.1 OCC=1CCCC1 Amb24479891 [0,1,0,0,0,0|1,0,1]=3 415 B7R1.1 OCC=1CNCC1 Amb25302340 [0,1,0,0,0,0|2,0,1]=4 416 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [0,1,0,0,0,0|1,0,2]=4 417 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [0,1,0,0,0,0|0,0,2]=3 418 B7R1.1 OC[C@@H]1OCCS1 Amb22748777 [0,1,0,0,0,0|1,0,2]=4 419 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [0,1,0,0,0,0|1,0,2]=4 420 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [0,1,0,0,0,0|0,0,2]=3 421 B7R1.1 OC[C@H]1OCCS1 Amb25198578 [0,1,0,0,0,0|1,0,2]=4 422 B7R1.1 ON=C1CNCC1 Amb24763630 [0,1,0,0,0,0|2,0,1]=4 423 B7R1.1 ON=C1COCC1 Amb24479869 [0,1,0,0,0,0|2,0,1]=4 424 B7R1.1 ON=C1CSCC1 Amb25269596 [0,1,0,0,0,0|2,0,1]=4 425 B7R1.1 ON=C1NCCN1 Amb25730435 [0,1,0,0,0,0|2,0,1]=4 426 B7R1.1 O\C=C/1\CCCN1 Amb24515856 [0,1,0,0,0,0|1,0,1]=3 427 B7R1.1 O\N=C/1\CNCC1 Amb23586431 [0,1,0,0,0,0|2,0,1]=4 428 B7R1.1 O\N=C\1/CCCN1 Amb19769769 [0,1,0,0,0,0|1,0,1]=3 429 B7R1.1 SCC1CCCC1 Amb19514712 [0,1,0,0,0,0|1,1,1]=4 430 B7R1.1 SCC1CCCO1 Amb10563132 [0,1,0,0,0,0|0,1,1]=3 431 B7R1.1 SCC=1CCCC1 Amb24697613 [0,1,0,0,0,0|1,1,0]=3 432 B7R1.1 SC[C@@H]1CCCN1 Amb24120350 [0,1,0,0,0,0|1,1,1]=4 433 B7R1.1 [13CH3][13CH2]C=1CCCN1 Amb22055208 [0,1,0,0,0,0|2,0,0]=3 434 B7R1.1 [C-]#[N+]C1CCCC1 Amb1981028 [0,1,0,0,0,0|2,0,1]=4 435 B7R1.2 BrC1=CC(=O)OC1 Amb10067500 [0,1,0,0,0,0|0,0,2]=3 436 B7R1.2 C=C1C=CC(=O)O1 Amb22001002 [0,1,0,0,0,0|0,0,3]=4 437 B7R1.2 C=C1CC(=O)C=C1 Amb24553656 [0,1,0,0,0,0|1,0,2]=4 438 B7R1.2 C=C1CC(=O)NC1 Amb25767177 [0,1,0,0,0,0|1,0,1]=3 439 B7R1.2 C=C1CC(=O)OC1 Amb24589821 [0,1,0,0,0,0|0,0,1]=2 440 B7R1.2 C=C1CC(Br)CC1 Amb25135798 [0,1,0,0,0,0|2,0,0]=3 441 B7R1.2 C=C1CC(N)CC1 Amb24352464 [0,1,0,0,0,0|2,0,0]=3 442 B7R1.2 C=C1CC(O)CC1 Amb25246529 [0,1,0,0,0,0|2,0,0]=3 443 B7R1.2 C=C1COC(=O)N1 Amb24541155 [0,1,0,0,0,0|1,0,1]=3 444 B7R1.2 C=C1COC(=O)O1 Amb20248769 [0,1,0,0,0,0|1,0,1]=3 445 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [0,1,0,0,0,0|1,0,2]=4 446 B7R1.2 CC1=CC(=S)CO1 Amb25026404 [0,1,0,0,0,0|1,0,2]=4 447 B7R1.2 CC1=CC(NC1)C Amb17593062 [0,1,0,0,0,0|3,0,0]=4 448 B7R1.2 CC1=CC(S)CS1 Amb25800834 [0,1,0,0,0,0|1,1,1]=4 449 B7R1.2 CC1=CCC(=O)N1 Amb24119179 [0,1,0,0,0,0|1,0,2]=4 450 B7R1.2 CC1=CNC(=O)O1 Amb22298623 [0,1,0,0,0,0|1,0,2]=4 451 B7R1.2 CC1=COC(=O)O1 Amb24693155 [0,1,0,0,0,0|1,0,2]=4 452 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [0,1,0,0,0,0|2,0,1]=4 453 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [0,1,0,0,0,0|2,0,1]=4 454 B7R1.2 CC1BC(C)CC1 Amb25760363 [0,1,0,0,0,0|2,0,1]=4 455 B7R1.2 CC1C=CC(=O)N1 Amb25248060 [0,1,0,0,0,0|1,0,2]=4 456 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [0,1,0,0,0,0|0,0,2]=3 457 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [0,1,0,0,0,0|0,1,2]=4 458 B7R1.2 CC1C=NC(=O)S1 Amb20620625 [0,1,0,0,0,0|1,1,1]=4 459 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,1,0,0,0,0|2,0,0]=3 460 B7R1.2 CC1CC(=O)NC1 Amb10608004 [0,1,0,0,0,0|1,0,0]=2 461 B7R1.2 CC1CC(Br)CO1 Amb25108601 [0,1,0,0,0,0|1,0,1]=3 462 B7R1.2 CC1CC(Cl)CC1 Amb25129430 [0,1,0,0,0,0|2,0,1]=4 463 B7R1.2 CC1CC(N)CC1 Amb20669202 [0,1,0,0,0,0|2,0,1]=4 464 B7R1.2 CC1CC(N)CC1 Amb24062164 [0,1,0,0,0,0|2,0,1]=4 465 B7R1.2 CC1CC(N)CS1 Amb18202610 [0,1,0,0,0,0|1,1,1]=4 466 B7R1.2 CC1CC(O)CN1 Amb20668139 [0,1,0,0,0,0|2,0,1]=4 467 B7R1.2 CC1CC(O)CS1 Amb24660406 [0,1,0,0,0,0|1,1,1]=4 468 B7R1.2 CC1CC(S)CC1 Amb25829470 [0,1,0,0,0,0|1,1,1]=4 469 B7R1.2 CC1CC=C(C)C1 Amb17674172 [0,1,0,0,0,0|2,0,0]=3 470 B7R1.2 CC1CCC(=N)N1 Amb24479850 [0,1,0,0,0,0|2,0,0]=3 471 B7R1.2 CC1CCC(=O)N1 Amb19267101 [0,1,0,0,0,0|1,0,0]=2 472 B7R1.2 CC1CCC(=S)O1 Amb25361484 [0,1,0,0,0,0|0,1,0]=2 473 B7R1.2 CC1CCC(C)=C1 Amb24479860 [0,1,0,0,0,0|2,0,0]=3 474 B7R1.2 CC1CCC(C)=N1 Amb24598049 [0,1,0,0,0,0|2,0,0]=3 475 B7R1.2 CC1CCC(C)N1 Amb20626165 [0,1,0,0,0,0|2,0,1]=4 476 B7R1.2 CC1CCC(O)O1 Amb22295909 [0,1,0,0,0,0|0,0,2]=3 477 B7R1.2 CC1CCC(O1)C Amb10602551 [0,1,0,0,0,0|1,0,1]=3 478 B7R1.2 CC1CN(N)CC1 Amb24385963 [0,1,0,0,0,0|3,0,0]=4 479 B7R1.2 CC1CN=C(C)O1 Amb25360042 [0,1,0,0,0,0|2,0,0]=3 480 B7R1.2 CC1CN=C(S)O1 Amb25196024 [0,1,0,0,0,0|1,1,0]=3 481 B7R1.2 CC1CNC(=N)S1 Amb24684074 [0,1,0,0,0,0|2,1,0]=4 482 B7R1.2 CC1CNC(=O)N1 Amb17506853 [0,1,0,0,0,0|2,0,0]=3 483 B7R1.2 CC1CNC(=O)O1 Amb19651732 [0,1,0,0,0,0|1,0,0]=2 484 B7R1.2 CC1CNC(=O)S1 Amb25367335 [0,1,0,0,0,0|1,1,0]=3 485 B7R1.2 CC1CNC(=S)S1 Amb17845151 [0,1,0,0,0,0|1,2,0]=4 486 B7R1.2 CC1CNC(C)=C1 Amb25806978 [0,1,0,0,0,0|2,0,1]=4 487 B7R1.2 CC1CNC(C)=N1 Amb22733191 [0,1,0,0,0,0|3,0,0]=4 488 B7R1.2 CC1CNC(C)C1 Amb19335336 [0,1,0,0,0,0|2,0,1]=4 489 B7R1.2 CC1CNC(N)=N1 Amb25186469 [0,1,0,0,0,0|3,0,0]=4 490 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,1,0,0,0,0|0,0,0]=1 491 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,1,0,0,0,0|1,0,0]=2 492 B7R1.2 CC1COC(=S)N1 Amb24479649 [0,1,0,0,0,0|1,1,0]=3 493 B7R1.2 CC1COC(N)=N1 Amb23449369 [0,1,0,0,0,0|2,0,0]=3 494 B7R1.2 CC1COC(O)O1 Amb25204639 [0,1,0,0,0,0|1,0,2]=4 495 B7R1.2 CC1COS(=O)O1 Amb22346070 [0,1,0,0,0,0|2,0,0]=3 496 B7R1.2 CC1CS(=O)CC1 Amb24333540 [0,1,0,0,0,0|2,0,0]=3 497 B7R1.2 CC1CSC(=O)C1 Amb25136024 [0,1,0,0,0,0|0,1,0]=2 498 B7R1.2 CC1CSC(=O)S1 Amb22055765 [0,1,0,0,0,0|1,1,0]=3 499 B7R1.2 CC1CSC(=S)N1 Amb25849326 [0,1,0,0,0,0|1,2,0]=4 500 B7R1.2 CC1CSC(Cl)=N1 Amb25811136 [0,1,0,0,0,0|2,1,0]=4 501 B7R1.2 CC1CSC(N)=N1 Amb25076082 [0,1,0,0,0,0|2,1,0]=4 502 B7R1.2 CC1NC(=S)CS1 Amb25131726 [0,1,0,0,0,0|2,1,0]=4 503 B7R1.2 CC1NCC(C1)C Amb17593077 [0,1,0,0,0,0|2,0,1]=4 504 B7R1.2 CC1NCC(O1)C Amb17506157 [0,1,0,0,0,0|2,0,1]=4 505 B7R1.2 CC1NNC(=O)C1 Amb2371659 [0,1,0,0,0,0|2,0,0]=3 506 B7R1.2 CC1NNC(=O)O1 Amb25832289 [0,1,0,0,0,0|2,0,0]=3 507 B7R1.2 CC1OC(=O)CS1 Amb25314322 [0,1,0,0,0,0|1,0,0]=2 508 B7R1.2 CC1OCC(C)O1 Amb24074042 [0,1,0,0,0,0|2,0,1]=4 509 B7R1.2 CC1OCC(N1)C Amb17506156 [0,1,0,0,0,0|2,0,1]=4 510 B7R1.2 CC1[N-]OC(=O)N1 Amb24481515 [0,1,0,0,0,0|2,0,0]=3 511 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [0,1,0,0,0,0|1,0,2]=4 512 B7R1.2 CC=1CC(=O)ON1 Amb22274079 [0,1,0,0,0,0|1,0,1]=3 513 B7R1.2 CC=1CC[C@H](O)C1 Amb24705946 [0,1,0,0,0,0|2,0,0]=3 514 B7R1.2 CC=1CNC(=O)C1 Amb24479892 [0,1,0,0,0,0|1,0,2]=4 515 B7R1.2 CC=1COC(=O)C1 Amb22002703 [0,1,0,0,0,0|0,0,2]=3 516 B7R1.2 CC=1NOC(=O)N1 Amb22491279 [0,1,0,0,0,0|2,0,1]=4 517 B7R1.2 CN1CC(=O)CC1 Amb22236123 [0,1,0,0,0,0|2,0,0]=3 518 B7R1.2 CN1CC(Br)CC1 Amb21861157 [0,1,0,0,0,0|3,0,0]=4 519 B7R1.2 CN1CC(Br)CC1 Amb22490539 [0,1,0,0,0,0|3,0,0]=4 520 B7R1.2 CN1CC(Cl)CC1 Amb21861153 [0,1,0,0,0,0|3,0,0]=4 521 B7R1.2 CN1CC(I)CC1 Amb21861007 [0,1,0,0,0,0|3,0,0]=4 522 B7R1.2 CN1CC(S)CC1 Amb24383489 [0,1,0,0,0,0|3,0,0]=4 523 B7R1.2 CN1CCC(=O)N1 Amb24064860 [0,1,0,0,0,0|2,0,0]=3 524 B7R1.2 CN1CCC(Br)=N1 Amb25243373 [0,1,0,0,0,0|3,0,0]=4 525 B7R1.2 CN1CCC(C1)N Amb10610163 [0,1,0,0,0,0|3,0,0]=4 526 B7R1.2 CN1CCC(Cl)=N1 Amb25180094 [0,1,0,0,0,0|3,0,0]=4 527 B7R1.2 CN1CCC(O)=C1 Amb24079726 [0,1,0,0,0,0|2,0,1]=4 528 B7R1.2 CN1CC[C@@H](C1)O Amb10070789 [0,1,0,0,0,0|3,0,0]=4 529 B7R1.2 CN1CNC(=O)C1 Amb24733801 [0,1,0,0,0,0|2,0,0]=3 530 B7R1.2 CN1C[C@@H](Br)CC1 Amb22226655 [0,1,0,0,0,0|3,0,0]=4 531 B7R1.2 CN1C[C@@H](Cl)CC1 Amb22226392 [0,1,0,0,0,0|3,0,0]=4 532 B7R1.2 CN1C[C@@H](I)CC1 Amb22226495 [0,1,0,0,0,0|3,0,0]=4 533 B7R1.2 CN1C[C@@H](N)CC1 Amb19890014 [0,1,0,0,0,0|3,0,0]=4 534 B7R1.2 CN1C[C@@H](N)CC1 Amb19929627 [0,1,0,0,0,0|3,0,0]=4 535 B7R1.2 CN1C[C@@H](N)CC1 Amb20671398 [0,1,0,0,0,0|3,0,0]=4 536 B7R1.2 CN1C[C@@H](O)CC1 Amb22748868 [0,1,0,0,0,0|3,0,0]=4 537 B7R1.2 CN1C[C@H](Br)CC1 Amb22225309 [0,1,0,0,0,0|3,0,0]=4 538 B7R1.2 CN1C[C@H](Cl)CC1 Amb22225040 [0,1,0,0,0,0|3,0,0]=4 539 B7R1.2 CN1C[C@H](I)CC1 Amb22225060 [0,1,0,0,0,0|3,0,0]=4 540 B7R1.2 CN1C[C@H](N)CC1 Amb19891803 [0,1,0,0,0,0|3,0,0]=4 541 B7R1.2 CP1CC(O)CC1 Amb24661188 [0,1,0,0,0,0|3,0,0]=4 542 B7R1.2 C[C@@H]1C=CC(=O)O1 Amb25114434 [0,1,0,0,0,0|0,0,2]=3 543 B7R1.2 C[C@@H]1CC(=O)CC1 Amb22801305 [0,1,0,0,0,0|1,0,0]=2 544 B7R1.2 C[C@@H]1CC(O)OC1 Amb25795468 [0,1,0,0,0,0|0,0,2]=3 545 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,1,0,0,0,0|1,0,0]=2 546 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [0,1,0,0,0,0|1,0,0]=2 547 B7R1.2 C[C@@H]1CCC(O)O1 Amb25369337 [0,1,0,0,0,0|0,0,2]=3 548 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb22366804 [0,1,0,0,0,0|2,0,1]=4 549 B7R1.2 C[C@@H]1CC[C@@H](N1)C Amb10567751 [0,1,0,0,0,0|2,0,1]=4 550 B7R1.2 C[C@@H]1CC[C@@H](O)O1 Amb25176141 [0,1,0,0,0,0|0,0,2]=3 551 B7R1.2 C[C@@H]1CC[C@H](C)N1 Amb24681649 [0,1,0,0,0,0|2,0,1]=4 552 B7R1.2 C[C@@H]1CC[C@H](C)O1 Amb22799402 [0,1,0,0,0,0|1,0,1]=3 553 B7R1.2 C[C@@H]1CC[C@H](N1)C Amb17613372 [0,1,0,0,0,0|2,0,1]=4 554 B7R1.2 C[C@@H]1CC[C@H](O)O1 Amb25175220 [0,1,0,0,0,0|0,0,2]=3 555 B7R1.2 C[C@@H]1CN=C(N)S1 Amb24479897 [0,1,0,0,0,0|2,1,0]=4 556 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,1,0,0,0,0|1,0,0]=2 557 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [0,1,0,0,0,0|1,0,0]=2 558 B7R1.2 C[C@@H]1CNC(=S)S1 Amb25686959 [0,1,0,0,0,0|1,2,0]=4 559 B7R1.2 C[C@@H]1CN[C@@H](C)C1 Amb25026729 [0,1,0,0,0,0|2,0,1]=4 560 B7R1.2 C[C@@H]1CN[C@H](C)C1 Amb18195964 [0,1,0,0,0,0|2,0,1]=4 561 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,1,0,0,0,0|0,0,0]=1 562 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,1,0,0,0,0|1,0,0]=2 563 B7R1.2 C[C@@H]1COC(=S)N1 Amb25823566 [0,1,0,0,0,0|1,1,0]=3 564 B7R1.2 C[C@@H]1COC(C)=N1 Amb24480955 [0,1,0,0,0,0|2,0,0]=3 565 B7R1.2 C[C@@H]1CSC(=S)N1 Amb24641156 [0,1,0,0,0,0|1,2,0]=4 566 B7R1.2 C[C@@H]1C[C@@H](C)CC1 Amb22747863 [0,1,0,0,0,0|2,0,1]=4 567 B7R1.2 C[C@@H]1C[C@@H](F)CN1 Amb22886338 [0,1,0,0,0,0|2,0,1]=4 568 B7R1.2 C[C@@H]1C[C@@H](F)CN1 Amb24745852 [0,1,0,0,0,0|2,0,1]=4 569 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22745222 [0,1,0,0,0,0|2,0,1]=4 570 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [0,1,0,0,0,0|2,0,1]=4 571 B7R1.2 C[C@@H]1C[C@H](Br)CC1 Amb25026616 [0,1,0,0,0,0|2,0,1]=4 572 B7R1.2 C[C@@H]1C[C@H](C)CC1 Amb22230412 [0,1,0,0,0,0|2,0,1]=4 573 B7R1.2 C[C@@H]1C[C@H](F)CN1 Amb22886231 [0,1,0,0,0,0|2,0,1]=4 574 B7R1.2 C[C@@H]1C[C@H](I)CC1 Amb24561074 [0,1,0,0,0,0|2,0,1]=4 575 B7R1.2 C[C@@H]1C[C@H](N)CC1 Amb25179651 [0,1,0,0,0,0|2,0,1]=4 576 B7R1.2 C[C@@H]1C[C@H](O)CC1 Amb25241408 [0,1,0,0,0,0|1,0,2]=4 577 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [0,1,0,0,0,0|2,0,1]=4 578 B7R1.2 C[C@@H]1N[C@@H](C)CO1 Amb25366562 [0,1,0,0,0,0|2,0,1]=4 579 B7R1.2 C[C@H]1C=CC(=O)O1 Amb13887292 [0,1,0,0,0,0|0,0,2]=3 580 B7R1.2 C[C@H]1CC(=O)CN1 Amb25746539 [0,1,0,0,0,0|2,0,0]=3 581 B7R1.2 C[C@H]1CCC(C)N1 Amb25147635 [0,1,0,0,0,0|2,0,1]=4 582 B7R1.2 C[C@H]1CCC(O)O1 Amb25796315 [0,1,0,0,0,0|0,0,2]=3 583 B7R1.2 C[C@H]1CC[C@H](C)O1 Amb25810674 [0,1,0,0,0,0|1,0,1]=3 584 B7R1.2 C[C@H]1CN=C(N)S1 Amb24479830 [0,1,0,0,0,0|2,1,0]=4 585 B7R1.2 C[C@H]1CNC(=O)O1 Amb24480854 [0,1,0,0,0,0|1,0,0]=2 586 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,1,0,0,0,0|0,0,0]=1 587 B7R1.2 C[C@H]1COC(=S)N1 Amb24480906 [0,1,0,0,0,0|1,1,0]=3 588 B7R1.2 C[C@H]1COC(N)=N1 Amb24654801 [0,1,0,0,0,0|2,0,0]=3 589 B7R1.2 C[C@H]1C[C@@H](N)CS1 Amb25265261 [0,1,0,0,0,0|1,1,1]=4 590 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb24560197 [0,1,0,0,0,0|2,0,1]=4 591 B7R1.2 C[C@H]1C[C@H](C)CC1 Amb25176920 [0,1,0,0,0,0|2,0,1]=4 592 B7R1.2 C[C@H]1C[C@H](I)CC1 Amb25338105 [0,1,0,0,0,0|2,0,1]=4 593 B7R1.2 C[C@H]1C[C@H](N)CN1 Amb24562233 [0,1,0,0,0,0|2,0,1]=4 594 B7R1.2 C[C@H]1C[C@H](O)CC1 Amb25241604 [0,1,0,0,0,0|1,0,2]=4 595 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb24523959 [0,1,0,0,0,0|2,0,1]=4 596 B7R1.2 C[C@H]1C[C@H](O)CO1 Amb25212245 [0,1,0,0,0,0|1,0,1]=3 597 B7R1.2 C[N+]=1[CH-]C(=O)ON1 Amb21876186 [0,1,0,0,0,0|2,0,1]=4 598 B7R1.2 ClC1CCC(Cl)O1 Amb25061300 [0,1,0,0,0,0|1,0,1]=3 599 B7R1.2 ClC1COC(=O)O1 Amb10842117 [0,1,0,0,0,0|1,0,0]=2 600 B7R1.2 Cl[C@@H]1C[C@@H](Cl)CC1 Amb24689661 [0,1,0,0,0,0|2,0,1]=4 601 B7R1.2 FC1COC(=O)O1 Amb10841016 [0,1,0,0,0,0|1,0,0]=2 602 B7R1.2 IC1=CC(=O)OC1 Amb2455617 [0,1,0,0,0,0|0,0,2]=3 603 B7R1.2 N=C1CCC(=O)N1 Amb10552414 [0,1,0,0,0,0|1,0,1]=3 604 B7R1.2 N=C1CSC(=O)N1 Amb2537154 [0,1,0,0,0,0|1,1,1]=4 605 B7R1.2 NC1=CC(=O)CN1 Amb25268710 [0,1,0,0,0,0|2,0,1]=4 606 B7R1.2 NC1=CC(=O)CO1 Amb24516411 [0,1,0,0,0,0|1,0,2]=4 607 B7R1.2 NC1=CC(=O)CS1 Amb22229937 [0,1,0,0,0,0|2,0,1]=4 608 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [0,1,0,0,0,0|1,0,2]=4 609 B7R1.2 NC1=NC(O)CS1 Amb25709666 [0,1,0,0,0,0|2,1,0]=4 610 B7R1.2 NC1=NCC(=O)O1 Amb24061087 [0,1,0,0,0,0|1,0,1]=3 611 B7R1.2 NC1=NCC(=O)S1 Amb25810910 [0,1,0,0,0,0|1,1,1]=4 612 B7R1.2 NC1=NCC(Cl)S1 Amb25169583 [0,1,0,0,0,0|2,1,0]=4 613 B7R1.2 NC1C=C=C(N)O1 Amb24528300 [0,1,0,0,0,0|1,0,2]=4 614 B7R1.2 NC1C=CC(=O)O1 Amb24349779 [0,1,0,0,0,0|0,0,2]=3 615 B7R1.2 NC1CC(=O)CC1 Amb22236085 [0,1,0,0,0,0|1,0,0]=2 616 B7R1.2 NC1CC(=O)CC1 Amb22494268 [0,1,0,0,0,0|1,0,0]=2 617 B7R1.2 NC1CC(=O)CS1 Amb25090377 [0,1,0,0,0,0|2,0,0]=3 618 B7R1.2 NC1CC(=O)NN1 Amb24071024 [0,1,0,0,0,0|2,0,0]=3 619 B7R1.2 NC1CC(=O)NO1 Amb24640844 [0,1,0,0,0,0|2,0,0]=3 620 B7R1.2 NC1CC(F)CC1 Amb23455257 [0,1,0,0,0,0|2,0,1]=4 621 B7R1.2 NC1CC(N)CC1 Amb22227723 [0,1,0,0,0,0|2,0,1]=4 622 B7R1.2 NC1CC(O)CC1 Amb18561405 [0,1,0,0,0,0|1,0,2]=4 623 B7R1.2 NC1CC(O)CC1 Amb19958405 [0,1,0,0,0,0|1,0,2]=4 624 B7R1.2 NC1CCC(=O)N1 Amb24480433 [0,1,0,0,0,0|1,0,0]=2 625 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,1,0,0,0,0|0,0,0]=1 626 B7R1.2 NC1CCC(=O)S1 Amb24479819 [0,1,0,0,0,0|0,1,0]=2 627 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,1,0,0,0,0|1,0,0]=2 628 B7R1.2 NC1COC(=O)N1 Amb23590649 [0,1,0,0,0,0|1,0,0]=2 629 B7R1.2 NC1CS(=O)CC1 Amb19149072 [0,1,0,0,0,0|2,0,0]=3 630 B7R1.2 NC1CS(=O)CC1 Amb25133789 [0,1,0,0,0,0|2,0,0]=3 631 B7R1.2 NC1NC(=O)CO1 Amb25709500 [0,1,0,0,0,0|2,0,0]=3 632 B7R1.2 NC1NC(=O)CS1 Amb1922196 [0,1,0,0,0,0|2,0,0]=3 633 B7R1.2 NC1NCC(=O)N1 Amb24079615 [0,1,0,0,0,0|2,0,0]=3 634 B7R1.2 NC=1CCC(=N)N1 Amb25328655 [0,1,0,0,0,0|2,0,1]=4 635 B7R1.2 NC=1CNC(=O)N1 Amb22059492 [0,1,0,0,0,0|2,0,1]=4 636 B7R1.2 NC=1COC(=O)N1 Amb24576517 [0,1,0,0,0,0|1,0,1]=3 637 B7R1.2 NC=1NC(=O)CN1 Amb21964674 [0,1,0,0,0,0|2,0,1]=4 638 B7R1.2 NC=1NCC(=O)N1 Amb18639307 [0,1,0,0,0,0|2,0,1]=4 639 B7R1.2 NC=1NOC(=O)N1 Amb24060381 [0,1,0,0,0,0|2,0,1]=4 640 B7R1.2 NN1CC(O)CC1 Amb22277098 [0,1,0,0,0,0|3,0,0]=4 641 B7R1.2 N[C@@H]1CC(=O)C=C1 Amb24579377 [0,1,0,0,0,0|1,0,1]=3 642 B7R1.2 N[C@@H]1CC[C@@H](C1)O Amb10066973 [0,1,0,0,0,0|1,0,2]=4 643 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb10066961 [0,1,0,0,0,0|1,0,2]=4 644 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb16233749 [0,1,0,0,0,0|1,0,2]=4 645 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,1,0,0,0,0|1,0,0]=2 646 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,1,0,0,0,0|1,0,0]=2 647 B7R1.2 N[C@@H]1COS(=O)C1 Amb24612429 [0,1,0,0,0,0|1,0,0]=2 648 B7R1.2 N[C@@H]1C[C@@H](F)CC1 Amb22886174 [0,1,0,0,0,0|2,0,1]=4 649 B7R1.2 N[C@@H]1C[C@@H](N)CC1 Amb22749033 [0,1,0,0,0,0|2,0,1]=4 650 B7R1.2 N[C@@H]1C[C@@H](N)CC1 Amb22823163 [0,1,0,0,0,0|2,0,1]=4 651 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22386861 [0,1,0,0,0,0|1,0,2]=4 652 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22746957 [0,1,0,0,0,0|1,0,2]=4 653 B7R1.2 N[C@@H]1C[C@H](F)CC1 Amb22886175 [0,1,0,0,0,0|2,0,1]=4 654 B7R1.2 N[C@@H]1C[C@H](F)CC1 Amb25228459 [0,1,0,0,0,0|2,0,1]=4 655 B7R1.2 N[C@@H]1C[C@H](N)CC1 Amb22746716 [0,1,0,0,0,0|2,0,1]=4 656 B7R1.2 N[C@@H]1C[C@H](N)CC1 Amb22746800 [0,1,0,0,0,0|2,0,1]=4 657 B7R1.2 N[C@@H]1C[C@H](O)CC1 Amb22274622 [0,1,0,0,0,0|1,0,2]=4 658 B7R1.2 N[C@H]1CC(=O)C=C1 Amb24605966 [0,1,0,0,0,0|1,0,1]=3 659 B7R1.2 N[C@H]1CC(=O)OC1 Amb16233747 [0,1,0,0,0,0|0,0,0]=1 660 B7R1.2 N[C@H]1CC[C@@H](C1)O Amb10066972 [0,1,0,0,0,0|1,0,2]=4 661 B7R1.2 N[C@H]1CC[C@H](C1)O Amb10066971 [0,1,0,0,0,0|1,0,2]=4 662 B7R1.2 N[C@H]1CN(N)CC1 Amb24480844 [0,1,0,0,0,0|3,0,0]=4 663 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,1,0,0,0,0|1,0,0]=2 664 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,1,0,0,0,0|0,0,0]=1 665 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,1,0,0,0,0|0,0,0]=1 666 B7R1.2 N[C@H]1C[C@@H](F)CC1 Amb24499537 [0,1,0,0,0,0|2,0,1]=4 667 B7R1.2 N[C@H]1C[C@@H](O)CC1 Amb22406236 [0,1,0,0,0,0|1,0,2]=4 668 B7R1.2 O=C1C=C(Br)CN1 Amb23400584 [0,1,0,0,0,0|1,0,2]=4 669 B7R1.2 O=C1C=C(Br)CN1 Amb23402184 [0,1,0,0,0,0|1,0,2]=4 670 B7R1.2 O=C1C=C(Br)CS1 Amb25026198 [0,1,0,0,0,0|0,1,2]=4 671 B7R1.2 O=C1C=C(Cl)CO1 Amb25241116 [0,1,0,0,0,0|0,0,2]=3 672 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [0,1,0,0,0,0|0,0,3]=4 673 B7R1.2 O=C1C=CC(=O)O1 Amb22369065 [0,1,0,0,0,0|0,0,3]=4 674 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [0,1,0,0,0,0|0,0,2]=3 675 B7R1.2 O=C1C=CC(I)O1 Amb25325287 [0,1,0,0,0,0|0,0,2]=3 676 B7R1.2 O=C1C=C[13C](=O)O1 Amb22367487 [0,1,0,0,0,0|0,0,3]=4 677 B7R1.2 O=C1C=NC(S)S1 Amb22734244 [0,1,0,0,0,0|1,1,1]=4 678 B7R1.2 O=C1CC(=O)C=C1 Amb22338203 [0,1,0,0,0,0|1,0,2]=4 679 B7R1.2 O=C1CC(Br)CC1 Amb24334292 [0,1,0,0,0,0|1,0,0]=2 680 B7R1.2 O=C1CC(Br)CO1 Amb25803413 [0,1,0,0,0,0|0,0,0]=1 681 B7R1.2 O=C1CC(Cl)=NN1 Amb25364597 [0,1,0,0,0,0|2,0,1]=4 682 B7R1.2 O=C1CC(Cl)C=C1 Amb25240609 [0,1,0,0,0,0|1,0,1]=3 683 B7R1.2 O=C1CC(Cl)CO1 Amb24608923 [0,1,0,0,0,0|0,0,0]=1 684 B7R1.2 O=C1CC(F)CC1 Amb21963553 [0,1,0,0,0,0|1,0,0]=2 685 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,1,0,0,0,0|0,0,0]=1 686 B7R1.2 O=C1CC(I)C=C1 Amb24666810 [0,1,0,0,0,0|1,0,1]=3 687 B7R1.2 O=C1CC(I)CC1 Amb22001809 [0,1,0,0,0,0|1,0,0]=2 688 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,1,0,0,0,0|1,0,0]=2 689 B7R1.2 O=C1CCC(=O)[15NH]1 Amb22338306 [0,1,0,0,0,0|1,0,1]=3 690 B7R1.2 O=C1CCC(Br)=C1 Amb23399816 [0,1,0,0,0,0|1,0,1]=3 691 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,1,0,0,0,0|0,0,0]=1 692 B7R1.2 O=C1CCC(Cl)=N1 Amb24712377 [0,1,0,0,0,0|1,0,1]=3 693 B7R1.2 O=C1CCC(Cl)N1 Amb24689591 [0,1,0,0,0,0|1,0,0]=2 694 B7R1.2 O=C1CCC(I)=C1 Amb25811714 [0,1,0,0,0,0|1,0,1]=3 695 B7R1.2 O=C1CC[C@@H](Cl)O1 Amb24710047 [0,1,0,0,0,0|0,0,0]=1 696 B7R1.2 O=C1CN(Br)CN1 Amb25112148 [0,1,0,0,0,0|2,0,0]=3 697 B7R1.2 O=C1CN=C(S)N1 Amb22058713 [0,1,0,0,0,0|2,0,1]=4 698 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [0,1,0,0,0,0|1,0,1]=3 699 B7R1.2 O=C1CNC(=S)N1 Amb1151361 [0,1,0,0,0,0|2,0,1]=4 700 B7R1.2 O=C1CNC(S)S1 Amb24460897 [0,1,0,0,0,0|1,1,0]=3 701 B7R1.2 O=C1COC(=S)N1 Amb17920585 [0,1,0,0,0,0|1,1,1]=4 702 B7R1.2 O=C1COC(Cl)=N1 Amb24511416 [0,1,0,0,0,0|2,0,1]=4 703 B7R1.2 O=C1CSC(=N)N1 Amb1397203 [0,1,0,0,0,0|2,0,1]=4 704 B7R1.2 O=C1CSC(=N1)N Amb2455844 [0,1,0,0,0,0|2,0,1]=4 705 B7R1.2 O=C1CSC(=N1)[S-] Amb2541926 [0,1,0,0,0,0|2,0,1]=4 706 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [0,1,0,0,0,0|0,1,1]=3 707 B7R1.2 O=C1CSC(=S)N1 Amb1008361 [0,1,0,0,0,0|2,0,1]=4 708 B7R1.2 O=C1C[C@@H](Br)C=C1 Amb25724437 [0,1,0,0,0,0|1,0,1]=3 709 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,1,0,0,0,0|1,0,0]=2 710 B7R1.2 O=C1C[C@H](Cl)C=C1 Amb25088364 [0,1,0,0,0,0|1,0,1]=3 711 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,1,0,0,0,0|1,0,0]=2 712 B7R1.2 O=C1NCC(=O)S1 Amb22372196 [0,1,0,0,0,0|1,1,1]=4 713 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [0,1,0,0,0,0|2,0,1]=4 714 B7R1.2 O=C1OC=C(C1)O Amb17621628 [0,1,0,0,0,0|0,0,2]=3 715 B7R1.2 O=C1OCC(=O)N1 Amb1625991 [0,1,0,0,0,0|1,0,1]=3 716 B7R1.2 O=C1OCC(I)O1 Amb25681787 [0,1,0,0,0,0|1,0,0]=2 717 B7R1.2 O=C1SCC(=O)N1 Amb1853667 [0,1,0,0,0,0|1,1,1]=4 718 B7R1.2 O=C1[13CH]=[13CH]C(=O)O1 Amb22353372 [0,1,0,0,0,0|0,0,3]=4 719 B7R1.2 O=C1[14CH2][14CH2]C(=O)O1 Amb22729170 [0,1,0,0,0,0|0,0,1]=2 720 B7R1.2 O=C1[15NH][13CH2]C(=O)N1 Amb17615001 [0,1,0,0,0,0|2,0,1]=4 721 B7R1.2 O=C1[15NH][13CH2][13C](=O)N1 Amb17615000 [0,1,0,0,0,0|2,0,1]=4 722 B7R1.2 O=[13C]1C=C[13C](=O)O1 Amb22367373 [0,1,0,0,0,0|0,0,3]=4 723 B7R1.2 O=[13C]1CC[13C](=O)O1 Amb20243426 [0,1,0,0,0,0|0,0,1]=2 724 B7R1.2 O=[13C]1[13CH2][13CH2][13C](=O)O1 Amb22056174 [0,1,0,0,0,0|0,0,1]=2 725 B7R1.2 O=[13C]1[13CH]=[13CH][13C](=O)O1 Amb22055653 [0,1,0,0,0,0|0,0,3]=4 726 B7R1.2 OC1C=CC(=O)O1 Amb24544763 [0,1,0,0,0,0|0,0,2]=3 727 B7R1.2 OC1CC(=O)CC1 Amb22057378 [0,1,0,0,0,0|1,0,0]=2 728 B7R1.2 OC1CC(Br)CC1 Amb25275238 [0,1,0,0,0,0|1,0,2]=4 729 B7R1.2 OC1CC(S)CC1 Amb25051687 [0,1,0,0,0,0|1,0,2]=4 730 B7R1.2 OC1CC=C(Br)C1 Amb25662365 [0,1,0,0,0,0|2,0,0]=3 731 B7R1.2 OC1CC=C(Cl)C1 Amb25215432 [0,1,0,0,0,0|2,0,0]=3 732 B7R1.2 OC1CCC(=O)N1 Amb21963236 [0,1,0,0,0,0|1,0,0]=2 733 B7R1.2 OC1CCC(=O)O1 Amb22740957 [0,1,0,0,0,0|0,0,0]=1 734 B7R1.2 OC1CCC(Cl)=C1 Amb24661186 [0,1,0,0,0,0|2,0,0]=3 735 B7R1.2 OC1CNC(=O)C1 Amb19958404 [0,1,0,0,0,0|1,0,0]=2 736 B7R1.2 OC1COC(=O)N1 Amb24428770 [0,1,0,0,0,0|1,0,0]=2 737 B7R1.2 OC1CSC(=S)N1 Amb25716234 [0,1,0,0,0,0|1,2,0]=4 738 B7R1.2 OC1CSS(=O)C1 Amb25169570 [0,1,0,0,0,0|1,1,0]=3 739 B7R1.2 OC=1CNC(=O)C1 Amb20623530 [0,1,0,0,0,0|1,0,2]=4 740 B7R1.2 ON1CC(=O)C=C1 Amb25286099 [0,1,0,0,0,0|2,0,1]=4 741 B7R1.2 O[C@@H]1C=CC(=O)N1 Amb25844488 [0,1,0,0,0,0|1,0,2]=4 742 B7R1.2 O[C@@H]1C=CC(=O)O1 Amb25064237 [0,1,0,0,0,0|0,0,2]=3 743 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [0,1,0,0,0,0|1,0,0]=2 744 B7R1.2 O[C@@H]1CN(O)CC1 Amb25025106 [0,1,0,0,0,0|2,0,1]=4 745 B7R1.2 O[C@H]1C=CC(=O)O1 Amb24479542 [0,1,0,0,0,0|0,0,2]=3 746 B7R1.2 O[C@H]1CCC(Br)=C1 Amb24479014 [0,1,0,0,0,0|2,0,0]=3 747 B7R1.2 O[C@H]1CSS(=O)C1 Amb25317551 [0,1,0,0,0,0|1,1,0]=3 748 B7R1.2 O[C@H]1C[C@H](O)CC1 Amb24519755 [0,1,0,0,0,0|1,0,2]=4 749 B7R1.2 S=C1CCC(=S)N1 Amb24479225 [0,1,0,0,0,0|1,1,1]=4 750 B7R1.2 S=C1CSC(=O)N1 Amb2469502 [0,1,0,0,0,0|1,1,1]=4 751 B7R1.2 S=C1NC(=S)CO1 Amb24552528 [0,1,0,0,0,0|1,1,1]=4 752 B7R1.2 S[C@@H]1CNC(=S)C1 Amb25215986 [0,1,0,0,0,0|1,1,0]=3 753 B7R1.2 S[C@H]1CNC(=S)C1 Amb25789949 [0,1,0,0,0,0|1,1,0]=3 754 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,1,0,0,0,0|1,0,0]=2 755 B7R1.4 BrC1CCOC1Br Amb17673849 [0,1,0,0,0,0|1,0,1]=3 756 B7R1.4 C=C1CCCC1Br Amb24634099 [0,1,0,0,0,0|2,0,0]=3 757 B7R1.4 C=C1CCCC1O Amb25045562 [0,1,0,0,0,0|2,0,0]=3 758 B7R1.4 C=C1CCC[C@@H]1O Amb24642468 [0,1,0,0,0,0|2,0,0]=3 759 B7R1.4 C=C1CNCC1=C Amb17593055 [0,1,0,0,0,0|3,0,0]=4 760 B7R1.4 C=C1COCC1O Amb24423437 [0,1,0,0,0,0|3,0,0]=4 761 B7R1.4 CC1=CCCC1Br Amb25279491 [0,1,0,0,0,0|2,0,0]=3 762 B7R1.4 CC1=CCCC1Cl Amb25139325 [0,1,0,0,0,0|2,0,0]=3 763 B7R1.4 CC1=CCCC1O Amb25220686 [0,1,0,0,0,0|2,0,0]=3 764 B7R1.4 CC1=CCC[C@@H]1O Amb24506387 [0,1,0,0,0,0|2,0,0]=3 765 B7R1.4 CC1=CNOC1=O Amb25843682 [0,1,0,0,0,0|1,0,2]=4 766 B7R1.4 CC1=NNCC1=O Amb25086598 [0,1,0,0,0,0|3,0,0]=4 767 B7R1.4 CC1C=CCC1=O Amb25233761 [0,1,0,0,0,0|1,0,2]=4 768 B7R1.4 CC1C=NNC1=O Amb22232312 [0,1,0,0,0,0|2,0,1]=4 769 B7R1.4 CC1CC=CC1=O Amb25143468 [0,1,0,0,0,0|1,0,1]=3 770 B7R1.4 CC1CCC=C1C Amb24479857 [0,1,0,0,0,0|2,0,0]=3 771 B7R1.4 CC1CCCC1=C Amb25066862 [0,1,0,0,0,0|2,0,0]=3 772 B7R1.4 CC1CCCC1Br Amb18180261 [0,1,0,0,0,0|2,0,1]=4 773 B7R1.4 CC1CCCC1I Amb24658382 [0,1,0,0,0,0|2,0,1]=4 774 B7R1.4 CC1CCCC1N Amb19373269 [0,1,0,0,0,0|2,0,1]=4 775 B7R1.4 CC1CCCC1O Amb22052652 [0,1,0,0,0,0|1,0,2]=4 776 B7R1.4 CC1CCCN1N Amb25068361 [0,1,0,0,0,0|2,0,1]=4 777 B7R1.4 CC1CCCN1O Amb25221771 [0,1,0,0,0,0|2,0,1]=4 778 B7R1.4 CC1CCN=C1C Amb24411616 [0,1,0,0,0,0|2,0,0]=3 779 B7R1.4 CC1CCNC1C Amb18277375 [0,1,0,0,0,0|2,0,1]=4 780 B7R1.4 CC1CCNC1C Amb20623813 [0,1,0,0,0,0|2,0,1]=4 781 B7R1.4 CC1CCSC1=O Amb25271791 [0,1,0,0,0,0|0,1,0]=2 782 B7R1.4 CC1COCC1=C Amb25830669 [0,1,0,0,0,0|3,0,0]=4 783 B7R1.4 CC1COCC1=O Amb24333426 [0,1,0,0,0,0|2,0,0]=3 784 B7R1.4 CC1CSCC1=O Amb21964769 [0,1,0,0,0,0|2,0,0]=3 785 B7R1.4 CC1CSSC1=O Amb25757909 [0,1,0,0,0,0|1,1,0]=3 786 B7R1.4 CC1N=CNC1=O Amb25351847 [0,1,0,0,0,0|2,0,1]=4 787 B7R1.4 CC1N=COC1=O Amb24518855 [0,1,0,0,0,0|1,0,1]=3 788 B7R1.4 CC1NCOC1=O Amb24409631 [0,1,0,0,0,0|1,0,0]=2 789 B7R1.4 CC1OCCC1=C Amb25254786 [0,1,0,0,0,0|1,0,2]=4 790 B7R1.4 CC1OCCC1Br Amb25073861 [0,1,0,0,0,0|1,0,1]=3 791 B7R1.4 CC1OCCC1Cl Amb24470094 [0,1,0,0,0,0|1,0,1]=3 792 B7R1.4 CC1OCCC1I Amb25840995 [0,1,0,0,0,0|1,0,1]=3 793 B7R1.4 CC1OCCC1N Amb22058722 [0,1,0,0,0,0|1,0,1]=3 794 B7R1.4 CC1O[Ag]OC1=O Amb22352183 [0,1,0,0,0,0|2,0,0]=3 795 B7R1.4 CC1SCCC1N Amb20623835 [0,1,0,0,0,0|1,1,1]=4 796 B7R1.4 CC1SCCC1O Amb20623836 [0,1,0,0,0,0|1,1,1]=4 797 B7R1.4 CC1SCC[C@@H]1O Amb20623838 [0,1,0,0,0,0|1,1,1]=4 798 B7R1.4 CC1SCC[C@H]1O Amb20623837 [0,1,0,0,0,0|1,1,1]=4 799 B7R1.4 CC1SCOC1=O Amb25347819 [0,1,0,0,0,0|1,0,0]=2 800 B7R1.4 CC=1CCCC1Br Amb24479762 [0,1,0,0,0,0|2,0,0]=3 801 B7R1.4 CC=1CCCC1C Amb22227705 [0,1,0,0,0,0|2,0,0]=3 802 B7R1.4 CC=1COCC1C Amb25294665 [0,1,0,0,0,0|3,0,0]=4 803 B7R1.4 CC=1SCCC1S Amb25846018 [0,1,0,0,0,0|1,1,1]=4 804 B7R1.4 CC=1SCC[N+]1C Amb24060954 [0,1,0,0,0,0|2,1,0]=4 805 B7R1.4 CN1=NCCC1O Amb21952741 [0,1,0,0,0,0|3,0,0]=4 806 B7R1.4 CN1C=CCC1=O Amb25806222 [0,1,0,0,0,0|1,0,2]=4 807 B7R1.4 CN1CC=CC1=O Amb22372248 [0,1,0,0,0,0|1,0,2]=4 808 B7R1.4 CN1CCC=C1C Amb17938859 [0,1,0,0,0,0|2,0,1]=4 809 B7R1.4 CN1CCCC1=N Amb20669437 [0,1,0,0,0,0|2,0,0]=3 810 B7R1.4 CN1CCCC1=O Amb22493780 [0,1,0,0,0,0|1,0,0]=2 811 B7R1.4 CN1CCCC1Br Amb24652845 [0,1,0,0,0,0|2,0,1]=4 812 B7R1.4 CN1CCCC1O Amb24064861 [0,1,0,0,0,0|1,0,2]=4 813 B7R1.4 CN1CCC[C@H]1O Amb25788080 [0,1,0,0,0,0|1,0,2]=4 814 B7R1.4 CN1CCN=C1N Amb18639451 [0,1,0,0,0,0|3,0,0]=4 815 B7R1.4 CN1CCOC1=O Amb22347786 [0,1,0,0,0,0|1,0,0]=2 816 B7R1.4 CN1CCOP1Cl Amb24104126 [0,1,0,0,0,0|3,0,0]=4 817 B7R1.4 CN1CCSC1=S Amb17845152 [0,1,0,0,0,0|1,2,0]=4 818 B7R1.4 CN1N=CCC1=O Amb22233815 [0,1,0,0,0,0|2,0,1]=4 819 B7R1.4 CN1NCCC1=O Amb18559311 [0,1,0,0,0,0|2,0,0]=3 820 B7R1.4 CN1OCCC1=O Amb25229271 [0,1,0,0,0,0|2,0,0]=3 821 B7R1.4 CN1SCCC1=O Amb25746503 [0,1,0,0,0,0|2,0,0]=3 822 B7R1.4 C[C@@H]1CCC[C@@H]1C Amb22230410 [0,1,0,0,0,0|2,0,1]=4 823 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [0,1,0,0,0,0|2,0,1]=4 824 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [0,1,0,0,0,0|2,0,1]=4 825 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [0,1,0,0,0,0|1,0,2]=4 826 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [0,1,0,0,0,0|2,0,1]=4 827 B7R1.4 C[C@@H]1CCC[C@H]1Cl Amb24597933 [0,1,0,0,0,0|2,0,1]=4 828 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,1,0,0,0,0|1,0,0]=2 829 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [0,1,0,0,0,0|2,0,1]=4 830 B7R1.4 C[C@@H]1CCN[C@H]1C Amb24515067 [0,1,0,0,0,0|2,0,1]=4 831 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [0,1,0,0,0,0|2,0,0]=3 832 B7R1.4 C[C@@H]1NCCC1N Amb18202992 [0,1,0,0,0,0|2,0,1]=4 833 B7R1.4 C[C@@H]1NCCC1O Amb18202778 [0,1,0,0,0,0|2,0,1]=4 834 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb24425021 [0,1,0,0,0,0|2,0,1]=4 835 B7R1.4 C[C@@H]1NCOC1=O Amb25273957 [0,1,0,0,0,0|1,0,0]=2 836 B7R1.4 C[C@@H]1OCCC1=O Amb24728733 [0,1,0,0,0,0|2,0,0]=3 837 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [0,1,0,0,0,0|1,0,1]=3 838 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [0,1,0,0,0,0|1,0,1]=3 839 B7R1.4 C[C@@H]1OCC[C@H]1O Amb24624737 [0,1,0,0,0,0|1,0,1]=3 840 B7R1.4 C[C@@H]1OCNC1=O Amb25115508 [0,1,0,0,0,0|2,0,0]=3 841 B7R1.4 C[C@@H]1SCC[C@@H]1N Amb25201157 [0,1,0,0,0,0|1,1,1]=4 842 B7R1.4 C[C@@H]1SCC[C@H]1N Amb25265262 [0,1,0,0,0,0|1,1,1]=4 843 B7R1.4 C[C@H]1CC=CC1=O Amb24364068 [0,1,0,0,0,0|1,0,1]=3 844 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [0,1,0,0,0,0|2,0,1]=4 845 B7R1.4 C[C@H]1CCC[C@H]1Br Amb24595359 [0,1,0,0,0,0|2,0,1]=4 846 B7R1.4 C[C@H]1CCC[C@H]1Cl Amb24690084 [0,1,0,0,0,0|2,0,1]=4 847 B7R1.4 C[C@H]1NCC[C@H]1O Amb25810947 [0,1,0,0,0,0|2,0,1]=4 848 B7R1.4 C[C@H]1OCCC1=O Amb25811510 [0,1,0,0,0,0|2,0,0]=3 849 B7R1.4 C[C@H]1OCC[C@@H]1N Amb24515056 [0,1,0,0,0,0|1,0,1]=3 850 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [0,1,0,0,0,0|1,0,1]=3 851 B7R1.4 C[C@H]1SCC[C@H]1O Amb25025820 [0,1,0,0,0,0|1,1,1]=4 852 B7R1.4 C[N+]1=C(C)CCC1 Amb10552692 [0,1,0,0,0,0|2,0,0]=3 853 B7R1.4 C[N+]=1OCCC1N Amb24721541 [0,1,0,0,0,0|2,0,1]=4 854 B7R1.4 ClC1CCOC1Cl Amb22731370 [0,1,0,0,0,0|1,0,1]=3 855 B7R1.4 ClC1OCCC1Br Amb25798941 [0,1,0,0,0,0|1,0,1]=3 856 B7R1.4 Cl[C@@H]1CCC[C@@H]1Cl Amb25296670 [0,1,0,0,0,0|2,0,1]=4 857 B7R1.4 Cl[C@@H]1CCC[C@H]1Cl Amb22231649 [0,1,0,0,0,0|2,0,1]=4 858 B7R1.4 Cl[C@@H]1OCO[C@H]1Cl Amb24711721 [0,1,0,0,0,0|2,0,1]=4 859 B7R1.4 Cl[C@H]1CCC[C@@H]1Cl Amb24553810 [0,1,0,0,0,0|2,0,1]=4 860 B7R1.4 F[C@@H]1CCC[C@H]1Br Amb24692923 [0,1,0,0,0,0|2,0,1]=4 861 B7R1.4 F[C@@H]1CCC[C@H]1Cl Amb25274976 [0,1,0,0,0,0|2,0,1]=4 862 B7R1.4 F[C@H]1CCC[C@H]1Br Amb25238330 [0,1,0,0,0,0|2,0,1]=4 863 B7R1.4 N=C1CCCN1C Amb16204491 [0,1,0,0,0,0|2,0,0]=3 864 B7R1.4 NC1=CCOC1=O Amb22234102 [0,1,0,0,0,0|0,0,2]=3 865 B7R1.4 NC1=NCCC1Br Amb24478948 [0,1,0,0,0,0|2,0,0]=3 866 B7R1.4 NC1=NCCN1N Amb24713156 [0,1,0,0,0,0|3,0,0]=4 867 B7R1.4 NC1C=NNC1=O Amb18202634 [0,1,0,0,0,0|2,0,1]=4 868 B7R1.4 NC1CCCC1=O Amb17939050 [0,1,0,0,0,0|1,0,0]=2 869 B7R1.4 NC1CCCC1Br Amb20667786 [0,1,0,0,0,0|2,0,1]=4 870 B7R1.4 NC1CCCC1Br Amb24691577 [0,1,0,0,0,0|2,0,1]=4 871 B7R1.4 NC1CCCC1F Amb23538754 [0,1,0,0,0,0|2,0,1]=4 872 B7R1.4 NC1CCCC1N Amb18639642 [0,1,0,0,0,0|2,0,1]=4 873 B7R1.4 NC1CCCC1S Amb18641940 [0,1,0,0,0,0|1,1,1]=4 874 B7R1.4 NC1CCNC1=O Amb21955321 [0,1,0,0,0,0|1,0,0]=2 875 B7R1.4 NC1CCOC1=O Amb22233082 [0,1,0,0,0,0|0,0,0]=1 876 B7R1.4 NC1CONC1=O Amb1865548 [0,1,0,0,0,0|2,0,0]=3 877 B7R1.4 NC1CSCC1=O Amb18202693 [0,1,0,0,0,0|2,0,0]=3 878 B7R1.4 NC1N=CNC1=O Amb25195540 [0,1,0,0,0,0|2,0,1]=4 879 B7R1.4 NC1NOCC1=O Amb25811419 [0,1,0,0,0,0|3,0,0]=4 880 B7R1.4 NN1C=COC1=O Amb24626105 [0,1,0,0,0,0|1,0,2]=4 881 B7R1.4 NN1CCNC1=S Amb22436481 [0,1,0,0,0,0|2,1,0]=4 882 B7R1.4 N[C@@H]1CCCC1Cl Amb24710762 [0,1,0,0,0,0|2,0,1]=4 883 B7R1.4 N[C@@H]1CCCC1O Amb24347806 [0,1,0,0,0,0|1,0,2]=4 884 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb25174659 [0,1,0,0,0,0|2,0,1]=4 885 B7R1.4 N[C@@H]1CCC[C@H]1Br Amb24612101 [0,1,0,0,0,0|2,0,1]=4 886 B7R1.4 N[C@@H]1CCC[C@H]1N Amb16231433 [0,1,0,0,0,0|2,0,1]=4 887 B7R1.4 N[C@@H]1CCC[C@H]1N Amb22748826 [0,1,0,0,0,0|2,0,1]=4 888 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [0,1,0,0,0,0|1,0,0]=2 889 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [0,1,0,0,0,0|1,0,0]=2 890 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,1,0,0,0,0|0,0,0]=1 891 B7R1.4 N[C@@H]1CCSC1=O Amb22745304 [0,1,0,0,0,0|0,1,0]=2 892 B7R1.4 N[C@@H]1CCSC1=O Amb22750668 [0,1,0,0,0,0|0,1,0]=2 893 B7R1.4 N[C@H]1C=COC1=O Amb25259750 [0,1,0,0,0,0|0,0,2]=3 894 B7R1.4 N[C@H]1CCC[C@@H]1N Amb16231434 [0,1,0,0,0,0|2,0,1]=4 895 B7R1.4 N[C@H]1CCC[C@H]1Cl Amb24578417 [0,1,0,0,0,0|2,0,1]=4 896 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [0,1,0,0,0,0|1,0,0]=2 897 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [0,1,0,0,0,0|1,0,0]=2 898 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [0,1,0,0,0,0|0,1,0]=2 899 B7R1.4 O=C1C=CCC1Br Amb24739668 [0,1,0,0,0,0|1,0,1]=3 900 B7R1.4 O=C1C=COC1=O Amb24706925 [0,1,0,0,0,0|0,0,3]=4 901 B7R1.4 O=C1C=COC1Br Amb24061538 [0,1,0,0,0,0|2,0,1]=4 902 B7R1.4 O=C1CCBC1=O Amb25186988 [0,1,0,0,0,0|1,0,1]=3 903 B7R1.4 O=C1CCC=C1Br Amb10067494 [0,1,0,0,0,0|1,0,1]=3 904 B7R1.4 O=C1CCC=C1Cl Amb24749092 [0,1,0,0,0,0|1,0,1]=3 905 B7R1.4 O=C1CCC=C1O Amb17593067 [0,1,0,0,0,0|1,0,1]=3 906 B7R1.4 O=C1CCCC1=C Amb17593061 [0,1,0,0,0,0|1,0,0]=2 907 B7R1.4 O=C1CCCC1=O Amb24053064 [0,1,0,0,0,0|1,0,0]=2 908 B7R1.4 O=C1CCCC1Br Amb16234114 [0,1,0,0,0,0|1,0,0]=2 909 B7R1.4 O=C1CCCC1I Amb25756212 [0,1,0,0,0,0|1,0,0]=2 910 B7R1.4 O=C1CCCC1O Amb17593081 [0,1,0,0,0,0|1,0,0]=2 911 B7R1.4 O=C1CCC[C@H]1Br Amb25778341 [0,1,0,0,0,0|1,0,0]=2 912 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [0,1,0,0,0,0|1,0,0]=2 913 B7R1.4 O=C1CCNC1=O Amb21858086 [0,1,0,0,0,0|1,0,1]=3 914 B7R1.4 O=C1CCOC1Br Amb24061539 [0,1,0,0,0,0|2,0,0]=3 915 B7R1.4 O=C1CCSC1Cl Amb24552901 [0,1,0,0,0,0|2,0,0]=3 916 B7R1.4 O=C1CNCC1=O Amb18639280 [0,1,0,0,0,0|2,0,0]=3 917 B7R1.4 O=C1CNCC1F Amb24540356 [0,1,0,0,0,0|2,0,0]=3 918 B7R1.4 O=C1COCC1=O Amb25723319 [0,1,0,0,0,0|2,0,0]=3 919 B7R1.4 O=C1COCC1Br Amb24525921 [0,1,0,0,0,0|2,0,0]=3 920 B7R1.4 O=C1CSCC1=O Amb25249861 [0,1,0,0,0,0|2,0,0]=3 921 B7R1.4 O=C1CSN=C1Cl Amb25233704 [0,1,0,0,0,0|3,0,0]=4 922 B7R1.4 O=C1NCCC1Br Amb20623055 [0,1,0,0,0,0|1,0,0]=2 923 B7R1.4 O=C1NCCC1C Amb10603701 [0,1,0,0,0,0|1,0,0]=2 924 B7R1.4 O=C1NCCC1F Amb25838145 [0,1,0,0,0,0|1,0,0]=2 925 B7R1.4 O=C1NCCC1O Amb10603089 [0,1,0,0,0,0|1,0,0]=2 926 B7R1.4 O=C1NCCC1S Amb18202686 [0,1,0,0,0,0|1,0,0]=2 927 B7R1.4 O=C1NCCN1Cl Amb24479801 [0,1,0,0,0,0|2,0,0]=3 928 B7R1.4 O=C1NCCN1[SiH3] Amb24386067 [0,1,0,0,0,0|2,0,0]=3 929 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [0,1,0,0,0,0|1,0,0]=2 930 B7R1.4 O=C1NCC[C@@H]1S Amb25366927 [0,1,0,0,0,0|1,0,0]=2 931 B7R1.4 O=C1NCC[C@H]1Cl Amb25331827 [0,1,0,0,0,0|1,0,0]=2 932 B7R1.4 O=C1NCC[C@H]1F Amb24481058 [0,1,0,0,0,0|1,0,0]=2 933 B7R1.4 O=C1NCC[C@H]1S Amb25304928 [0,1,0,0,0,0|1,0,0]=2 934 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,1,0,0,0,0|0,0,2]=3 935 B7R1.4 O=C1OC=CC1I Amb24679050 [0,1,0,0,0,0|0,0,2]=3 936 B7R1.4 O=C1OCC=C1Br Amb10067498 [0,1,0,0,0,0|0,0,2]=3 937 B7R1.4 O=C1OCC=C1C Amb16231256 [0,1,0,0,0,0|0,0,2]=3 938 B7R1.4 O=C1OCC=C1Cl Amb23571857 [0,1,0,0,0,0|0,0,2]=3 939 B7R1.4 O=C1OCC=C1I Amb24679080 [0,1,0,0,0,0|0,0,2]=3 940 B7R1.4 O=C1OCCC1C Amb16185414 [0,1,0,0,0,0|0,0,0]=1 941 B7R1.4 O=C1OCCC1Cl Amb25065373 [0,1,0,0,0,0|0,0,0]=1 942 B7R1.4 O=C1OCCC1I Amb24418518 [0,1,0,0,0,0|0,0,0]=1 943 B7R1.4 O=C1OCCC1N Amb1151850 [0,1,0,0,0,0|0,0,0]=1 944 B7R1.4 O=C1OCCC1N Amb17614991 [0,1,0,0,0,0|0,0,0]=1 945 B7R1.4 O=C1OCCC1S Amb25146639 [0,1,0,0,0,0|0,0,0]=1 946 B7R1.4 O=C1OCCN1N Amb10068971 [0,1,0,0,0,0|1,0,0]=2 947 B7R1.4 O=C1OCC[C@@H]1N Amb10982617 [0,1,0,0,0,0|0,0,0]=1 948 B7R1.4 O=C1OCC[C@H]1N Amb10601656 [0,1,0,0,0,0|0,0,0]=1 949 B7R1.4 O=C1OCNC1Br Amb25299209 [0,1,0,0,0,0|1,0,0]=2 950 B7R1.4 O=C1OCOC1Br Amb25237748 [0,1,0,0,0,0|1,0,0]=2 951 B7R1.4 O=C1ON=CC1=O Amb25319011 [0,1,0,0,0,0|1,0,2]=4 952 B7R1.4 O=C1O[Ca]OC1=O Amb20671286 [0,1,0,0,0,0|2,0,1]=4 953 B7R1.4 O=C1O[Fe]OC1=O Amb22167955 [0,1,0,0,0,0|2,0,1]=4 954 B7R1.4 O=C1O[Sn]OC1=O Amb19894343 [0,1,0,0,0,0|2,0,1]=4 955 B7R1.4 O=C1O[Sr]OC1=O Amb22338392 [0,1,0,0,0,0|2,0,1]=4 956 B7R1.4 O=C1SCCC1N Amb1151877 [0,1,0,0,0,0|0,1,0]=2 957 B7R1.4 O=C1SCC[C@@H]1Cl Amb25279498 [0,1,0,0,0,0|0,1,0]=2 958 B7R1.4 O=C1SSCC1Cl Amb25810342 [0,1,0,0,0,0|1,1,0]=3 959 B7R1.4 O=C=1CCCC1Br Amb21927711 [0,1,0,0,0,0|1,0,1]=3 960 B7R1.4 O=S1CCC[C@@H]1Br Amb25257694 [0,1,0,0,0,0|2,0,0]=3 961 B7R1.4 O=S1CCC[C@@H]1Cl Amb25242432 [0,1,0,0,0,0|2,0,0]=3 962 B7R1.4 O=S1CCC[C@H]1Cl Amb25708398 [0,1,0,0,0,0|2,0,0]=3 963 B7R1.4 OC1=CCOC1=O Amb25147525 [0,1,0,0,0,0|0,0,2]=3 964 B7R1.4 OC1C=CCC1=O Amb24734405 [0,1,0,0,0,0|1,0,2]=4 965 B7R1.4 OC1C=COC1=O Amb25296159 [0,1,0,0,0,0|0,0,2]=3 966 B7R1.4 OC1CCC=C1Br Amb24429462 [0,1,0,0,0,0|2,0,0]=3 967 B7R1.4 OC1CCC=C1Cl Amb25202022 [0,1,0,0,0,0|2,0,0]=3 968 B7R1.4 OC1CCCC1F Amb25746323 [0,1,0,0,0,0|1,0,2]=4 969 B7R1.4 OC1CCCC1N Amb13951342 [0,1,0,0,0,0|1,0,2]=4 970 B7R1.4 OC1CCCC1O Amb17935884 [0,1,0,0,0,0|1,0,2]=4 971 B7R1.4 OC1CCOC1Cl Amb25783977 [0,1,0,0,0,0|1,0,1]=3 972 B7R1.4 OC1CNCC1=O Amb22500423 [0,1,0,0,0,0|2,0,0]=3 973 B7R1.4 OC1OCCC1F Amb22641467 [0,1,0,0,0,0|0,0,2]=3 974 B7R1.4 OC1SC=NC1=O Amb24664718 [0,1,0,0,0,0|2,0,1]=4 975 B7R1.4 ON1CNCC1=O Amb24480663 [0,1,0,0,0,0|2,0,0]=3 976 B7R1.4 O[C@@H]1CC=CC1=O Amb24571805 [0,1,0,0,0,0|1,0,1]=3 977 B7R1.4 O[C@@H]1CCC=C1Br Amb24631856 [0,1,0,0,0,0|2,0,0]=3 978 B7R1.4 O[C@@H]1CCCC1=O Amb25166028 [0,1,0,0,0,0|1,0,0]=2 979 B7R1.4 O[C@@H]1CCC[C@@H]1Br Amb24470331 [0,1,0,0,0,0|1,0,2]=4 980 B7R1.4 O[C@@H]1CCC[C@@H]1N Amb10603107 [0,1,0,0,0,0|1,0,2]=4 981 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb17938993 [0,1,0,0,0,0|1,0,2]=4 982 B7R1.4 O[C@@H]1CCC[C@H]1N Amb1993811 [0,1,0,0,0,0|1,0,2]=4 983 B7R1.4 O[C@@H]1CCC[C@H]1N Amb1993922 [0,1,0,0,0,0|1,0,2]=4 984 B7R1.4 O[C@@H]1CCC[C@H]1O Amb22224803 [0,1,0,0,0,0|1,0,2]=4 985 B7R1.4 O[C@@H]1CCC[C@H]1O Amb22224833 [0,1,0,0,0,0|1,0,2]=4 986 B7R1.4 O[C@@H]1CCNC1=O Amb22225343 [0,1,0,0,0,0|1,0,0]=2 987 B7R1.4 O[C@@H]1CCOC1O Amb25769388 [0,1,0,0,0,0|0,0,2]=3 988 B7R1.4 O[C@@H]1CCO[C@H]1O Amb24618710 [0,1,0,0,0,0|0,0,2]=3 989 B7R1.4 O[C@H]1CC=CC1=O Amb25745808 [0,1,0,0,0,0|1,0,1]=3 990 B7R1.4 O[C@H]1CCC=C1Br Amb25186071 [0,1,0,0,0,0|2,0,0]=3 991 B7R1.4 O[C@H]1CCC[C@@H]1Br Amb25373943 [0,1,0,0,0,0|1,0,2]=4 992 B7R1.4 O[C@H]1CCC[C@@H]1C Amb10844719 [0,1,0,0,0,0|1,0,2]=4 993 B7R1.4 O[C@H]1CCC[C@@H]1F Amb24612635 [0,1,0,0,0,0|1,0,2]=4 994 B7R1.4 O[C@H]1CCC[C@@H]1N Amb10604100 [0,1,0,0,0,0|1,0,2]=4 995 B7R1.4 O[C@H]1CCC[C@@H]1O Amb22350708 [0,1,0,0,0,0|1,0,2]=4 996 B7R1.4 O[C@H]1CCC[C@H]1N Amb1993810 [0,1,0,0,0,0|1,0,2]=4 997 B7R1.4 O[C@H]1CCC[C@H]1N Amb1993921 [0,1,0,0,0,0|1,0,2]=4 998 B7R1.4 O[C@H]1CCC[C@H]1S Amb24749619 [0,1,0,0,0,0|1,0,2]=4 999 B7R1.4 O[C@H]1CCO[C@H]1O Amb25025810 [0,1,0,0,0,0|0,0,2]=3 1000 B7R1.4 O[C@H]1OCC[C@@H]1Cl Amb25232988 [0,1,0,0,0,0|0,0,2]=3 1001 B7R1.4 S=C1CCCN1C Amb10562641 [0,1,0,0,0,0|1,1,0]=3 1002 B7R1.4 SC1=C(C)OCC1 Amb16232456 [0,1,0,0,0,0|1,0,1]=3 1003 B7R1.4 SC1CCCC1Cl Amb24558650 [0,1,0,0,0,0|1,1,1]=4 1004 B7R1.4 SC1CCCC1O Amb17593219 [0,1,0,0,0,0|1,0,2]=4 1005 B7R1.4 S[C@H]1CCC[C@H]1Cl Amb25235093 [0,1,0,0,0,0|1,1,1]=4 1006 B7R1.4 [13CH3]N1[13CH2]CC[13C]1=O Amb22055816 [0,1,0,0,0,0|1,0,0]=2 1007 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [0,1,0,0,0,0|0,1,0]=2 1008 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [0,1,0,0,0,0|0,1,0]=2 1009 B7R1.14 Br[Se]1(Br)CCCC1 Amb22345411 [0,1,0,0,0,0|3,0,0]=4 1010 B7R1.14 CC1(Br)CCCC1 Amb24612443 [0,1,0,0,0,0|2,0,1]=4 1011 B7R1.14 CC1(C)CCCO1 Amb22053786 [0,1,0,0,0,0|1,0,1]=3 1012 B7R1.14 CC1(C)CCC[Cl+]1 Amb24483149 [0,1,0,0,0,0|2,0,1]=4 1013 B7R1.14 CC1(C)NCCO1 Amb25083606 [0,1,0,0,0,0|2,0,1]=4 1014 B7R1.14 CC1(C)OCNC1 Amb17506151 [0,1,0,0,0,0|2,0,1]=4 1015 B7R1.14 CC1(N)CCCC1 Amb10609055 [0,1,0,0,0,0|2,0,1]=4 1016 B7R1.14 CP1(=O)C=CCO1 Amb25345454 [0,1,0,0,0,0|1,0,2]=4 1017 B7R1.14 CP1(=O)CCCO1 Amb22732093 [0,1,0,0,0,0|1,0,0]=2 1018 B7R1.14 C[Si]1(C)CCCC1 Amb19893503 [0,1,0,0,0,0|2,1,0]=4 1019 B7R1.14 C[Si]1(Cl)CCCC1 Amb19893715 [0,1,0,0,0,0|2,1,0]=4 1020 B7R1.14 ClC1(Cl)CCCC1 Amb22733951 [0,1,0,0,0,0|2,0,1]=4 1021 B7R1.14 Cl[Si]1(Cl)CCCC1 Amb19893524 [0,1,0,0,0,0|2,1,0]=4 1022 B7R1.14 FC1(F)CCCC1 Amb10838599 [0,1,0,0,0,0|2,0,1]=4 1023 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [0,1,0,0,0,0|2,0,0]=3 1024 B7R1.14 NC1(O)CCCC1 Amb24465053 [0,1,0,0,0,0|1,0,2]=4 1025 B7R1.14 O=S1(=O)C=CCO1 Amb19957378 [0,1,0,0,0,0|1,0,2]=4 1026 B7R1.14 O=S1(=O)CCC=C1 Amb1099221 [0,1,0,0,0,0|2,0,1]=4 1027 B7R1.14 O=S1(=O)CCC=C1 Amb23496206 [0,1,0,0,0,0|2,0,1]=4 1028 B7R1.14 O=S1(=O)CCC=N1 Amb21964374 [0,1,0,0,0,0|2,0,1]=4 1029 B7R1.14 O=S1(=O)NCCN1 Amb21520325 [0,1,0,0,0,0|3,0,0]=4 1030 B7R1.14 O=S1(=O)NCCO1 Amb23440061 [0,1,0,0,0,0|2,0,0]=3 1031 B7R1.14 O=S1(=O)OCCO1 Amb15691656 [0,1,0,0,0,0|2,0,0]=3 1032 B7R1.14 [O-][S+]1(=O)CCC=C1 Amb10238597 [0,1,0,0,0,0|2,0,1]=4 1033 B5R0.1 BC(=O)NCC Amb22343194 [0,0,1,0,0,0|2,0,0]=3 1034 B5R0.1 C/C=C/C(C)=O Amb17940030 [0,0,1,0,0,0|1,0,1]=3 1035 B5R0.1 C=C(Br)CCBr Amb25827098 [0,0,1,0,0,0|3,0,0]=4 1036 B5R0.1 C=C(Br)CCN Amb23512022 [0,0,1,0,0,0|3,0,0]=4 1037 B5R0.1 C=C(Cl)CCCl Amb24636781 [0,0,1,0,0,0|3,0,0]=4 1038 B5R0.1 C=C(F)CCO Amb25747437 [0,0,1,0,0,0|3,0,0]=4 1039 B5R0.1 C=C(I)CCCl Amb24349789 [0,0,1,0,0,0|3,0,0]=4 1040 B5R0.1 C=C(I)CCN Amb24756665 [0,0,1,0,0,0|3,0,0]=4 1041 B5R0.1 C=C=CC(O)=O Amb24391957 [0,0,1,0,0,0|0,0,3]=4 1042 B5R0.1 CC#CC(=O)C Amb17593016 [0,0,1,0,0,0|1,0,1]=3 1043 B5R0.1 CC#CC(=O)N Amb10552409 [0,0,1,0,0,0|1,0,2]=4 1044 B5R0.1 CC#CC(C)=C Amb25062515 [0,0,1,0,0,0|2,0,1]=4 1045 B5R0.1 CC(=C)CCBr Amb21857866 [0,0,1,0,0,0|3,0,0]=4 1046 B5R0.1 CC(=C)CCN Amb17673481 [0,0,1,0,0,0|3,0,0]=4 1047 B5R0.1 CC(=C)\C=C/C Amb22733448 [0,0,1,0,0,0|2,0,1]=4 1048 B5R0.1 CC(=N)NCO Amb24751321 [0,0,1,0,0,0|3,0,0]=4 1049 B5R0.1 CC(=O)C#CBr Amb24334279 [0,0,1,0,0,0|2,0,1]=4 1050 B5R0.1 CC(=O)C=C=C Amb23447108 [0,0,1,0,0,0|1,0,2]=4 1051 B5R0.1 CC(=O)C=C=N Amb25663158 [0,0,1,0,0,0|2,0,1]=4 1052 B5R0.1 CC(=O)CC#C Amb17673302 [0,0,1,0,0,0|1,0,2]=4 1053 B5R0.1 CC(=O)CC#N Amb1102132 [0,0,1,0,0,0|2,0,1]=4 1054 B5R0.1 CC(=O)CC#N Amb22274239 [0,0,1,0,0,0|2,0,1]=4 1055 B5R0.1 CC(=O)CC=O Amb17666764 [0,0,1,0,0,0|2,0,1]=4 1056 B5R0.1 CC(=O)CCBr Amb24078246 [0,0,1,0,0,0|2,0,0]=3 1057 B5R0.1 CC(=O)CCN Amb10067110 [0,0,1,0,0,0|2,0,0]=3 1058 B5R0.1 CC(=O)CCN Amb18632933 [0,0,1,0,0,0|2,0,0]=3 1059 B5R0.1 CC(=O)CN=O Amb24645582 [0,0,1,0,0,0|3,0,0]=4 1060 B5R0.1 CC(=O)CON Amb25128844 [0,0,1,0,0,0|3,0,0]=4 1061 B5R0.1 CC(=O)CSCl Amb24631131 [0,0,1,0,0,0|3,0,0]=4 1062 B5R0.1 CC(=O)NC#N Amb17772293 [0,0,1,0,0,0|2,0,1]=4 1063 B5R0.1 CC(=O)NC#P Amb24356543 [0,0,1,0,0,0|2,0,1]=4 1064 B5R0.1 CC(=O)NC=C Amb24323579 [0,0,1,0,0,0|1,0,2]=4 1065 B5R0.1 CC(=O)NC=S Amb24390998 [0,0,1,0,0,0|2,0,1]=4 1066 B5R0.1 CC(=O)NCCl Amb25790034 [0,0,1,0,0,0|2,0,0]=3 1067 B5R0.1 CC(=O)NCS Amb25124326 [0,0,1,0,0,0|2,0,0]=3 1068 B5R0.1 CC(=O)OC=C Amb21618930 [0,0,1,0,0,0|0,0,2]=3 1069 B5R0.1 CC(=O)OC=C Amb22338143 [0,0,1,0,0,0|0,0,2]=3 1070 B5R0.1 CC(=O)OC=C Amb22338476 [0,0,1,0,0,0|0,0,2]=3 1071 B5R0.1 CC(=O)OC=C Amb22366845 [0,0,1,0,0,0|0,0,2]=3 1072 B5R0.1 CC(=O)OC=O Amb25283525 [0,0,1,0,0,0|1,0,1]=3 1073 B5R0.1 CC(=O)OCCl Amb17673336 [0,0,1,0,0,0|1,0,0]=2 1074 B5R0.1 CC(=O)OCI Amb25226851 [0,0,1,0,0,0|1,0,0]=2 1075 B5R0.1 CC(=O)OCN Amb24359000 [0,0,1,0,0,0|1,0,0]=2 1076 B5R0.1 CC(=O)ONN Amb17615002 [0,0,1,0,0,0|2,0,0]=3 1077 B5R0.1 CC(=O)O[13CH]=[13CH2] Amb22351356 [0,0,1,0,0,0|0,0,2]=3 1078 B5R0.1 CC(=O)SCBr Amb25349900 [0,0,1,0,0,0|1,1,0]=3 1079 B5R0.1 CC(=O)\C=C/N Amb25147403 [0,0,1,0,0,0|2,0,1]=4 1080 B5R0.1 CC(=O)\C=C\Br Amb25803449 [0,0,1,0,0,0|2,0,1]=4 1081 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [0,0,1,0,0,0|2,0,1]=4 1082 B5R0.1 CC(=O)\C=C\I Amb25269482 [0,0,1,0,0,0|2,0,1]=4 1083 B5R0.1 CC(=S)NCO Amb25739054 [0,0,1,0,0,0|2,1,0]=4 1084 B5R0.1 CC(Br)=CCO Amb25719036 [0,0,1,0,0,0|3,0,0]=4 1085 B5R0.1 CC(C)=CCI Amb24332962 [0,0,1,0,0,0|3,0,0]=4 1086 B5R0.1 CC(C)OCCl Amb22168148 [0,0,1,0,0,0|2,0,1]=4 1087 B5R0.1 CC(Cl)=CCBr Amb25026669 [0,0,1,0,0,0|3,0,0]=4 1088 B5R0.1 CC(Cl)=CCCl Amb24564316 [0,0,1,0,0,0|3,0,0]=4 1089 B5R0.1 CC(Cl)=CCN Amb24099962 [0,0,1,0,0,0|3,0,0]=4 1090 B5R0.1 CC(Cl)=CCO Amb24061938 [0,0,1,0,0,0|3,0,0]=4 1091 B5R0.1 CC(Cl)OCCl Amb25314428 [0,0,1,0,0,0|2,0,1]=4 1092 B5R0.1 CC(I)=CCO Amb24652791 [0,0,1,0,0,0|3,0,0]=4 1093 B5R0.1 CC(O)CCCl Amb24551052 [0,0,1,0,0,0|2,0,1]=4 1094 B5R0.1 CC(O)CCO Amb22227721 [0,0,1,0,0,0|2,0,1]=4 1095 B5R0.1 CC(O)CCO Amb22232248 [0,0,1,0,0,0|2,0,1]=4 1096 B5R0.1 CC(O)CCS Amb22359316 [0,0,1,0,0,0|2,0,1]=4 1097 B5R0.1 CC=CC(C)=O Amb24061083 [0,0,1,0,0,0|1,0,1]=3 1098 B5R0.1 CCC=C(C)C Amb22336412 [0,0,1,0,0,0|2,0,0]=3 1099 B5R0.1 CCC=C(F)F Amb10839842 [0,0,1,0,0,0|2,0,1]=4 1100 B5R0.1 CCCB(O)O Amb2447105 [0,0,1,0,0,0|1,0,1]=3 1101 B5R0.1 CCCC(=C)Br Amb22583743 [0,0,1,0,0,0|2,0,0]=3 1102 B5R0.1 CCCC(=N)N Amb10610381 [0,0,1,0,0,0|2,0,0]=3 1103 B5R0.1 CCCC(=O)Br Amb22734023 [0,0,1,0,0,0|1,0,0]=2 1104 B5R0.1 CCCC(=S)Cl Amb24626931 [0,0,1,0,0,0|1,1,0]=3 1105 B5R0.1 CCCC(C)F Amb22008011 [0,0,1,0,0,0|2,0,1]=4 1106 B5R0.1 CCCC(C)I Amb17939400 [0,0,1,0,0,0|2,0,1]=4 1107 B5R0.1 CCCC(Cl)Cl Amb25062516 [0,0,1,0,0,0|2,0,1]=4 1108 B5R0.1 CCCC(F)Cl Amb25065258 [0,0,1,0,0,0|2,0,1]=4 1109 B5R0.1 CCCC(N)C Amb10609075 [0,0,1,0,0,0|2,0,1]=4 1110 B5R0.1 CCCC(N)O Amb25147414 [0,0,1,0,0,0|1,0,1]=3 1111 B5R0.1 CCCC(O)=S Amb22229383 [0,0,1,0,0,0|0,1,0]=2 1112 B5R0.1 CCCC(O)Br Amb25106743 [0,0,1,0,0,0|1,0,1]=3 1113 B5R0.1 CCCC(O)Cl Amb22552567 [0,0,1,0,0,0|1,0,1]=3 1114 B5R0.1 CCCC([O-])=O Amb17772223 [0,0,1,0,0,0|0,0,1]=2 1115 B5R0.1 CCCC([O-])=O Amb22732283 [0,0,1,0,0,0|0,0,1]=2 1116 B5R0.1 CCCC([O-])=O Amb22732651 [0,0,1,0,0,0|0,0,1]=2 1117 B5R0.1 CCCN(C)C Amb22336514 [0,0,1,0,0,0|3,0,0]=4 1118 B5R0.1 CCCN(C)C Amb22733186 [0,0,1,0,0,0|3,0,0]=4 1119 B5R0.1 CCCN(C)N Amb24587192 [0,0,1,0,0,0|3,0,0]=4 1120 B5R0.1 CCCN(C)O Amb25024622 [0,0,1,0,0,0|2,0,0]=3 1121 B5R0.1 CCCP(Cl)Cl Amb22053969 [0,0,1,0,0,0|3,0,0]=4 1122 B5R0.1 CCCS(=O)Cl Amb25025566 [0,0,1,0,0,0|2,0,0]=3 1123 B5R0.1 CCCS(N)=O Amb24733579 [0,0,1,0,0,0|2,0,0]=3 1124 B5R0.1 CCCS(O)=O Amb24615072 [0,0,1,0,0,0|1,0,0]=2 1125 B5R0.1 CCCS([O-])=O Amb19929119 [0,0,1,0,0,0|1,0,1]=3 1126 B5R0.1 CCC[13C](O)=O Amb22337992 [0,0,1,0,0,0|0,0,0]=1 1127 B5R0.1 CCC[13C](O)=O Amb22338339 [0,0,1,0,0,0|0,0,0]=1 1128 B5R0.1 CCC[C@@H](C)Br Amb24373894 [0,0,1,0,0,0|2,0,1]=4 1129 B5R0.1 CCC[C@@H](C)Cl Amb24711432 [0,0,1,0,0,0|2,0,1]=4 1130 B5R0.1 CCC[C@@H](C)I Amb24432363 [0,0,1,0,0,0|2,0,1]=4 1131 B5R0.1 CCC[C@@H](C)N Amb22898992 [0,0,1,0,0,0|2,0,1]=4 1132 B5R0.1 CCC[C@@H](C)N Amb23439500 [0,0,1,0,0,0|2,0,1]=4 1133 B5R0.1 CCC[C@H](C)I Amb25237438 [0,0,1,0,0,0|2,0,1]=4 1134 B5R0.1 CCC[C@H](C)N Amb21618754 [0,0,1,0,0,0|2,0,1]=4 1135 B5R0.1 CCNC(=O)Br Amb24563760 [0,0,1,0,0,0|2,0,0]=3 1136 B5R0.1 CCNC(=O)Cl Amb25791793 [0,0,1,0,0,0|2,0,0]=3 1137 B5R0.1 CCNC(=S)Cl Amb25063250 [0,0,1,0,0,0|2,1,0]=4 1138 B5R0.1 CCNC(C)=N Amb25246070 [0,0,1,0,0,0|2,0,0]=3 1139 B5R0.1 CCNC(C)=S Amb24580999 [0,0,1,0,0,0|1,1,0]=3 1140 B5R0.1 CCNC(N)=N Amb21964689 [0,0,1,0,0,0|3,0,0]=4 1141 B5R0.1 CCNC(N)=N Amb22053912 [0,0,1,0,0,0|3,0,0]=4 1142 B5R0.1 CCNC(N)=N Amb22168156 [0,0,1,0,0,0|3,0,0]=4 1143 B5R0.1 CCNC(N)=[NH2+] Amb22734753 [0,0,1,0,0,0|3,0,0]=4 1144 B5R0.1 CCNC(O)=S Amb24612743 [0,0,1,0,0,0|1,1,0]=3 1145 B5R0.1 CCOC(=C)Cl Amb25768135 [0,0,1,0,0,0|1,0,1]=3 1146 B5R0.1 CCOC(=N)N Amb16231402 [0,0,1,0,0,0|2,0,0]=3 1147 B5R0.1 CCOC(=S)N Amb10241338 [0,0,1,0,0,0|1,1,0]=3 1148 B5R0.1 CCOC(C)=S Amb22047276 [0,0,1,0,0,0|0,1,0]=2 1149 B5R0.1 CCOC(C)Br Amb17689406 [0,0,1,0,0,0|1,0,1]=3 1150 B5R0.1 CCOC(C)C Amb22230687 [0,0,1,0,0,0|1,0,1]=3 1151 B5R0.1 CCOC(C)Cl Amb17939011 [0,0,1,0,0,0|1,0,1]=3 1152 B5R0.1 CCOC(Cl)Cl Amb24635701 [0,0,1,0,0,0|2,0,1]=4 1153 B5R0.1 CCOC(F)F Amb24667751 [0,0,1,0,0,0|2,0,1]=4 1154 B5R0.1 CCOC(O)O Amb24749789 [0,0,1,0,0,0|1,0,2]=4 1155 B5R0.1 CCOC(S)=S Amb17938960 [0,0,1,0,0,0|1,1,0]=3 1156 B5R0.1 CCOC(S)=S Amb22274286 [0,0,1,0,0,0|1,1,0]=3 1157 B5R0.1 CCOC([13CH3])=O Amb22363103 [0,0,1,0,0,0|0,0,0]=1 1158 B5R0.1 CCOC([S-])=S Amb22729921 [0,0,1,0,0,0|1,1,0]=3 1159 B5R0.1 CCOP(=O)=O Amb25808749 [0,0,1,0,0,0|2,0,0]=3 1160 B5R0.1 CCOP(=O)S Amb24540781 [0,0,1,0,0,0|2,0,0]=3 1161 B5R0.1 CCOP(C)=O Amb17673512 [0,0,1,0,0,0|1,0,0]=2 1162 B5R0.1 CCOP(O)=O Amb22360741 [0,0,1,0,0,0|2,0,0]=3 1163 B5R0.1 CCOP(O)O Amb25348821 [0,0,1,0,0,0|2,0,1]=4 1164 B5R0.1 CCOP([O-])=O Amb22731647 [0,0,1,0,0,0|2,0,0]=3 1165 B5R0.1 CCOS(=O)Cl Amb25239825 [0,0,1,0,0,0|2,0,0]=3 1166 B5R0.1 CCO[13C](C)=O Amb22363160 [0,0,1,0,0,0|0,0,0]=1 1167 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [0,0,1,0,0,0|0,0,0]=1 1168 B5R0.1 CCO[14C](N)=O Amb22732757 [0,0,1,0,0,0|1,0,0]=2 1169 B5R0.1 CCO[N+]([O-])=O Amb22732543 [0,0,1,0,0,0|2,0,0]=3 1170 B5R0.1 CCSC(=N)N Amb16205363 [0,0,1,0,0,0|2,1,0]=4 1171 B5R0.1 CCSC(=N)[NH3+] Amb24113877 [0,0,1,0,0,0|2,1,0]=4 1172 B5R0.1 CCSC(C)Br Amb25746385 [0,0,1,0,0,0|1,1,1]=4 1173 B5R0.1 CCSC(C)C Amb22731934 [0,0,1,0,0,0|1,1,1]=4 1174 B5R0.1 CCSC(C)Cl Amb24417939 [0,0,1,0,0,0|1,1,1]=4 1175 B5R0.1 CCSC(N)=O Amb24394612 [0,0,1,0,0,0|1,1,0]=3 1176 B5R0.1 CCSC(O)O Amb25788582 [0,0,1,0,0,0|1,0,2]=4 1177 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [0,0,1,0,0,0|0,0,0]=1 1178 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [0,0,1,0,0,0|0,0,1]=2 1179 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [0,0,1,0,0,0|0,0,0]=1 1180 B5R0.1 CC[O+]=C(N)N Amb22492446 [0,0,1,0,0,0|2,0,1]=4 1181 B5R0.1 CN(O)CCO Amb25234570 [0,0,1,0,0,0|3,0,0]=4 1182 B5R0.1 CN=CC(C)=O Amb25746654 [0,0,1,0,0,0|2,0,0]=3 1183 B5R0.1 CNCC(=C)Br Amb18950247 [0,0,1,0,0,0|3,0,0]=4 1184 B5R0.1 CNCC(=C)Cl Amb18281327 [0,0,1,0,0,0|3,0,0]=4 1185 B5R0.1 CNCC(=O)C Amb17621974 [0,0,1,0,0,0|2,0,0]=3 1186 B5R0.1 CNCC(=O)N Amb10610205 [0,0,1,0,0,0|2,0,0]=3 1187 B5R0.1 CNCC(=S)N Amb17231807 [0,0,1,0,0,0|2,1,0]=4 1188 B5R0.1 CNCC(C)=O Amb21959975 [0,0,1,0,0,0|2,0,0]=3 1189 B5R0.1 CNCC([O-])=O Amb20246714 [0,0,1,0,0,0|1,0,1]=3 1190 B5R0.1 CNCP(O)=O Amb24478116 [0,0,1,0,0,0|2,0,0]=3 1191 B5R0.1 CNN=C(C)C Amb25266075 [0,0,1,0,0,0|3,0,0]=4 1192 B5R0.1 CNN=C(C)N Amb20622969 [0,0,1,0,0,0|3,0,0]=4 1193 B5R0.1 CNOC(C)=O Amb24323679 [0,0,1,0,0,0|1,0,0]=2 1194 B5R0.1 CNOC(C)=O Amb24629247 [0,0,1,0,0,0|1,0,0]=2 1195 B5R0.1 CNOC(C)C Amb25272672 [0,0,1,0,0,0|2,0,1]=4 1196 B5R0.1 COC=C(C)C Amb25063853 [0,0,1,0,0,0|3,0,0]=4 1197 B5R0.1 COCC(=C)Br Amb25361496 [0,0,1,0,0,0|3,0,0]=4 1198 B5R0.1 COCC(=O)Br Amb25282928 [0,0,1,0,0,0|2,0,0]=3 1199 B5R0.1 COCC(=O)N Amb1153776 [0,0,1,0,0,0|2,0,0]=3 1200 B5R0.1 COCC(C)=S Amb25108516 [0,0,1,0,0,0|2,1,0]=4 1201 B5R0.1 CON=C(C)C Amb24118020 [0,0,1,0,0,0|3,0,0]=4 1202 B5R0.1 CON=C(C)N Amb24746796 [0,0,1,0,0,0|3,0,0]=4 1203 B5R0.1 CONC(=O)N Amb2417193 [0,0,1,0,0,0|3,0,0]=4 1204 B5R0.1 CONC(C)=O Amb25046114 [0,0,1,0,0,0|2,0,0]=3 1205 B5R0.1 CS(=O)CCCl Amb24116979 [0,0,1,0,0,0|3,0,0]=4 1206 B5R0.1 CS(=O)CCN Amb19889121 [0,0,1,0,0,0|3,0,0]=4 1207 B5R0.1 CS(=O)CCN Amb20248083 [0,0,1,0,0,0|3,0,0]=4 1208 B5R0.1 CSCC(=O)Cl Amb24528357 [0,0,1,0,0,0|2,0,0]=3 1209 B5R0.1 CSCC(=O)O Amb1152425 [0,0,1,0,0,0|1,0,0]=2 1210 B5R0.1 CSCC(=S)N Amb17503394 [0,0,1,0,0,0|2,1,0]=4 1211 B5R0.1 CSCC(C)=C Amb20671946 [0,0,1,0,0,0|3,0,0]=4 1212 B5R0.1 CSCC(C)=O Amb20621731 [0,0,1,0,0,0|2,0,0]=3 1213 B5R0.1 CSCC(C)O Amb20622311 [0,0,1,0,0,0|2,0,1]=4 1214 B5R0.1 CSCC(N)=O Amb19515874 [0,0,1,0,0,0|2,0,0]=3 1215 B5R0.1 CSCS(C)=O Amb22045140 [0,0,1,0,0,0|3,0,0]=4 1216 B5R0.1 CSC[C@@H](C)O Amb24408899 [0,0,1,0,0,0|2,0,1]=4 1217 B5R0.1 CSC[C@H](C)O Amb24699036 [0,0,1,0,0,0|2,0,1]=4 1218 B5R0.1 CSNC(C)=O Amb22500292 [0,0,1,0,0,0|2,0,0]=3 1219 B5R0.1 CSNC(N)=O Amb25810134 [0,0,1,0,0,0|3,0,0]=4 1220 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [0,0,1,0,0,0|0,0,1]=2 1221 B5R0.1 C[C@@H](O)CCCl Amb24565032 [0,0,1,0,0,0|2,0,1]=4 1222 B5R0.1 C[C@@H](O)CCN Amb22736702 [0,0,1,0,0,0|2,0,1]=4 1223 B5R0.1 C[C@H](O)CCI Amb24675161 [0,0,1,0,0,0|2,0,1]=4 1224 B5R0.1 C[C@H](O)CCN Amb22736705 [0,0,1,0,0,0|2,0,1]=4 1225 B5R0.1 C\C(=C/CO)\I Amb17616110 [0,0,1,0,0,0|3,0,0]=4 1226 B5R0.1 C\C(\Br)=C\CBr Amb25811392 [0,0,1,0,0,0|3,0,0]=4 1227 B5R0.1 C\C(\Cl)=C\CN Amb21953974 [0,0,1,0,0,0|3,0,0]=4 1228 B5R0.1 C\C(\Cl)=C\CO Amb25663061 [0,0,1,0,0,0|3,0,0]=4 1229 B5R0.1 C\C(\I)=C\CCl Amb25785116 [0,0,1,0,0,0|3,0,0]=4 1230 B5R0.1 C\C=C\C(=O)Br Amb25026006 [0,0,1,0,0,0|1,0,2]=4 1231 B5R0.1 C\C=C\C(C)=C Amb22733185 [0,0,1,0,0,0|2,0,1]=4 1232 B5R0.1 C\C=C\C([O-])=O Amb22231404 [0,0,1,0,0,0|0,0,3]=4 1233 B5R0.1 ClC(=O)CC#N Amb17593096 [0,0,1,0,0,0|2,0,1]=4 1234 B5R0.1 ClCC=C(C)C Amb2371433 [0,0,1,0,0,0|3,0,0]=4 1235 B5R0.1 N#CCC(O)=O Amb20247050 [0,0,1,0,0,0|1,0,1]=3 1236 B5R0.1 N#CCS(O)=O Amb25232047 [0,0,1,0,0,0|2,0,1]=4 1237 B5R0.1 N#C[13CH2][13C]([O-])=O Amb22054790 [0,0,1,0,0,0|1,0,2]=4 1238 B5R0.1 NC(=N)CCCl Amb25839424 [0,0,1,0,0,0|3,0,0]=4 1239 B5R0.1 NC(=N)CCS Amb25126101 [0,0,1,0,0,0|3,0,0]=4 1240 B5R0.1 NC(=O)CC=C Amb17610156 [0,0,1,0,0,0|1,0,2]=4 1241 B5R0.1 NC(=O)CC=O Amb25777522 [0,0,1,0,0,0|2,0,1]=4 1242 B5R0.1 NC(=O)CCBr Amb21618712 [0,0,1,0,0,0|2,0,0]=3 1243 B5R0.1 NC(=O)CCCl Amb1127569 [0,0,1,0,0,0|2,0,0]=3 1244 B5R0.1 NC(=O)CNO Amb25199017 [0,0,1,0,0,0|3,0,0]=4 1245 B5R0.1 NC(=O)NCCl Amb25130799 [0,0,1,0,0,0|3,0,0]=4 1246 B5R0.1 NC(=O)NCO Amb17674341 [0,0,1,0,0,0|3,0,0]=4 1247 B5R0.1 NC(=O)OC=C Amb17621270 [0,0,1,0,0,0|1,0,2]=4 1248 B5R0.1 NC(=O)OCCl Amb24681219 [0,0,1,0,0,0|2,0,0]=3 1249 B5R0.1 NC(=O)OCI Amb25146422 [0,0,1,0,0,0|2,0,0]=3 1250 B5R0.1 NC(=O)OCO Amb25662384 [0,0,1,0,0,0|2,0,0]=3 1251 B5R0.1 NC(=S)CCS Amb17503271 [0,0,1,0,0,0|2,1,0]=4 1252 B5R0.1 NCC=C(C)C Amb10601678 [0,0,1,0,0,0|3,0,0]=4 1253 B5R0.1 NCC=C(C)C Amb10601679 [0,0,1,0,0,0|3,0,0]=4 1254 B5R0.1 NCCC(=O)Cl Amb24117140 [0,0,1,0,0,0|2,0,0]=3 1255 B5R0.1 NCCC(=O)N Amb1137251 [0,0,1,0,0,0|2,0,0]=3 1256 B5R0.1 NCCC(=O)O Amb1935127 [0,0,1,0,0,0|1,0,0]=2 1257 B5R0.1 NCCC(N)=S Amb18523221 [0,0,1,0,0,0|2,1,0]=4 1258 B5R0.1 NCCC(N)O Amb24657290 [0,0,1,0,0,0|2,0,1]=4 1259 B5R0.1 NCCP(O)=O Amb22168066 [0,0,1,0,0,0|2,0,0]=3 1260 B5R0.1 NCCS(=O)=O Amb25744074 [0,0,1,0,0,0|2,0,1]=4 1261 B5R0.1 NCC[N+]([O-])=O Amb18203119 [0,0,1,0,0,0|2,0,1]=4 1262 B5R0.1 NCOP(O)=O Amb24333271 [0,0,1,0,0,0|3,0,0]=4 1263 B5R0.1 NOCC(=O)O Amb1154237 [0,0,1,0,0,0|2,0,0]=3 1264 B5R0.1 NOCC(N)=O Amb22059481 [0,0,1,0,0,0|3,0,0]=4 1265 B5R0.1 NS(=O)CCCl Amb24407159 [0,0,1,0,0,0|3,0,0]=4 1266 B5R0.1 N[C@H](O)CCO Amb24421109 [0,0,1,0,0,0|2,0,1]=4 1267 B5R0.1 N\N=C\C(O)=O Amb25703365 [0,0,1,0,0,0|2,0,1]=4 1268 B5R0.1 O=C(Br)CCBr Amb24624022 [0,0,1,0,0,0|2,0,0]=3 1269 B5R0.1 O=C(Br)CCCl Amb24474527 [0,0,1,0,0,0|2,0,0]=3 1270 B5R0.1 O=C(F)NCF Amb24478456 [0,0,1,0,0,0|3,0,0]=4 1271 B5R0.1 O=C(I)CCCl Amb25146462 [0,0,1,0,0,0|2,0,0]=3 1272 B5R0.1 O=C=CC(=O)C Amb10603952 [0,0,1,0,0,0|2,0,1]=4 1273 B5R0.1 O=C=NC(=O)C Amb17231800 [0,0,1,0,0,0|2,0,1]=4 1274 B5R0.1 O=S(Cl)CCBr Amb24563387 [0,0,1,0,0,0|3,0,0]=4 1275 B5R0.1 OC(=O)C#CBr Amb17593707 [0,0,1,0,0,0|1,0,2]=4 1276 B5R0.1 OC(=O)C#CCl Amb17593098 [0,0,1,0,0,0|1,0,2]=4 1277 B5R0.1 OC(=O)C#CI Amb25274128 [0,0,1,0,0,0|1,0,2]=4 1278 B5R0.1 OC(=O)C=C=O Amb24671304 [0,0,1,0,0,0|1,0,2]=4 1279 B5R0.1 OC(=O)CC=O Amb22169407 [0,0,1,0,0,0|1,0,1]=3 1280 B5R0.1 OC(=O)CCF Amb10603694 [0,0,1,0,0,0|1,0,0]=2 1281 B5R0.1 OC(=O)CI=O Amb25146428 [0,0,1,0,0,0|2,0,0]=3 1282 B5R0.1 OC(=O)CNBr Amb25053433 [0,0,1,0,0,0|2,0,0]=3 1283 B5R0.1 OC(=O)CNCl Amb24653229 [0,0,1,0,0,0|2,0,0]=3 1284 B5R0.1 OC(=O)CNI Amb25216175 [0,0,1,0,0,0|2,0,0]=3 1285 B5R0.1 OC(=O)CSCl Amb24597301 [0,0,1,0,0,0|2,0,0]=3 1286 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [0,0,1,0,0,0|2,0,0]=3 1287 B5R0.1 OC(=O)\C=C/Br Amb18644453 [0,0,1,0,0,0|1,0,2]=4 1288 B5R0.1 OC(=O)\C=C\F Amb24417763 [0,0,1,0,0,0|1,0,2]=4 1289 B5R0.1 OC(=O)\C=C\I Amb20242758 [0,0,1,0,0,0|1,0,2]=4 1290 B5R0.1 OC(O)CCS Amb25746150 [0,0,1,0,0,0|1,0,2]=4 1291 B5R0.1 OCCS(=O)=O Amb24474283 [0,0,1,0,0,0|2,0,1]=4 1292 B5R0.1 OCOP(O)=O Amb24333194 [0,0,1,0,0,0|3,0,0]=4 1293 B5R0.1 OCOS(=O)[Na] Amb22339041 [0,0,1,0,0,0|3,0,0]=4 1294 B5R0.1 OCOS(O)=O Amb25106091 [0,0,1,0,0,0|3,0,0]=4 1295 B5R0.1 ON=CC(O)=O Amb25046587 [0,0,1,0,0,0|2,0,1]=4 1296 B5R0.1 ONCC(O)=O Amb24120360 [0,0,1,0,0,0|2,0,0]=3 1297 B5R0.1 OP(=O)CC=O Amb25706451 [0,0,1,0,0,0|2,0,1]=4 1298 B5R0.1 OP(=O)CCBr Amb24634095 [0,0,1,0,0,0|2,0,0]=3 1299 B5R0.1 OP(=O)CCCl Amb24465178 [0,0,1,0,0,0|2,0,0]=3 1300 B5R0.1 O\N=C/C(=O)O Amb10601571 [0,0,1,0,0,0|2,0,1]=4 1301 B5R0.1 O\N=C\C(O)=O Amb20671938 [0,0,1,0,0,0|2,0,1]=4 1302 B5R0.1 SCC=C(C)C Amb17617244 [0,0,1,0,0,0|3,0,0]=4 1303 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [0,0,1,0,0,0|0,0,1]=2 1304 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [0,0,1,0,0,0|0,0,1]=2 1305 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [0,0,1,0,0,0|0,0,1]=2 1306 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [0,0,1,0,0,0|1,0,0]=2 1307 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [0,0,1,0,0,0|1,0,0]=2 1308 B5R0.1 [2H]C(=O)OCC Amb22336312 [0,0,1,0,0,0|1,0,0]=2 1309 B5R0.1 [N-]=[N+]=CC(O)=O Amb24333367 [0,0,1,0,0,0|2,0,1]=4 1310 B5R0.1 [O-]C(=O)CCBr Amb22229633 [0,0,1,0,0,0|1,0,1]=3 1311 B5R0.1 [O-]C(=O)CCCl Amb10604124 [0,0,1,0,0,0|1,0,1]=3 1312 B5R0.1 [O-]C(=O)CCCl Amb22051669 [0,0,1,0,0,0|1,0,1]=3 1313 B5R0.1 [O-]C(=O)CCO Amb22055495 [0,0,1,0,0,0|1,0,1]=3 1314 B5R0.1 [O-]S(=O)CCBr Amb24442971 [0,0,1,0,0,0|2,0,1]=4 1315 B5R0.1 [O-][N+](=O)CCF Amb17674352 [0,0,1,0,0,0|2,0,1]=4 1316 B5R0.1 [O-]\C=C\C(=O)C Amb15772268 [0,0,1,0,0,0|2,0,1]=4 1317 B5R0.1 [O-]\C=C\C(=O)C Amb2228039 [0,0,1,0,0,0|2,0,1]=4 1318 B5R0.1 [S-]C(=S)OCC Amb10789364 [0,0,1,0,0,0|1,1,0]=3 1319 B5R0.2 BCCCCN Amb24745748 [0,0,1,0,0,0|2,0,1]=4 1320 B5R0.2 BSCCCC Amb25339480 [0,0,1,0,0,0|3,0,0]=4 1321 B5R0.2 BrCCCC#C Amb17610060 [0,0,1,0,0,0|2,0,1]=4 1322 B5R0.2 BrCCN=C=O Amb17194090 [0,0,1,0,0,0|2,0,1]=4 1323 B5R0.2 BrCCOCC Amb1158671 [0,0,1,0,0,0|2,0,1]=4 1324 B5R0.2 BrCOCCBr Amb25846664 [0,0,1,0,0,0|2,0,1]=4 1325 B5R0.2 Br\C=C\CCBr Amb25663040 [0,0,1,0,0,0|2,0,1]=4 1326 B5R0.2 C#CCCCI Amb25843530 [0,0,1,0,0,0|2,0,1]=4 1327 B5R0.2 C#CCCCN Amb18962495 [0,0,1,0,0,0|2,0,1]=4 1328 B5R0.2 C#CCCCN Amb22886202 [0,0,1,0,0,0|2,0,1]=4 1329 B5R0.2 C#CCCCS Amb24333394 [0,0,1,0,0,0|1,1,1]=4 1330 B5R0.2 C=C=NCCO Amb24719710 [0,0,1,0,0,0|2,0,1]=4 1331 B5R0.2 C=CCCC#C Amb18117518 [0,0,1,0,0,0|2,0,1]=4 1332 B5R0.2 C=CCCC#N Amb10605750 [0,0,1,0,0,0|2,0,1]=4 1333 B5R0.2 C=CCCCCl Amb22229585 [0,0,1,0,0,0|2,0,0]=3 1334 B5R0.2 C=CCCCF Amb25689705 [0,0,1,0,0,0|2,0,0]=3 1335 B5R0.2 C=CCCCI Amb25278794 [0,0,1,0,0,0|2,0,0]=3 1336 B5R0.2 C=CCCCN Amb18299670 [0,0,1,0,0,0|2,0,0]=3 1337 B5R0.2 C=CCCCN Amb22001451 [0,0,1,0,0,0|2,0,0]=3 1338 B5R0.2 C=CCCNN Amb25747040 [0,0,1,0,0,0|3,0,0]=4 1339 B5R0.2 C=CCCON Amb22233632 [0,0,1,0,0,0|3,0,0]=4 1340 B5R0.2 C=CCCON Amb22896384 [0,0,1,0,0,0|3,0,0]=4 1341 B5R0.2 C=CCC[Mg]Br Amb22338020 [0,0,1,0,0,0|3,0,0]=4 1342 B5R0.2 C=CCC[Zn]Br Amb22000510 [0,0,1,0,0,0|3,0,0]=4 1343 B5R0.2 C=CCOC=O Amb22051694 [0,0,1,0,0,0|0,0,2]=3 1344 B5R0.2 C=CCOCO Amb25115933 [0,0,1,0,0,0|2,0,0]=3 1345 B5R0.2 C=CCSCBr Amb25232617 [0,0,1,0,0,0|3,0,0]=4 1346 B5R0.2 C=CCSCCl Amb25859631 [0,0,1,0,0,0|3,0,0]=4 1347 B5R0.2 C=CNCCO Amb24380906 [0,0,1,0,0,0|2,0,0]=3 1348 B5R0.2 C=COCC=C Amb17933943 [0,0,1,0,0,0|1,0,2]=4 1349 B5R0.2 C=CSCCN Amb25147236 [0,0,1,0,0,0|2,1,0]=4 1350 B5R0.2 C=NOCCO Amb25246977 [0,0,1,0,0,0|3,0,0]=4 1351 B5R0.2 CC=C=CCO Amb24657460 [0,0,1,0,0,0|1,0,2]=4 1352 B5R0.2 CC=CCCN Amb19374038 [0,0,1,0,0,0|2,0,1]=4 1353 B5R0.2 CCC#CC=C Amb24333935 [0,0,1,0,0,0|2,0,1]=4 1354 B5R0.2 CCC#CC=O Amb25663194 [0,0,1,0,0,0|1,0,1]=3 1355 B5R0.2 CCC/C=C/Br Amb17673688 [0,0,1,0,0,0|2,0,0]=3 1356 B5R0.2 CCCC#CBr Amb24648680 [0,0,1,0,0,0|2,0,1]=4 1357 B5R0.2 CCCC#CI Amb22733682 [0,0,1,0,0,0|2,0,1]=4 1358 B5R0.2 CCCCC=C Amb22338530 [0,0,1,0,0,0|2,0,0]=3 1359 B5R0.2 CCCCCC Amb2447471 [0,0,1,0,0,0|2,0,1]=4 1360 B5R0.2 CCCCCF Amb10838686 [0,0,1,0,0,0|2,0,1]=4 1361 B5R0.2 CCCCC[13CH3] Amb22353529 [0,0,1,0,0,0|2,0,1]=4 1362 B5R0.2 CCCCC[Mg+] Amb22045757 [0,0,1,0,0,0|2,0,1]=4 1363 B5R0.2 CCCCC[SiH3] Amb19893989 [0,0,1,0,0,0|2,0,1]=4 1364 B5R0.2 CCCCNN Amb1105203 [0,0,1,0,0,0|3,0,0]=4 1365 B5R0.2 CCCCNN Amb22230363 [0,0,1,0,0,0|3,0,0]=4 1366 B5R0.2 CCCCNN Amb22732372 [0,0,1,0,0,0|3,0,0]=4 1367 B5R0.2 CCCCNO Amb24686451 [0,0,1,0,0,0|2,0,1]=4 1368 B5R0.2 CCCCON Amb17101066 [0,0,1,0,0,0|3,0,0]=4 1369 B5R0.2 CCCCO[2H] Amb16185547 [0,0,1,0,0,0|3,0,0]=4 1370 B5R0.2 CCCCS[Na] Amb22360783 [0,0,1,0,0,0|3,0,0]=4 1371 B5R0.2 CCCC[Hg]Cl Amb22366548 [0,0,1,0,0,0|3,0,0]=4 1372 B5R0.2 CCCC[Mg]Br Amb17666637 [0,0,1,0,0,0|3,0,0]=4 1373 B5R0.2 CCCC[Zn]Br Amb22000415 [0,0,1,0,0,0|3,0,0]=4 1374 B5R0.2 CCCN=C=O Amb22338287 [0,0,1,0,0,0|1,0,1]=3 1375 B5R0.2 CCCN=[N+]=[N-] Amb25811439 [0,0,1,0,0,0|3,0,0]=4 1376 B5R0.2 CCCNC#N Amb25801573 [0,0,1,0,0,0|2,0,1]=4 1377 B5R0.2 CCCNCO Amb25746089 [0,0,1,0,0,0|1,0,2]=4 1378 B5R0.2 CCCOC=C Amb17940706 [0,0,1,0,0,0|1,0,0]=2 1379 B5R0.2 CCCOCBr Amb25351883 [0,0,1,0,0,0|1,0,1]=3 1380 B5R0.2 CCCOCC Amb17673668 [0,0,1,0,0,0|1,0,1]=3 1381 B5R0.2 CCCOCCl Amb22002403 [0,0,1,0,0,0|1,0,1]=3 1382 B5R0.2 CCCON=O Amb22732190 [0,0,1,0,0,0|1,0,0]=2 1383 B5R0.2 CCCONC Amb25109607 [0,0,1,0,0,0|2,0,0]=3 1384 B5R0.2 CCCSCO Amb24466323 [0,0,1,0,0,0|0,1,2]=4 1385 B5R0.2 CCC\C=C\Cl Amb25026521 [0,0,1,0,0,0|2,0,0]=3 1386 B5R0.2 CCC\C=C\I Amb24333664 [0,0,1,0,0,0|2,0,0]=3 1387 B5R0.2 CCNCC=C Amb13951161 [0,0,1,0,0,0|3,0,0]=4 1388 B5R0.2 CCNCCO Amb19372818 [0,0,1,0,0,0|2,0,1]=4 1389 B5R0.2 CCNCCO Amb22284537 [0,0,1,0,0,0|2,0,1]=4 1390 B5R0.2 CCNCN=O Amb24382131 [0,0,1,0,0,0|3,0,0]=4 1391 B5R0.2 CCNN=CN Amb24461199 [0,0,1,0,0,0|3,0,0]=4 1392 B5R0.2 CCO/C=C/Cl Amb17689421 [0,0,1,0,0,0|3,0,0]=4 1393 B5R0.2 CCOCCI Amb25117446 [0,0,1,0,0,0|2,0,1]=4 1394 B5R0.2 CCOCCN Amb21954038 [0,0,1,0,0,0|2,0,1]=4 1395 B5R0.2 CCO\C=C/Br Amb2455970 [0,0,1,0,0,0|3,0,0]=4 1396 B5R0.2 CCO\C=C\Br Amb10068669 [0,0,1,0,0,0|3,0,0]=4 1397 B5R0.2 CCSCC=O Amb17940620 [0,0,1,0,0,0|2,0,0]=3 1398 B5R0.2 CCSCCC Amb22168047 [0,0,1,0,0,0|1,1,1]=4 1399 B5R0.2 CCS\C=C\Br Amb25745106 [0,0,1,0,0,0|3,0,0]=4 1400 B5R0.2 CCS\C=C\Cl Amb25258363 [0,0,1,0,0,0|3,0,0]=4 1401 B5R0.2 CC\C=C/C=C Amb25025160 [0,0,1,0,0,0|2,0,1]=4 1402 B5R0.2 CNCCC=C Amb18993048 [0,0,1,0,0,0|3,0,0]=4 1403 B5R0.2 CNCCCCl Amb22002154 [0,0,1,0,0,0|3,0,0]=4 1404 B5R0.2 CNCCCS Amb18121219 [0,0,1,0,0,0|2,1,0]=4 1405 B5R0.2 CNC\C=C/I Amb23539307 [0,0,1,0,0,0|3,0,0]=4 1406 B5R0.2 CNC\C=C\I Amb25203641 [0,0,1,0,0,0|3,0,0]=4 1407 B5R0.2 CNNCCC Amb24057117 [0,0,1,0,0,0|3,0,0]=4 1408 B5R0.2 CNNCCC Amb25283190 [0,0,1,0,0,0|3,0,0]=4 1409 B5R0.2 CNOCCN Amb22411501 [0,0,1,0,0,0|3,0,0]=4 1410 B5R0.2 CNOCCN Amb22490915 [0,0,1,0,0,0|3,0,0]=4 1411 B5R0.2 CN\C=C\C=O Amb24564349 [0,0,1,0,0,0|2,0,1]=4 1412 B5R0.2 COCCC=O Amb10602324 [0,0,1,0,0,0|2,0,0]=3 1413 B5R0.2 COCCCF Amb22007998 [0,0,1,0,0,0|3,0,0]=4 1414 B5R0.2 COCCCI Amb22755452 [0,0,1,0,0,0|3,0,0]=4 1415 B5R0.2 COCCCS Amb13952794 [0,0,1,0,0,0|2,1,0]=4 1416 B5R0.2 COCCNO Amb25284480 [0,0,1,0,0,0|3,0,0]=4 1417 B5R0.2 COCOCCl Amb25335675 [0,0,1,0,0,0|2,0,1]=4 1418 B5R0.2 COC\C=C\Br Amb25109338 [0,0,1,0,0,0|3,0,0]=4 1419 B5R0.2 COC\C=C\Cl Amb24478538 [0,0,1,0,0,0|3,0,0]=4 1420 B5R0.2 COC\C=C\I Amb24512110 [0,0,1,0,0,0|3,0,0]=4 1421 B5R0.2 CSCCC=C Amb24431590 [0,0,1,0,0,0|3,0,0]=4 1422 B5R0.2 CSCCCBr Amb18180189 [0,0,1,0,0,0|3,0,0]=4 1423 B5R0.2 CSCCCCl Amb10602296 [0,0,1,0,0,0|3,0,0]=4 1424 B5R0.2 CSCCCS Amb25744031 [0,0,1,0,0,0|2,1,0]=4 1425 B5R0.2 CSCN=C=O Amb25114951 [0,0,1,0,0,0|2,0,1]=4 1426 B5R0.2 CSCNC=O Amb24421815 [0,0,1,0,0,0|2,0,0]=3 1427 B5R0.2 CSC\C=C/Cl Amb24710128 [0,0,1,0,0,0|3,0,0]=4 1428 B5R0.2 CSC\C=C\Cl Amb24565594 [0,0,1,0,0,0|3,0,0]=4 1429 B5R0.2 CS\C=C\C=O Amb25811358 [0,0,1,0,0,0|2,0,1]=4 1430 B5R0.2 C[SiH2]CCCCl Amb24594928 [0,0,1,0,0,0|2,1,0]=4 1431 B5R0.2 C[SiH2]CCCI Amb24673429 [0,0,1,0,0,0|2,1,0]=4 1432 B5R0.2 C\C=C/CC=O Amb24728871 [0,0,1,0,0,0|1,0,2]=4 1433 B5R0.2 C\C=C/CCO Amb19930204 [0,0,1,0,0,0|1,0,1]=3 1434 B5R0.2 C\C=C\CCBr Amb25808954 [0,0,1,0,0,0|2,0,1]=4 1435 B5R0.2 C\C=C\CCI Amb25744699 [0,0,1,0,0,0|2,0,1]=4 1436 B5R0.2 C\C=C\CCN Amb10601619 [0,0,1,0,0,0|2,0,1]=4 1437 B5R0.2 C\C=C\CCN Amb24271068 [0,0,1,0,0,0|2,0,1]=4 1438 B5R0.2 C\C=C\CCO Amb24655557 [0,0,1,0,0,0|1,0,1]=3 1439 B5R0.2 C\C=C\CSC Amb24634458 [0,0,1,0,0,0|3,0,0]=4 1440 B5R0.2 C\C=C\NCC Amb25141439 [0,0,1,0,0,0|3,0,0]=4 1441 B5R0.2 ClCCCOCl Amb24333124 [0,0,1,0,0,0|3,0,0]=4 1442 B5R0.2 ClCCOCBr Amb25240611 [0,0,1,0,0,0|2,0,1]=4 1443 B5R0.2 ClCOCCCl Amb22000864 [0,0,1,0,0,0|2,0,1]=4 1444 B5R0.2 Cl\C=C\CCBr Amb24334549 [0,0,1,0,0,0|2,0,1]=4 1445 B5R0.2 FCCCCF Amb10839858 [0,0,1,0,0,0|2,0,1]=4 1446 B5R0.2 FCCCCS Amb25065453 [0,0,1,0,0,0|1,1,1]=4 1447 B5R0.2 FCCOCCl Amb24709276 [0,0,1,0,0,0|2,0,1]=4 1448 B5R0.2 F\C=C/CCI Amb25264412 [0,0,1,0,0,0|2,0,1]=4 1449 B5R0.2 ICCCCI Amb17672573 [0,0,1,0,0,0|2,0,1]=4 1450 B5R0.2 N#CCCCF Amb25146362 [0,0,1,0,0,0|2,0,1]=4 1451 B5R0.2 N#CCCNO Amb22748730 [0,0,1,0,0,0|2,0,1]=4 1452 B5R0.2 N#CCNC=O Amb24618148 [0,0,1,0,0,0|2,0,1]=4 1453 B5R0.2 N#CCOC=O Amb22347946 [0,0,1,0,0,0|1,0,1]=3 1454 B5R0.2 N#CNCCO Amb24734478 [0,0,1,0,0,0|2,0,1]=4 1455 B5R0.2 N#CSCC=O Amb25678532 [0,0,1,0,0,0|2,0,1]=4 1456 B5R0.2 N#CSCCO Amb25024916 [0,0,1,0,0,0|2,0,1]=4 1457 B5R0.2 NCCCCBr Amb18644498 [0,0,1,0,0,0|2,0,1]=4 1458 B5R0.2 NCCCCBr Amb21858985 [0,0,1,0,0,0|2,0,1]=4 1459 B5R0.2 NCCCCCl Amb18640687 [0,0,1,0,0,0|2,0,1]=4 1460 B5R0.2 NCCCCCl Amb22233734 [0,0,1,0,0,0|2,0,1]=4 1461 B5R0.2 NCCCCN Amb22352431 [0,0,1,0,0,0|2,0,1]=4 1462 B5R0.2 NCCCCN Amb22489528 [0,0,1,0,0,0|2,0,1]=4 1463 B5R0.2 NCCCCS Amb17500976 [0,0,1,0,0,0|1,1,1]=4 1464 B5R0.2 NCCCCS Amb22546260 [0,0,1,0,0,0|1,1,1]=4 1465 B5R0.2 NCCCNCl Amb24333308 [0,0,1,0,0,0|3,0,0]=4 1466 B5R0.2 NCCNC=O Amb25213948 [0,0,1,0,0,0|2,0,0]=3 1467 B5R0.2 NCCNN=O Amb24377161 [0,0,1,0,0,0|3,0,0]=4 1468 B5R0.2 NCCOC=C Amb17593030 [0,0,1,0,0,0|2,0,0]=3 1469 B5R0.2 NCCOC=O Amb24612320 [0,0,1,0,0,0|1,0,0]=2 1470 B5R0.2 NCCOCC Amb1130918 [0,0,1,0,0,0|2,0,1]=4 1471 B5R0.2 NCOCCO Amb25851211 [0,0,1,0,0,0|2,0,1]=4 1472 B5R0.2 NNCCCF Amb25696672 [0,0,1,0,0,0|3,0,0]=4 1473 B5R0.2 NNCCCO Amb19514839 [0,0,1,0,0,0|2,0,0]=3 1474 B5R0.2 NNCCCO Amb22058994 [0,0,1,0,0,0|2,0,0]=3 1475 B5R0.2 NNCOP=O Amb24334346 [0,0,1,0,0,0|3,0,0]=4 1476 B5R0.2 NOCCCF Amb22896552 [0,0,1,0,0,0|3,0,0]=4 1477 B5R0.2 NOCCCF Amb24632017 [0,0,1,0,0,0|3,0,0]=4 1478 B5R0.2 NOCCCO Amb18061671 [0,0,1,0,0,0|2,0,0]=3 1479 B5R0.2 NOCCCS Amb17608230 [0,0,1,0,0,0|2,1,0]=4 1480 B5R0.2 N[13CH2]CC[13CH2]N Amb22367523 [0,0,1,0,0,0|2,0,1]=4 1481 B5R0.2 N[13CH2][13CH2][13CH2][13CH2]N Amb22336801 [0,0,1,0,0,0|2,0,1]=4 1482 B5R0.2 N\C=C\CC=O Amb24706738 [0,0,1,0,0,0|1,0,2]=4 1483 B5R0.2 O=C=NCCF Amb24710430 [0,0,1,0,0,0|2,0,1]=4 1484 B5R0.2 O=CCCC=O Amb22231966 [0,0,1,0,0,0|0,0,2]=3 1485 B5R0.2 O=CCCCBr Amb18644189 [0,0,1,0,0,0|1,0,0]=2 1486 B5R0.2 O=CCCCF Amb24056028 [0,0,1,0,0,0|1,0,0]=2 1487 B5R0.2 O=CCCSCl Amb25146622 [0,0,1,0,0,0|2,0,0]=3 1488 B5R0.2 O=CCCSS Amb22524519 [0,0,1,0,0,0|1,1,0]=3 1489 B5R0.2 O=CCN=C=S Amb25833744 [0,0,1,0,0,0|1,1,1]=4 1490 B5R0.2 O=CCOCBr Amb25765436 [0,0,1,0,0,0|2,0,0]=3 1491 B5R0.2 O=CCOCC Amb24052108 [0,0,1,0,0,0|2,0,0]=3 1492 B5R0.2 O=CCOCCl Amb24671305 [0,0,1,0,0,0|2,0,0]=3 1493 B5R0.2 O=CC\C=C\Cl Amb24571938 [0,0,1,0,0,0|1,0,2]=4 1494 B5R0.2 O=COCCCl Amb22345927 [0,0,1,0,0,0|1,0,0]=2 1495 B5R0.2 O=CSCCCl Amb25808568 [0,0,1,0,0,0|1,1,0]=3 1496 B5R0.2 O=C\C=C\CBr Amb18124626 [0,0,1,0,0,0|1,0,2]=4 1497 B5R0.2 O=C\C=C\CCl Amb18122401 [0,0,1,0,0,0|1,0,2]=4 1498 B5R0.2 O=C\C=C\CF Amb24569288 [0,0,1,0,0,0|1,0,2]=4 1499 B5R0.2 O=NOCCBr Amb24334595 [0,0,1,0,0,0|2,0,0]=3 1500 B5R0.2 OC#CCCO Amb24333438 [0,0,1,0,0,0|0,0,3]=4 1501 B5R0.2 OC=NCCCl Amb24684796 [0,0,1,0,0,0|2,0,1]=4 1502 B5R0.2 OCC#CC=C Amb17593015 [0,0,1,0,0,0|1,0,2]=4 1503 B5R0.2 OCC#CC=O Amb24566145 [0,0,1,0,0,0|0,0,2]=3 1504 B5R0.2 OCCC#CI Amb2229180 [0,0,1,0,0,0|1,0,2]=4 1505 B5R0.2 OCCC=C=C Amb17593020 [0,0,1,0,0,0|1,0,2]=4 1506 B5R0.2 OCCC=NO Amb24581888 [0,0,1,0,0,0|1,0,2]=4 1507 B5R0.2 OCCCC#C Amb1219893 [0,0,1,0,0,0|1,0,1]=3 1508 B5R0.2 OCCCC=O Amb24589235 [0,0,1,0,0,0|0,0,0]=1 1509 B5R0.2 OCCCCCl Amb1101976 [0,0,1,0,0,0|1,0,1]=3 1510 B5R0.2 OCCCCF Amb17593046 [0,0,1,0,0,0|1,0,1]=3 1511 B5R0.2 OCCCCI Amb25689806 [0,0,1,0,0,0|1,0,1]=3 1512 B5R0.2 OCCCCS Amb22229807 [0,0,1,0,0,0|0,1,1]=3 1513 B5R0.2 OCCCNCl Amb25146306 [0,0,1,0,0,0|2,0,0]=3 1514 B5R0.2 OCCCNO Amb24719785 [0,0,1,0,0,0|1,0,1]=3 1515 B5R0.2 OCCN=C=S Amb24675520 [0,0,1,0,0,0|1,1,1]=4 1516 B5R0.2 OCCNC=S Amb24723087 [0,0,1,0,0,0|1,1,0]=3 1517 B5R0.2 OCCOC=C Amb17674184 [0,0,1,0,0,0|2,0,0]=3 1518 B5R0.2 OCCOCCl Amb24673634 [0,0,1,0,0,0|2,0,1]=4 1519 B5R0.2 OCCON=O Amb22363071 [0,0,1,0,0,0|2,0,0]=3 1520 B5R0.2 OCCSCC Amb1085958 [0,0,1,0,0,0|2,0,1]=4 1521 B5R0.2 OCCSN=O Amb25145493 [0,0,1,0,0,0|2,0,0]=3 1522 B5R0.2 OCC\C=C\I Amb24332782 [0,0,1,0,0,0|1,0,1]=3 1523 B5R0.2 OCNCCO Amb22228429 [0,0,1,0,0,0|1,0,2]=4 1524 B5R0.2 OCOCCCl Amb25335353 [0,0,1,0,0,0|1,0,2]=4 1525 B5R0.2 OCOCCO Amb22228906 [0,0,1,0,0,0|1,0,2]=4 1526 B5R0.2 OC\C=C\C=O Amb24356008 [0,0,1,0,0,0|0,0,2]=3 1527 B5R0.2 ON=CCC=O Amb25744688 [0,0,1,0,0,0|1,0,1]=3 1528 B5R0.2 ON=CNC=O Amb25130798 [0,0,1,0,0,0|2,0,1]=4 1529 B5R0.2 ON=NCCO Amb25747385 [0,0,1,0,0,0|2,0,1]=4 1530 B5R0.2 ONC\C=C\Cl Amb24540806 [0,0,1,0,0,0|2,0,1]=4 1531 B5R0.2 O\C=C\CCO Amb24333503 [0,0,1,0,0,0|0,0,2]=3 1532 B5R0.2 O\N=C\CC=O Amb24640219 [0,0,1,0,0,0|1,0,1]=3 1533 B5R0.2 SCCCC#N Amb17504257 [0,0,1,0,0,0|1,1,1]=4 1534 B5R0.2 SCCCC=C Amb17939241 [0,0,1,0,0,0|1,1,0]=3 1535 B5R0.2 SCCCCCl Amb24665692 [0,0,1,0,0,0|1,1,1]=4 1536 B5R0.2 [15NH2]CCCC[15NH2] Amb22353369 [0,0,1,0,0,0|2,0,1]=4 1537 B5R0.2 [C-]#[N+]CCC=O Amb24706723 [0,0,1,0,0,0|2,0,0]=3 1538 B5R0.2 [C-]#[N+]CCCC Amb2235001 [0,0,1,0,0,0|3,0,0]=4 1539 B5R0.2 [N-]=[N+]=NCCO Amb19514563 [0,0,1,0,0,0|3,0,0]=4 1540 B5R0.3 BrCC(=O)C=C Amb10602446 [0,0,1,0,0,0|2,0,1]=4 1541 B5R0.3 BrC[13C](=O)CBr Amb17612534 [0,0,1,0,0,0|3,0,0]=4 1542 B5R0.3 C=CC(=O)CI Amb24645771 [0,0,1,0,0,0|2,0,1]=4 1543 B5R0.3 C=CC(=O)CN Amb24334239 [0,0,1,0,0,0|2,0,1]=4 1544 B5R0.3 C=CC(=O)O[K] Amb22363270 [0,0,1,0,0,0|1,0,2]=4 1545 B5R0.3 C=CC(=O)O[Na] Amb22336198 [0,0,1,0,0,0|1,0,2]=4 1546 B5R0.3 CC(OC)CN Amb2140564 [0,0,1,0,0,0|2,0,1]=4 1547 B5R0.3 CC/C(C)=C/C Amb17940137 [0,0,1,0,0,0|2,0,0]=3 1548 B5R0.3 CC=C(C)OC Amb25747357 [0,0,1,0,0,0|1,0,1]=3 1549 B5R0.3 CCB(O)CC Amb25265307 [0,0,1,0,0,0|2,0,1]=4 1550 B5R0.3 CCC(=C)C=O Amb17940102 [0,0,1,0,0,0|3,0,0]=4 1551 B5R0.3 CCC(=C)CBr Amb22059701 [0,0,1,0,0,0|3,0,0]=4 1552 B5R0.3 CCC(=C)CC Amb17940707 [0,0,1,0,0,0|2,0,0]=3 1553 B5R0.3 CCC(=C)CI Amb24478536 [0,0,1,0,0,0|3,0,0]=4 1554 B5R0.3 CCC(=C)CS Amb24576625 [0,0,1,0,0,0|3,0,0]=4 1555 B5R0.3 CCC(=N)NO Amb19515903 [0,0,1,0,0,0|3,0,0]=4 1556 B5R0.3 CCC(=N)NO Amb22266115 [0,0,1,0,0,0|3,0,0]=4 1557 B5R0.3 CCC(=O)C#N Amb17231799 [0,0,1,0,0,0|2,0,0]=3 1558 B5R0.3 CCC(=O)C=O Amb22228532 [0,0,1,0,0,0|2,0,0]=3 1559 B5R0.3 CCC(=O)CCl Amb19338105 [0,0,1,0,0,0|2,0,0]=3 1560 B5R0.3 CCC(=O)CF Amb23454809 [0,0,1,0,0,0|2,0,0]=3 1561 B5R0.3 CCC(=O)CN Amb18203134 [0,0,1,0,0,0|2,0,0]=3 1562 B5R0.3 CCC(=O)CN Amb19959206 [0,0,1,0,0,0|2,0,0]=3 1563 B5R0.3 CCC(=O)CO Amb22227965 [0,0,1,0,0,0|2,0,0]=3 1564 B5R0.3 CCC(=O)NN Amb1104708 [0,0,1,0,0,0|2,0,0]=3 1565 B5R0.3 CCC(=O)OBr Amb25746234 [0,0,1,0,0,0|1,0,0]=2 1566 B5R0.3 CCC(=O)SC Amb24691233 [0,0,1,0,0,0|0,1,0]=2 1567 B5R0.3 CCC(=S)OC Amb22168046 [0,0,1,0,0,0|0,1,0]=2 1568 B5R0.3 CCC(C)=C=O Amb25788880 [0,0,1,0,0,0|3,0,0]=4 1569 B5R0.3 CCC(C)=CI Amb25810062 [0,0,1,0,0,0|3,0,0]=4 1570 B5R0.3 CCC(C)=NN Amb24528237 [0,0,1,0,0,0|3,0,0]=4 1571 B5R0.3 CCC(C)SC Amb22043308 [0,0,1,0,0,0|1,1,1]=4 1572 B5R0.3 CCC(CC)N Amb1154143 [0,0,1,0,0,0|2,0,1]=4 1573 B5R0.3 CCC(Cl)=CCl Amb24553945 [0,0,1,0,0,0|3,0,0]=4 1574 B5R0.3 CCC(Cl)=NO Amb24713413 [0,0,1,0,0,0|3,0,0]=4 1575 B5R0.3 CCC(F)CC Amb24372682 [0,0,1,0,0,0|2,0,1]=4 1576 B5R0.3 CCC(I)CC Amb17673918 [0,0,1,0,0,0|2,0,1]=4 1577 B5R0.3 CCC(NC)C Amb10609216 [0,0,1,0,0,0|2,0,1]=4 1578 B5R0.3 CCC(O)OC Amb24334558 [0,0,1,0,0,0|0,0,2]=3 1579 B5R0.3 CCC(OC)C Amb10069005 [0,0,1,0,0,0|1,0,1]=3 1580 B5R0.3 CCS(=O)CC Amb17845324 [0,0,1,0,0,0|2,0,0]=3 1581 B5R0.3 CCS(=O)CCl Amb25024774 [0,0,1,0,0,0|3,0,0]=4 1582 B5R0.3 CCS(=O)NN Amb24557357 [0,0,1,0,0,0|3,0,0]=4 1583 B5R0.3 CC[14C](=O)O[Na] Amb22352512 [0,0,1,0,0,0|1,0,0]=2 1584 B5R0.3 CC[SiH](Cl)CC Amb22730140 [0,0,1,0,0,0|2,1,0]=4 1585 B5R0.3 CC[Sn](=O)CC Amb19894307 [0,0,1,0,0,0|2,0,0]=3 1586 B5R0.3 CC[Tl](Br)CC Amb22347149 [0,0,1,0,0,0|3,0,0]=4 1587 B5R0.3 CC[Tl](I)CC Amb22347150 [0,0,1,0,0,0|3,0,0]=4 1588 B5R0.3 CC\C(=N/O)\N Amb10609125 [0,0,1,0,0,0|3,0,0]=4 1589 B5R0.3 CC\C(=N\O)\N Amb1125701 [0,0,1,0,0,0|3,0,0]=4 1590 B5R0.3 CC\C(\C)=C/C Amb25332651 [0,0,1,0,0,0|2,0,0]=3 1591 B5R0.3 CC\C(\Cl)=C/Cl Amb24652361 [0,0,1,0,0,0|3,0,0]=4 1592 B5R0.3 CC\C(\N)=N\N Amb17934241 [0,0,1,0,0,0|3,0,0]=4 1593 B5R0.3 CC\C(\N)=N\O Amb19883708 [0,0,1,0,0,0|3,0,0]=4 1594 B5R0.3 CNC(=C)NC Amb24561635 [0,0,1,0,0,0|3,0,0]=4 1595 B5R0.3 CNC(=N)CN Amb24680568 [0,0,1,0,0,0|3,0,0]=4 1596 B5R0.3 CNC(=N)CO Amb23514994 [0,0,1,0,0,0|3,0,0]=4 1597 B5R0.3 CNC(=N)NC Amb22731268 [0,0,1,0,0,0|3,0,0]=4 1598 B5R0.3 CNC(=N)SC Amb19374860 [0,0,1,0,0,0|2,1,0]=4 1599 B5R0.3 CNC(=O)C#C Amb25147319 [0,0,1,0,0,0|1,0,2]=4 1600 B5R0.3 CNC(=O)CBr Amb2090678 [0,0,1,0,0,0|2,0,0]=3 1601 B5R0.3 CNC(=O)CF Amb25293692 [0,0,1,0,0,0|2,0,0]=3 1602 B5R0.3 CNC(=O)CI Amb23512488 [0,0,1,0,0,0|2,0,0]=3 1603 B5R0.3 CNC(=O)CN Amb2371053 [0,0,1,0,0,0|2,0,0]=3 1604 B5R0.3 CNC(=O)CS Amb22348209 [0,0,1,0,0,0|2,0,0]=3 1605 B5R0.3 CNC(=O)N=O Amb25738596 [0,0,1,0,0,0|3,0,0]=4 1606 B5R0.3 CNC(=O)NN Amb22899159 [0,0,1,0,0,0|3,0,0]=4 1607 B5R0.3 CNC(=O)NO Amb25185417 [0,0,1,0,0,0|3,0,0]=4 1608 B5R0.3 CNC(=O)OC Amb16185431 [0,0,1,0,0,0|1,0,0]=2 1609 B5R0.3 CNC(=O)ON Amb25234932 [0,0,1,0,0,0|2,0,0]=3 1610 B5R0.3 CNC(=S)OC Amb25084590 [0,0,1,0,0,0|1,1,0]=3 1611 B5R0.3 CNC(=S)SC Amb24351565 [0,0,1,0,0,0|1,2,0]=4 1612 B5R0.3 CNC(C)OC Amb24619320 [0,0,1,0,0,0|2,0,1]=4 1613 B5R0.3 CNC(Cl)=NC Amb24502728 [0,0,1,0,0,0|3,0,0]=4 1614 B5R0.3 CN\C(=N/C)\C Amb10552433 [0,0,1,0,0,0|3,0,0]=4 1615 B5R0.3 CN\C(=N/C)\N Amb10552390 [0,0,1,0,0,0|3,0,0]=4 1616 B5R0.3 COB(Cl)OC Amb24646872 [0,0,1,0,0,0|3,0,0]=4 1617 B5R0.3 COC(=C)C#C Amb17939756 [0,0,1,0,0,0|1,0,2]=4 1618 B5R0.3 COC(=C)CBr Amb25177183 [0,0,1,0,0,0|2,0,0]=3 1619 B5R0.3 COC(=C)CO Amb25345119 [0,0,1,0,0,0|2,0,0]=3 1620 B5R0.3 COC(=C)OC Amb10603349 [0,0,1,0,0,0|2,0,0]=3 1621 B5R0.3 COC(=N)C#N Amb25747279 [0,0,1,0,0,0|2,0,1]=4 1622 B5R0.3 COC(=N)CI Amb24544873 [0,0,1,0,0,0|2,0,0]=3 1623 B5R0.3 COC(=N)CN Amb25024621 [0,0,1,0,0,0|2,0,0]=3 1624 B5R0.3 COC(=N)OC Amb25026539 [0,0,1,0,0,0|2,0,0]=3 1625 B5R0.3 COC(=O)C#N Amb22350567 [0,0,1,0,0,0|1,0,1]=3 1626 B5R0.3 COC(=O)C=C Amb22336504 [0,0,1,0,0,0|0,0,2]=3 1627 B5R0.3 COC(=O)C=C Amb22338013 [0,0,1,0,0,0|0,0,2]=3 1628 B5R0.3 COC(=O)C=C Amb22351400 [0,0,1,0,0,0|0,0,2]=3 1629 B5R0.3 COC(=O)C=C Amb22353461 [0,0,1,0,0,0|0,0,2]=3 1630 B5R0.3 COC(=O)CI Amb22036593 [0,0,1,0,0,0|1,0,0]=2 1631 B5R0.3 COC(=O)CN Amb1153098 [0,0,1,0,0,0|1,0,0]=2 1632 B5R0.3 COC(=O)CN Amb22236127 [0,0,1,0,0,0|1,0,0]=2 1633 B5R0.3 COC(=O)NN Amb1800924 [0,0,1,0,0,0|2,0,0]=3 1634 B5R0.3 COC(=O)NO Amb25210328 [0,0,1,0,0,0|2,0,0]=3 1635 B5R0.3 COC(=S)NN Amb22504666 [0,0,1,0,0,0|2,1,0]=4 1636 B5R0.3 COC(=S)SC Amb25138885 [0,0,1,0,0,0|1,1,0]=3 1637 B5R0.3 COC(Br)CBr Amb17940725 [0,0,1,0,0,0|2,0,1]=4 1638 B5R0.3 COC(C)=CBr Amb24590077 [0,0,1,0,0,0|2,0,1]=4 1639 B5R0.3 COC(C)=CCl Amb25065366 [0,0,1,0,0,0|2,0,1]=4 1640 B5R0.3 COC(C)CBr Amb24711458 [0,0,1,0,0,0|2,0,1]=4 1641 B5R0.3 COC(C)CI Amb24371608 [0,0,1,0,0,0|2,0,1]=4 1642 B5R0.3 COC(C)CO Amb19517078 [0,0,1,0,0,0|2,0,1]=4 1643 B5R0.3 COC(Cl)=CBr Amb25361127 [0,0,1,0,0,0|2,0,1]=4 1644 B5R0.3 COC(Cl)CBr Amb25809875 [0,0,1,0,0,0|2,0,1]=4 1645 B5R0.3 COC(Cl)CCl Amb17689392 [0,0,1,0,0,0|2,0,1]=4 1646 B5R0.3 COC(F)=CCl Amb24565713 [0,0,1,0,0,0|2,0,1]=4 1647 B5R0.3 COC(N)=NCl Amb24681496 [0,0,1,0,0,0|3,0,0]=4 1648 B5R0.3 COC(N)CO Amb24615890 [0,0,1,0,0,0|2,0,1]=4 1649 B5R0.3 COC(O)CCl Amb24065467 [0,0,1,0,0,0|1,0,2]=4 1650 B5R0.3 COC(O)CO Amb25747170 [0,0,1,0,0,0|1,0,2]=4 1651 B5R0.3 COC(O)OC Amb25746849 [0,0,1,0,0,0|1,0,2]=4 1652 B5R0.3 CON(C)CO Amb25745642 [0,0,1,0,0,0|3,0,0]=4 1653 B5R0.3 COP(Cl)OC Amb22731550 [0,0,1,0,0,0|3,0,0]=4 1654 B5R0.3 COP(O)CCl Amb24422944 [0,0,1,0,0,0|2,0,1]=4 1655 B5R0.3 CO[C+](N)SC Amb24469292 [0,0,1,0,0,0|2,0,1]=4 1656 B5R0.3 CO[C@@H](C)CN Amb22746816 [0,0,1,0,0,0|2,0,1]=4 1657 B5R0.3 CP(OC)OC Amb22730471 [0,0,1,0,0,0|3,0,0]=4 1658 B5R0.3 CS=C(O)SC Amb22167602 [0,0,1,0,0,0|1,1,1]=4 1659 B5R0.3 CSC(=C)CO Amb25334721 [0,0,1,0,0,0|2,1,0]=4 1660 B5R0.3 CSC(=C)SC Amb22731907 [0,0,1,0,0,0|2,1,0]=4 1661 B5R0.3 CSC(=O)CI Amb24352866 [0,0,1,0,0,0|1,1,0]=3 1662 B5R0.3 CSC(=O)CO Amb25834913 [0,0,1,0,0,0|1,1,0]=3 1663 B5R0.3 CSC(=O)NN Amb25299875 [0,0,1,0,0,0|2,1,0]=4 1664 B5R0.3 CSC(=O)SC Amb19944681 [0,0,1,0,0,0|1,1,0]=3 1665 B5R0.3 CSC(=S)CBr Amb25065365 [0,0,1,0,0,0|1,2,0]=4 1666 B5R0.3 CSC(=S)CCl Amb25066875 [0,0,1,0,0,0|1,2,0]=4 1667 B5R0.3 CSC(=S)SC Amb21520373 [0,0,1,0,0,0|1,2,0]=4 1668 B5R0.3 C[C@@H](OC)CO Amb10603218 [0,0,1,0,0,0|2,0,1]=4 1669 B5R0.3 C[CH-]C(=O)CC Amb25370013 [0,0,1,0,0,0|1,0,0]=2 1670 B5R0.3 C[ClH]C(=O)CCl Amb25238807 [0,0,1,0,0,0|2,0,0]=3 1671 B5R0.3 C[SiH](CC)CC Amb19893812 [0,0,1,0,0,0|2,1,0]=4 1672 B5R0.3 C[SiH](OC)OC Amb19893947 [0,0,1,0,0,0|2,1,0]=4 1673 B5R0.3 C\C(\CC)=C/C Amb22733177 [0,0,1,0,0,0|2,0,0]=3 1674 B5R0.3 C\C=C(/Br)\CBr Amb25822740 [0,0,1,0,0,0|3,0,0]=4 1675 B5R0.3 C\C=C(/Br)\CN Amb25231059 [0,0,1,0,0,0|3,0,0]=4 1676 B5R0.3 C\C=C(/Cl)\CBr Amb25811587 [0,0,1,0,0,0|3,0,0]=4 1677 B5R0.3 C\C=C(/F)\CBr Amb22546798 [0,0,1,0,0,0|3,0,0]=4 1678 B5R0.3 C\C=C(/F)\CO Amb22546797 [0,0,1,0,0,0|3,0,0]=4 1679 B5R0.3 C\C=C(\Br)/CO Amb25809972 [0,0,1,0,0,0|3,0,0]=4 1680 B5R0.3 C\C=C(\C)/CBr Amb24595225 [0,0,1,0,0,0|3,0,0]=4 1681 B5R0.3 C\C=C(\C)/CI Amb24711603 [0,0,1,0,0,0|3,0,0]=4 1682 B5R0.3 C\C=C(\C)/CN Amb25083555 [0,0,1,0,0,0|3,0,0]=4 1683 B5R0.3 C\C=C(\Cl)/CBr Amb25024328 [0,0,1,0,0,0|3,0,0]=4 1684 B5R0.3 C\C=C(\Cl)/CCl Amb25727694 [0,0,1,0,0,0|3,0,0]=4 1685 B5R0.3 C\C=C(\I)/CN Amb24519149 [0,0,1,0,0,0|3,0,0]=4 1686 B5R0.3 C\C=C(\I)/CO Amb25046626 [0,0,1,0,0,0|3,0,0]=4 1687 B5R0.3 N#CC(=O)CF Amb25318806 [0,0,1,0,0,0|3,0,0]=4 1688 B5R0.3 N#CC(=O)CO Amb25146313 [0,0,1,0,0,0|3,0,0]=4 1689 B5R0.3 NCC(=O)CN Amb17593034 [0,0,1,0,0,0|3,0,0]=4 1690 B5R0.3 NCC(=O)CN Amb22227724 [0,0,1,0,0,0|3,0,0]=4 1691 B5R0.3 NCC(=O)CN Amb22338039 [0,0,1,0,0,0|3,0,0]=4 1692 B5R0.3 NCC(=O)NN Amb18559478 [0,0,1,0,0,0|3,0,0]=4 1693 B5R0.3 NCC(=O)NO Amb2433859 [0,0,1,0,0,0|3,0,0]=4 1694 B5R0.3 NCC(=O)OI Amb25727816 [0,0,1,0,0,0|2,0,0]=3 1695 B5R0.3 NNC(=O)CF Amb24501438 [0,0,1,0,0,0|3,0,0]=4 1696 B5R0.3 NNC(=O)CO Amb17615031 [0,0,1,0,0,0|3,0,0]=4 1697 B5R0.3 NNC(=O)CS Amb22058763 [0,0,1,0,0,0|3,0,0]=4 1698 B5R0.3 NOC(=O)CCl Amb25762118 [0,0,1,0,0,0|2,0,0]=3 1699 B5R0.3 O=C(CBr)O[K] Amb20248290 [0,0,1,0,0,0|2,0,0]=3 1700 B5R0.3 O=C(CCl)CBr Amb24064676 [0,0,1,0,0,0|3,0,0]=4 1701 B5R0.3 O=C(CCl)NBr Amb25139377 [0,0,1,0,0,0|3,0,0]=4 1702 B5R0.3 O=C(CCl)NI Amb25772911 [0,0,1,0,0,0|3,0,0]=4 1703 B5R0.3 O=C(CCl)OCl Amb24665690 [0,0,1,0,0,0|2,0,0]=3 1704 B5R0.3 O=C(CF)CCl Amb24531400 [0,0,1,0,0,0|3,0,0]=4 1705 B5R0.3 O=C(CF)CF Amb19895356 [0,0,1,0,0,0|3,0,0]=4 1706 B5R0.3 O=C(CF)O[Na] Amb22361244 [0,0,1,0,0,0|2,0,0]=3 1707 B5R0.3 O=C(CI)CI Amb22227730 [0,0,1,0,0,0|3,0,0]=4 1708 B5R0.3 O=C(CI)NCl Amb25091806 [0,0,1,0,0,0|3,0,0]=4 1709 B5R0.3 O=C(O[Ag])O[Ag] Amb20240527 [0,0,1,0,0,0|3,0,0]=4 1710 B5R0.3 O=C(O[Na])O[Na] Amb22338269 [0,0,1,0,0,0|3,0,0]=4 1711 B5R0.3 O=C(O[Tl])O[Tl] Amb22052528 [0,0,1,0,0,0|3,0,0]=4 1712 B5R0.3 O=CC(=O)CBr Amb18644452 [0,0,1,0,0,0|3,0,0]=4 1713 B5R0.3 O=CC(=O)CCl Amb18122597 [0,0,1,0,0,0|3,0,0]=4 1714 B5R0.3 O=CC(=O)CF Amb25145488 [0,0,1,0,0,0|3,0,0]=4 1715 B5R0.3 O=[13C](O[Ag])O[Ag] Amb22353084 [0,0,1,0,0,0|3,0,0]=4 1716 B5R0.3 O=[13C](O[Na])O[Na] Amb22338192 [0,0,1,0,0,0|3,0,0]=4 1717 B5R0.3 O=[14C](O[Na])O[Na] Amb22352742 [0,0,1,0,0,0|3,0,0]=4 1718 B5R0.3 OCC(=O)C=O Amb17593031 [0,0,1,0,0,0|3,0,0]=4 1719 B5R0.3 OCC(=O)CO Amb22732522 [0,0,1,0,0,0|3,0,0]=4 1720 B5R0.3 ONC(=O)CBr Amb24332664 [0,0,1,0,0,0|3,0,0]=4 1721 B5R0.3 ONC(=O)CCl Amb25324352 [0,0,1,0,0,0|3,0,0]=4 1722 B5R0.3 [13CH3]O[13C](=O)O[13CH3] Amb22338936 [0,0,1,0,0,0|1,0,0]=2 1723 B5R0.3 [13CH3][13CH2]C(=O)O[Na] Amb22338657 [0,0,1,0,0,0|1,0,0]=2 1724 B5R0.3 [13CH3][13CH2][13C](=O)O[Na] Amb22354040 [0,0,1,0,0,0|1,0,0]=2 1725 B5R0.3 [2H]N(CC)CC Amb22733341 [0,0,1,0,0,0|3,0,0]=4 1726 B5R0.3 [CH2-]C(CC)CC Amb24117230 [0,0,1,0,0,0|2,0,1]=4 1727 B5R0.3 [Cs]OC(=O)O[Cs] Amb17674132 [0,0,1,0,0,0|3,0,0]=4 1728 B5R0.3 [Li]N(CC)CC Amb22338214 [0,0,1,0,0,0|3,0,0]=4 1729 B5R0.3 [Na]OC(=O)C#C Amb10552373 [0,0,1,0,0,0|1,0,2]=4 1730 B5R0.3 [Rb]OC(=O)O[Rb] Amb17674131 [0,0,1,0,0,0|3,0,0]=4 1731 B7R2.9 OC1C2CCC21 Amb24333578 [0,0,0,1,0,0|1,0,2]=4 1732 B7R2.9 O[C@@H]1[C@H]2CC[C@H]21 Amb25107675 [0,0,0,1,0,0|1,0,2]=4 1733 B7R2.10 O=C1NC2CC12 Amb25663246 [0,0,0,1,0,0|1,0,0]=2 1734 B7R2.10 O=C1N[C@@H]2C[C@H]12 Amb24568016 [0,0,0,1,0,0|1,0,0]=2 1735 B7R2.10 O[C@@H]1CC2C[C@H]21 Amb25662903 [0,0,0,1,0,0|1,0,2]=4 1736 B7R2.10 O[C@H]1C[C@@H]2C[C@@H]21 Amb24533866 [0,0,0,1,0,0|1,0,2]=4 1737 B7R2.11 C1C2CC1CC2 Amb25338323 [0,0,0,1,0,0|2,0,1]=4 1738 B7R2.11 C1C2CCC1N2 Amb24117066 [0,0,0,1,0,0|2,0,1]=4 1739 B7R2.11 C1NC2CC1C2 Amb21964458 [0,0,0,1,0,0|2,0,1]=4 1740 B7R2.11 C1NC2CC1C2 Amb22493767 [0,0,0,1,0,0|2,0,1]=4 1741 B7R2.11 C1N[C@@H]2C[C@H]1C2 Amb25147805 [0,0,0,1,0,0|2,0,1]=4 1742 B7R2.11 C1[C@@H]2C[C@H]1CC2 Amb25359464 [0,0,0,1,0,0|2,0,1]=4 1743 B7R2.13 C1C2CCCC21 Amb25723975 [0,0,0,1,0,0|2,0,1]=4 1744 B7R2.13 C1C2NCCC21 Amb19375213 [0,0,0,1,0,0|2,0,1]=4 1745 B7R2.13 C1C2NCCC21 Amb22755961 [0,0,0,1,0,0|2,0,1]=4 1746 B7R2.13 C1CC2C(C1)N2 Amb10609121 [0,0,0,1,0,0|2,0,1]=4 1747 B7R2.13 C1CC2C(C1)O2 Amb2372554 [0,0,0,1,0,0|1,0,2]=4 1748 B7R2.13 C1CC2SC2C1 Amb17672825 [0,0,0,1,0,0|1,1,1]=4 1749 B7R2.13 C1CC[C@H]2O[C@H]21 Amb24748515 [0,0,0,1,0,0|1,0,2]=4 1750 B7R2.13 C1N2CCCN21 Amb24581679 [0,0,0,1,0,0|3,0,0]=4 1751 B7R2.13 C1[C@@H]2NCC[C@@H]21 Amb25273841 [0,0,0,1,0,0|2,0,1]=4 1752 B5R1.2 BrC1CNC1 Amb22229230 [0,0,0,0,1,0|2,0,1]=4 1753 B5R1.2 BrC1CNC1 Amb22235472 [0,0,0,0,1,0|2,0,1]=4 1754 B5R1.2 BrC1CNC1 Amb22304219 [0,0,0,0,1,0|2,0,1]=4 1755 B5R1.2 BrC1COC1 Amb2383522 [0,0,0,0,1,0|2,0,1]=4 1756 B5R1.2 BrC1CSC1 Amb24476921 [0,0,0,0,1,0|2,0,1]=4 1757 B5R1.2 C=C1CCC1 Amb19374657 [0,0,0,0,1,0|1,0,0]=2 1758 B5R1.2 C=C1CCO1 Amb22736695 [0,0,0,0,1,0|1,0,0]=2 1759 B5R1.2 CC1CCC1 Amb25744850 [0,0,0,0,1,0|1,0,1]=3 1760 B5R1.2 CC1CCN1 Amb19373963 [0,0,0,0,1,0|2,0,1]=4 1761 B5R1.2 CC1CCO1 Amb22284855 [0,0,0,0,1,0|1,0,1]=3 1762 B5R1.2 CC1CNC1 Amb19957931 [0,0,0,0,1,0|2,0,1]=4 1763 B5R1.2 CC1COC1 Amb20621708 [0,0,0,0,1,0|2,0,1]=4 1764 B5R1.2 CN1CCC1 Amb22230922 [0,0,0,0,1,0|2,0,0]=3 1765 B5R1.2 C[C@H]1CCN1 Amb24476939 [0,0,0,0,1,0|2,0,1]=4 1766 B5R1.2 C[SiH]1CCC1 Amb25714712 [0,0,0,0,1,0|1,1,0]=3 1767 B5R1.2 ClC1CNC1 Amb21960859 [0,0,0,0,1,0|2,0,1]=4 1768 B5R1.2 ClC1CNC1 Amb22232545 [0,0,0,0,1,0|2,0,1]=4 1769 B5R1.2 ClC1COC1 Amb22737242 [0,0,0,0,1,0|2,0,1]=4 1770 B5R1.2 ClC1CSC1 Amb24678921 [0,0,0,0,1,0|2,0,1]=4 1771 B5R1.2 FC1CNC1 Amb19148506 [0,0,0,0,1,0|2,0,1]=4 1772 B5R1.2 FC1COC1 Amb21960819 [0,0,0,0,1,0|2,0,1]=4 1773 B5R1.2 IC1CCC1 Amb24476982 [0,0,0,0,1,0|1,0,1]=3 1774 B5R1.2 IC1CNC1 Amb22229328 [0,0,0,0,1,0|2,0,1]=4 1775 B5R1.2 IC1COC1 Amb2383523 [0,0,0,0,1,0|2,0,1]=4 1776 B5R1.2 NC1CCO1 Amb24505850 [0,0,0,0,1,0|1,0,1]=3 1777 B5R1.2 NC1CNC1 Amb22737488 [0,0,0,0,1,0|2,0,1]=4 1778 B5R1.2 NC1COC1 Amb21928045 [0,0,0,0,1,0|2,0,1]=4 1779 B5R1.2 NC1CSC1 Amb17597694 [0,0,0,0,1,0|2,0,1]=4 1780 B5R1.2 NC1CSC1 Amb19373792 [0,0,0,0,1,0|2,0,1]=4 1781 B5R1.2 NC1CSC1 Amb22295804 [0,0,0,0,1,0|2,0,1]=4 1782 B5R1.2 NN1CCC1 Amb24392919 [0,0,0,0,1,0|2,0,0]=3 1783 B5R1.2 O=C1CC=C1 Amb24477666 [0,0,0,0,1,0|0,0,2]=3 1784 B5R1.2 O=C1CNC1 Amb10975976 [0,0,0,0,1,0|1,0,0]=2 1785 B5R1.2 O=C1COC1 Amb10067645 [0,0,0,0,1,0|1,0,0]=2 1786 B5R1.2 O=C1CSC1 Amb19516222 [0,0,0,0,1,0|1,0,0]=2 1787 B5R1.2 O=C1O[Ba]O1 Amb22052524 [0,0,0,0,1,0|2,0,0]=3 1788 B5R1.2 O=C1O[Mg]O1 Amb22052493 [0,0,0,0,1,0|2,0,0]=3 1789 B5R1.2 O=C1O[Ni]O1 Amb22336202 [0,0,0,0,1,0|2,0,0]=3 1790 B5R1.2 O=C1O[Pb]O1 Amb22052516 [0,0,0,0,1,0|2,0,0]=3 1791 B5R1.2 O=[14C]1O[Ba]O1 Amb22730314 [0,0,0,0,1,0|2,0,0]=3 1792 B5R1.2 O=[Se]1O[Pb]O1 Amb22351681 [0,0,0,0,1,0|3,0,0]=4 1793 B5R1.2 O=[Ti]1O[Fe]O1 Amb22336654 [0,0,0,0,1,0|3,0,0]=4 1794 B5R1.2 O=[Zr]1O[Cd]O1 Amb22338793 [0,0,0,0,1,0|3,0,0]=4 1795 B5R1.2 OC1CCS1 Amb24705821 [0,0,0,0,1,0|0,1,2]=4 1796 B5R1.2 OC1CNC1 Amb22489446 [0,0,0,0,1,0|1,0,2]=4 1797 B5R1.2 OC1COC1 Amb10602318 [0,0,0,0,1,0|1,0,2]=4 1798 B5R1.2 OC1CSC1 Amb17593039 [0,0,0,0,1,0|1,0,2]=4 1799 B5R1.2 OC1C[NH2+]C1 Amb10559772 [0,0,0,0,1,0|1,0,2]=4 1800 B5R1.2 SC1CCC1 Amb25339328 [0,0,0,0,1,0|0,1,1]=3 1801 B5R1.2 SC1CNC1 Amb24477050 [0,0,0,0,1,0|1,1,1]=4 1802 B5R1.2 SC1COC1 Amb22737528 [0,0,0,0,1,0|1,1,1]=4 1803 B7R1.3 BN1CCCCC1 Amb24621882 [0,0,0,0,0,1|3,0,0]=4 1804 B7R1.3 BrC1=CCCCO1 Amb24322651 [0,0,0,0,0,1|1,0,0]=2 1805 B7R1.3 BrC1=COCCO1 Amb24322806 [0,0,0,0,0,1|1,0,1]=3 1806 B7R1.3 BrC1CCCCO1 Amb24322575 [0,0,0,0,0,1|1,0,1]=3 1807 B7R1.3 BrC1CCCN=C1 Amb24322652 [0,0,0,0,0,1|2,0,1]=4 1808 B7R1.3 BrC1CCCNC1 Amb10603668 [0,0,0,0,0,1|2,0,1]=4 1809 B7R1.3 BrC1CCNCC1 Amb22229718 [0,0,0,0,0,1|2,0,1]=4 1810 B7R1.3 BrC1CCSCC1 Amb18181050 [0,0,0,0,0,1|2,0,1]=4 1811 B7R1.3 BrC1CNCCC1 Amb22497824 [0,0,0,0,0,1|2,0,1]=4 1812 B7R1.3 BrC1COCCO1 Amb24322807 [0,0,0,0,0,1|1,0,1]=3 1813 B7R1.3 BrC=1CCCCC1 Amb21856761 [0,0,0,0,0,1|2,0,0]=3 1814 B7R1.3 BrC=1CCCOC1 Amb24322600 [0,0,0,0,0,1|1,0,0]=2 1815 B7R1.3 BrC=1CCNCC1 Amb24317585 [0,0,0,0,0,1|2,0,0]=3 1816 B7R1.3 BrC=1CCOCC1 Amb21964919 [0,0,0,0,0,1|2,0,0]=3 1817 B7R1.3 BrC=1CCSCC1 Amb22229691 [0,0,0,0,0,1|2,0,0]=3 1818 B7R1.3 C1SC=CNC1=O Amb2386683 [0,0,0,0,0,1|1,0,2]=4 1819 B7R1.3 C=C1CCNCC1 Amb19514763 [0,0,0,0,0,1|2,0,0]=3 1820 B7R1.3 C=C1CCNCC1 Amb24079604 [0,0,0,0,0,1|2,0,0]=3 1821 B7R1.3 C=C1CCOCC1 Amb22000865 [0,0,0,0,0,1|2,0,0]=3 1822 B7R1.3 C=C1CCSCC1 Amb25811623 [0,0,0,0,0,1|2,0,0]=3 1823 B7R1.3 C=C1CNCCC1 Amb19514641 [0,0,0,0,0,1|2,0,0]=3 1824 B7R1.3 C=C1CNCCC1 Amb22059305 [0,0,0,0,0,1|2,0,0]=3 1825 B7R1.3 C=C1CNCCO1 Amb25800394 [0,0,0,0,0,1|1,0,0]=2 1826 B7R1.3 C=C1CSCCC1 Amb22494848 [0,0,0,0,0,1|1,1,0]=3 1827 B7R1.3 C=C1OCCCO1 Amb25734089 [0,0,0,0,0,1|1,0,0]=2 1828 B7R1.3 CB1OCCCO1 Amb25273130 [0,0,0,0,0,1|2,0,0]=3 1829 B7R1.3 CC1=CCCCO1 Amb24480530 [0,0,0,0,0,1|1,0,0]=2 1830 B7R1.3 CC1=CNCCS1 Amb24359845 [0,0,0,0,0,1|1,1,1]=4 1831 B7R1.3 CC1=NCCCS1 Amb25808748 [0,0,0,0,0,1|1,1,0]=3 1832 B7R1.3 CC1CC=CCO1 Amb25719582 [0,0,0,0,0,1|1,0,2]=4 1833 B7R1.3 CC1CCCCN1 Amb10552680 [0,0,0,0,0,1|2,0,1]=4 1834 B7R1.3 CC1CCCCS1 Amb17666899 [0,0,0,0,0,1|1,1,1]=4 1835 B7R1.3 CC1CCNCC1 Amb22549250 [0,0,0,0,0,1|2,0,1]=4 1836 B7R1.3 CC1CCOCC1 Amb22043825 [0,0,0,0,0,1|2,0,1]=4 1837 B7R1.3 CC1CCOCO1 Amb17776591 [0,0,0,0,0,1|1,0,1]=3 1838 B7R1.3 CC1CCSCN1 Amb24475244 [0,0,0,0,0,1|2,0,1]=4 1839 B7R1.3 CC1CNCCC1 Amb22491688 [0,0,0,0,0,1|2,0,1]=4 1840 B7R1.3 CC1CNCCO1 Amb20621613 [0,0,0,0,0,1|1,0,1]=3 1841 B7R1.3 CC1COCCC1 Amb22347806 [0,0,0,0,0,1|1,0,1]=3 1842 B7R1.3 CC1COCCN1 Amb22728071 [0,0,0,0,0,1|2,0,1]=4 1843 B7R1.3 CC1COCOC1 Amb24587149 [0,0,0,0,0,1|2,0,1]=4 1844 B7R1.3 CC1NCCCN1 Amb24381838 [0,0,0,0,0,1|2,0,1]=4 1845 B7R1.3 CC1NCCCO1 Amb17506191 [0,0,0,0,0,1|1,0,1]=3 1846 B7R1.3 CC1NCCCS1 Amb22356247 [0,0,0,0,0,1|1,1,1]=4 1847 B7R1.3 CC1NCCCS1 Amb24479852 [0,0,0,0,0,1|1,1,1]=4 1848 B7R1.3 CC1SCCCS1 Amb10071965 [0,0,0,0,0,1|1,1,1]=4 1849 B7R1.3 CC=1CC=CCC1 Amb19892223 [0,0,0,0,0,1|2,0,1]=4 1850 B7R1.3 CC=1CCCNC1 Amb25694414 [0,0,0,0,0,1|2,0,0]=3 1851 B7R1.3 CC=1CCNCC1 Amb18639053 [0,0,0,0,0,1|2,0,0]=3 1852 B7R1.3 CC=1CCNCC1 Amb21961140 [0,0,0,0,0,1|2,0,0]=3 1853 B7R1.3 CC=1CCOCC1 Amb24070517 [0,0,0,0,0,1|2,0,0]=3 1854 B7R1.3 CC=1CNCCC1 Amb23439963 [0,0,0,0,0,1|2,0,0]=3 1855 B7R1.3 CC=1CNCCC1 Amb25063349 [0,0,0,0,0,1|2,0,0]=3 1856 B7R1.3 CC=1CNCCN1 Amb22755966 [0,0,0,0,0,1|2,0,0]=3 1857 B7R1.3 CC=1NCCNN1 Amb24479798 [0,0,0,0,0,1|3,0,0]=4 1858 B7R1.3 CN1CCCCN1 Amb24681349 [0,0,0,0,0,1|3,0,0]=4 1859 B7R1.3 CN1CCOCC1 Amb2031952 [0,0,0,0,0,1|3,0,0]=4 1860 B7R1.3 CN1CCOCC1 Amb22730073 [0,0,0,0,0,1|3,0,0]=4 1861 B7R1.3 CN1CNCCC1 Amb18121429 [0,0,0,0,0,1|3,0,0]=4 1862 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [0,0,0,0,0,1|2,0,1]=4 1863 B7R1.3 C[C@@H]1CNCCC1 Amb22745835 [0,0,0,0,0,1|2,0,1]=4 1864 B7R1.3 C[C@@H]1CNCCN1 Amb23399598 [0,0,0,0,0,1|2,0,1]=4 1865 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [0,0,0,0,0,1|1,0,1]=3 1866 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [0,0,0,0,0,1|1,0,1]=3 1867 B7R1.3 C[C@@H]1COCCN1 Amb10066948 [0,0,0,0,0,1|2,0,1]=4 1868 B7R1.3 C[C@@H]1COCCN1 Amb22169654 [0,0,0,0,0,1|2,0,1]=4 1869 B7R1.3 C[C@@H]1CSCCN1 Amb25241759 [0,0,0,0,0,1|2,0,1]=4 1870 B7R1.3 C[C@H]1CNCCC1 Amb24461444 [0,0,0,0,0,1|2,0,1]=4 1871 B7R1.3 C[C@H]1CNCCN1 Amb22226120 [0,0,0,0,0,1|2,0,1]=4 1872 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [0,0,0,0,0,1|1,0,1]=3 1873 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [0,0,0,0,0,1|1,0,1]=3 1874 B7R1.3 C[C@H]1COCCN1 Amb10066947 [0,0,0,0,0,1|2,0,1]=4 1875 B7R1.3 C[C@H]1COCCN1 Amb19516190 [0,0,0,0,0,1|2,0,1]=4 1876 B7R1.3 C[C@H]1CSCCN1 Amb25212371 [0,0,0,0,0,1|2,0,1]=4 1877 B7R1.3 ClC1CCCC=C1 Amb22229267 [0,0,0,0,0,1|2,0,1]=4 1878 B7R1.3 ClC1CCCCN1 Amb20242688 [0,0,0,0,0,1|2,0,1]=4 1879 B7R1.3 ClC1CCCCO1 Amb17673285 [0,0,0,0,0,1|1,0,1]=3 1880 B7R1.3 ClC1CCSCC1 Amb24355721 [0,0,0,0,0,1|2,0,1]=4 1881 B7R1.3 ClC1CNCCC1 Amb20618570 [0,0,0,0,0,1|2,0,1]=4 1882 B7R1.3 ClC1CNCCC1 Amb22229260 [0,0,0,0,0,1|2,0,1]=4 1883 B7R1.3 ClC1COCCC1 Amb20622589 [0,0,0,0,0,1|1,0,1]=3 1884 B7R1.3 ClC1COCCO1 Amb24677637 [0,0,0,0,0,1|1,0,1]=3 1885 B7R1.3 ClC1COCCS1 Amb25092492 [0,0,0,0,0,1|1,1,1]=4 1886 B7R1.3 ClC1COCOC1 Amb25064950 [0,0,0,0,0,1|2,0,1]=4 1887 B7R1.3 ClC1SCCCS1 Amb25770692 [0,0,0,0,0,1|1,1,1]=4 1888 B7R1.3 ClC=1CCOCC1 Amb24581676 [0,0,0,0,0,1|2,0,0]=3 1889 B7R1.3 ClC=1CCSCC1 Amb25025197 [0,0,0,0,0,1|2,0,0]=3 1890 B7R1.3 ClN1CCOCC1 Amb20670597 [0,0,0,0,0,1|3,0,0]=4 1891 B7R1.3 Cl[C@@H]1CNCCC1 Amb22226397 [0,0,0,0,0,1|2,0,1]=4 1892 B7R1.3 Cl[C@H]1CCCCO1 Amb24479760 [0,0,0,0,0,1|1,0,1]=3 1893 B7R1.3 Cl[C@H]1CNCCC1 Amb22225326 [0,0,0,0,0,1|2,0,1]=4 1894 B7R1.3 FC1=COCCO1 Amb24322817 [0,0,0,0,0,1|1,0,1]=3 1895 B7R1.3 FC1CCCCO1 Amb24322826 [0,0,0,0,0,1|1,0,1]=3 1896 B7R1.3 FC1CCCNC1 Amb13953137 [0,0,0,0,0,1|2,0,1]=4 1897 B7R1.3 FC1CCNCC1 Amb13885425 [0,0,0,0,0,1|2,0,1]=4 1898 B7R1.3 FC1CCNCC1 Amb22753888 [0,0,0,0,0,1|2,0,1]=4 1899 B7R1.3 FC1CCOCC1 Amb22296909 [0,0,0,0,0,1|2,0,1]=4 1900 B7R1.3 FC1COCCC1 Amb24322825 [0,0,0,0,0,1|1,0,1]=3 1901 B7R1.3 FC1COCCO1 Amb24322827 [0,0,0,0,0,1|1,0,1]=3 1902 B7R1.3 FC1C[NH2+]CCC1 Amb22042691 [0,0,0,0,0,1|2,0,1]=4 1903 B7R1.3 FC=1CCCOC1 Amb24322810 [0,0,0,0,0,1|1,0,0]=2 1904 B7R1.3 FN1CCCCC1 Amb24541335 [0,0,0,0,0,1|3,0,0]=4 1905 B7R1.3 F[C@@H]1CNCCC1 Amb20242275 [0,0,0,0,0,1|2,0,1]=4 1906 B7R1.3 F[C@H]1CNCCC1 Amb20242276 [0,0,0,0,0,1|2,0,1]=4 1907 B7R1.3 IC1=COCCO1 Amb24322818 [0,0,0,0,0,1|1,0,1]=3 1908 B7R1.3 IC1CCNCC1 Amb21860421 [0,0,0,0,0,1|2,0,1]=4 1909 B7R1.3 IC1CCNCC1 Amb22229796 [0,0,0,0,0,1|2,0,1]=4 1910 B7R1.3 IC1CNCCC1 Amb22496356 [0,0,0,0,0,1|2,0,1]=4 1911 B7R1.3 IC1COCCC1 Amb22831295 [0,0,0,0,0,1|1,0,1]=3 1912 B7R1.3 IC1CSCCC1 Amb25744806 [0,0,0,0,0,1|1,1,1]=4 1913 B7R1.3 IC=1CCCOC1 Amb24322812 [0,0,0,0,0,1|1,0,0]=2 1914 B7R1.3 IC=1CCOCC1 Amb25364046 [0,0,0,0,0,1|2,0,0]=3 1915 B7R1.3 N=C1CCCCN1 Amb17616049 [0,0,0,0,0,1|2,0,0]=3 1916 B7R1.3 N=C1CCNCC1 Amb24626089 [0,0,0,0,0,1|2,0,0]=3 1917 B7R1.3 N=C1CCOCC1 Amb24618556 [0,0,0,0,0,1|2,0,0]=3 1918 B7R1.3 N=C1CNCCN1 Amb24587647 [0,0,0,0,0,1|2,0,0]=3 1919 B7R1.3 N=C1CNCCS1 Amb24542565 [0,0,0,0,0,1|1,1,0]=3 1920 B7R1.3 N=C1COCCN1 Amb24654396 [0,0,0,0,0,1|2,0,0]=3 1921 B7R1.3 N=C1NCCCN1 Amb22642014 [0,0,0,0,0,1|2,0,0]=3 1922 B7R1.3 N=C1NCCCO1 Amb23597225 [0,0,0,0,0,1|1,0,0]=2 1923 B7R1.3 N=C1NCCCS1 Amb22524353 [0,0,0,0,0,1|1,1,0]=3 1924 B7R1.3 NC1=CC=CCO1 Amb22167473 [0,0,0,0,0,1|1,0,2]=4 1925 B7R1.3 NC1=CCC=CO1 Amb24351196 [0,0,0,0,0,1|1,0,2]=4 1926 B7R1.3 NC1=CCN=NC1 Amb10603742 [0,0,0,0,0,1|3,0,0]=4 1927 B7R1.3 NC1=NCCCN1 Amb17608307 [0,0,0,0,0,1|2,0,0]=3 1928 B7R1.3 NC1CCCC=C1 Amb20668839 [0,0,0,0,0,1|2,0,1]=4 1929 B7R1.3 NC1CCCC=C1 Amb23385297 [0,0,0,0,0,1|2,0,1]=4 1930 B7R1.3 NC1CCCCC1 Amb17837163 [0,0,0,0,0,1|2,0,1]=4 1931 B7R1.3 NC1CCCCC1 Amb20246801 [0,0,0,0,0,1|2,0,1]=4 1932 B7R1.3 NC1CCCCC1 Amb22350215 [0,0,0,0,0,1|2,0,1]=4 1933 B7R1.3 NC1CCCCC1 Amb22352716 [0,0,0,0,0,1|2,0,1]=4 1934 B7R1.3 NC1CCCCN1 Amb16233706 [0,0,0,0,0,1|2,0,1]=4 1935 B7R1.3 NC1CCCCN1 Amb22491043 [0,0,0,0,0,1|2,0,1]=4 1936 B7R1.3 NC1CCCCO1 Amb25137158 [0,0,0,0,0,1|1,0,1]=3 1937 B7R1.3 NC1CCCOC1 Amb1091859 [0,0,0,0,0,1|1,0,1]=3 1938 B7R1.3 NC1CCCSC1 Amb13953228 [0,0,0,0,0,1|1,1,1]=4 1939 B7R1.3 NC1CCNCC1 Amb17943826 [0,0,0,0,0,1|2,0,1]=4 1940 B7R1.3 NC1CCNCC1 Amb20620337 [0,0,0,0,0,1|2,0,1]=4 1941 B7R1.3 NC1CCNCN1 Amb24095692 [0,0,0,0,0,1|2,0,1]=4 1942 B7R1.3 NC1CCOCC1 Amb10069117 [0,0,0,0,0,1|2,0,1]=4 1943 B7R1.3 NC1CCOCC1 Amb1102242 [0,0,0,0,0,1|2,0,1]=4 1944 B7R1.3 NC1CCSCC1 Amb13952147 [0,0,0,0,0,1|2,0,1]=4 1945 B7R1.3 NC1CNCCN1 Amb22228552 [0,0,0,0,0,1|2,0,1]=4 1946 B7R1.3 NC1COCCC1 Amb19889218 [0,0,0,0,0,1|1,0,1]=3 1947 B7R1.3 NC1NCCCN1 Amb24086916 [0,0,0,0,0,1|2,0,1]=4 1948 B7R1.3 NC=1NCCCN1 Amb18278170 [0,0,0,0,0,1|2,0,0]=3 1949 B7R1.3 NN1CCNCC1 Amb10071260 [0,0,0,0,0,1|3,0,0]=4 1950 B7R1.3 NN1CCOCC1 Amb22450064 [0,0,0,0,0,1|3,0,0]=4 1951 B7R1.3 NN1CCOCC1 Amb24066189 [0,0,0,0,0,1|3,0,0]=4 1952 B7R1.3 NN1CCSCC1 Amb18641480 [0,0,0,0,0,1|3,0,0]=4 1953 B7R1.3 NN1COCCC1 Amb24333890 [0,0,0,0,0,1|2,0,0]=3 1954 B7R1.3 N[C@@H]1CCCC=C1 Amb22799885 [0,0,0,0,0,1|2,0,1]=4 1955 B7R1.3 N[C@@H]1CCCCO1 Amb25146492 [0,0,0,0,0,1|1,0,1]=3 1956 B7R1.3 N[C@@H]1CCCNC1 Amb16233705 [0,0,0,0,0,1|2,0,1]=4 1957 B7R1.3 N[C@@H]1CNCCC1 Amb22756860 [0,0,0,0,0,1|2,0,1]=4 1958 B7R1.3 N[C@@H]1COCCC1 Amb19516313 [0,0,0,0,0,1|1,0,1]=3 1959 B7R1.3 N[C@@H]1COCCC1 Amb20241266 [0,0,0,0,0,1|1,0,1]=3 1960 B7R1.3 N[C@@H]1COCCN1 Amb22747393 [0,0,0,0,0,1|2,0,1]=4 1961 B7R1.3 N[C@H]1CCCC=C1 Amb24640515 [0,0,0,0,0,1|2,0,1]=4 1962 B7R1.3 N[C@H]1CCCNC1 Amb17134809 [0,0,0,0,0,1|2,0,1]=4 1963 B7R1.3 N[C@H]1COCCC1 Amb19516292 [0,0,0,0,0,1|1,0,1]=3 1964 B7R1.3 N[C@H]1COCCC1 Amb20241267 [0,0,0,0,0,1|1,0,1]=3 1965 B7R1.3 O=C1C=CC=CO1 Amb21951679 [0,0,0,0,0,1|0,0,3]=4 1966 B7R1.3 O=C1C=CCC=C1 Amb24708511 [0,0,0,0,0,1|1,0,2]=4 1967 B7R1.3 O=C1C=CCC=N1 Amb24076140 [0,0,0,0,0,1|1,0,2]=4 1968 B7R1.3 O=C1C=CCCN1 Amb22001783 [0,0,0,0,0,1|1,0,1]=3 1969 B7R1.3 O=C1C=COCN1 Amb24065292 [0,0,0,0,0,1|1,0,2]=4 1970 B7R1.3 O=C1C=NCN=C1 Amb24093693 [0,0,0,0,0,1|2,0,1]=4 1971 B7R1.3 O=C1CC=CCC1 Amb22365196 [0,0,0,0,0,1|1,0,1]=3 1972 B7R1.3 O=C1CC=CCN1 Amb24697654 [0,0,0,0,0,1|1,0,1]=3 1973 B7R1.3 O=C1CC=CNC1 Amb25190066 [0,0,0,0,0,1|1,0,2]=4 1974 B7R1.3 O=C1CC=NC=N1 Amb10601894 [0,0,0,0,0,1|1,0,2]=4 1975 B7R1.3 O=C1CCCC=C1 Amb17843126 [0,0,0,0,0,1|1,0,0]=2 1976 B7R1.3 O=C1CCCCS1 Amb25186924 [0,0,0,0,0,1|0,1,0]=2 1977 B7R1.3 O=C1CCCNC1 Amb10070944 [0,0,0,0,0,1|1,0,0]=2 1978 B7R1.3 O=C1CCCNC1 Amb10602349 [0,0,0,0,0,1|1,0,0]=2 1979 B7R1.3 O=C1CCCNN1 Amb18061622 [0,0,0,0,0,1|1,0,0]=2 1980 B7R1.3 O=C1CCCSC1 Amb13952257 [0,0,0,0,0,1|0,1,0]=2 1981 B7R1.3 O=C1CCOC=C1 Amb22000873 [0,0,0,0,0,1|1,0,1]=3 1982 B7R1.3 O=C1CCSC=C1 Amb25375022 [0,0,0,0,0,1|1,0,1]=3 1983 B7R1.3 O=C1CCSCC1 Amb1154265 [0,0,0,0,0,1|1,0,0]=2 1984 B7R1.3 O=C1CCSCN1 Amb24479868 [0,0,0,0,0,1|1,0,0]=2 1985 B7R1.3 O=C1CN=CN=C1 Amb24093715 [0,0,0,0,0,1|2,0,1]=4 1986 B7R1.3 O=C1CNCCC1 Amb19958010 [0,0,0,0,0,1|1,0,0]=2 1987 B7R1.3 O=C1CNCCO1 Amb19958702 [0,0,0,0,0,1|0,0,0]=1 1988 B7R1.3 O=C1CNCNC1 Amb24479362 [0,0,0,0,0,1|2,0,0]=3 1989 B7R1.3 O=C1COCC=C1 Amb22234519 [0,0,0,0,0,1|0,0,2]=3 1990 B7R1.3 O=C1COCCC1 Amb19373430 [0,0,0,0,0,1|0,0,0]=1 1991 B7R1.3 O=C1COCCN1 Amb15691115 [0,0,0,0,0,1|1,0,0]=2 1992 B7R1.3 O=C1COCCO1 Amb17933352 [0,0,0,0,0,1|0,0,0]=1 1993 B7R1.3 O=C1COCOC1 Amb25319015 [0,0,0,0,0,1|1,0,0]=2 1994 B7R1.3 O=C1CSCCS1 Amb24539369 [0,0,0,0,0,1|0,1,0]=2 1995 B7R1.3 O=C1CSCSC1 Amb19148039 [0,0,0,0,0,1|1,1,0]=3 1996 B7R1.3 O=C1CSSCC1 Amb25718327 [0,0,0,0,0,1|1,1,0]=3 1997 B7R1.3 O=C1NCC=NN1 Amb25806617 [0,0,0,0,0,1|2,0,1]=4 1998 B7R1.3 O=C1NCCC=N1 Amb24480889 [0,0,0,0,0,1|1,0,1]=3 1999 B7R1.3 O=C1NCCCO1 Amb10608499 [0,0,0,0,0,1|0,0,0]=1 2000 B7R1.3 O=C1NCCCS1 Amb24117134 [0,0,0,0,0,1|0,1,0]=2 2001 B7R1.3 O=C1NCN=CN1 Amb24762961 [0,0,0,0,0,1|2,0,1]=4 2002 B7R1.3 O=C1NCNCN1 Amb25146452 [0,0,0,0,0,1|2,0,0]=3 2003 B7R1.3 O=C1NCOCN1 Amb24561653 [0,0,0,0,0,1|2,0,0]=3 2004 B7R1.3 O=C1NCSCN1 Amb24480692 [0,0,0,0,0,1|2,0,0]=3 2005 B7R1.3 O=C1OCCC=C1 Amb15693457 [0,0,0,0,0,1|0,0,1]=2 2006 B7R1.3 O=S1CCNCC1 Amb18943760 [0,0,0,0,0,1|2,0,0]=3 2007 B7R1.3 O=S1CCSCC1 Amb25679286 [0,0,0,0,0,1|2,0,0]=3 2008 B7R1.3 O=S1OCCCO1 Amb20240777 [0,0,0,0,0,1|1,0,0]=2 2009 B7R1.3 O=[13C]1CCCCC1 Amb22367406 [0,0,0,0,0,1|1,0,0]=2 2010 B7R1.3 OC1=CCNCN1 Amb24607917 [0,0,0,0,0,1|1,0,2]=4 2011 B7R1.3 OC1C=CCCO1 Amb24526044 [0,0,0,0,0,1|0,0,3]=4 2012 B7R1.3 OC1CCCCN1 Amb20247437 [0,0,0,0,0,1|1,0,2]=4 2013 B7R1.3 OC1CCCCS1 Amb17615672 [0,0,0,0,0,1|0,1,2]=4 2014 B7R1.3 OC1CCCOC1 Amb16192108 [0,0,0,0,0,1|0,0,2]=3 2015 B7R1.3 OC1CCNCC1 Amb1152974 [0,0,0,0,0,1|1,0,2]=4 2016 B7R1.3 OC1CNCCN1 Amb23442001 [0,0,0,0,0,1|1,0,2]=4 2017 B7R1.3 OC1CNCCO1 Amb13883759 [0,0,0,0,0,1|0,0,2]=3 2018 B7R1.3 OC1CNCCO1 Amb22011707 [0,0,0,0,0,1|0,0,2]=3 2019 B7R1.3 OC1COCCO1 Amb24536571 [0,0,0,0,0,1|0,0,2]=3 2020 B7R1.3 OC1COCCS1 Amb24404788 [0,0,0,0,0,1|0,1,2]=4 2021 B7R1.3 OC1CSCCO1 Amb25721431 [0,0,0,0,0,1|0,0,2]=3 2022 B7R1.3 OC1CSCCS1 Amb25333667 [0,0,0,0,0,1|0,1,2]=4 2023 B7R1.3 OC1OCCCO1 Amb24736493 [0,0,0,0,0,1|0,0,2]=3 2024 B7R1.3 OC=1CCN=NC1 Amb22756935 [0,0,0,0,0,1|2,0,1]=4 2025 B7R1.3 OC=1CNCCN1 Amb22330543 [0,0,0,0,0,1|1,0,1]=3 2026 B7R1.3 ON1CCOCC1 Amb25243510 [0,0,0,0,0,1|2,0,1]=4 2027 B7R1.3 O[13CH]1CCCCC1 Amb22336567 [0,0,0,0,0,1|1,0,2]=4 2028 B7R1.3 O[C@@H]1CCCC=C1 Amb10601567 [0,0,0,0,0,1|1,0,2]=4 2029 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [0,0,0,0,0,1|0,0,2]=3 2030 B7R1.3 O[C@@H]1COCCC1 Amb20241306 [0,0,0,0,0,1|0,0,2]=3 2031 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [0,0,0,0,0,1|1,0,2]=4 2032 B7R1.3 O[C@H]1CNCCC1 Amb20241315 [0,0,0,0,0,1|1,0,2]=4 2033 B7R1.3 O[C@H]1CSCCC1 Amb25761109 [0,0,0,0,0,1|0,1,2]=4 2034 B7R1.3 PC1CCCCC1 Amb19889857 [0,0,0,0,0,1|2,0,1]=4 2035 B7R1.3 S=C1CCCCC1 Amb24565839 [0,0,0,0,0,1|1,1,0]=3 2036 B7R1.3 S=C1CNCCC1 Amb24334274 [0,0,0,0,0,1|1,1,0]=3 2037 B7R1.3 S=C1NCCCO1 Amb22524560 [0,0,0,0,0,1|0,1,0]=2 2038 B7R1.3 S=C1NCNCN1 Amb1289820 [0,0,0,0,0,1|2,1,0]=4 2039 B7R1.3 S=C1NNCCN1 Amb24480644 [0,0,0,0,0,1|2,1,0]=4 2040 B7R1.3 SC1=NCCCN1 Amb2537133 [0,0,0,0,0,1|1,1,0]=3 2041 B7R1.3 SC1CCNCC1 Amb17502200 [0,0,0,0,0,1|1,1,1]=4 2042 B7R1.3 SC1CCNCC1 Amb22371055 [0,0,0,0,0,1|1,1,1]=4 2043 B7R1.3 SC1CNCCC1 Amb22371077 [0,0,0,0,0,1|1,1,1]=4 2044 B7R1.3 SC1COCCC1 Amb24066221 [0,0,0,0,0,1|0,1,1]=3 2045 B7R1.3 SC=1NCOCN1 Amb25758682 [0,0,0,0,0,1|2,1,0]=4 2046 B7R1.3 SN1CCCCC1 Amb24479351 [0,0,0,0,0,1|2,1,0]=4 2047 B7R1.3 [BH3-][NH+]1CCNCC1 Amb24478563 [0,0,0,0,0,1|3,0,0]=4 2048 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [0,0,0,0,0,1|2,0,1]=4 2049 B7R1.3 [NH3+]C1CCCCC1 Amb10552681 [0,0,0,0,0,1|2,0,1]=4 2050 B7R1.3 [NH3+]C1CCOCC1 Amb22008598 [0,0,0,0,0,1|2,0,1]=4 2051 B7R1.3 [SiH3]N1CCCCC1 Amb24565228 [0,0,0,0,0,1|3,0,0]=4 2052 B7R1.3 [SiH3]N1CCNCC1 Amb25770236 [0,0,0,0,0,1|3,0,0]=4 2053 B4R0.1 BC(=O)OC Amb22337865 [1,0,1,0,0,0|1,0,0]=3 2054 B4R0.1 BC(=O)OC Amb25199772 [1,0,1,0,0,0|1,0,0]=3 2055 B4R0.1 BCC(C)=O Amb25024392 [1,0,1,0,0,0|1,0,0]=3 2056 B4R0.1 C=CC(O)=O Amb22227738 [1,0,1,0,0,0|0,0,2]=4 2057 B4R0.1 C=CC(O)=O Amb22336305 [1,0,1,0,0,0|0,0,2]=4 2058 B4R0.1 C=CC(O)=O Amb22338581 [1,0,1,0,0,0|0,0,2]=4 2059 B4R0.1 C=CC(O)=O Amb22351186 [1,0,1,0,0,0|0,0,2]=4 2060 B4R0.1 C=CC(O)=O Amb22351399 [1,0,1,0,0,0|0,0,2]=4 2061 B4R0.1 C=CC(O)=O Amb22363130 [1,0,1,0,0,0|0,0,2]=4 2062 B4R0.1 C=C[13C](O)=O Amb22351199 [1,0,1,0,0,0|0,0,2]=4 2063 B4R0.1 CC(=C)CN Amb10071222 [1,0,1,0,0,0|2,0,0]=4 2064 B4R0.1 CC(=C)CN Amb17749039 [1,0,1,0,0,0|2,0,0]=4 2065 B4R0.1 CC(=C)CS Amb19888160 [1,0,1,0,0,0|2,0,0]=4 2066 B4R0.1 CC(=C)C[Pd+] Amb22729504 [1,0,1,0,0,0|2,0,0]=4 2067 B4R0.1 CC(=N)CO Amb24478077 [1,0,1,0,0,0|2,0,0]=4 2068 B4R0.1 CC(=O)C#N Amb17231798 [1,0,1,0,0,0|1,0,1]=4 2069 B4R0.1 CC(=O)CI Amb22831972 [1,0,1,0,0,0|1,0,0]=3 2070 B4R0.1 CC(=O)CN Amb10603379 [1,0,1,0,0,0|1,0,0]=3 2071 B4R0.1 CC(=O)CN Amb22489444 [1,0,1,0,0,0|1,0,0]=3 2072 B4R0.1 CC(=O)CO Amb2404925 [1,0,1,0,0,0|1,0,0]=3 2073 B4R0.1 CC(=O)CS Amb19148935 [1,0,1,0,0,0|1,0,0]=3 2074 B4R0.1 CC(=O)N=O Amb25745528 [1,0,1,0,0,0|2,0,0]=4 2075 B4R0.1 CC(=O)NBr Amb17672559 [1,0,1,0,0,0|2,0,0]=4 2076 B4R0.1 CC(=O)NCl Amb17939326 [1,0,1,0,0,0|2,0,0]=4 2077 B4R0.1 CC(=O)NN Amb1153969 [1,0,1,0,0,0|2,0,0]=4 2078 B4R0.1 CC(=O)N[SiH3] Amb25746995 [1,0,1,0,0,0|1,1,0]=4 2079 B4R0.1 CC(=O)OS Amb22168358 [1,0,1,0,0,0|1,0,0]=3 2080 B4R0.1 CC(=O)O[Hg] Amb22732602 [1,0,1,0,0,0|1,0,0]=3 2081 B4R0.1 CC(=S)CBr Amb24358071 [1,0,1,0,0,0|1,1,0]=4 2082 B4R0.1 CC(=S)CCl Amb24476902 [1,0,1,0,0,0|1,1,0]=4 2083 B4R0.1 CCC(=C)Br Amb22052658 [1,0,1,0,0,0|1,0,1]=4 2084 B4R0.1 CCC(=C)C Amb10069004 [1,0,1,0,0,0|1,0,0]=3 2085 B4R0.1 CCC(=C)Cl Amb22228725 [1,0,1,0,0,0|1,0,1]=4 2086 B4R0.1 CCC(=C)O Amb22338693 [1,0,1,0,0,0|1,0,0]=3 2087 B4R0.1 CCC(=O)Cl Amb22338551 [1,0,1,0,0,0|1,0,0]=3 2088 B4R0.1 CCC(=O)F Amb10839798 [1,0,1,0,0,0|1,0,0]=3 2089 B4R0.1 CCC(=S)N Amb1114671 [1,0,1,0,0,0|1,1,0]=4 2090 B4R0.1 CCC(C)F Amb22008012 [1,0,1,0,0,0|1,0,1]=4 2091 B4R0.1 CCC(C)[Mg+] Amb24325479 [1,0,1,0,0,0|1,0,1]=4 2092 B4R0.1 CCC(C)[Zn+] Amb22228696 [1,0,1,0,0,0|1,0,1]=4 2093 B4R0.1 CCC(N)O Amb25076743 [1,0,1,0,0,0|1,0,1]=4 2094 B4R0.1 CCC(O)=O Amb22363268 [1,0,1,0,0,0|0,0,0]=2 2095 B4R0.1 CCC(O)Br Amb25045070 [1,0,1,0,0,0|1,0,1]=4 2096 B4R0.1 CCC(O)Cl Amb24390895 [1,0,1,0,0,0|1,0,1]=4 2097 B4R0.1 CCC(O)S Amb25057963 [1,0,1,0,0,0|0,1,1]=4 2098 B4R0.1 CCC(S)=S Amb25219037 [1,0,1,0,0,0|0,2,0]=4 2099 B4R0.1 CCC([O-])=O Amb17942918 [1,0,1,0,0,0|0,0,1]=3 2100 B4R0.1 CCC([O-])=O Amb22043363 [1,0,1,0,0,0|0,0,1]=3 2101 B4R0.1 CCC([O-])=O Amb22053980 [1,0,1,0,0,0|0,0,1]=3 2102 B4R0.1 CCC([O-])=O Amb22353324 [1,0,1,0,0,0|0,0,1]=3 2103 B4R0.1 CCC([O-])=O Amb22730265 [1,0,1,0,0,0|0,0,1]=3 2104 B4R0.1 CCC([O-])=O Amb22731204 [1,0,1,0,0,0|0,0,1]=3 2105 B4R0.1 CCC([O-])=O Amb22732964 [1,0,1,0,0,0|0,0,1]=3 2106 B4R0.1 CCC([O-])=O Amb22733966 [1,0,1,0,0,0|0,0,1]=3 2107 B4R0.1 CCI(=O)=O Amb25809920 [1,0,1,0,0,0|1,0,1]=4 2108 B4R0.1 CCN(C)C Amb22337954 [1,0,1,0,0,0|2,0,0]=4 2109 B4R0.1 CCN(C)N Amb19664241 [1,0,1,0,0,0|2,0,0]=4 2110 B4R0.1 CCN(C)O Amb25746619 [1,0,1,0,0,0|1,0,1]=4 2111 B4R0.1 CCS(=O)Cl Amb24647938 [1,0,1,0,0,0|2,0,0]=4 2112 B4R0.1 CCS(C)=O Amb25301908 [1,0,1,0,0,0|1,0,0]=3 2113 B4R0.1 CCS(N)=O Amb24734600 [1,0,1,0,0,0|2,0,0]=4 2114 B4R0.1 CCS(O)=O Amb24332177 [1,0,1,0,0,0|1,0,0]=3 2115 B4R0.1 CCS([O-])=O Amb17943109 [1,0,1,0,0,0|1,0,1]=4 2116 B4R0.1 CCS([O-])=O Amb22411287 [1,0,1,0,0,0|1,0,1]=4 2117 B4R0.1 CC[13C](O)=O Amb22336570 [1,0,1,0,0,0|0,0,0]=2 2118 B4R0.1 CC[13C](O)=O Amb22732548 [1,0,1,0,0,0|0,0,0]=2 2119 B4R0.1 CC[13C]([O-])=O Amb22363364 [1,0,1,0,0,0|0,0,1]=3 2120 B4R0.1 CC[C@@H](C)Br Amb25809928 [1,0,1,0,0,0|1,0,1]=4 2121 B4R0.1 CC[C@@H](C)I Amb25110237 [1,0,1,0,0,0|1,0,1]=4 2122 B4R0.1 CC[C@@H](C)N Amb22225170 [1,0,1,0,0,0|1,0,1]=4 2123 B4R0.1 CC[C@@H](N)O Amb25824305 [1,0,1,0,0,0|1,0,1]=4 2124 B4R0.1 CC[C@H](C)Cl Amb25689589 [1,0,1,0,0,0|1,0,1]=4 2125 B4R0.1 CC[C@H](C)I Amb24426180 [1,0,1,0,0,0|1,0,1]=4 2126 B4R0.1 CC[C@H](C)N Amb19889468 [1,0,1,0,0,0|1,0,1]=4 2127 B4R0.1 CC[C@H](C)S Amb25775158 [1,0,1,0,0,0|0,1,1]=4 2128 B4R0.1 CC[SiH](C)C Amb19893872 [1,0,1,0,0,0|1,1,0]=4 2129 B4R0.1 CN=C(C)C Amb24449148 [1,0,1,0,0,0|2,0,0]=4 2130 B4R0.1 CNC(=O)Br Amb25764660 [1,0,1,0,0,0|2,0,0]=4 2131 B4R0.1 CNC(=O)N Amb1152075 [1,0,1,0,0,0|2,0,0]=4 2132 B4R0.1 CNC(C)=S Amb23590663 [1,0,1,0,0,0|1,1,0]=4 2133 B4R0.1 CNC(Cl)=O Amb17942998 [1,0,1,0,0,0|2,0,0]=4 2134 B4R0.1 CNC(N)=O Amb22899158 [1,0,1,0,0,0|2,0,0]=4 2135 B4R0.1 CNC(O)=S Amb25747283 [1,0,1,0,0,0|1,1,0]=4 2136 B4R0.1 CNS(C)=O Amb24626150 [1,0,1,0,0,0|2,0,0]=4 2137 B4R0.1 COC(=N)C Amb10844798 [1,0,1,0,0,0|1,0,0]=3 2138 B4R0.1 COC(=N)N Amb13777319 [1,0,1,0,0,0|2,0,0]=4 2139 B4R0.1 COC(=N)N Amb16232485 [1,0,1,0,0,0|2,0,0]=4 2140 B4R0.1 COC(=N)[NH3+] Amb24113668 [1,0,1,0,0,0|2,0,0]=4 2141 B4R0.1 COC(C)=S Amb23554940 [1,0,1,0,0,0|0,1,0]=3 2142 B4R0.1 COC(C)Br Amb17689405 [1,0,1,0,0,0|1,0,1]=4 2143 B4R0.1 COC(C)C Amb22732422 [1,0,1,0,0,0|1,0,1]=4 2144 B4R0.1 COC(C)Cl Amb17689403 [1,0,1,0,0,0|1,0,1]=4 2145 B4R0.1 COC(C)O Amb24376229 [1,0,1,0,0,0|0,0,2]=4 2146 B4R0.1 COC(N)=N Amb22552499 [1,0,1,0,0,0|2,0,0]=4 2147 B4R0.1 COC(N)=S Amb25067716 [1,0,1,0,0,0|1,1,0]=4 2148 B4R0.1 COC(N)=[NH2+] Amb19957963 [1,0,1,0,0,0|2,0,0]=4 2149 B4R0.1 COC(N)=[NH2+] Amb22733848 [1,0,1,0,0,0|2,0,0]=4 2150 B4R0.1 COC(S)=S Amb22011691 [1,0,1,0,0,0|1,1,0]=4 2151 B4R0.1 COC([O-])=O Amb22731820 [1,0,1,0,0,0|1,0,0]=3 2152 B4R0.1 COC([O-])=O Amb25688001 [1,0,1,0,0,0|1,0,0]=3 2153 B4R0.1 COC([S-])=S Amb19650987 [1,0,1,0,0,0|1,1,0]=4 2154 B4R0.1 COC([S-])=S Amb20527632 [1,0,1,0,0,0|1,1,0]=4 2155 B4R0.1 CON(C)C Amb22732357 [1,0,1,0,0,0|2,0,0]=4 2156 B4R0.1 COP(C)=O Amb25278680 [1,0,1,0,0,0|1,0,0]=3 2157 B4R0.1 COP(C)O Amb24410264 [1,0,1,0,0,0|1,0,1]=4 2158 B4R0.1 CO[13C](N)=N Amb22367018 [1,0,1,0,0,0|2,0,0]=4 2159 B4R0.1 CO[N+]([O-])=O Amb17938647 [1,0,1,0,0,0|2,0,0]=4 2160 B4R0.1 CO[S+](C)C Amb25025830 [1,0,1,0,0,0|2,0,0]=4 2161 B4R0.1 CO[SiH](C)C Amb19893837 [1,0,1,0,0,0|1,1,0]=4 2162 B4R0.1 CS(=O)CBr Amb24476829 [1,0,1,0,0,0|2,0,0]=4 2163 B4R0.1 CS(=O)C[Na] Amb25809809 [1,0,1,0,0,0|2,0,0]=4 2164 B4R0.1 CSC(=O)Cl Amb22336225 [1,0,1,0,0,0|1,1,0]=4 2165 B4R0.1 CSC(C)=O Amb22043188 [1,0,1,0,0,0|0,1,0]=3 2166 B4R0.1 CSC(N)=O Amb25082577 [1,0,1,0,0,0|1,1,0]=4 2167 B4R0.1 CSS(C)=O Amb25786159 [1,0,1,0,0,0|1,1,0]=4 2168 B4R0.1 C[13CH2]C([O-])=O Amb22368991 [1,0,1,0,0,0|0,0,1]=3 2169 B4R0.1 C[13CH2][13C]([O-])=O Amb22338749 [1,0,1,0,0,0|0,0,1]=3 2170 B4R0.1 C[14C](=O)O[Na] Amb22350228 [1,0,1,0,0,0|1,0,0]=3 2171 B4R0.1 C\C=C(/C)\Br Amb21953703 [1,0,1,0,0,0|1,0,1]=4 2172 B4R0.1 C\C=C(/C)\Cl Amb25025045 [1,0,1,0,0,0|1,0,1]=4 2173 B4R0.1 C\C=C(\C)/Br Amb20001493 [1,0,1,0,0,0|1,0,1]=4 2174 B4R0.1 C\C=C(\C)/Cl Amb22731715 [1,0,1,0,0,0|1,0,1]=4 2175 B4R0.1 FC(=O)CCl Amb10839258 [1,0,1,0,0,0|2,0,0]=4 2176 B4R0.1 FCC(=O)Cl Amb16185604 [1,0,1,0,0,0|2,0,0]=4 2177 B4R0.1 NC(=O)CCl Amb1933827 [1,0,1,0,0,0|2,0,0]=4 2178 B4R0.1 NC(=O)CCl Amb20620153 [1,0,1,0,0,0|2,0,0]=4 2179 B4R0.1 NC(=O)CN Amb22234569 [1,0,1,0,0,0|2,0,0]=4 2180 B4R0.1 NC(=O)CO Amb1804460 [1,0,1,0,0,0|2,0,0]=4 2181 B4R0.1 NCC(=O)N Amb10604177 [1,0,1,0,0,0|2,0,0]=4 2182 B4R0.1 NCC(=O)S Amb17593043 [1,0,1,0,0,0|1,1,0]=4 2183 B4R0.1 NCC(O)=O Amb22274145 [1,0,1,0,0,0|1,0,0]=3 2184 B4R0.1 NCC(O)=O Amb22731925 [1,0,1,0,0,0|1,0,0]=3 2185 B4R0.1 NCC([O-])=O Amb20240906 [1,0,1,0,0,0|1,0,1]=4 2186 B4R0.1 NCC([O-])=O Amb21962917 [1,0,1,0,0,0|1,0,1]=4 2187 B4R0.1 NCC([O-])=O Amb22167467 [1,0,1,0,0,0|1,0,1]=4 2188 B4R0.1 NCC([O-])=O Amb22167948 [1,0,1,0,0,0|1,0,1]=4 2189 B4R0.1 NCC([O-])=O Amb22336294 [1,0,1,0,0,0|1,0,1]=4 2190 B4R0.1 NCC([O-])=O Amb22493796 [1,0,1,0,0,0|1,0,1]=4 2191 B4R0.1 NCC([O-])=O Amb22729954 [1,0,1,0,0,0|1,0,1]=4 2192 B4R0.1 NCC([O-])=O Amb22729967 [1,0,1,0,0,0|1,0,1]=4 2193 B4R0.1 NCC([O-])=O Amb22733691 [1,0,1,0,0,0|1,0,1]=4 2194 B4R0.1 NC[13C](O)=O Amb22354047 [1,0,1,0,0,0|1,0,0]=3 2195 B4R0.1 N[13CH2]C(O)=O Amb22363299 [1,0,1,0,0,0|1,0,0]=3 2196 B4R0.1 N[13CH2][13C](O)=O Amb22351252 [1,0,1,0,0,0|1,0,0]=3 2197 B4R0.1 O=C(Cl)CI Amb22045163 [1,0,1,0,0,0|2,0,0]=4 2198 B4R0.1 O=C(F)CF Amb24476837 [1,0,1,0,0,0|2,0,0]=4 2199 B4R0.1 O=C(P)CCl Amb24377624 [1,0,1,0,0,0|2,0,0]=4 2200 B4R0.1 OC(=O)CI Amb1916034 [1,0,1,0,0,0|1,0,0]=3 2201 B4R0.1 OC(=O)CI Amb22274295 [1,0,1,0,0,0|1,0,0]=3 2202 B4R0.1 OC(=O)CI Amb22353096 [1,0,1,0,0,0|1,0,0]=3 2203 B4R0.1 OC(=O)CO Amb22338156 [1,0,1,0,0,0|1,0,0]=3 2204 B4R0.1 OC(=O)CP Amb24476887 [1,0,1,0,0,0|1,0,0]=3 2205 B4R0.1 OC(=O)CS Amb22360787 [1,0,1,0,0,0|1,0,0]=3 2206 B4R0.1 OC(=O)CS Amb24323537 [1,0,1,0,0,0|1,0,0]=3 2207 B4R0.1 OC(=O)O[Na] Amb22411585 [1,0,1,0,0,0|2,0,0]=4 2208 B4R0.1 OC(=O)[13CH2]Br Amb22363172 [1,0,1,0,0,0|1,0,0]=3 2209 B4R0.1 OC(=O)[13CH2]Cl Amb22351601 [1,0,1,0,0,0|1,0,0]=3 2210 B4R0.1 OC(=O)[13CH2]I Amb22367368 [1,0,1,0,0,0|1,0,0]=3 2211 B4R0.1 OC(=S)CCl Amb25064312 [1,0,1,0,0,0|1,1,0]=4 2212 B4R0.1 OC(=[18O])CBr Amb22367291 [1,0,1,0,0,0|1,0,0]=3 2213 B4R0.1 OCC(=O)Cl Amb25121296 [1,0,1,0,0,0|2,0,0]=4 2214 B4R0.1 OCC(O)=S Amb25245907 [1,0,1,0,0,0|1,1,0]=4 2215 B4R0.1 OCP(=O)O Amb1981423 [1,0,1,0,0,0|2,0,0]=4 2216 B4R0.1 O[13CH2][13C](O)=O Amb22055344 [1,0,1,0,0,0|1,0,0]=3 2217 B4R0.1 O[13C](=O)CBr Amb22351346 [1,0,1,0,0,0|1,0,0]=3 2218 B4R0.1 O[13C](=O)CCl Amb22351545 [1,0,1,0,0,0|1,0,0]=3 2219 B4R0.1 O[13C](=O)CI Amb22367367 [1,0,1,0,0,0|1,0,0]=3 2220 B4R0.1 O[13C](=O)[13CH2]Br Amb22351322 [1,0,1,0,0,0|1,0,0]=3 2221 B4R0.1 O[13C](=O)[13CH2]Cl Amb17610796 [1,0,1,0,0,0|1,0,0]=3 2222 B4R0.1 O[13C](=O)[13CH2]I Amb22367449 [1,0,1,0,0,0|1,0,0]=3 2223 B4R0.1 O[13C](=O)[13CH]=O Amb22055361 [1,0,1,0,0,0|1,0,1]=4 2224 B4R0.1 O[13C](=O)[13CH]=[13CH2] Amb17607705 [1,0,1,0,0,0|0,0,2]=4 2225 B4R0.1 O[13C](=[18O])CBr Amb22337237 [1,0,1,0,0,0|1,0,0]=3 2226 B4R0.1 O[14C](=O)CBr Amb22731740 [1,0,1,0,0,0|1,0,0]=3 2227 B4R0.1 O[14C](=O)O[Na] Amb22350243 [1,0,1,0,0,0|2,0,0]=4 2228 B4R0.1 [13CH3]CC([O-])=O Amb22336277 [1,0,1,0,0,0|0,0,1]=3 2229 B4R0.1 [13CH3][13CH2]C(O)=O Amb22337241 [1,0,1,0,0,0|0,0,0]=2 2230 B4R0.1 [13CH3][13CH2][13C](O)=O Amb22367502 [1,0,1,0,0,0|0,0,0]=2 2231 B4R0.1 [14CH3]C(=O)O[Na] Amb22349811 [1,0,1,0,0,0|1,0,0]=3 2232 B4R0.1 [15NH2]C(=O)CI Amb22367467 [1,0,1,0,0,0|2,0,0]=4 2233 B4R0.1 [15NH2]CC(O)=O Amb22337980 [1,0,1,0,0,0|1,0,0]=3 2234 B4R0.1 [15NH2]C[13C](O)=O Amb22367030 [1,0,1,0,0,0|1,0,0]=3 2235 B4R0.1 [15NH2][13CH2]C(O)=O Amb22353332 [1,0,1,0,0,0|1,0,0]=3 2236 B4R0.1 [15NH2][13CH2][13C](O)=O Amb22055358 [1,0,1,0,0,0|1,0,0]=3 2237 B4R0.1 [2H]C(=O)O[Na] Amb22336426 [1,0,1,0,0,0|2,0,0]=4 2238 B4R0.1 [BH3-]OC(C)=O Amb24625387 [1,0,1,0,0,0|1,0,0]=3 2239 B4R0.1 [Na]OC(=O)C Amb10552368 [1,0,1,0,0,0|1,0,0]=3 2240 B4R0.1 [O-]C(=O)CBr Amb22049507 [1,0,1,0,0,0|1,0,1]=4 2241 B4R0.1 [O-]C(=O)CC Amb10844614 [1,0,1,0,0,0|0,0,1]=3 2242 B4R0.1 [O-]C(=O)CCl Amb22330602 [1,0,1,0,0,0|1,0,1]=4 2243 B4R0.1 [O-]C(=O)CF Amb10840933 [1,0,1,0,0,0|1,0,1]=4 2244 B4R0.1 [O-]C(=O)CF Amb22230760 [1,0,1,0,0,0|1,0,1]=4 2245 B4R0.1 [O-]C(=O)CF Amb22730747 [1,0,1,0,0,0|1,0,1]=4 2246 B4R0.1 [O-]C(=O)CI Amb22229643 [1,0,1,0,0,0|1,0,1]=4 2247 B4R0.1 [O-]C(=O)CO Amb22045509 [1,0,1,0,0,0|1,0,1]=4 2248 B4R0.1 [O-]C(=O)CO Amb22730982 [1,0,1,0,0,0|1,0,1]=4 2249 B4R0.1 [O-]CC([O-])=O Amb22739620 [1,0,1,0,0,0|1,0,1]=4 2250 B4R0.1 [O-]OC([O-])=O Amb20240923 [1,0,1,0,0,0|2,0,0]=4 2251 B4R0.2 BrCCCI Amb18090828 [1,0,1,0,0,0|2,0,0]=4 2252 B4R0.2 BrC[13CH2]CBr Amb22367401 [1,0,1,0,0,0|2,0,0]=4 2253 B4R0.2 Br[13CH2]C[13CH2]Br Amb22353660 [1,0,1,0,0,0|2,0,0]=4 2254 B4R0.2 C#CCC=O Amb25681696 [1,0,1,0,0,0|0,0,2]=4 2255 B4R0.2 C=CCC=O Amb25058716 [1,0,1,0,0,0|0,0,2]=4 2256 B4R0.2 C=CCCCl Amb22229725 [1,0,1,0,0,0|1,0,1]=4 2257 B4R0.2 C=CCCI Amb24079603 [1,0,1,0,0,0|1,0,1]=4 2258 B4R0.2 C=CCCS Amb24117955 [1,0,1,0,0,0|0,1,1]=4 2259 B4R0.2 C=COC=O Amb22734253 [1,0,1,0,0,0|0,0,2]=4 2260 B4R0.2 C=COCI Amb24470182 [1,0,1,0,0,0|1,0,1]=4 2261 B4R0.2 CC#CC=O Amb24477088 [1,0,1,0,0,0|0,0,2]=4 2262 B4R0.2 CC=C=CC Amb17670597 [1,0,1,0,0,0|1,0,1]=4 2263 B4R0.2 CC=COC Amb22552518 [1,0,1,0,0,0|0,0,1]=3 2264 B4R0.2 CCBCC Amb24425029 [1,0,1,0,0,0|1,0,1]=4 2265 B4R0.2 CCC#CO Amb22492573 [1,0,1,0,0,0|0,0,2]=4 2266 B4R0.2 CCC=C=C Amb10565985 [1,0,1,0,0,0|1,0,1]=4 2267 B4R0.2 CCC=CCl Amb22227554 [1,0,1,0,0,0|1,0,1]=4 2268 B4R0.2 CCC=NN Amb25114077 [1,0,1,0,0,0|2,0,0]=4 2269 B4R0.2 CCC=NO Amb24369620 [1,0,1,0,0,0|1,0,1]=4 2270 B4R0.2 CCC=[N+]=[N-] Amb25326268 [1,0,1,0,0,0|2,0,0]=4 2271 B4R0.2 CCCCN Amb22002333 [1,0,1,0,0,0|1,0,1]=4 2272 B4R0.2 CCCCN Amb24325127 [1,0,1,0,0,0|1,0,1]=4 2273 B4R0.2 CCCCN Amb24325258 [1,0,1,0,0,0|1,0,1]=4 2274 B4R0.2 CCCCO Amb22336484 [1,0,1,0,0,0|0,0,1]=3 2275 B4R0.2 CCCCO Amb22338139 [1,0,1,0,0,0|0,0,1]=3 2276 B4R0.2 CCCCO Amb22338167 [1,0,1,0,0,0|0,0,1]=3 2277 B4R0.2 CCCCO Amb22351678 [1,0,1,0,0,0|0,0,1]=3 2278 B4R0.2 CCCCP Amb24334197 [1,0,1,0,0,0|1,0,1]=4 2279 B4R0.2 CCCCS Amb22367090 [1,0,1,0,0,0|0,1,1]=4 2280 B4R0.2 CCCC[*] Amb24270972 [1,0,1,0,0,0|1,0,1]=4 2281 B4R0.2 CCCC[Mg+] Amb22045798 [1,0,1,0,0,0|1,0,1]=4 2282 B4R0.2 CCCC[NH3+] Amb22366025 [1,0,1,0,0,0|1,0,1]=4 2283 B4R0.2 CCCC[O-] Amb17940588 [1,0,1,0,0,0|0,0,2]=4 2284 B4R0.2 CCCC[O-] Amb22045714 [1,0,1,0,0,0|0,0,2]=4 2285 B4R0.2 CCCC[O-] Amb22047270 [1,0,1,0,0,0|0,0,2]=4 2286 B4R0.2 CCCC[O-] Amb22052429 [1,0,1,0,0,0|0,0,2]=4 2287 B4R0.2 CCCC[O-] Amb22053566 [1,0,1,0,0,0|0,0,2]=4 2288 B4R0.2 CCCC[O-] Amb22053645 [1,0,1,0,0,0|0,0,2]=4 2289 B4R0.2 CCCC[O-] Amb22053708 [1,0,1,0,0,0|0,0,2]=4 2290 B4R0.2 CCCC[SiH3] Amb19883792 [1,0,1,0,0,0|1,0,1]=4 2291 B4R0.2 CCCC[Sn+3] Amb22053676 [1,0,1,0,0,0|1,0,1]=4 2292 B4R0.2 CCCC[Zn+] Amb22230365 [1,0,1,0,0,0|1,0,1]=4 2293 B4R0.2 CCCNC Amb1125050 [1,0,1,0,0,0|1,0,1]=4 2294 B4R0.2 CCCNC Amb13951517 [1,0,1,0,0,0|1,0,1]=4 2295 B4R0.2 CCCNN Amb22490873 [1,0,1,0,0,0|2,0,0]=4 2296 B4R0.2 CCCNO Amb20621997 [1,0,1,0,0,0|1,0,0]=3 2297 B4R0.2 CCCNO Amb24333131 [1,0,1,0,0,0|1,0,0]=3 2298 B4R0.2 CCCOC Amb22227974 [1,0,1,0,0,0|0,0,1]=3 2299 B4R0.2 CCCON Amb21929105 [1,0,1,0,0,0|1,0,0]=3 2300 B4R0.2 CCCO[NH3+] Amb2412392 [1,0,1,0,0,0|1,0,0]=3 2301 B4R0.2 CCCPC Amb24334551 [1,0,1,0,0,0|1,0,1]=4 2302 B4R0.2 CCCSC Amb22045208 [1,0,1,0,0,0|0,1,1]=4 2303 B4R0.2 CCCS[Na] Amb22352940 [1,0,1,0,0,0|1,1,0]=4 2304 B4R0.2 CCC[Hg]Cl Amb22730789 [1,0,1,0,0,0|2,0,0]=4 2305 B4R0.2 CCC[Mg]Br Amb17939070 [1,0,1,0,0,0|2,0,0]=4 2306 B4R0.2 CCC[Mg]Cl Amb22352591 [1,0,1,0,0,0|2,0,0]=4 2307 B4R0.2 CCC[SiH2]C Amb19892273 [1,0,1,0,0,0|1,0,1]=4 2308 B4R0.2 CCC[SiH2]S Amb24349756 [1,0,1,0,0,0|0,2,0]=4 2309 B4R0.2 CCC[Zn]Br Amb22000414 [1,0,1,0,0,0|2,0,0]=4 2310 B4R0.2 CCNC=C Amb24120592 [1,0,1,0,0,0|1,0,1]=4 2311 B4R0.2 CCNC=O Amb22229692 [1,0,1,0,0,0|1,0,0]=3 2312 B4R0.2 CCNC=S Amb24476965 [1,0,1,0,0,0|1,1,0]=4 2313 B4R0.2 CCNCC Amb21520464 [1,0,1,0,0,0|1,0,1]=4 2314 B4R0.2 CCNCC Amb22047271 [1,0,1,0,0,0|1,0,1]=4 2315 B4R0.2 CCNCC Amb22055088 [1,0,1,0,0,0|1,0,1]=4 2316 B4R0.2 CCNCC Amb22230065 [1,0,1,0,0,0|1,0,1]=4 2317 B4R0.2 CCNCC Amb24325405 [1,0,1,0,0,0|1,0,1]=4 2318 B4R0.2 CCNOC Amb25082359 [1,0,1,0,0,0|1,0,0]=3 2319 B4R0.2 CCOC=C Amb2447619 [1,0,1,0,0,0|0,0,1]=3 2320 B4R0.2 CCOC=N Amb22167706 [1,0,1,0,0,0|1,0,0]=3 2321 B4R0.2 CCOCC Amb10807375 [1,0,1,0,0,0|0,0,1]=3 2322 B4R0.2 CCOCC Amb22041346 [1,0,1,0,0,0|0,0,1]=3 2323 B4R0.2 CCOCC Amb22336266 [1,0,1,0,0,0|0,0,1]=3 2324 B4R0.2 CCOCC Amb22366872 [1,0,1,0,0,0|0,0,1]=3 2325 B4R0.2 CCOCC Amb22735021 [1,0,1,0,0,0|0,0,1]=3 2326 B4R0.2 CCOCI Amb25719508 [1,0,1,0,0,0|1,0,1]=4 2327 B4R0.2 CCOCN Amb24629720 [1,0,1,0,0,0|1,0,1]=4 2328 B4R0.2 CCOCO Amb25042105 [1,0,1,0,0,0|0,0,2]=4 2329 B4R0.2 CCOClC Amb25843141 [1,0,1,0,0,0|1,0,0]=3 2330 B4R0.2 CCON=O Amb17938639 [1,0,1,0,0,0|1,0,0]=3 2331 B4R0.2 CCONC Amb22388890 [1,0,1,0,0,0|1,0,0]=3 2332 B4R0.2 CCO[13CH]=O Amb22351501 [1,0,1,0,0,0|0,0,0]=2 2333 B4R0.2 CCPCC Amb19889866 [1,0,1,0,0,0|1,0,1]=4 2334 B4R0.2 CCSC=C Amb10604172 [1,0,1,0,0,0|0,1,1]=4 2335 B4R0.2 CCSCC Amb22002238 [1,0,1,0,0,0|0,1,1]=4 2336 B4R0.2 CC[15NH]CC Amb22351888 [1,0,1,0,0,0|1,0,1]=4 2337 B4R0.2 CC[Al+]CC Amb22053706 [1,0,1,0,0,0|1,0,1]=4 2338 B4R0.2 CC[Al+]CC Amb22053728 [1,0,1,0,0,0|1,0,1]=4 2339 B4R0.2 CC[AsH]CC Amb22734251 [1,0,1,0,0,0|1,0,1]=4 2340 B4R0.2 CC[Cd]CC Amb21520378 [1,0,1,0,0,0|1,0,1]=4 2341 B4R0.2 CC[Ga+]CC Amb22733949 [1,0,1,0,0,0|1,0,1]=4 2342 B4R0.2 CC[GeH2]CC Amb19930259 [1,0,1,0,0,0|1,0,1]=4 2343 B4R0.2 CC[Ge]CC Amb22730158 [1,0,1,0,0,0|1,0,1]=4 2344 B4R0.2 CC[Hg]CC Amb22732529 [1,0,1,0,0,0|1,0,1]=4 2345 B4R0.2 CC[N+]#CC Amb24417208 [1,0,1,0,0,0|1,0,1]=4 2346 B4R0.2 CC[N-]CC Amb22045676 [1,0,1,0,0,0|1,0,1]=4 2347 B4R0.2 CC[N-]CC Amb22045681 [1,0,1,0,0,0|1,0,1]=4 2348 B4R0.2 CC[N-]CC Amb22045887 [1,0,1,0,0,0|1,0,1]=4 2349 B4R0.2 CC[N-]CC Amb22045897 [1,0,1,0,0,0|1,0,1]=4 2350 B4R0.2 CC[N-]CC Amb22732897 [1,0,1,0,0,0|1,0,1]=4 2351 B4R0.2 CC[NH2+]CC Amb17942806 [1,0,1,0,0,0|1,0,1]=4 2352 B4R0.2 CC[NH2+]CC Amb24483037 [1,0,1,0,0,0|1,0,1]=4 2353 B4R0.2 CC[Se]CC Amb22338511 [1,0,1,0,0,0|0,1,1]=4 2354 B4R0.2 CC[SiH2]CC Amb19893778 [1,0,1,0,0,0|1,0,1]=4 2355 B4R0.2 CC[Sn+2]CC Amb22053681 [1,0,1,0,0,0|1,0,1]=4 2356 B4R0.2 CC[Te]CC Amb15692680 [1,0,1,0,0,0|0,1,1]=4 2357 B4R0.2 CC\C=C\Br Amb22002685 [1,0,1,0,0,0|1,0,1]=4 2358 B4R0.2 CC\C=C\Cl Amb25024567 [1,0,1,0,0,0|1,0,1]=4 2359 B4R0.2 CC\C=C\N Amb25188893 [1,0,1,0,0,0|1,0,1]=4 2360 B4R0.2 CC\C=N\O Amb24333315 [1,0,1,0,0,0|1,0,1]=4 2361 B4R0.2 CNCNO Amb24392932 [1,0,1,0,0,0|2,0,0]=4 2362 B4R0.2 CNCOC Amb25026027 [1,0,1,0,0,0|1,0,1]=4 2363 B4R0.2 CNNCC Amb24057116 [1,0,1,0,0,0|2,0,0]=4 2364 B4R0.2 CN\C=N\C Amb10559551 [1,0,1,0,0,0|2,0,0]=4 2365 B4R0.2 COC=C=C Amb17673262 [1,0,1,0,0,0|0,0,2]=4 2366 B4R0.2 COCC=C Amb10070248 [1,0,1,0,0,0|2,0,0]=4 2367 B4R0.2 COCCF Amb24436610 [1,0,1,0,0,0|1,0,1]=4 2368 B4R0.2 COCCI Amb22228848 [1,0,1,0,0,0|1,0,1]=4 2369 B4R0.2 COCCO Amb22338563 [1,0,1,0,0,0|1,0,1]=4 2370 B4R0.2 COCC[O-] Amb22034397 [1,0,1,0,0,0|1,0,1]=4 2371 B4R0.2 COCC[O-] Amb22042733 [1,0,1,0,0,0|1,0,1]=4 2372 B4R0.2 COCC[O-] Amb22045683 [1,0,1,0,0,0|1,0,1]=4 2373 B4R0.2 COCC[O-] Amb22045752 [1,0,1,0,0,0|1,0,1]=4 2374 B4R0.2 COCC[O-] Amb22045812 [1,0,1,0,0,0|1,0,1]=4 2375 B4R0.2 COCC[O-] Amb22045867 [1,0,1,0,0,0|1,0,1]=4 2376 B4R0.2 COCC[O-] Amb22045871 [1,0,1,0,0,0|1,0,1]=4 2377 B4R0.2 COCC[O-] Amb22052469 [1,0,1,0,0,0|1,0,1]=4 2378 B4R0.2 COCC[O-] Amb22729947 [1,0,1,0,0,0|1,0,1]=4 2379 B4R0.2 COCC[O-] Amb22731112 [1,0,1,0,0,0|1,0,1]=4 2380 B4R0.2 COCON Amb22549472 [1,0,1,0,0,0|2,0,0]=4 2381 B4R0.2 CONOC Amb24586447 [1,0,1,0,0,0|2,0,0]=4 2382 B4R0.2 CO[CH+]OC Amb25808602 [1,0,1,0,0,0|1,0,1]=4 2383 B4R0.2 CO[Ca]OC Amb22338443 [1,0,1,0,0,0|2,0,0]=4 2384 B4R0.2 CO[Mg]OC Amb22351773 [1,0,1,0,0,0|2,0,0]=4 2385 B4R0.2 CO[Sn]OC Amb22733664 [1,0,1,0,0,0|2,0,0]=4 2386 B4R0.2 CO\C=C\Cl Amb24696330 [1,0,1,0,0,0|1,0,1]=4 2387 B4R0.2 CSSCC Amb22230676 [1,0,1,0,0,0|1,1,0]=4 2388 B4R0.2 C[Se]CC=C Amb22735092 [1,0,1,0,0,0|2,0,0]=4 2389 B4R0.2 C\C=C/CO Amb24089436 [1,0,1,0,0,0|1,0,1]=4 2390 B4R0.2 C\C=C\CC Amb22730891 [1,0,1,0,0,0|1,0,0]=3 2391 B4R0.2 C\C=C\CN Amb22490422 [1,0,1,0,0,0|2,0,0]=4 2392 B4R0.2 C\C=C\CS Amb24476237 [1,0,1,0,0,0|2,0,0]=4 2393 B4R0.2 C\C=C\OC Amb25747348 [1,0,1,0,0,0|0,0,1]=3 2394 B4R0.2 C\C=N\OC Amb24115747 [1,0,1,0,0,0|1,0,1]=4 2395 B4R0.2 ClCCC=O Amb16233605 [1,0,1,0,0,0|1,0,0]=3 2396 B4R0.2 FCCCBr Amb10845700 [1,0,1,0,0,0|2,0,0]=4 2397 B4R0.2 FCCCF Amb10839359 [1,0,1,0,0,0|2,0,0]=4 2398 B4R0.2 FCCCI Amb10838561 [1,0,1,0,0,0|2,0,0]=4 2399 B4R0.2 NCCC=C Amb10601640 [1,0,1,0,0,0|1,0,1]=4 2400 B4R0.2 NCCC=O Amb24476871 [1,0,1,0,0,0|1,0,0]=3 2401 B4R0.2 NCCCBr Amb22489540 [1,0,1,0,0,0|2,0,0]=4 2402 B4R0.2 NCCCF Amb16186035 [1,0,1,0,0,0|2,0,0]=4 2403 B4R0.2 NCCCF Amb19374917 [1,0,1,0,0,0|2,0,0]=4 2404 B4R0.2 NCCCN Amb21953130 [1,0,1,0,0,0|2,0,0]=4 2405 B4R0.2 NCCCN Amb21953284 [1,0,1,0,0,0|2,0,0]=4 2406 B4R0.2 NCCCN Amb22347967 [1,0,1,0,0,0|2,0,0]=4 2407 B4R0.2 NCCCN Amb22731203 [1,0,1,0,0,0|2,0,0]=4 2408 B4R0.2 NCCCN Amb24325075 [1,0,1,0,0,0|2,0,0]=4 2409 B4R0.2 NCCCN Amb24325119 [1,0,1,0,0,0|2,0,0]=4 2410 B4R0.2 NCCCO Amb22229163 [1,0,1,0,0,0|1,0,0]=3 2411 B4R0.2 NCCCO Amb22350557 [1,0,1,0,0,0|1,0,0]=3 2412 B4R0.2 NCCCP Amb24476866 [1,0,1,0,0,0|2,0,0]=4 2413 B4R0.2 NCCCS Amb17500723 [1,0,1,0,0,0|1,1,0]=4 2414 B4R0.2 NCCCS Amb18368606 [1,0,1,0,0,0|1,1,0]=4 2415 B4R0.2 NCCCS Amb20623313 [1,0,1,0,0,0|1,1,0]=4 2416 B4R0.2 NCCC[*] Amb24270973 [1,0,1,0,0,0|2,0,0]=4 2417 B4R0.2 NCCC[SiH3] Amb24568762 [1,0,1,0,0,0|1,1,0]=4 2418 B4R0.2 NCCNO Amb24476856 [1,0,1,0,0,0|2,0,0]=4 2419 B4R0.2 NCCON Amb19958432 [1,0,1,0,0,0|2,0,0]=4 2420 B4R0.2 NCCON Amb22054301 [1,0,1,0,0,0|2,0,0]=4 2421 B4R0.2 NCCON Amb22233863 [1,0,1,0,0,0|2,0,0]=4 2422 B4R0.2 NCCS=O Amb25826403 [1,0,1,0,0,0|1,1,0]=4 2423 B4R0.2 NCNCO Amb24461606 [1,0,1,0,0,0|2,0,0]=4 2424 B4R0.2 NNCC=O Amb24550561 [1,0,1,0,0,0|2,0,0]=4 2425 B4R0.2 NOCCBr Amb24429982 [1,0,1,0,0,0|2,0,0]=4 2426 B4R0.2 NOCCCl Amb25705610 [1,0,1,0,0,0|2,0,0]=4 2427 B4R0.2 NOCCF Amb22008453 [1,0,1,0,0,0|2,0,0]=4 2428 B4R0.2 NOCCF Amb25858004 [1,0,1,0,0,0|2,0,0]=4 2429 B4R0.2 NOCCO Amb17190317 [1,0,1,0,0,0|2,0,0]=4 2430 B4R0.2 NOCCO Amb22896795 [1,0,1,0,0,0|2,0,0]=4 2431 B4R0.2 NSCCO Amb25025533 [1,0,1,0,0,0|2,0,0]=4 2432 B4R0.2 O=CCCBr Amb18124460 [1,0,1,0,0,0|1,0,0]=3 2433 B4R0.2 O=CCCF Amb21858609 [1,0,1,0,0,0|1,0,0]=3 2434 B4R0.2 O=CCN=O Amb24477338 [1,0,1,0,0,0|1,0,1]=4 2435 B4R0.2 O=CNCCl Amb24613099 [1,0,1,0,0,0|2,0,0]=4 2436 B4R0.2 O=NCCCl Amb25721260 [1,0,1,0,0,0|2,0,0]=4 2437 B4R0.2 OCC=C=C Amb17673299 [1,0,1,0,0,0|0,0,2]=4 2438 B4R0.2 OCCC=O Amb24412391 [1,0,1,0,0,0|0,0,0]=2 2439 B4R0.2 OCCCO Amb22369724 [1,0,1,0,0,0|0,0,1]=3 2440 B4R0.2 OCCCO Amb22733136 [1,0,1,0,0,0|0,0,1]=3 2441 B4R0.2 OCCNO Amb24477455 [1,0,1,0,0,0|1,0,1]=4 2442 B4R0.2 OCCNS Amb24478081 [1,0,1,0,0,0|1,1,0]=4 2443 B4R0.2 OCCSO Amb25840750 [1,0,1,0,0,0|1,0,1]=4 2444 B4R0.2 OCCSS Amb25058419 [1,0,1,0,0,0|1,1,0]=4 2445 B4R0.2 OCNCCl Amb16224807 [1,0,1,0,0,0|2,0,0]=4 2446 B4R0.2 OCOC=O Amb25694134 [1,0,1,0,0,0|1,0,0]=3 2447 B4R0.2 OCOCO Amb25024936 [1,0,1,0,0,0|1,0,1]=4 2448 B4R0.2 OC[13CH2]CO Amb22338655 [1,0,1,0,0,0|0,0,1]=3 2449 B4R0.2 OC\C=C/I Amb23539305 [1,0,1,0,0,0|1,0,1]=4 2450 B4R0.2 OC\C=C\I Amb24642752 [1,0,1,0,0,0|1,0,1]=4 2451 B4R0.2 ON=CC=O Amb25746308 [1,0,1,0,0,0|1,0,1]=4 2452 B4R0.2 O[13CH2][13CH2][13CH2]Br Amb22338924 [1,0,1,0,0,0|1,0,0]=3 2453 B4R0.2 O\C=C/C=O Amb24567056 [1,0,1,0,0,0|0,0,2]=4 2454 B4R0.2 O\C=C/CCl Amb22338049 [1,0,1,0,0,0|1,0,1]=4 2455 B4R0.2 PCCCBr Amb24477118 [1,0,1,0,0,0|2,0,0]=4 2456 B4R0.2 PCCCCl Amb24332665 [1,0,1,0,0,0|2,0,0]=4 2457 B4R0.2 PCCCP Amb22227719 [1,0,1,0,0,0|2,0,0]=4 2458 B4R0.2 SCCCBr Amb22270209 [1,0,1,0,0,0|1,1,0]=4 2459 B4R0.2 SCCCCl Amb22360786 [1,0,1,0,0,0|1,1,0]=4 2460 B4R0.2 [13CH3]O[13CH2][13CH2]O Amb22337754 [1,0,1,0,0,0|1,0,1]=4 2461 B4R0.2 [2H]OCCC Amb22731779 [1,0,1,0,0,0|1,0,0]=3 2462 B4R0.2 [C-]#[N+]CCC Amb24117082 [1,0,1,0,0,0|1,0,1]=4 2463 B6R0.1 C=C(CCO)C=O Amb25278289 [0,1,1,0,0,0|2,0,0]=4 2464 B6R0.1 C=C(CCO)CO Amb25825219 [0,1,1,0,0,0|2,0,0]=4 2465 B6R0.1 C=C(CO)CCN Amb24426567 [0,1,1,0,0,0|2,0,0]=4 2466 B6R0.1 C=CC(=O)CCCl Amb24446646 [0,1,1,0,0,0|2,0,0]=4 2467 B6R0.1 C=CC(=O)OCN Amb25200249 [0,1,1,0,0,0|1,0,1]=4 2468 B6R0.1 C=COC(=O)CBr Amb22732072 [0,1,1,0,0,0|0,0,2]=4 2469 B6R0.1 C=COC(=O)CCl Amb22045210 [0,1,1,0,0,0|0,0,2]=4 2470 B6R0.1 C=COC(=O)CI Amb17934194 [0,1,1,0,0,0|0,0,2]=4 2471 B6R0.1 CC#CC(=O)NC Amb25128033 [0,1,1,0,0,0|1,0,1]=4 2472 B6R0.1 CCC(=C)CCC Amb22228810 [0,1,1,0,0,0|2,0,0]=4 2473 B6R0.1 CCC(=N)OCC Amb20673165 [0,1,1,0,0,0|1,0,0]=3 2474 B6R0.1 CCC(=O)CCN Amb18202790 [0,1,1,0,0,0|2,0,0]=4 2475 B6R0.1 CCC(=O)CCS Amb24733984 [0,1,1,0,0,0|2,0,0]=4 2476 B6R0.1 CCC(=O)COC Amb19515551 [0,1,1,0,0,0|2,0,0]=4 2477 B6R0.1 CCC(=O)NCBr Amb25662588 [0,1,1,0,0,0|2,0,0]=4 2478 B6R0.1 CCC(=O)NCCl Amb24577565 [0,1,1,0,0,0|2,0,0]=4 2479 B6R0.1 CCC(=O)OCO Amb25080504 [0,1,1,0,0,0|1,0,0]=3 2480 B6R0.1 CCC(=O)SCC Amb22043397 [0,1,1,0,0,0|0,1,0]=3 2481 B6R0.1 CCC(=S)NCC Amb24761445 [0,1,1,0,0,0|1,1,0]=4 2482 B6R0.1 CCC(O)OCC Amb25845245 [0,1,1,0,0,0|0,0,2]=4 2483 B6R0.1 CCCC(=C)C=O Amb18639170 [0,1,1,0,0,0|1,0,0]=3 2484 B6R0.1 CCCC(=N)NO Amb10069022 [0,1,1,0,0,0|1,0,0]=3 2485 B6R0.1 CCCC(=O)C#C Amb25696103 [0,1,1,0,0,0|1,0,0]=3 2486 B6R0.1 CCCC(=O)C=O Amb18639569 [0,1,1,0,0,0|0,0,1]=3 2487 B6R0.1 CCCC(=O)CBr Amb24433274 [0,1,1,0,0,0|1,0,0]=3 2488 B6R0.1 CCCC(=O)CCl Amb19372924 [0,1,1,0,0,0|1,0,0]=3 2489 B6R0.1 CCCC(=O)CF Amb25370812 [0,1,1,0,0,0|1,0,0]=3 2490 B6R0.1 CCCC(=O)CN Amb17593086 [0,1,1,0,0,0|1,0,0]=3 2491 B6R0.1 CCCC(=O)CO Amb25125092 [0,1,1,0,0,0|0,0,0]=2 2492 B6R0.1 CCCC(=O)CS Amb24631668 [0,1,1,0,0,0|0,1,0]=3 2493 B6R0.1 CCCC(=S)OC Amb22043317 [0,1,1,0,0,0|0,1,0]=3 2494 B6R0.1 CCCC(Br)C=O Amb18126388 [0,1,1,0,0,0|1,0,1]=4 2495 B6R0.1 CCCC(Br)CO Amb25320904 [0,1,1,0,0,0|1,0,1]=4 2496 B6R0.1 CCCC(C)=CBr Amb24373188 [0,1,1,0,0,0|2,0,0]=4 2497 B6R0.1 CCCC(C)=CC Amb25744974 [0,1,1,0,0,0|2,0,0]=4 2498 B6R0.1 CCCC(C)=NN Amb24673239 [0,1,1,0,0,0|2,0,0]=4 2499 B6R0.1 CCCC(C)=NO Amb24693854 [0,1,1,0,0,0|1,0,0]=3 2500 B6R0.1 CCCC(C)NO Amb25737149 [0,1,1,0,0,0|1,0,1]=4 2501 B6R0.1 CCCC(C)ON Amb24424249 [0,1,1,0,0,0|1,0,1]=4 2502 B6R0.1 CCCC(Cl)C=O Amb18124277 [0,1,1,0,0,0|1,0,1]=4 2503 B6R0.1 CCCC(F)C=O Amb24544750 [0,1,1,0,0,0|1,0,1]=4 2504 B6R0.1 CCCC(I)C=O Amb25290285 [0,1,1,0,0,0|1,0,1]=4 2505 B6R0.1 CCCC(O)C=C Amb22002474 [0,1,1,0,0,0|1,0,1]=4 2506 B6R0.1 CCCC(O)C=O Amb24531721 [0,1,1,0,0,0|0,0,1]=3 2507 B6R0.1 CCCC(O)CBr Amb24365915 [0,1,1,0,0,0|1,0,1]=4 2508 B6R0.1 CCCC(O)CCl Amb24470722 [0,1,1,0,0,0|1,0,1]=4 2509 B6R0.1 CCCC(O)NN Amb25282642 [0,1,1,0,0,0|1,0,1]=4 2510 B6R0.1 CCCN(C)N=O Amb25231763 [0,1,1,0,0,0|2,0,0]=4 2511 B6R0.1 CCCN(C)OC Amb25250408 [0,1,1,0,0,0|2,0,0]=4 2512 B6R0.1 CCCN(N)C=O Amb18121867 [0,1,1,0,0,0|2,0,0]=4 2513 B6R0.1 CCCS(=O)NC Amb24645515 [0,1,1,0,0,0|2,0,0]=4 2514 B6R0.1 CCCS(=O)NN Amb24707685 [0,1,1,0,0,0|2,0,0]=4 2515 B6R0.1 CCC[14C](=O)O[Na] Amb22352104 [0,1,1,0,0,0|0,0,0]=2 2516 B6R0.1 CCC[C@@H](C)CO Amb22823174 [0,1,1,0,0,0|1,0,1]=4 2517 B6R0.1 CCC[C@@H](N)CO Amb22756532 [0,1,1,0,0,0|1,0,1]=4 2518 B6R0.1 CCC[C@@H](O)CCl Amb22736025 [0,1,1,0,0,0|1,0,1]=4 2519 B6R0.1 CCC[C@@H](O)CN Amb24428580 [0,1,1,0,0,0|1,0,1]=4 2520 B6R0.1 CCC[C@@H](O)CO Amb25215310 [0,1,1,0,0,0|0,0,2]=4 2521 B6R0.1 CCC[C@H](Br)CO Amb24478880 [0,1,1,0,0,0|1,0,1]=4 2522 B6R0.1 CCC[C@H](Cl)C=O Amb24470180 [0,1,1,0,0,0|1,0,1]=4 2523 B6R0.1 CCC[C@H](Cl)CO Amb25858080 [0,1,1,0,0,0|1,0,1]=4 2524 B6R0.1 CCC[C@H](O)C=C Amb25133740 [0,1,1,0,0,0|1,0,1]=4 2525 B6R0.1 CCC[C@H](O)CCl Amb22735942 [0,1,1,0,0,0|1,0,1]=4 2526 B6R0.1 CCC[C@H](O)CO Amb22225461 [0,1,1,0,0,0|0,0,2]=4 2527 B6R0.1 CCC\C(\C)=C/Cl Amb25299421 [0,1,1,0,0,0|2,0,0]=4 2528 B6R0.1 CCC\C(\Cl)=C\Cl Amb24546444 [0,1,1,0,0,0|2,0,0]=4 2529 B6R0.1 CCC\C(\N)=N\N Amb17933232 [0,1,1,0,0,0|2,0,0]=4 2530 B6R0.1 CCC\C(\N)=N\O Amb19890174 [0,1,1,0,0,0|1,0,0]=3 2531 B6R0.1 CCN(N)OCC Amb24612108 [0,1,1,0,0,0|2,0,0]=4 2532 B6R0.1 CCNC(=N)CN Amb24472238 [0,1,1,0,0,0|2,0,0]=4 2533 B6R0.1 CCNC(=N)CO Amb23514995 [0,1,1,0,0,0|2,0,0]=4 2534 B6R0.1 CCNC(=N)OC Amb25335141 [0,1,1,0,0,0|2,0,0]=4 2535 B6R0.1 CCNC(=O)C#C Amb24057137 [0,1,1,0,0,0|1,0,1]=4 2536 B6R0.1 CCNC(=O)CBr Amb2090261 [0,1,1,0,0,0|1,0,0]=3 2537 B6R0.1 CCNC(=O)CCl Amb1643925 [0,1,1,0,0,0|1,0,0]=3 2538 B6R0.1 CCNC(=O)CI Amb23512617 [0,1,1,0,0,0|1,0,0]=3 2539 B6R0.1 CCNC(=O)CN Amb21956656 [0,1,1,0,0,0|1,0,0]=3 2540 B6R0.1 CCNC(=O)N=O Amb25745700 [0,1,1,0,0,0|1,0,1]=4 2541 B6R0.1 CCNC(=O)OC Amb22734099 [0,1,1,0,0,0|1,0,0]=3 2542 B6R0.1 CCNC(=O)ON Amb25108031 [0,1,1,0,0,0|1,0,0]=3 2543 B6R0.1 CCNC(C)=NN Amb25024696 [0,1,1,0,0,0|2,0,0]=4 2544 B6R0.1 CCNC(N)=NO Amb24389708 [0,1,1,0,0,0|2,0,0]=4 2545 B6R0.1 CCOC(=C)C#N Amb24552774 [0,1,1,0,0,0|1,0,1]=4 2546 B6R0.1 CCOC(=C)C=O Amb18639586 [0,1,1,0,0,0|0,0,1]=3 2547 B6R0.1 CCOC(=C)CO Amb23585492 [0,1,1,0,0,0|1,0,0]=3 2548 B6R0.1 CCOC(=C)CS Amb25314283 [0,1,1,0,0,0|1,0,0]=3 2549 B6R0.1 CCOC(=N)C#N Amb17593071 [0,1,1,0,0,0|1,0,1]=4 2550 B6R0.1 CCOC(=N)CBr Amb20673075 [0,1,1,0,0,0|1,0,0]=3 2551 B6R0.1 CCOC(=N)CBr Amb24425061 [0,1,1,0,0,0|1,0,0]=3 2552 B6R0.1 CCOC(=N)CC Amb17673175 [0,1,1,0,0,0|1,0,0]=3 2553 B6R0.1 CCOC(=N)CCl Amb17939373 [0,1,1,0,0,0|1,0,0]=3 2554 B6R0.1 CCOC(=N)CCl Amb20673164 [0,1,1,0,0,0|1,0,0]=3 2555 B6R0.1 CCOC(=N)CF Amb24480787 [0,1,1,0,0,0|1,0,0]=3 2556 B6R0.1 CCOC(=N)CO Amb17593094 [0,1,1,0,0,0|1,0,0]=3 2557 B6R0.1 CCOC(=O)C#C Amb2182884 [0,1,1,0,0,0|0,0,1]=3 2558 B6R0.1 CCOC(=O)C=C Amb22338016 [0,1,1,0,0,0|0,0,1]=3 2559 B6R0.1 CCOC(=O)CN Amb20246808 [0,1,1,0,0,0|0,0,0]=2 2560 B6R0.1 CCOC(=O)C[NH3+] Amb24113741 [0,1,1,0,0,0|0,0,0]=2 2561 B6R0.1 CCOC(=O)NCl Amb24381604 [0,1,1,0,0,0|1,0,0]=3 2562 B6R0.1 CCOC(=O)[13CH2]Br Amb22337807 [0,1,1,0,0,0|0,0,0]=2 2563 B6R0.1 CCOC(=O)[13CH2]N Amb22055360 [0,1,1,0,0,0|0,0,0]=2 2564 B6R0.1 CCOC(=S)C=O Amb25746370 [0,1,1,0,0,0|1,0,0]=3 2565 B6R0.1 CCOC(=S)CO Amb25720817 [0,1,1,0,0,0|0,1,0]=3 2566 B6R0.1 CCOC(=S)NC Amb24481088 [0,1,1,0,0,0|0,1,0]=3 2567 B6R0.1 CCOC(=S)SC Amb23399830 [0,1,1,0,0,0|0,1,0]=3 2568 B6R0.1 CCOC(=S)S[Tl] Amb22366482 [0,1,1,0,0,0|1,1,0]=4 2569 B6R0.1 CCOC(Br)CBr Amb17939012 [0,1,1,0,0,0|1,0,1]=4 2570 B6R0.1 CCOC(C)C#N Amb17673808 [0,1,1,0,0,0|1,0,1]=4 2571 B6R0.1 CCOC(C)C=O Amb18639937 [0,1,1,0,0,0|0,0,1]=3 2572 B6R0.1 CCOC(C)CC Amb17939313 [0,1,1,0,0,0|1,0,1]=4 2573 B6R0.1 CCOC(C)CCl Amb24453724 [0,1,1,0,0,0|1,0,1]=4 2574 B6R0.1 CCOC(C)CN Amb19959926 [0,1,1,0,0,0|1,0,1]=4 2575 B6R0.1 CCOC(C)CO Amb22641850 [0,1,1,0,0,0|0,0,2]=4 2576 B6R0.1 CCOC(Cl)CBr Amb24373157 [0,1,1,0,0,0|1,0,1]=4 2577 B6R0.1 CCOC(Cl)CCl Amb17940714 [0,1,1,0,0,0|1,0,1]=4 2578 B6R0.1 CCOC(F)=CBr Amb24658512 [0,1,1,0,0,0|1,0,1]=4 2579 B6R0.1 CCOC(N)=NN Amb25024652 [0,1,1,0,0,0|2,0,0]=4 2580 B6R0.1 CCOC(O)C=O Amb25207812 [0,1,1,0,0,0|1,0,1]=4 2581 B6R0.1 CCOC(O)CBr Amb25124104 [0,1,1,0,0,0|0,0,2]=4 2582 B6R0.1 CCOP(=O)CCl Amb24422619 [0,1,1,0,0,0|1,0,0]=3 2583 B6R0.1 CCOP(=O)CO Amb25219603 [0,1,1,0,0,0|1,0,0]=3 2584 B6R0.1 CCO[13C](=O)CBr Amb22363272 [0,1,1,0,0,0|0,0,0]=2 2585 B6R0.1 CCO[13C](=O)[13CH2]Br Amb22351963 [0,1,1,0,0,0|0,0,0]=2 2586 B6R0.1 CCO[13C](=O)[13CH2]Cl Amb17613989 [0,1,1,0,0,0|0,0,0]=2 2587 B6R0.1 CCO[13C](=O)[13CH2]N Amb17614823 [0,1,1,0,0,0|0,0,0]=2 2588 B6R0.1 CCO[C@@H](C)CO Amb24352251 [0,1,1,0,0,0|0,0,2]=4 2589 B6R0.1 CCO[C@H](C)CO Amb25745761 [0,1,1,0,0,0|0,0,2]=4 2590 B6R0.1 CCO\C(\Cl)=C/Cl Amb24479861 [0,1,1,0,0,0|1,0,1]=4 2591 B6R0.1 CCO\C(\F)=C/Cl Amb24478463 [0,1,1,0,0,0|1,0,1]=4 2592 B6R0.1 CCO\C(\N)=N\O Amb25378748 [0,1,1,0,0,0|1,0,1]=4 2593 B6R0.1 CCS(=O)NCC Amb24737256 [0,1,1,0,0,0|2,0,0]=4 2594 B6R0.1 CCSC(=O)CBr Amb25227484 [0,1,1,0,0,0|0,1,0]=3 2595 B6R0.1 CCSC(=O)CCl Amb24530234 [0,1,1,0,0,0|0,1,0]=3 2596 B6R0.1 CCSC(=O)CN Amb24479789 [0,1,1,0,0,0|0,1,0]=3 2597 B6R0.1 CCSC(=O)NN Amb25074866 [0,1,1,0,0,0|1,1,0]=4 2598 B6R0.1 CCSC(=S)NC Amb25338669 [0,1,1,0,0,0|0,2,0]=4 2599 B6R0.1 CCSC(N)=NC Amb25244293 [0,1,1,0,0,0|1,1,0]=4 2600 B6R0.1 CCSC(N)=NC Amb25802582 [0,1,1,0,0,0|1,1,0]=4 2601 B6R0.1 CC[C@H](O)CCC Amb25781736 [0,1,1,0,0,0|1,0,1]=4 2602 B6R0.1 CC\C=C(/Br)\C=O Amb25278288 [0,1,1,0,0,0|1,0,1]=4 2603 B6R0.1 CC\C=C(/C)\C#N Amb25274256 [0,1,1,0,0,0|2,0,0]=4 2604 B6R0.1 CC\C=C(/C)\CBr Amb24710151 [0,1,1,0,0,0|2,0,0]=4 2605 B6R0.1 CC\C=C(/C)\CO Amb22347713 [0,1,1,0,0,0|1,0,1]=4 2606 B6R0.1 CC\C=C(/Cl)\CCl Amb24478858 [0,1,1,0,0,0|2,0,0]=4 2607 B6R0.1 CC\C=C(/F)\C=O Amb25122538 [0,1,1,0,0,0|1,0,1]=4 2608 B6R0.1 CC\C=C(\Br)/C=O Amb18645748 [0,1,1,0,0,0|1,0,1]=4 2609 B6R0.1 CC\C=C(\C)/CN Amb24479885 [0,1,1,0,0,0|2,0,0]=4 2610 B6R0.1 CC\C=C(\C)/CO Amb24677771 [0,1,1,0,0,0|1,0,1]=4 2611 B6R0.1 CC\C=C(\Cl)/C=O Amb18640561 [0,1,1,0,0,0|1,0,1]=4 2612 B6R0.1 CC\C=C(\Cl)/CCl Amb25175108 [0,1,1,0,0,0|2,0,0]=4 2613 B6R0.1 CC\C=C(\F)/CO Amb25692315 [0,1,1,0,0,0|1,0,1]=4 2614 B6R0.1 CC\N=C(\N)/SC Amb24479872 [0,1,1,0,0,0|2,0,0]=4 2615 B6R0.1 CNC(=N)NCC Amb24404052 [0,1,1,0,0,0|2,0,0]=4 2616 B6R0.1 CNC(=O)C=NC Amb25833118 [0,1,1,0,0,0|2,0,0]=4 2617 B6R0.1 CNC(=O)CCBr Amb17332890 [0,1,1,0,0,0|2,0,0]=4 2618 B6R0.1 CNC(=O)CCCl Amb1130566 [0,1,1,0,0,0|2,0,0]=4 2619 B6R0.1 CNC(=O)CCI Amb25205915 [0,1,1,0,0,0|2,0,0]=4 2620 B6R0.1 CNC(=O)CCN Amb1139824 [0,1,1,0,0,0|2,0,0]=4 2621 B6R0.1 CNC(=O)CCO Amb10608414 [0,1,1,0,0,0|2,0,0]=4 2622 B6R0.1 CNC(=O)CCS Amb25727705 [0,1,1,0,0,0|2,0,0]=4 2623 B6R0.1 CNC(=O)COC Amb22275885 [0,1,1,0,0,0|2,0,0]=4 2624 B6R0.1 CNC(=O)NCC Amb24120627 [0,1,1,0,0,0|1,0,0]=3 2625 B6R0.1 CNC(=O)NOC Amb24618015 [0,1,1,0,0,0|2,0,0]=4 2626 B6R0.1 CNC(=O)OC=C Amb24334277 [0,1,1,0,0,0|0,0,2]=4 2627 B6R0.1 CNCC(=O)C#C Amb25675071 [0,1,1,0,0,0|2,0,0]=4 2628 B6R0.1 CNCC(=O)CN Amb25218252 [0,1,1,0,0,0|2,0,0]=4 2629 B6R0.1 CNCC(=O)NC Amb2371052 [0,1,1,0,0,0|2,0,0]=4 2630 B6R0.1 CNCC(=O)NN Amb16186920 [0,1,1,0,0,0|2,0,0]=4 2631 B6R0.1 CNCC(=O)NO Amb24640961 [0,1,1,0,0,0|1,0,0]=3 2632 B6R0.1 CNCC(=O)OC Amb1153975 [0,1,1,0,0,0|1,0,0]=3 2633 B6R0.1 CNCC(=O)OC Amb2371116 [0,1,1,0,0,0|1,0,0]=3 2634 B6R0.1 CNCC(N)=NO Amb24648670 [0,1,1,0,0,0|2,0,0]=4 2635 B6R0.1 CNN=C(C)C=O Amb25253490 [0,1,1,0,0,0|2,0,0]=4 2636 B6R0.1 CNNC(=O)OC Amb22411352 [0,1,1,0,0,0|2,0,0]=4 2637 B6R0.1 CNOC(=O)CN Amb25843279 [0,1,1,0,0,0|1,0,0]=3 2638 B6R0.1 CN\C=C(\C)/C=O Amb24641474 [0,1,1,0,0,0|2,0,0]=4 2639 B6R0.1 CN\N=C(/C)\C=O Amb24452178 [0,1,1,0,0,0|2,0,0]=4 2640 B6R0.1 COC(=C)CCO Amb25024469 [0,1,1,0,0,0|2,0,0]=4 2641 B6R0.1 COC(=N)CCCl Amb19958799 [0,1,1,0,0,0|2,0,0]=4 2642 B6R0.1 COC(=N)CCCl Amb22234673 [0,1,1,0,0,0|2,0,0]=4 2643 B6R0.1 COC(=N)CCO Amb17593095 [0,1,1,0,0,0|2,0,0]=4 2644 B6R0.1 COC(=O)CC=O Amb18199826 [0,1,1,0,0,0|1,0,1]=4 2645 B6R0.1 COC(=O)CCF Amb22748635 [0,1,1,0,0,0|1,0,0]=3 2646 B6R0.1 COC(=O)CCI Amb24442243 [0,1,1,0,0,0|1,0,0]=3 2647 B6R0.1 COC(=O)CCN Amb1105940 [0,1,1,0,0,0|1,0,0]=3 2648 B6R0.1 COC(=O)CCN Amb22489470 [0,1,1,0,0,0|1,0,0]=3 2649 B6R0.1 COC(=O)CON Amb18640433 [0,1,1,0,0,0|2,0,0]=4 2650 B6R0.1 COC(=O)NCCl Amb24479773 [0,1,1,0,0,0|2,0,0]=4 2651 B6R0.1 COC(=O)NOC Amb24480502 [0,1,1,0,0,0|2,0,0]=4 2652 B6R0.1 COC(=O)OCC Amb22732530 [0,1,1,0,0,0|0,0,0]=2 2653 B6R0.1 COC(=O)OCCl Amb20623618 [0,1,1,0,0,0|1,0,0]=3 2654 B6R0.1 COC(=S)CCCl Amb25758715 [0,1,1,0,0,0|1,1,0]=4 2655 B6R0.1 COC(=S)CCS Amb10795255 [0,1,1,0,0,0|1,1,0]=4 2656 B6R0.1 COC(Cl)OCC Amb25811176 [0,1,1,0,0,0|1,0,1]=4 2657 B6R0.1 COCC(=C)CO Amb24523815 [0,1,1,0,0,0|2,0,0]=4 2658 B6R0.1 COCC(=N)NO Amb21858420 [0,1,1,0,0,0|2,0,0]=4 2659 B6R0.1 COCC(=O)C#N Amb25744731 [0,1,1,0,0,0|2,0,0]=4 2660 B6R0.1 COCC(=O)C=C Amb22168158 [0,1,1,0,0,0|2,0,0]=4 2661 B6R0.1 COCC(=O)CCl Amb24523799 [0,1,1,0,0,0|2,0,0]=4 2662 B6R0.1 COCC(=O)CN Amb18833134 [0,1,1,0,0,0|2,0,0]=4 2663 B6R0.1 COCC(=O)CO Amb24364722 [0,1,1,0,0,0|1,0,0]=3 2664 B6R0.1 COCC(=O)O[Na] Amb2227682 [0,1,1,0,0,0|1,0,0]=3 2665 B6R0.1 COCC(C)=NO Amb24530685 [0,1,1,0,0,0|2,0,0]=4 2666 B6R0.1 COCC(N)=S=O Amb25843320 [0,1,1,0,0,0|2,0,0]=4 2667 B6R0.1 COCC(O)C=O Amb18122318 [0,1,1,0,0,0|1,0,1]=4 2668 B6R0.1 CONC(=O)CI Amb25275195 [0,1,1,0,0,0|2,0,0]=4 2669 B6R0.1 CONC(=O)CN Amb20669419 [0,1,1,0,0,0|2,0,0]=4 2670 B6R0.1 COS(=O)CCCl Amb24635086 [0,1,1,0,0,0|2,0,0]=4 2671 B6R0.1 COS(=O)CCO Amb25713675 [0,1,1,0,0,0|2,0,0]=4 2672 B6R0.1 COS(=O)OCC Amb22729134 [0,1,1,0,0,0|1,0,0]=3 2673 B6R0.1 CO[13C](=O)[13CH2][15NH][13CH3] Amb22336903 [0,1,1,0,0,0|1,0,0]=3 2674 B6R0.1 CO\C=C(\C)/C=O Amb25358935 [0,1,1,0,0,0|2,0,0]=4 2675 B6R0.1 CSC(=O)CCCl Amb24735675 [0,1,1,0,0,0|1,1,0]=4 2676 B6R0.1 CSCC(=O)NN Amb22058723 [0,1,1,0,0,0|2,0,0]=4 2677 B6R0.1 CSCC(C)=NO Amb25316343 [0,1,1,0,0,0|2,0,0]=4 2678 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [0,1,1,0,0,0|1,0,0]=3 2679 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [0,1,1,0,0,0|1,0,0]=3 2680 B6R0.1 C\C(\C=C)=C/CC Amb25723992 [0,1,1,0,0,0|2,0,0]=4 2681 B6R0.1 C\C(\C=O)=C/CCl Amb18122638 [0,1,1,0,0,0|2,0,0]=4 2682 B6R0.1 C\C(\C=O)=C\CC Amb18120867 [0,1,1,0,0,0|1,0,0]=3 2683 B6R0.1 C\C(\C=O)=C\CO Amb18639610 [0,1,1,0,0,0|2,0,0]=4 2684 B6R0.1 C\C(\CC)=C/CC Amb24379721 [0,1,1,0,0,0|2,0,0]=4 2685 B6R0.1 C\C(\CCC)=C/C Amb22734722 [0,1,1,0,0,0|2,0,0]=4 2686 B6R0.1 C\C=C/C(=O)CO Amb24530239 [0,1,1,0,0,0|0,0,2]=4 2687 B6R0.1 C\C=C\C(=O)CO Amb24633379 [0,1,1,0,0,0|0,0,2]=4 2688 B6R0.1 C\C=C\C(=O)NC Amb25067932 [0,1,1,0,0,0|1,0,1]=4 2689 B6R0.1 C\C=C\C(=O)NO Amb25076258 [0,1,1,0,0,0|0,0,2]=4 2690 B6R0.1 N#CC(=O)CCO Amb25730943 [0,1,1,0,0,0|2,0,0]=4 2691 B6R0.1 N=C(CCO)NO Amb22491265 [0,1,1,0,0,0|2,0,0]=4 2692 B6R0.1 NC(CCF)=NO Amb24540455 [0,1,1,0,0,0|2,0,0]=4 2693 B6R0.1 NCC(=O)CCN Amb18121893 [0,1,1,0,0,0|2,0,0]=4 2694 B6R0.1 NCC(=O)CCN Amb22227739 [0,1,1,0,0,0|2,0,0]=4 2695 B6R0.1 NCC(=O)CCN Amb22360700 [0,1,1,0,0,0|2,0,0]=4 2696 B6R0.1 NCC(=O)OCO Amb22233222 [0,1,1,0,0,0|1,0,0]=3 2697 B6R0.1 NCCC(=O)CBr Amb24479170 [0,1,1,0,0,0|2,0,0]=4 2698 B6R0.1 NCCC(=O)NN Amb18559344 [0,1,1,0,0,0|2,0,0]=4 2699 B6R0.1 NCCC(=O)NO Amb22751684 [0,1,1,0,0,0|1,0,0]=3 2700 B6R0.1 NCCC(N)=NO Amb24761482 [0,1,1,0,0,0|2,0,0]=4 2701 B6R0.1 NCCC(O)C=O Amb25682881 [0,1,1,0,0,0|1,0,1]=4 2702 B6R0.1 NNC(=O)CCO Amb20622339 [0,1,1,0,0,0|2,0,0]=4 2703 B6R0.1 NNC(=O)CCS Amb20622690 [0,1,1,0,0,0|2,0,0]=4 2704 B6R0.1 O=C(CCCl)CCl Amb22395038 [0,1,1,0,0,0|2,0,0]=4 2705 B6R0.1 O=C(CCCl)NBr Amb24391501 [0,1,1,0,0,0|2,0,0]=4 2706 B6R0.1 O=C(CCCl)NCl Amb24427328 [0,1,1,0,0,0|2,0,0]=4 2707 B6R0.1 O=C(CCl)OCBr Amb25258315 [0,1,1,0,0,0|1,0,0]=3 2708 B6R0.1 O=C(CF)NCCl Amb24560316 [0,1,1,0,0,0|2,0,0]=4 2709 B6R0.1 O=C(CF)OCCl Amb24467312 [0,1,1,0,0,0|1,0,0]=3 2710 B6R0.1 O=NOC(=O)CCl Amb25759337 [0,1,1,0,0,0|2,0,0]=4 2711 B6R0.1 OCC(=O)CCO Amb24061314 [0,1,1,0,0,0|1,0,0]=3 2712 B6R0.1 OCC(=O)CCS Amb24332279 [0,1,1,0,0,0|1,0,0]=3 2713 B6R0.1 OCCC(=NO)N Amb13952693 [0,1,1,0,0,0|2,0,0]=4 2714 B6R0.1 OCCC(=O)CBr Amb25210851 [0,1,1,0,0,0|2,0,0]=4 2715 B6R0.1 OCCC(=O)CCl Amb24674169 [0,1,1,0,0,0|2,0,0]=4 2716 B6R0.1 OCCC(=O)CO Amb10603377 [0,1,1,0,0,0|1,0,0]=3 2717 B6R0.1 OCC[C@@H](O)C=O Amb24741761 [0,1,1,0,0,0|1,0,1]=4 2718 B6R0.1 OCC\C(=N\O)\N Amb1113605 [0,1,1,0,0,0|2,0,0]=4 2719 B6R0.1 OCNC(=O)CBr Amb25286051 [0,1,1,0,0,0|2,0,0]=4 2720 B6R0.1 OCNC(=O)CCl Amb1153096 [0,1,1,0,0,0|2,0,0]=4 2721 B6R0.1 OCNC(=O)CI Amb24374693 [0,1,1,0,0,0|2,0,0]=4 2722 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [0,1,1,0,0,0|0,0,2]=4 2723 B6R0.2 CC(=C)CC(=O)C Amb17593075 [0,1,1,0,0,0|1,0,1]=4 2724 B6R0.2 CC(=CC(=O)O)C Amb1485519 [0,1,1,0,0,0|0,0,2]=4 2725 B6R0.2 CC(=N)CC(N)=O Amb25259783 [0,1,1,0,0,0|1,0,1]=4 2726 B6R0.2 CC(=O)C=S(C)C Amb25370005 [0,1,1,0,0,0|2,0,0]=4 2727 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [0,1,1,0,0,0|1,0,1]=4 2728 B6R0.2 CC(=O)CC(C)=N Amb22345922 [0,1,1,0,0,0|1,0,1]=4 2729 B6R0.2 CC(=O)CC(C)=O Amb22727963 [0,1,1,0,0,0|1,0,1]=4 2730 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,1,1,0,0,0|1,0,0]=3 2731 B6R0.2 CC(=O)CC(C)[O-] Amb22729909 [0,1,1,0,0,0|1,0,0]=3 2732 B6R0.2 CC(=O)CC(Cl)Cl Amb24476084 [0,1,1,0,0,0|2,0,0]=4 2733 B6R0.2 CC(=O)CC(F)F Amb24669174 [0,1,1,0,0,0|2,0,0]=4 2734 B6R0.2 CC(=O)CC(O)=O Amb22348460 [0,1,1,0,0,0|0,0,1]=3 2735 B6R0.2 CC(=O)CC(O)=S Amb24689856 [0,1,1,0,0,0|0,1,1]=4 2736 B6R0.2 CC(=O)CC(O)O Amb25273111 [0,1,1,0,0,0|2,0,0]=4 2737 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [0,1,1,0,0,0|0,0,2]=4 2738 B6R0.2 CC(=O)CS(C)=O Amb25025354 [0,1,1,0,0,0|2,0,0]=4 2739 B6R0.2 CC(=O)C[S+](C)C Amb24614662 [0,1,1,0,0,0|2,0,0]=4 2740 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,1,1,0,0,0|2,0,0]=4 2741 B6R0.2 CC(=O)OC(N)=N Amb25242014 [0,1,1,0,0,0|1,0,1]=4 2742 B6R0.2 CC(=O)O[Al](O)O Amb22336483 [0,1,1,0,0,0|2,0,0]=4 2743 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22045487 [0,1,1,0,0,0|1,0,1]=4 2744 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22053694 [0,1,1,0,0,0|1,0,1]=4 2745 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22054021 [0,1,1,0,0,0|1,0,1]=4 2746 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22730050 [0,1,1,0,0,0|1,0,1]=4 2747 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22730391 [0,1,1,0,0,0|1,0,1]=4 2748 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22733055 [0,1,1,0,0,0|1,0,1]=4 2749 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734591 [0,1,1,0,0,0|1,0,1]=4 2750 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734615 [0,1,1,0,0,0|1,0,1]=4 2751 B6R0.2 CC(=O)\C=C(\C)/[O-] Amb22734932 [0,1,1,0,0,0|1,0,1]=4 2752 B6R0.2 CC(=S)CC(N)=O Amb24479846 [0,1,1,0,0,0|1,0,1]=4 2753 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [0,1,1,0,0,0|0,0,2]=4 2754 B6R0.2 CC(Br)C=C(C)C Amb25745333 [0,1,1,0,0,0|2,0,0]=4 2755 B6R0.2 CC(Br)CC(C)=C Amb24365286 [0,1,1,0,0,0|2,0,0]=4 2756 B6R0.2 CC(Br)CC(C)O Amb25139315 [0,1,1,0,0,0|1,0,1]=4 2757 B6R0.2 CC(Br)CC(N)=N Amb25700372 [0,1,1,0,0,0|2,0,0]=4 2758 B6R0.2 CC(Br)CC(N)=O Amb24635749 [0,1,1,0,0,0|1,0,0]=3 2759 B6R0.2 CC(Br)OC(C)=O Amb19958925 [0,1,1,0,0,0|0,0,0]=2 2760 B6R0.2 CC(C)CC(=C)Br Amb22583739 [0,1,1,0,0,0|2,0,0]=4 2761 B6R0.2 CC(C)CC([O-])=O Amb22732147 [0,1,1,0,0,0|0,0,1]=3 2762 B6R0.2 CC(C)CC([O-])=O Amb22732282 [0,1,1,0,0,0|0,0,1]=3 2763 B6R0.2 CC(C)CC([O-])=O Amb22734041 [0,1,1,0,0,0|0,0,1]=3 2764 B6R0.2 CC(C)CC([O-])=O Amb22734425 [0,1,1,0,0,0|0,0,1]=3 2765 B6R0.2 CC(C)CS(N)=O Amb24527860 [0,1,1,0,0,0|2,0,0]=4 2766 B6R0.2 CC(C)CS([O-])=O Amb19930010 [0,1,1,0,0,0|1,0,1]=4 2767 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [0,1,1,0,0,0|0,0,0]=2 2768 B6R0.2 CC(C)C[13C]([O-])=O Amb22336662 [0,1,1,0,0,0|0,0,1]=3 2769 B6R0.2 CC(C)C[N+]([O-])=O Amb17672613 [0,1,1,0,0,0|1,0,1]=4 2770 B6R0.2 CC(C)NC(=O)F Amb24567697 [0,1,1,0,0,0|2,0,0]=4 2771 B6R0.2 CC(C)NC(C)=C Amb25746179 [0,1,1,0,0,0|2,0,0]=4 2772 B6R0.2 CC(C)NC(C)=N Amb25711699 [0,1,1,0,0,0|2,0,0]=4 2773 B6R0.2 CC(C)OC(=C)O Amb24086570 [0,1,1,0,0,0|0,0,2]=4 2774 B6R0.2 CC(C)OC(C)=S Amb24697607 [0,1,1,0,0,0|0,1,0]=3 2775 B6R0.2 CC(C)OC(N)=S Amb25732665 [0,1,1,0,0,0|1,1,0]=4 2776 B6R0.2 CC(C)OC(S)=S Amb22274297 [0,1,1,0,0,0|1,1,0]=4 2777 B6R0.2 CC(C)OC(S)=S Amb24465791 [0,1,1,0,0,0|1,1,0]=4 2778 B6R0.2 CC(C)OC([S-])=S Amb19748282 [0,1,1,0,0,0|1,1,0]=4 2779 B6R0.2 CC(C)OC([S-])=S Amb22729007 [0,1,1,0,0,0|1,1,0]=4 2780 B6R0.2 CC(C)OP(C)=O Amb24592794 [0,1,1,0,0,0|1,0,0]=3 2781 B6R0.2 CC(C)O[Al](C)C Amb22353901 [0,1,1,0,0,0|2,0,0]=4 2782 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [0,1,1,0,0,0|1,1,0]=4 2783 B6R0.2 CC(C)SC(N)=O Amb24461669 [0,1,1,0,0,0|1,1,0]=4 2784 B6R0.2 CC(CC(=C)C)O Amb17593083 [0,1,1,0,0,0|2,0,0]=4 2785 B6R0.2 CC(CC(=N)N)C Amb10066934 [0,1,1,0,0,0|2,0,0]=4 2786 B6R0.2 CC(CC(=O)C)Cl Amb17593234 [0,1,1,0,0,0|1,0,0]=3 2787 B6R0.2 CC(CC(=O)C)N Amb2583230 [0,1,1,0,0,0|1,0,0]=3 2788 B6R0.2 CC(CC(=O)C)O Amb17593091 [0,1,1,0,0,0|1,0,0]=3 2789 B6R0.2 CC(CC(Cl)C)O Amb17593253 [0,1,1,0,0,0|1,0,1]=4 2790 B6R0.2 CC(CC(O)C)O Amb10068523 [0,1,1,0,0,0|1,0,1]=4 2791 B6R0.2 CC(Cl)CC(C)=C Amb24558200 [0,1,1,0,0,0|2,0,0]=4 2792 B6R0.2 CC(Cl)CP(O)O Amb25061243 [0,1,1,0,0,0|1,0,1]=4 2793 B6R0.2 CC(Cl)NC(=O)Cl Amb24480662 [0,1,1,0,0,0|2,0,0]=4 2794 B6R0.2 CC(Cl)OC(=S)Cl Amb25210549 [0,1,1,0,0,0|1,1,0]=4 2795 B6R0.2 CC(Cl)OC(C)=O Amb24058273 [0,1,1,0,0,0|0,0,0]=2 2796 B6R0.2 CC(Cl)OC(C)Cl Amb17673696 [0,1,1,0,0,0|1,0,1]=4 2797 B6R0.2 CC(Cl)OC(N)=O Amb24372683 [0,1,1,0,0,0|1,0,0]=3 2798 B6R0.2 CC(Cl)SC(C)=O Amb24625146 [0,1,1,0,0,0|0,1,0]=3 2799 B6R0.2 CC(Cl)\C=C(/C)\Cl Amb25242497 [0,1,1,0,0,0|2,0,0]=4 2800 B6R0.2 CC(F)=CC(O)=O Amb24676595 [0,1,1,0,0,0|0,0,2]=4 2801 B6R0.2 CC(F)CC(O)=O Amb24561809 [0,1,1,0,0,0|0,0,0]=2 2802 B6R0.2 CC(F)C[N+]([O-])=O Amb25024317 [0,1,1,0,0,0|1,0,1]=4 2803 B6R0.2 CC(I)=CC(O)=O Amb24668934 [0,1,1,0,0,0|0,0,2]=4 2804 B6R0.2 CC(I)CC(C)O Amb25743469 [0,1,1,0,0,0|1,0,1]=4 2805 B6R0.2 CC(I)CC(N)=O Amb25783800 [0,1,1,0,0,0|1,0,0]=3 2806 B6R0.2 CC(N)=CC(O)=O Amb25856437 [0,1,1,0,0,0|0,0,2]=4 2807 B6R0.2 CC(N)CC(=O)Cl Amb25830663 [0,1,1,0,0,0|1,0,0]=3 2808 B6R0.2 CC(N)CC(C)=C Amb25064223 [0,1,1,0,0,0|2,0,0]=4 2809 B6R0.2 CC(N)CC(C)=O Amb22587050 [0,1,1,0,0,0|1,0,0]=3 2810 B6R0.2 CC(N)CC(N)=N Amb25051498 [0,1,1,0,0,0|2,0,0]=4 2811 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,1,1,0,0,0|1,0,0]=3 2812 B6R0.2 CC(N)CC(N)=S Amb25198821 [0,1,1,0,0,0|1,1,0]=4 2813 B6R0.2 CC(N)CC(O)=O Amb19888354 [0,1,1,0,0,0|0,0,0]=2 2814 B6R0.2 CC(NC(=O)N)C Amb1104587 [0,1,1,0,0,0|2,0,0]=4 2815 B6R0.2 CC(O)C=C(C)C Amb22229846 [0,1,1,0,0,0|2,0,0]=4 2816 B6R0.2 CC(O)CC(=C)Br Amb24618620 [0,1,1,0,0,0|2,0,0]=4 2817 B6R0.2 CC(O)CC(C)N Amb18640217 [0,1,1,0,0,0|1,0,1]=4 2818 B6R0.2 CC(O)CC(N)=S Amb24479794 [0,1,1,0,0,0|1,1,0]=4 2819 B6R0.2 CC(O)CC(O)=O Amb22348403 [0,1,1,0,0,0|0,0,0]=2 2820 B6R0.2 CC(O)CC(O)O Amb25716084 [0,1,1,0,0,0|0,0,2]=4 2821 B6R0.2 CC(O)CC(S)=S Amb25215114 [0,1,1,0,0,0|0,2,0]=4 2822 B6R0.2 CC(O)CP(O)=O Amb24406357 [0,1,1,0,0,0|1,0,0]=3 2823 B6R0.2 CC(O)NC(N)=O Amb25811550 [0,1,1,0,0,0|2,0,0]=4 2824 B6R0.2 CC(O)OC(C)N Amb24479444 [0,1,1,0,0,0|0,0,2]=4 2825 B6R0.2 CC(O)OC(C)O Amb25662319 [0,1,1,0,0,0|0,0,2]=4 2826 B6R0.2 CC(O)OC(N)=O Amb24669632 [0,1,1,0,0,0|1,0,0]=3 2827 B6R0.2 CC(O)SC(C)=O Amb24544015 [0,1,1,0,0,0|0,1,0]=3 2828 B6R0.2 CC(O)\C=C(\C)/S Amb25800756 [0,1,1,0,0,0|1,1,0]=4 2829 B6R0.2 CC(OC(=S)[S-])C Amb2371664 [0,1,1,0,0,0|1,1,0]=4 2830 B6R0.2 CC(O[N+](=O)[O-])C Amb2447326 [0,1,1,0,0,0|2,0,0]=4 2831 B6R0.2 CC(P)CC(C)O Amb25792365 [0,1,1,0,0,0|1,0,1]=4 2832 B6R0.2 CC(S)=CC(C)=O Amb24611600 [0,1,1,0,0,0|1,0,1]=4 2833 B6R0.2 CC(S)CC(C)=O Amb24600676 [0,1,1,0,0,0|1,0,0]=3 2834 B6R0.2 CC(S)CC(C)O Amb24122653 [0,1,1,0,0,0|1,0,1]=4 2835 B6R0.2 CC(S)CC(N)=O Amb24479823 [0,1,1,0,0,0|1,0,0]=3 2836 B6R0.2 CC(S)CC(O)=O Amb18281031 [0,1,1,0,0,0|0,0,0]=2 2837 B6R0.2 CN(Br)CC(O)=O Amb25745878 [0,1,1,0,0,0|1,0,0]=3 2838 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,1,1,0,0,0|2,0,0]=4 2839 B6R0.2 CN(C)CC([O-])=O Amb22002291 [0,1,1,0,0,0|1,0,1]=4 2840 B6R0.2 CN(C)CS(O)=O Amb25376029 [0,1,1,0,0,0|2,0,0]=4 2841 B6R0.2 CN(CC(=O)N)C Amb17231806 [0,1,1,0,0,0|2,0,0]=4 2842 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [0,1,1,0,0,0|1,0,0]=3 2843 B6R0.2 CN(N)CC(O)=O Amb23592296 [0,1,1,0,0,0|1,0,0]=3 2844 B6R0.2 CN(O)CC(O)=O Amb24732008 [0,1,1,0,0,0|1,0,0]=3 2845 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,1,1,0,0,0|2,0,0]=4 2846 B6R0.2 CS(=O)CC(O)=O Amb18957960 [0,1,1,0,0,0|1,0,0]=3 2847 B6R0.2 CS(C)=CC(O)=O Amb25717234 [0,1,1,0,0,0|1,0,1]=4 2848 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [0,1,1,0,0,0|0,0,1]=3 2849 B6R0.2 C[13C](=O)O[13C](C)=O Amb22353530 [0,1,1,0,0,0|0,0,1]=3 2850 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [0,1,1,0,0,0|0,0,0]=2 2851 B6R0.2 C[C@@H](Cl)CC(=O)Cl Amb25321802 [0,1,1,0,0,0|1,0,0]=3 2852 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [0,1,1,0,0,0|1,0,0]=3 2853 B6R0.2 C[C@@H](O)C=C(C)C Amb25700154 [0,1,1,0,0,0|2,0,0]=4 2854 B6R0.2 C[C@@H](O)CC(=C)Br Amb25045702 [0,1,1,0,0,0|2,0,0]=4 2855 B6R0.2 C[C@@H](O)CC(C)O Amb25083401 [0,1,1,0,0,0|1,0,1]=4 2856 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [0,1,1,0,0,0|1,0,0]=3 2857 B6R0.2 C[C@@H](O)C[C@@H](C)N Amb24568258 [0,1,1,0,0,0|1,0,1]=4 2858 B6R0.2 C[C@@H](O)C[C@H](C)N Amb24479559 [0,1,1,0,0,0|1,0,1]=4 2859 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [0,1,1,0,0,0|0,0,0]=2 2860 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [0,1,1,0,0,0|0,0,0]=2 2861 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [0,1,1,0,0,0|0,0,0]=2 2862 B6R0.2 C[C@H](Cl)CC(=O)Cl Amb25053837 [0,1,1,0,0,0|1,0,0]=3 2863 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [0,1,1,0,0,0|0,0,0]=2 2864 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [0,1,1,0,0,0|0,0,0]=2 2865 B6R0.2 C[C@H](N)C=C(C)C Amb24333107 [0,1,1,0,0,0|2,0,0]=4 2866 B6R0.2 C[C@H](O)C=C(C)C Amb24734239 [0,1,1,0,0,0|2,0,0]=4 2867 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [0,1,1,0,0,0|1,0,0]=3 2868 B6R0.2 C[C@H](O)CC(C)N Amb25835759 [0,1,1,0,0,0|1,0,1]=4 2869 B6R0.2 C[C@H](O)CC(C)O Amb25381310 [0,1,1,0,0,0|1,0,1]=4 2870 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [0,1,1,0,0,0|0,0,0]=2 2871 B6R0.2 C[C@H](O)C[C@@H](C)N Amb24351024 [0,1,1,0,0,0|1,0,1]=4 2872 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [0,1,1,0,0,0|1,0,1]=4 2873 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [0,1,1,0,0,0|0,0,0]=2 2874 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,1,1,0,0,0|2,0,0]=4 2875 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [0,1,1,0,0,0|1,0,0]=3 2876 B6R0.2 C\C(=C/C(=O)C)\N Amb1149988 [0,1,1,0,0,0|1,0,1]=4 2877 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [0,1,1,0,0,0|0,0,2]=4 2878 B6R0.2 C\C(\Cl)=C/C(C)=O Amb25795658 [0,1,1,0,0,0|1,0,1]=4 2879 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [0,1,1,0,0,0|0,0,2]=4 2880 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [0,1,1,0,0,0|0,0,2]=4 2881 B6R0.2 C\C(\F)=C/C(C)=O Amb24614698 [0,1,1,0,0,0|1,0,1]=4 2882 B6R0.2 C\C(\F)=C\C(C)=O Amb25717786 [0,1,1,0,0,0|1,0,1]=4 2883 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [0,1,1,0,0,0|0,0,2]=4 2884 B6R0.2 C\C(\O)=C\C(C)=O Amb22034390 [0,1,1,0,0,0|1,0,1]=4 2885 B6R0.2 C\C(\[O-])=C/C(C)=O Amb19894693 [0,1,1,0,0,0|1,0,1]=4 2886 B6R0.2 C\C(\[O-])=C\C(C)=O Amb19959976 [0,1,1,0,0,0|1,0,1]=4 2887 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239360 [0,1,1,0,0,0|1,0,1]=4 2888 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239373 [0,1,1,0,0,0|1,0,1]=4 2889 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239374 [0,1,1,0,0,0|1,0,1]=4 2890 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20239443 [0,1,1,0,0,0|1,0,1]=4 2891 B6R0.2 C\C(\[O-])=C\C(C)=O Amb20246565 [0,1,1,0,0,0|1,0,1]=4 2892 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045337 [0,1,1,0,0,0|1,0,1]=4 2893 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045339 [0,1,1,0,0,0|1,0,1]=4 2894 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045350 [0,1,1,0,0,0|1,0,1]=4 2895 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045370 [0,1,1,0,0,0|1,0,1]=4 2896 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045376 [0,1,1,0,0,0|1,0,1]=4 2897 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045378 [0,1,1,0,0,0|1,0,1]=4 2898 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045379 [0,1,1,0,0,0|1,0,1]=4 2899 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045386 [0,1,1,0,0,0|1,0,1]=4 2900 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045388 [0,1,1,0,0,0|1,0,1]=4 2901 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045392 [0,1,1,0,0,0|1,0,1]=4 2902 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045393 [0,1,1,0,0,0|1,0,1]=4 2903 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045408 [0,1,1,0,0,0|1,0,1]=4 2904 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045419 [0,1,1,0,0,0|1,0,1]=4 2905 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045578 [0,1,1,0,0,0|1,0,1]=4 2906 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045602 [0,1,1,0,0,0|1,0,1]=4 2907 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045712 [0,1,1,0,0,0|1,0,1]=4 2908 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045835 [0,1,1,0,0,0|1,0,1]=4 2909 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045854 [0,1,1,0,0,0|1,0,1]=4 2910 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22045869 [0,1,1,0,0,0|1,0,1]=4 2911 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22052617 [0,1,1,0,0,0|1,0,1]=4 2912 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053071 [0,1,1,0,0,0|1,0,1]=4 2913 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053499 [0,1,1,0,0,0|1,0,1]=4 2914 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053500 [0,1,1,0,0,0|1,0,1]=4 2915 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053502 [0,1,1,0,0,0|1,0,1]=4 2916 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053503 [0,1,1,0,0,0|1,0,1]=4 2917 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053559 [0,1,1,0,0,0|1,0,1]=4 2918 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053596 [0,1,1,0,0,0|1,0,1]=4 2919 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053692 [0,1,1,0,0,0|1,0,1]=4 2920 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053697 [0,1,1,0,0,0|1,0,1]=4 2921 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053737 [0,1,1,0,0,0|1,0,1]=4 2922 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053933 [0,1,1,0,0,0|1,0,1]=4 2923 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053935 [0,1,1,0,0,0|1,0,1]=4 2924 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053939 [0,1,1,0,0,0|1,0,1]=4 2925 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053940 [0,1,1,0,0,0|1,0,1]=4 2926 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22053954 [0,1,1,0,0,0|1,0,1]=4 2927 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054002 [0,1,1,0,0,0|1,0,1]=4 2928 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054020 [0,1,1,0,0,0|1,0,1]=4 2929 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054022 [0,1,1,0,0,0|1,0,1]=4 2930 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22054119 [0,1,1,0,0,0|1,0,1]=4 2931 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22466635 [0,1,1,0,0,0|1,0,1]=4 2932 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22728947 [0,1,1,0,0,0|1,0,1]=4 2933 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729908 [0,1,1,0,0,0|1,0,1]=4 2934 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729969 [0,1,1,0,0,0|1,0,1]=4 2935 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22729970 [0,1,1,0,0,0|1,0,1]=4 2936 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22730028 [0,1,1,0,0,0|1,0,1]=4 2937 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22730125 [0,1,1,0,0,0|1,0,1]=4 2938 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22731170 [0,1,1,0,0,0|1,0,1]=4 2939 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22733289 [0,1,1,0,0,0|1,0,1]=4 2940 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22733723 [0,1,1,0,0,0|1,0,1]=4 2941 B6R0.2 C\C(\[O-])=C\C(C)=O Amb22735083 [0,1,1,0,0,0|1,0,1]=4 2942 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [0,1,1,0,0,0|1,0,1]=4 2943 B6R0.2 NC(=O)CC(Cl)Cl Amb24479899 [0,1,1,0,0,0|2,0,0]=4 2944 B6R0.2 NC(=O)CC(O)O Amb25810087 [0,1,1,0,0,0|2,0,0]=4 2945 B6R0.2 NC(F)CC(O)=O Amb24479804 [0,1,1,0,0,0|1,0,0]=3 2946 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [0,1,1,0,0,0|1,0,0]=3 2947 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [0,1,1,0,0,0|1,0,0]=3 2948 B6R0.2 O=C(Cl)CC(Cl)Cl Amb24478549 [0,1,1,0,0,0|2,0,0]=4 2949 B6R0.2 OB(CC(C)C)O Amb2447316 [0,1,1,0,0,0|1,0,1]=4 2950 B6R0.2 OB(O)CC(O)=O Amb24053058 [0,1,1,0,0,0|2,0,0]=4 2951 B6R0.2 OC(=O)CC(=S)N Amb17465742 [0,1,1,0,0,0|1,0,1]=4 2952 B6R0.2 OC(=O)CC(F)Br Amb25336987 [0,1,1,0,0,0|1,0,0]=3 2953 B6R0.2 OC(=O)CC(F)F Amb22001551 [0,1,1,0,0,0|1,0,0]=3 2954 B6R0.2 OC(=O)CC(O)=O Amb21935659 [0,1,1,0,0,0|1,0,1]=4 2955 B6R0.2 OC(=O)CC(O)=O Amb22230690 [0,1,1,0,0,0|1,0,1]=4 2956 B6R0.2 OC(=O)CC(O)=O Amb22230927 [0,1,1,0,0,0|1,0,1]=4 2957 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [0,1,1,0,0,0|2,0,0]=4 2958 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [0,1,1,0,0,0|1,0,1]=4 2959 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [0,1,1,0,0,0|1,0,1]=4 2960 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [0,1,1,0,0,0|1,0,1]=4 2961 B6R0.2 [13CH3]C(=O)OC([13CH3])=O Amb22336728 [0,1,1,0,0,0|0,0,1]=3 2962 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [0,1,1,0,0,0|0,0,1]=3 2963 B6R0.2 [13CH3][13CH]([13CH3])O[13CH]([13CH3])[13CH3] Amb22367319 [0,1,1,0,0,0|1,0,1]=4 2964 B6R0.2 [13CH3][13C](=O)O[13C]([13CH3])=O Amb22338759 [0,1,1,0,0,0|0,0,1]=3 2965 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [0,1,1,0,0,0|1,0,0]=3 2966 B6R0.2 [O-]C(=O)CC(F)F Amb24117960 [0,1,1,0,0,0|1,0,1]=4 2967 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [0,1,1,0,0,0|0,0,1]=3 2968 B6R0.3 C#CC(O)C(O)=O Amb22731622 [0,1,1,0,0,0|0,0,2]=4 2969 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [0,1,1,0,0,0|0,0,2]=4 2970 B6R0.3 C=C(CF)C(O)=O Amb25215375 [0,1,1,0,0,0|1,0,1]=4 2971 B6R0.3 C=C(CI)C(O)=O Amb24419641 [0,1,1,0,0,0|1,0,1]=4 2972 B6R0.3 C=C(CN)C(O)=O Amb25200864 [0,1,1,0,0,0|1,0,1]=4 2973 B6R0.3 C=C(CO)C(O)=O Amb18121817 [0,1,1,0,0,0|1,0,1]=4 2974 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [0,1,1,0,0,0|0,0,2]=4 2975 B6R0.3 C=CC(N)C(O)=O Amb20240543 [0,1,1,0,0,0|0,0,2]=4 2976 B6R0.3 C=CC(O)C(O)=O Amb24061247 [0,1,1,0,0,0|0,0,2]=4 2977 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [0,1,1,0,0,0|0,0,2]=4 2978 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [0,1,1,0,0,0|0,0,2]=4 2979 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [0,1,1,0,0,0|0,0,2]=4 2980 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [0,1,1,0,0,0|0,0,2]=4 2981 B6R0.3 CC(=NC)C(C)=O Amb25179556 [0,1,1,0,0,0|2,0,0]=4 2982 B6R0.3 CC(=O)C(=C)CBr Amb24478554 [0,1,1,0,0,0|2,0,0]=4 2983 B6R0.3 CC(=O)C(=C)CCl Amb25141482 [0,1,1,0,0,0|2,0,0]=4 2984 B6R0.3 CC(=O)C(=C)CO Amb24571845 [0,1,1,0,0,0|2,0,0]=4 2985 B6R0.3 CC(=O)C(=O)CBr Amb17506257 [0,1,1,0,0,0|2,0,0]=4 2986 B6R0.3 CC(=O)C(=O)CCl Amb17506258 [0,1,1,0,0,0|2,0,0]=4 2987 B6R0.3 CC(=O)C(Br)CO Amb24649743 [0,1,1,0,0,0|2,0,0]=4 2988 B6R0.3 CC(=O)C(Cl)CF Amb24594938 [0,1,1,0,0,0|2,0,0]=4 2989 B6R0.3 CC(=O)C(Cl)CO Amb25321596 [0,1,1,0,0,0|2,0,0]=4 2990 B6R0.3 CC(=O)C(F)CO Amb24725289 [0,1,1,0,0,0|2,0,0]=4 2991 B6R0.3 CC(=O)C(N)CN Amb24479898 [0,1,1,0,0,0|2,0,0]=4 2992 B6R0.3 CC(=O)C(N)CO Amb18640011 [0,1,1,0,0,0|2,0,0]=4 2993 B6R0.3 CC(=O)C(N)CS Amb24479874 [0,1,1,0,0,0|2,0,0]=4 2994 B6R0.3 CC(=O)C(O)CN Amb24636554 [0,1,1,0,0,0|2,0,0]=4 2995 B6R0.3 CC(=O)N(C)CCl Amb24428489 [0,1,1,0,0,0|2,0,0]=4 2996 B6R0.3 CC(=O)[C@@H](N)CO Amb22745043 [0,1,1,0,0,0|2,0,0]=4 2997 B6R0.3 CC(=O)[C@@H](O)CCl Amb24401543 [0,1,1,0,0,0|2,0,0]=4 2998 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [0,1,1,0,0,0|2,0,0]=4 2999 B6R0.3 CC(=O)[C@H](O)CCl Amb25169511 [0,1,1,0,0,0|2,0,0]=4 3000 B6R0.3 CC(=O)[C@H](O)CO Amb25838797 [0,1,1,0,0,0|2,0,0]=4 3001 B6R0.3 CC(=O)\C(\Cl)=C/C Amb24736181 [0,1,1,0,0,0|1,0,1]=4 3002 B6R0.3 CC(C#C)C(O)=O Amb25085390 [0,1,1,0,0,0|0,0,2]=4 3003 B6R0.3 CC(C(=O)C)CO Amb10844844 [0,1,1,0,0,0|2,0,0]=4 3004 B6R0.3 CC(C(=O)O)C#N Amb17210512 [0,1,1,0,0,0|1,0,1]=4 3005 B6R0.3 CC(C=C)C(O)=O Amb21618706 [0,1,1,0,0,0|0,0,2]=4 3006 B6R0.3 CC(CBr)C(C)=O Amb25296678 [0,1,1,0,0,0|2,0,0]=4 3007 B6R0.3 CC(CBr)C(O)=O Amb22002601 [0,1,1,0,0,0|1,0,0]=3 3008 B6R0.3 CC(CC)C(O)Br Amb24635628 [0,1,1,0,0,0|1,0,1]=4 3009 B6R0.3 CC(CCl)C(=O)Cl Amb24479841 [0,1,1,0,0,0|2,0,0]=4 3010 B6R0.3 CC(CCl)C(=O)S Amb24410197 [0,1,1,0,0,0|1,1,0]=4 3011 B6R0.3 CC(CCl)C(N)=O Amb25061744 [0,1,1,0,0,0|2,0,0]=4 3012 B6R0.3 CC(CCl)C(O)=O Amb18522181 [0,1,1,0,0,0|1,0,0]=3 3013 B6R0.3 CC(CF)C(C)=O Amb25253758 [0,1,1,0,0,0|2,0,0]=4 3014 B6R0.3 CC(CF)C(O)=O Amb24432331 [0,1,1,0,0,0|1,0,0]=3 3015 B6R0.3 CC(CI)C(O)=O Amb25695307 [0,1,1,0,0,0|1,0,0]=3 3016 B6R0.3 CC(CN)C(=O)Cl Amb24525988 [0,1,1,0,0,0|2,0,0]=4 3017 B6R0.3 CC(CN)C(C)=O Amb18639690 [0,1,1,0,0,0|2,0,0]=4 3018 B6R0.3 CC(CO)C([O-])=O Amb24123145 [0,1,1,0,0,0|1,0,1]=4 3019 B6R0.3 CC(CS)C(C)=O Amb25830693 [0,1,1,0,0,0|2,0,0]=4 3020 B6R0.3 CC(CS)C(N)=O Amb25759660 [0,1,1,0,0,0|2,0,0]=4 3021 B6R0.3 CC(N=C)C(O)=O Amb24591339 [0,1,1,0,0,0|1,0,1]=4 3022 B6R0.3 CC(NBr)C(O)=O Amb24677636 [0,1,1,0,0,0|2,0,0]=4 3023 B6R0.3 CC(NCl)C(O)=O Amb25267473 [0,1,1,0,0,0|2,0,0]=4 3024 B6R0.3 CC(NN)C(O)=O Amb18640367 [0,1,1,0,0,0|2,0,0]=4 3025 B6R0.3 CC(O)[C@@H](N)CC Amb24453251 [0,1,1,0,0,0|1,0,1]=4 3026 B6R0.3 CC(ON)C(O)=O Amb24479235 [0,1,1,0,0,0|2,0,0]=4 3027 B6R0.3 CCC(=C)C(=O)Cl Amb22353554 [0,1,1,0,0,0|1,0,1]=4 3028 B6R0.3 CCC(=C)C(N)=O Amb24480748 [0,1,1,0,0,0|1,0,1]=4 3029 B6R0.3 CCC(=C)C(O)=O Amb18639591 [0,1,1,0,0,0|0,0,1]=3 3030 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,1,1,0,0,0|1,0,1]=4 3031 B6R0.3 CCC(=O)C(O)=O Amb22274199 [0,1,1,0,0,0|0,0,1]=3 3032 B6R0.3 CCC(=O)C([O-])=O Amb22360646 [0,1,1,0,0,0|0,0,2]=4 3033 B6R0.3 CCC(B(O)O)C Amb10071974 [0,1,1,0,0,0|1,0,1]=4 3034 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [0,1,1,0,0,0|1,0,0]=3 3035 B6R0.3 CCC(Br)C(C)=O Amb24615269 [0,1,1,0,0,0|1,0,0]=3 3036 B6R0.3 CCC(Br)C(Cl)=O Amb17666758 [0,1,1,0,0,0|1,0,0]=3 3037 B6R0.3 CCC(Br)[N+]([O-])=O Amb17673702 [0,1,1,0,0,0|1,0,1]=4 3038 B6R0.3 CCC(C(=O)Cl)N Amb17593240 [0,1,1,0,0,0|1,0,0]=3 3039 B6R0.3 CCC(C(=O)N)Br Amb13952819 [0,1,1,0,0,0|1,0,0]=3 3040 B6R0.3 CCC(C(=O)N)N Amb1914080 [0,1,1,0,0,0|1,0,0]=3 3041 B6R0.3 CCC(C(=O)O)S Amb17501370 [0,1,1,0,0,0|0,0,0]=2 3042 B6R0.3 CCC(C(O)C)O Amb2227553 [0,1,1,0,0,0|1,0,1]=4 3043 B6R0.3 CCC(C)C(=C)Br Amb22583745 [0,1,1,0,0,0|2,0,0]=4 3044 B6R0.3 CCC(C)S([O-])=O Amb19893328 [0,1,1,0,0,0|1,0,1]=4 3045 B6R0.3 CCC(Cl)C(=C)Cl Amb24426218 [0,1,1,0,0,0|2,0,0]=4 3046 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [0,1,1,0,0,0|1,0,0]=3 3047 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [0,1,1,0,0,0|1,0,0]=3 3048 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [0,1,1,0,0,0|1,0,0]=3 3049 B6R0.3 CCC(F)C(C)=O Amb24736393 [0,1,1,0,0,0|1,0,0]=3 3050 B6R0.3 CCC(F)C(N)=O Amb25811426 [0,1,1,0,0,0|1,0,0]=3 3051 B6R0.3 CCC(F)C(O)=O Amb25716167 [0,1,1,0,0,0|0,0,0]=2 3052 B6R0.3 CCC(I)C(N)=O Amb25131171 [0,1,1,0,0,0|1,0,0]=3 3053 B6R0.3 CCC(N)C(=O)S Amb24479075 [0,1,1,0,0,0|0,1,0]=3 3054 B6R0.3 CCC(N)C(C)=O Amb18202785 [0,1,1,0,0,0|1,0,0]=3 3055 B6R0.3 CCC(N)C(N)=S Amb24573684 [0,1,1,0,0,0|1,1,0]=4 3056 B6R0.3 CCC(N)P(O)=O Amb25269903 [0,1,1,0,0,0|1,0,0]=3 3057 B6R0.3 CCC(O)C(=C)Br Amb25236591 [0,1,1,0,0,0|2,0,0]=4 3058 B6R0.3 CCC(O)C(C)=O Amb25336501 [0,1,1,0,0,0|1,0,0]=3 3059 B6R0.3 CCC(O)C(N)=O Amb24116514 [0,1,1,0,0,0|1,0,0]=3 3060 B6R0.3 CCC(O)C(N)=S Amb23449332 [0,1,1,0,0,0|1,1,0]=4 3061 B6R0.3 CCC(O)C(O)=O Amb22352315 [0,1,1,0,0,0|0,0,0]=2 3062 B6R0.3 CCC(O)C(O)=O Amb22360643 [0,1,1,0,0,0|0,0,0]=2 3063 B6R0.3 CCC(O)C([O-])=O Amb17943026 [0,1,1,0,0,0|0,0,1]=3 3064 B6R0.3 CCC(O)C([O-])=O Amb24325325 [0,1,1,0,0,0|0,0,1]=3 3065 B6R0.3 CCC(O)P(O)=O Amb25169578 [0,1,1,0,0,0|1,0,0]=3 3066 B6R0.3 CCC(S)C(N)=O Amb24479879 [0,1,1,0,0,0|1,0,0]=3 3067 B6R0.3 CCN(C)C(C)=N Amb25107219 [0,1,1,0,0,0|2,0,0]=4 3068 B6R0.3 CCN(C)C(C)=O Amb22753516 [0,1,1,0,0,0|1,0,0]=3 3069 B6R0.3 CCN(O)C(N)=O Amb24669876 [0,1,1,0,0,0|2,0,0]=4 3070 B6R0.3 CC[C@@H](Br)C(=O)Cl Amb24582761 [0,1,1,0,0,0|1,0,0]=3 3071 B6R0.3 CC[C@@H](Br)C(N)=O Amb25025862 [0,1,1,0,0,0|1,0,0]=3 3072 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [0,1,1,0,0,0|1,0,0]=3 3073 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [0,1,1,0,0,0|1,0,0]=3 3074 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [0,1,1,0,0,0|1,0,0]=3 3075 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [0,1,1,0,0,0|0,0,0]=2 3076 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [0,1,1,0,0,0|0,0,0]=2 3077 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [0,1,1,0,0,0|1,0,0]=3 3078 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [0,1,1,0,0,0|1,0,0]=3 3079 B6R0.3 CC[C@@H](O)C(C)=O Amb25108045 [0,1,1,0,0,0|1,0,0]=3 3080 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [0,1,1,0,0,0|0,0,0]=2 3081 B6R0.3 CC[C@H](Br)C(N)=O Amb24365914 [0,1,1,0,0,0|1,0,0]=3 3082 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [0,1,1,0,0,0|0,0,0]=2 3083 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [0,1,1,0,0,0|0,0,0]=2 3084 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [0,1,1,0,0,0|1,0,1]=4 3085 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [0,1,1,0,0,0|1,0,0]=3 3086 B6R0.3 CC[C@H](C)C(N)=S Amb25266928 [0,1,1,0,0,0|1,1,0]=4 3087 B6R0.3 CC[C@H](Cl)C(=O)Cl Amb24710023 [0,1,1,0,0,0|1,0,0]=3 3088 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [0,1,1,0,0,0|0,0,0]=2 3089 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [0,1,1,0,0,0|0,0,0]=2 3090 B6R0.3 CC[C@H](O)C(C)=O Amb24332700 [0,1,1,0,0,0|1,0,0]=3 3091 B6R0.3 CC[C@H](O)C(N)=O Amb25858046 [0,1,1,0,0,0|1,0,0]=3 3092 B6R0.3 CC[N+](N)=C(C)N Amb25107724 [0,1,1,0,0,0|2,0,0]=4 3093 B6R0.3 CN=C(Cl)C(O)=O Amb24446313 [0,1,1,0,0,0|1,0,1]=4 3094 B6R0.3 CNC(=C)C(O)=O Amb25743212 [0,1,1,0,0,0|1,0,1]=4 3095 B6R0.3 CNC(=N)C(O)=O Amb18639921 [0,1,1,0,0,0|1,0,1]=4 3096 B6R0.3 CNC(=O)C(=O)C Amb17399787 [0,1,1,0,0,0|2,0,0]=4 3097 B6R0.3 CNC(=S)C(O)=O Amb24479905 [0,1,1,0,0,0|1,0,1]=4 3098 B6R0.3 CNC(C)C(C)=O Amb24369529 [0,1,1,0,0,0|2,0,0]=4 3099 B6R0.3 CNC(C)C(O)=O Amb19373699 [0,1,1,0,0,0|1,0,0]=3 3100 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [0,1,1,0,0,0|2,0,0]=4 3101 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [0,1,1,0,0,0|2,0,0]=4 3102 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [0,1,1,0,0,0|2,0,0]=4 3103 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [0,1,1,0,0,0|2,0,0]=4 3104 B6R0.3 COC(=C)C(O)=O Amb18639906 [0,1,1,0,0,0|1,0,1]=4 3105 B6R0.3 COC(=O)C(O)=O Amb22011503 [0,1,1,0,0,0|1,0,1]=4 3106 B6R0.3 COC(Br)C(C)=O Amb25360111 [0,1,1,0,0,0|2,0,0]=4 3107 B6R0.3 COC(N)C(N)=O Amb25178891 [0,1,1,0,0,0|2,0,0]=4 3108 B6R0.3 COC(N)C(O)=O Amb24621851 [0,1,1,0,0,0|1,0,0]=3 3109 B6R0.3 COC(O)C(O)=O Amb24479754 [0,1,1,0,0,0|1,0,0]=3 3110 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [0,1,1,0,0,0|2,0,0]=4 3111 B6R0.3 CSC(=O)C(O)=O Amb24731100 [0,1,1,0,0,0|1,0,1]=4 3112 B6R0.3 CSC(=S)C(O)=O Amb25702678 [0,1,1,0,0,0|1,0,1]=4 3113 B6R0.3 CSC(Br)C(O)=O Amb25169549 [0,1,1,0,0,0|1,0,0]=3 3114 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [0,1,1,0,0,0|2,0,0]=4 3115 B6R0.3 CSC(F)C(O)=O Amb25043740 [0,1,1,0,0,0|1,0,0]=3 3116 B6R0.3 CSC(O)C(C)=O Amb24479166 [0,1,1,0,0,0|2,0,0]=4 3117 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [0,1,1,0,0,0|1,0,0]=3 3118 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [0,1,1,0,0,0|1,0,0]=3 3119 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [0,1,1,0,0,0|1,0,0]=3 3120 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [0,1,1,0,0,0|1,0,0]=3 3121 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [0,1,1,0,0,0|1,0,0]=3 3122 B6R0.3 C[C@@H](CC)[C@H](C)O Amb24456969 [0,1,1,0,0,0|1,0,1]=4 3123 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [0,1,1,0,0,0|1,0,0]=3 3124 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [0,1,1,0,0,0|2,0,0]=4 3125 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [0,1,1,0,0,0|1,0,0]=3 3126 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [0,1,1,0,0,0|2,0,0]=4 3127 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [0,1,1,0,0,0|2,0,0]=4 3128 B6R0.3 C[C@@H](O)[C@@H](N)CC Amb24117049 [0,1,1,0,0,0|1,0,1]=4 3129 B6R0.3 C[C@@H](O)[C@H](N)CC Amb24117050 [0,1,1,0,0,0|1,0,1]=4 3130 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [0,1,1,0,0,0|2,0,0]=4 3131 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [0,1,1,0,0,0|1,0,0]=3 3132 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [0,1,1,0,0,0|1,0,0]=3 3133 B6R0.3 C[C@H](CC)[C@H](C)O Amb25675718 [0,1,1,0,0,0|1,0,1]=4 3134 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [0,1,1,0,0,0|2,0,0]=4 3135 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [0,1,1,0,0,0|1,0,0]=3 3136 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [0,1,1,0,0,0|1,0,0]=3 3137 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [0,1,1,0,0,0|1,0,0]=3 3138 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [0,1,1,0,0,0|1,0,1]=4 3139 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [0,1,1,0,0,0|2,0,0]=4 3140 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [0,1,1,0,0,0|2,0,0]=4 3141 B6R0.3 C\C(=C\C)\C(C)=O Amb25718935 [0,1,1,0,0,0|1,0,1]=4 3142 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [0,1,1,0,0,0|0,0,2]=4 3143 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [0,1,1,0,0,0|0,0,2]=4 3144 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [0,1,1,0,0,0|0,0,2]=4 3145 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [0,1,1,0,0,0|2,0,0]=4 3146 B6R0.3 NC(=O)C(Cl)CO Amb24392534 [0,1,1,0,0,0|2,0,0]=4 3147 B6R0.3 NC(=O)C(F)CF Amb25128008 [0,1,1,0,0,0|2,0,0]=4 3148 B6R0.3 NC(=O)C(F)CO Amb24507432 [0,1,1,0,0,0|2,0,0]=4 3149 B6R0.3 NC(=O)[C@H](O)CO Amb25732480 [0,1,1,0,0,0|2,0,0]=4 3150 B6R0.3 NC(C#N)C(O)=O Amb25328320 [0,1,1,0,0,0|1,0,1]=4 3151 B6R0.3 NC(C(=O)N)CO Amb17593097 [0,1,1,0,0,0|2,0,0]=4 3152 B6R0.3 NC(C(=O)O)CF Amb10839589 [0,1,1,0,0,0|1,0,0]=3 3153 B6R0.3 NC(C(=O)O)CS Amb13961966 [0,1,1,0,0,0|1,0,0]=3 3154 B6R0.3 NC(C=O)C(O)=O Amb24349579 [0,1,1,0,0,0|1,0,1]=4 3155 B6R0.3 NC(C=S)C(O)=O Amb25227802 [0,1,1,0,0,0|1,0,1]=4 3156 B6R0.3 NC(CCl)C(O)=O Amb19651457 [0,1,1,0,0,0|1,0,0]=3 3157 B6R0.3 NC(CCl)C(O)=O Amb21961077 [0,1,1,0,0,0|1,0,0]=3 3158 B6R0.3 NC(CI)C(O)=O Amb25177412 [0,1,1,0,0,0|1,0,0]=3 3159 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [0,1,1,0,0,0|1,0,0]=3 3160 B6R0.3 NC(CS)C(N)=O Amb18641990 [0,1,1,0,0,0|2,0,0]=4 3161 B6R0.3 NC(CS)C(O)=O Amb22489523 [0,1,1,0,0,0|1,0,0]=3 3162 B6R0.3 NC(CS)P(O)=O Amb25772157 [0,1,1,0,0,0|2,0,0]=4 3163 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [0,1,1,0,0,0|1,0,0]=3 3164 B6R0.3 NCC(=O)C(O)=O Amb24361938 [0,1,1,0,0,0|1,0,1]=4 3165 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [0,1,1,0,0,0|1,0,0]=3 3166 B6R0.3 NCC(C(=O)O)S Amb17593238 [0,1,1,0,0,0|1,0,0]=3 3167 B6R0.3 NCC(Cl)C(N)=O Amb25173817 [0,1,1,0,0,0|2,0,0]=4 3168 B6R0.3 NCC(F)C(O)=O Amb22733051 [0,1,1,0,0,0|1,0,0]=3 3169 B6R0.3 NCC(N)C(N)=O Amb18122079 [0,1,1,0,0,0|2,0,0]=4 3170 B6R0.3 NCC(N)C(O)=O Amb22899095 [0,1,1,0,0,0|1,0,0]=3 3171 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [0,1,1,0,0,0|1,0,0]=3 3172 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [0,1,1,0,0,0|1,0,0]=3 3173 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [0,1,1,0,0,0|1,0,0]=3 3174 B6R0.3 NC[C@@H](S)C(N)=O Amb25106293 [0,1,1,0,0,0|2,0,0]=4 3175 B6R0.3 NC[C@H](N)C(N)=O Amb24470655 [0,1,1,0,0,0|2,0,0]=4 3176 B6R0.3 NOC(F)C(O)=O Amb24446310 [0,1,1,0,0,0|2,0,0]=4 3177 B6R0.3 NOC(O)C(O)=O Amb24735537 [0,1,1,0,0,0|2,0,0]=4 3178 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [0,1,1,0,0,0|1,0,0]=3 3179 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [0,1,1,0,0,0|1,0,0]=3 3180 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [0,1,1,0,0,0|1,0,0]=3 3181 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [0,1,1,0,0,0|1,0,0]=3 3182 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [0,1,1,0,0,0|1,0,0]=3 3183 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [0,1,1,0,0,0|1,0,0]=3 3184 B6R0.3 N[C@@H](CS)C(=O)Cl Amb24562196 [0,1,1,0,0,0|2,0,0]=4 3185 B6R0.3 N[C@@H](CS)C(N)=O Amb23437751 [0,1,1,0,0,0|2,0,0]=4 3186 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [0,1,1,0,0,0|1,0,0]=3 3187 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [0,1,1,0,0,0|1,0,0]=3 3188 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [0,1,1,0,0,0|1,0,0]=3 3189 B6R0.3 N[C@H](CO)C(N)=O Amb22886957 [0,1,1,0,0,0|2,0,0]=4 3190 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [0,1,1,0,0,0|1,0,0]=3 3191 B6R0.3 O=C(Cl)C(F)CCl Amb25324478 [0,1,1,0,0,0|2,0,0]=4 3192 B6R0.3 O=C(S)C(Cl)CCl Amb25112062 [0,1,1,0,0,0|1,1,0]=4 3193 B6R0.3 OC(=O)C(=O)CBr Amb10068671 [0,1,1,0,0,0|1,0,1]=4 3194 B6R0.3 OC(=O)C(=O)CCl Amb16233358 [0,1,1,0,0,0|1,0,1]=4 3195 B6R0.3 OC(=O)C(=O)CF Amb22008247 [0,1,1,0,0,0|1,0,1]=4 3196 B6R0.3 OC(=O)C(=O)CF Amb22274202 [0,1,1,0,0,0|1,0,1]=4 3197 B6R0.3 OC(=O)C(=O)CS Amb22360785 [0,1,1,0,0,0|1,0,1]=4 3198 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [0,1,1,0,0,0|1,0,0]=3 3199 B6R0.3 OC(=O)C(CF)Br Amb10605519 [0,1,1,0,0,0|1,0,0]=3 3200 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [0,1,1,0,0,0|1,0,1]=4 3201 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [0,1,1,0,0,0|1,0,0]=3 3202 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [0,1,1,0,0,0|1,0,0]=3 3203 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [0,1,1,0,0,0|1,0,0]=3 3204 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [0,1,1,0,0,0|1,0,0]=3 3205 B6R0.3 OC(=O)C(F)C=O Amb22055301 [0,1,1,0,0,0|1,0,1]=4 3206 B6R0.3 OC(=O)C(F)CF Amb24746801 [0,1,1,0,0,0|1,0,0]=3 3207 B6R0.3 OC(=O)C(S)CS Amb18643295 [0,1,1,0,0,0|1,0,0]=3 3208 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [0,1,1,0,0,0|1,0,0]=3 3209 B6R0.3 OC(C=O)C(O)=O Amb18640325 [0,1,1,0,0,0|1,0,1]=4 3210 B6R0.3 OC(CBr)C(O)=O Amb24061932 [0,1,1,0,0,0|1,0,0]=3 3211 B6R0.3 OC(CCl)P(O)=O Amb25069434 [0,1,1,0,0,0|2,0,0]=4 3212 B6R0.3 OC(CS)C(O)=O Amb18642053 [0,1,1,0,0,0|1,0,0]=3 3213 B6R0.3 OCC(Br)C(O)=O Amb18126327 [0,1,1,0,0,0|1,0,0]=3 3214 B6R0.3 OCC(C(=O)O)F Amb17593117 [0,1,1,0,0,0|1,0,0]=3 3215 B6R0.3 OCC(C(=O)O)O Amb17593103 [0,1,1,0,0,0|1,0,0]=3 3216 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [0,1,1,0,0,0|1,0,0]=3 3217 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [0,1,1,0,0,0|1,0,0]=3 3218 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [0,1,1,0,0,0|1,0,0]=3 3219 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [0,1,1,0,0,0|1,0,0]=3 3220 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [0,1,1,0,0,0|1,0,0]=3 3221 B6R0.3 ONC(O)C(O)=O Amb25832155 [0,1,1,0,0,0|2,0,0]=4 3222 B6R0.3 O[13C](=O)C(=O)CBr Amb22363329 [0,1,1,0,0,0|1,0,1]=4 3223 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [0,1,1,0,0,0|1,0,0]=3 3224 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [0,1,1,0,0,0|1,0,0]=3 3225 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [0,1,1,0,0,0|1,0,0]=3 3226 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [0,1,1,0,0,0|1,0,0]=3 3227 B6R0.3 [13CH3]CC(=O)C([O-])=O Amb22353582 [0,1,1,0,0,0|0,0,2]=4 3228 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [0,1,1,0,0,0|0,0,0]=2 3229 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [0,1,1,0,0,0|1,0,0]=3 3230 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [0,1,1,0,0,0|1,0,0]=3 3231 B6R0.3 [O-]C(=O)C(O)CO Amb22045196 [0,1,1,0,0,0|1,0,1]=4 3232 B6R0.3 [O-]C(=O)[C@@H](O)CO Amb22799769 [0,1,1,0,0,0|1,0,1]=4 3233 B6R0.3 [O-]C(=O)[C@H](C[S-])N Amb17621353 [0,1,1,0,0,0|1,0,1]=4 3234 B6R0.4 BC(=O)OCCCl Amb25199831 [0,1,1,0,0,0|1,0,0]=3 3235 B6R0.4 BrCCOC(C)C Amb1105066 [0,1,1,0,0,0|1,0,1]=4 3236 B6R0.4 C#CCCC(N)=O Amb18636026 [0,1,1,0,0,0|1,0,1]=4 3237 B6R0.4 C#CCCC([O-])=O Amb22232009 [0,1,1,0,0,0|0,0,2]=4 3238 B6R0.4 C=C(Cl)CCCBr Amb25811643 [0,1,1,0,0,0|2,0,0]=4 3239 B6R0.4 C=C(Cl)CCCCl Amb24635037 [0,1,1,0,0,0|2,0,0]=4 3240 B6R0.4 C=C(F)CCCO Amb25811029 [0,1,1,0,0,0|2,0,0]=4 3241 B6R0.4 C=C(I)CCCN Amb24581029 [0,1,1,0,0,0|2,0,0]=4 3242 B6R0.4 C=NCCC(O)=O Amb24480865 [0,1,1,0,0,0|0,0,1]=3 3243 B6R0.4 CB(C)OCCN Amb25704633 [0,1,1,0,0,0|2,0,0]=4 3244 B6R0.4 CC#CCC(N)=O Amb24761404 [0,1,1,0,0,0|1,0,1]=4 3245 B6R0.4 CC#CCC(O)=O Amb17939740 [0,1,1,0,0,0|0,0,1]=3 3246 B6R0.4 CC(=C)CCCBr Amb22886717 [0,1,1,0,0,0|2,0,0]=4 3247 B6R0.4 CC(=C)CCCCl Amb24089299 [0,1,1,0,0,0|2,0,0]=4 3248 B6R0.4 CC(=C)CCCN Amb24761452 [0,1,1,0,0,0|2,0,0]=4 3249 B6R0.4 CC(=C)CCCO Amb22886814 [0,1,1,0,0,0|2,0,0]=4 3250 B6R0.4 CC(=C)NCCO Amb25127040 [0,1,1,0,0,0|2,0,0]=4 3251 B6R0.4 CC(=N)OCCCl Amb25063085 [0,1,1,0,0,0|1,0,0]=3 3252 B6R0.4 CC(=O)C#CCCl Amb24427329 [0,1,1,0,0,0|1,0,1]=4 3253 B6R0.4 CC(=O)CCC=O Amb18639597 [0,1,1,0,0,0|1,0,1]=4 3254 B6R0.4 CC(=O)CCC=S Amb25662155 [0,1,1,0,0,0|1,0,1]=4 3255 B6R0.4 CC(=O)CCCF Amb25068187 [0,1,1,0,0,0|1,0,0]=3 3256 B6R0.4 CC(=O)CCCI Amb25346994 [0,1,1,0,0,0|1,0,0]=3 3257 B6R0.4 CC(=O)CCCN Amb18121547 [0,1,1,0,0,0|1,0,0]=3 3258 B6R0.4 CC(=O)CCON Amb25186994 [0,1,1,0,0,0|2,0,0]=4 3259 B6R0.4 CC(=O)COC=O Amb24736861 [0,1,1,0,0,0|1,0,1]=4 3260 B6R0.4 CC(=O)N=CCO Amb24420730 [0,1,1,0,0,0|1,0,1]=4 3261 B6R0.4 CC(=O)NCC#C Amb20623038 [0,1,1,0,0,0|1,0,1]=4 3262 B6R0.4 CC(=O)NCC=O Amb25757509 [0,1,1,0,0,0|1,0,1]=4 3263 B6R0.4 CC(=O)NCCF Amb25832238 [0,1,1,0,0,0|1,0,0]=3 3264 B6R0.4 CC(=O)NCCI Amb25761166 [0,1,1,0,0,0|1,0,0]=3 3265 B6R0.4 CC(=O)NCCN Amb1218225 [0,1,1,0,0,0|1,0,0]=3 3266 B6R0.4 CC(=O)NCCS Amb22230992 [0,1,1,0,0,0|1,0,0]=3 3267 B6R0.4 CC(=O)NNCCl Amb24532146 [0,1,1,0,0,0|2,0,0]=4 3268 B6R0.4 CC(=O)OCCF Amb25123333 [0,1,1,0,0,0|0,0,0]=2 3269 B6R0.4 CC(=O)OCCI Amb17673987 [0,1,1,0,0,0|0,0,0]=2 3270 B6R0.4 CC(=O)OCCN Amb18121947 [0,1,1,0,0,0|0,0,0]=2 3271 B6R0.4 CC(=O)OCCP Amb25810695 [0,1,1,0,0,0|0,0,0]=2 3272 B6R0.4 CC(=O)ON=CCl Amb24677824 [0,1,1,0,0,0|1,0,1]=4 3273 B6R0.4 CC(=O)ON=CN Amb25732130 [0,1,1,0,0,0|1,0,1]=4 3274 B6R0.4 CC(=O)O\C=C/Cl Amb25190035 [0,1,1,0,0,0|0,0,2]=4 3275 B6R0.4 CC(=O)O\N=C/Cl Amb24373196 [0,1,1,0,0,0|1,0,1]=4 3276 B6R0.4 CC(=O)SCC=C Amb24531624 [0,1,1,0,0,0|0,1,1]=4 3277 B6R0.4 CC(=O)SCCBr Amb24608039 [0,1,1,0,0,0|0,1,0]=3 3278 B6R0.4 CC(=O)SCCCl Amb24746776 [0,1,1,0,0,0|0,1,0]=3 3279 B6R0.4 CC(=O)SCCN Amb21953963 [0,1,1,0,0,0|0,1,0]=3 3280 B6R0.4 CC(=O)SCCN Amb22011516 [0,1,1,0,0,0|0,1,0]=3 3281 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [0,1,1,0,0,0|1,0,1]=4 3282 B6R0.4 CC(=O)\C=C\CO Amb24414835 [0,1,1,0,0,0|1,0,1]=4 3283 B6R0.4 CC(=S)NCCO Amb25747406 [0,1,1,0,0,0|1,1,0]=4 3284 B6R0.4 CC(=S)OCC#N Amb22492642 [0,1,1,0,0,0|0,1,1]=4 3285 B6R0.4 CC(=S)OCC=C Amb22230177 [0,1,1,0,0,0|0,1,1]=4 3286 B6R0.4 CC(Br)=CCCO Amb24734140 [0,1,1,0,0,0|2,0,0]=4 3287 B6R0.4 CC(C)=CCCI Amb22395000 [0,1,1,0,0,0|2,0,0]=4 3288 B6R0.4 CC(C)=CCCN Amb18962494 [0,1,1,0,0,0|2,0,0]=4 3289 B6R0.4 CC(C)=CCCO Amb22002283 [0,1,1,0,0,0|2,0,0]=4 3290 B6R0.4 CC(C)=NCCN Amb24479886 [0,1,1,0,0,0|2,0,0]=4 3291 B6R0.4 CC(C)OCCN Amb21955181 [0,1,1,0,0,0|1,0,1]=4 3292 B6R0.4 CC(C)OCCN Amb22491045 [0,1,1,0,0,0|1,0,1]=4 3293 B6R0.4 CC(C)OCCS Amb25107566 [0,1,1,0,0,0|1,0,1]=4 3294 B6R0.4 CC(Cl)=CCCBr Amb24479000 [0,1,1,0,0,0|2,0,0]=4 3295 B6R0.4 CC(Cl)OCCCl Amb24470572 [0,1,1,0,0,0|1,0,1]=4 3296 B6R0.4 CC(I)=CCCN Amb25663209 [0,1,1,0,0,0|2,0,0]=4 3297 B6R0.4 CC(N)=NCCO Amb25083393 [0,1,1,0,0,0|2,0,0]=4 3298 B6R0.4 CC(O)CCCCl Amb22270232 [0,1,1,0,0,0|1,0,1]=4 3299 B6R0.4 CC(O)CCCF Amb24385806 [0,1,1,0,0,0|1,0,1]=4 3300 B6R0.4 CC(O)CCCO Amb22227752 [0,1,1,0,0,0|1,0,1]=4 3301 B6R0.4 CC(O)CCCS Amb25219256 [0,1,1,0,0,0|1,0,1]=4 3302 B6R0.4 CC(O)OCCCl Amb24523748 [0,1,1,0,0,0|0,0,2]=4 3303 B6R0.4 CC(O)OCCS Amb25313392 [0,1,1,0,0,0|0,0,2]=4 3304 B6R0.4 CC=C=CC(=O)O Amb17593065 [0,1,1,0,0,0|0,0,2]=4 3305 B6R0.4 CCC#CC(=O)Cl Amb25857496 [0,1,1,0,0,0|1,0,1]=4 3306 B6R0.4 CCC#CC(N)=O Amb25255265 [0,1,1,0,0,0|1,0,1]=4 3307 B6R0.4 CCC=CC(C)=O Amb22731698 [0,1,1,0,0,0|1,0,0]=3 3308 B6R0.4 CCCC=C(F)F Amb10840483 [0,1,1,0,0,0|2,0,0]=4 3309 B6R0.4 CCCCB(O)O Amb2447142 [0,1,1,0,0,0|1,0,1]=4 3310 B6R0.4 CCCCC(=C)Br Amb22583744 [0,1,1,0,0,0|2,0,0]=4 3311 B6R0.4 CCCCC(=N)N Amb10066937 [0,1,1,0,0,0|2,0,0]=4 3312 B6R0.4 CCCCC(=O)Br Amb22730323 [0,1,1,0,0,0|1,0,0]=3 3313 B6R0.4 CCCCC(N)O Amb24479887 [0,1,1,0,0,0|1,0,1]=4 3314 B6R0.4 CCCCC(O)=S Amb24682342 [0,1,1,0,0,0|0,1,0]=3 3315 B6R0.4 CCCCC(O)O Amb24687253 [0,1,1,0,0,0|0,0,2]=4 3316 B6R0.4 CCCCC(O)S Amb24480485 [0,1,1,0,0,0|0,1,1]=4 3317 B6R0.4 CCCCC([O-])=O Amb19879370 [0,1,1,0,0,0|0,0,1]=3 3318 B6R0.4 CCCCC([O-])=O Amb22056343 [0,1,1,0,0,0|0,0,1]=3 3319 B6R0.4 CCCCC([O-])=O Amb22729192 [0,1,1,0,0,0|0,0,1]=3 3320 B6R0.4 CCCCC([O-])=O Amb22731639 [0,1,1,0,0,0|0,0,1]=3 3321 B6R0.4 CCCCS(=O)Cl Amb24551332 [0,1,1,0,0,0|2,0,0]=4 3322 B6R0.4 CCCCS([O-])=O Amb19889352 [0,1,1,0,0,0|1,0,1]=4 3323 B6R0.4 CCCC[13C](O)=O Amb22367454 [0,1,1,0,0,0|0,0,0]=2 3324 B6R0.4 CCCC[C@@H](C)O Amb19929139 [0,1,1,0,0,0|1,0,1]=4 3325 B6R0.4 CCCC[Sn](=O)S Amb22730994 [0,1,1,0,0,0|1,1,0]=4 3326 B6R0.4 CCCC[Sn](O)=O Amb22336393 [0,1,1,0,0,0|1,0,0]=3 3327 B6R0.4 CCCNC(=N)N Amb10844865 [0,1,1,0,0,0|2,0,0]=4 3328 B6R0.4 CCCNC(=N)N Amb16206147 [0,1,1,0,0,0|2,0,0]=4 3329 B6R0.4 CCCNC(=O)Cl Amb25688616 [0,1,1,0,0,0|1,0,0]=3 3330 B6R0.4 CCCNC(=O)N Amb1152241 [0,1,1,0,0,0|1,0,0]=3 3331 B6R0.4 CCCNC(=S)N Amb1152085 [0,1,1,0,0,0|1,1,0]=4 3332 B6R0.4 CCCNC(C)=S Amb25742111 [0,1,1,0,0,0|1,1,0]=4 3333 B6R0.4 CCCNC(C)O Amb25821613 [0,1,1,0,0,0|1,0,1]=4 3334 B6R0.4 CCCNC(N)=N Amb20667746 [0,1,1,0,0,0|2,0,0]=4 3335 B6R0.4 CCCNC(O)=S Amb25302945 [0,1,1,0,0,0|0,1,0]=3 3336 B6R0.4 CCCNS(C)=O Amb25024775 [0,1,1,0,0,0|2,0,0]=4 3337 B6R0.4 CCCN[N+]([O-])=O Amb21953652 [0,1,1,0,0,0|1,0,1]=4 3338 B6R0.4 CCCOC(=O)Cl Amb10604123 [0,1,1,0,0,0|1,0,0]=3 3339 B6R0.4 CCCOC(N)=S Amb24382119 [0,1,1,0,0,0|1,1,0]=4 3340 B6R0.4 CCCOC([S-])=S Amb22334111 [0,1,1,0,0,0|0,2,0]=4 3341 B6R0.4 CCCOP(O)=O Amb25366595 [0,1,1,0,0,0|1,0,0]=3 3342 B6R0.4 CCCO[N+]([O-])=O Amb22732564 [0,1,1,0,0,0|1,0,1]=4 3343 B6R0.4 CCCSC(C)=O Amb22043301 [0,1,1,0,0,0|0,1,0]=3 3344 B6R0.4 CCCSC(N)=N Amb20676008 [0,1,1,0,0,0|2,0,0]=4 3345 B6R0.4 CCCSC(N)=N Amb23482968 [0,1,1,0,0,0|2,0,0]=4 3346 B6R0.4 CCCSC(N)=S Amb24349580 [0,1,1,0,0,0|1,1,0]=4 3347 B6R0.4 CCNC=C(C)C Amb25224644 [0,1,1,0,0,0|2,0,0]=4 3348 B6R0.4 CCNCC(=C)Br Amb18969562 [0,1,1,0,0,0|2,0,0]=4 3349 B6R0.4 CCNCC(=C)Cl Amb18289297 [0,1,1,0,0,0|2,0,0]=4 3350 B6R0.4 CCNCC(=O)N Amb1128676 [0,1,1,0,0,0|1,0,0]=3 3351 B6R0.4 CCNCC(=O)O Amb10609667 [0,1,1,0,0,0|0,0,0]=2 3352 B6R0.4 CCNCC(=S)N Amb17231834 [0,1,1,0,0,0|1,1,0]=4 3353 B6R0.4 CCNCC(C)=O Amb24545893 [0,1,1,0,0,0|1,0,0]=3 3354 B6R0.4 CCNC[C@H](C)O Amb25785620 [0,1,1,0,0,0|1,0,1]=4 3355 B6R0.4 CCNOC(C)C Amb25839173 [0,1,1,0,0,0|1,0,1]=4 3356 B6R0.4 CCN\N=C(\C)/N Amb24479322 [0,1,1,0,0,0|2,0,0]=4 3357 B6R0.4 CCOCB(O)O Amb25356792 [0,1,1,0,0,0|1,0,1]=4 3358 B6R0.4 CCOCC(=C)Br Amb24673237 [0,1,1,0,0,0|1,0,1]=4 3359 B6R0.4 CCOCC(C)=C Amb25761593 [0,1,1,0,0,0|1,0,0]=3 3360 B6R0.4 CCOCC(C)C Amb17673917 [0,1,1,0,0,0|1,0,1]=4 3361 B6R0.4 CCOCC(C)Cl Amb24429086 [0,1,1,0,0,0|1,0,1]=4 3362 B6R0.4 CCOCC(N)=N Amb19890012 [0,1,1,0,0,0|2,0,0]=4 3363 B6R0.4 CCOCC(N)C Amb10610346 [0,1,1,0,0,0|1,0,1]=4 3364 B6R0.4 CCOCC(N)C Amb1133021 [0,1,1,0,0,0|1,0,1]=4 3365 B6R0.4 CCOC[C@@H](C)N Amb18016634 [0,1,1,0,0,0|1,0,1]=4 3366 B6R0.4 CCOC[C@@H](N)C Amb17061642 [0,1,1,0,0,0|1,0,1]=4 3367 B6R0.4 CCOC[C@H](C)O Amb25067464 [0,1,1,0,0,0|0,0,2]=4 3368 B6R0.4 CCON=C(C)N Amb25046559 [0,1,1,0,0,0|1,0,0]=3 3369 B6R0.4 CCONC(C)=O Amb22230675 [0,1,1,0,0,0|0,0,0]=2 3370 B6R0.4 CCONC(N)=N Amb25783705 [0,1,1,0,0,0|2,0,0]=4 3371 B6R0.4 CCSCC(=O)O Amb1125185 [0,1,1,0,0,0|0,0,0]=2 3372 B6R0.4 CCSCC(C)O Amb24458211 [0,1,1,0,0,0|1,0,1]=4 3373 B6R0.4 CCSCC(N)=O Amb24420234 [0,1,1,0,0,0|1,0,0]=3 3374 B6R0.4 CCSC[C@H](C)O Amb25220206 [0,1,1,0,0,0|1,0,1]=4 3375 B6R0.4 CCSNC(N)=O Amb24479375 [0,1,1,0,0,0|1,1,0]=4 3376 B6R0.4 CC\C=C/C(O)=O Amb22230421 [0,1,1,0,0,0|0,0,1]=3 3377 B6R0.4 CC\C=C\C(N)=O Amb25770876 [0,1,1,0,0,0|1,0,1]=4 3378 B6R0.4 CC\C=N\C(N)=O Amb24479183 [0,1,1,0,0,0|1,0,1]=4 3379 B6R0.4 CN=C=CC(C)=O Amb25233778 [0,1,1,0,0,0|1,0,1]=4 3380 B6R0.4 CN=CCC(C)=O Amb25261368 [0,1,1,0,0,0|1,0,1]=4 3381 B6R0.4 CNCC=C(C)C Amb18121215 [0,1,1,0,0,0|2,0,0]=4 3382 B6R0.4 CNCCC(=O)O Amb10609760 [0,1,1,0,0,0|0,0,0]=2 3383 B6R0.4 CNCCC(=S)N Amb17231833 [0,1,1,0,0,0|1,1,0]=4 3384 B6R0.4 CNCCC(C)=C Amb18993045 [0,1,1,0,0,0|2,0,0]=4 3385 B6R0.4 CNCCC(C)=O Amb24560306 [0,1,1,0,0,0|1,0,0]=3 3386 B6R0.4 CNCCC(N)=O Amb19959913 [0,1,1,0,0,0|1,0,0]=3 3387 B6R0.4 CNCCC(O)C Amb17569889 [0,1,1,0,0,0|1,0,1]=4 3388 B6R0.4 CNCCS(C)=O Amb21984676 [0,1,1,0,0,0|2,0,0]=4 3389 B6R0.4 CNC\C=C(\C)/Cl Amb25041057 [0,1,1,0,0,0|2,0,0]=4 3390 B6R0.4 CNN=CC(C)=O Amb24481082 [0,1,1,0,0,0|2,0,0]=4 3391 B6R0.4 CNNCC(N)=O Amb25773971 [0,1,1,0,0,0|2,0,0]=4 3392 B6R0.4 CNNCC(O)=O Amb21929288 [0,1,1,0,0,0|1,0,0]=3 3393 B6R0.4 CNOCC(C)=C Amb25235106 [0,1,1,0,0,0|2,0,0]=4 3394 B6R0.4 CNOCC(O)=O Amb25104714 [0,1,1,0,0,0|1,0,0]=3 3395 B6R0.4 CN\C=C/C(C)=O Amb24646447 [0,1,1,0,0,0|1,0,1]=4 3396 B6R0.4 CN\C=C\C(=O)C Amb17593076 [0,1,1,0,0,0|1,0,1]=4 3397 B6R0.4 COCCC(C)O Amb20621489 [0,1,1,0,0,0|1,0,1]=4 3398 B6R0.4 COCCC(N)O Amb25727188 [0,1,1,0,0,0|1,0,1]=4 3399 B6R0.4 COCCC(O)Br Amb20242943 [0,1,1,0,0,0|1,0,1]=4 3400 B6R0.4 COCCN(=O)=O Amb24126452 [0,1,1,0,0,0|1,0,1]=4 3401 B6R0.4 COCNC(C)=O Amb24659843 [0,1,1,0,0,0|1,0,0]=3 3402 B6R0.4 COCNC(N)=O Amb25744350 [0,1,1,0,0,0|2,0,0]=4 3403 B6R0.4 CON=CC(C)=O Amb25236948 [0,1,1,0,0,0|2,0,0]=4 3404 B6R0.4 CON=CC(O)=O Amb25292253 [0,1,1,0,0,0|1,0,1]=4 3405 B6R0.4 CO\C=C\C(O)=O Amb18121767 [0,1,1,0,0,0|0,0,2]=4 3406 B6R0.4 CO\N=C\C(=O)O Amb10976081 [0,1,1,0,0,0|1,0,1]=4 3407 B6R0.4 CP(=O)OCCO Amb25221445 [0,1,1,0,0,0|1,0,0]=3 3408 B6R0.4 CP(Cl)OCCCl Amb17674071 [0,1,1,0,0,0|2,0,0]=4 3409 B6R0.4 CP(O)OCCN Amb25127648 [0,1,1,0,0,0|1,0,1]=4 3410 B6R0.4 CS(=O)CCCBr Amb24365916 [0,1,1,0,0,0|2,0,0]=4 3411 B6R0.4 CS(=O)CCCN Amb18974527 [0,1,1,0,0,0|2,0,0]=4 3412 B6R0.4 CS(=O)NCCI Amb24662928 [0,1,1,0,0,0|2,0,0]=4 3413 B6R0.4 CSCCC(=S)N Amb17307559 [0,1,1,0,0,0|1,1,0]=4 3414 B6R0.4 CSCCC(N)=N Amb19373501 [0,1,1,0,0,0|2,0,0]=4 3415 B6R0.4 CSCCC(N)=N Amb19516878 [0,1,1,0,0,0|2,0,0]=4 3416 B6R0.4 CSCCC(N)=O Amb24479809 [0,1,1,0,0,0|1,0,0]=3 3417 B6R0.4 CSCCN(=O)=O Amb24179458 [0,1,1,0,0,0|1,0,1]=4 3418 B6R0.4 CSCNC(C)=O Amb24561383 [0,1,1,0,0,0|1,0,0]=3 3419 B6R0.4 CSCNC(N)=O Amb24612362 [0,1,1,0,0,0|2,0,0]=4 3420 B6R0.4 CSCOC(C)=O Amb19884027 [0,1,1,0,0,0|0,0,0]=2 3421 B6R0.4 CSSCC(N)=O Amb24480454 [0,1,1,0,0,0|2,0,0]=4 3422 B6R0.4 CSSCC(O)=O Amb25378801 [0,1,1,0,0,0|1,0,0]=3 3423 B6R0.4 CS\C=C\C(C)=O Amb25768455 [0,1,1,0,0,0|1,0,1]=4 3424 B6R0.4 CS\C=C\C(O)=O Amb18641964 [0,1,1,0,0,0|0,0,2]=4 3425 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [0,1,1,0,0,0|1,0,1]=4 3426 B6R0.4 C[C@@H](O)CCCN Amb24479875 [0,1,1,0,0,0|1,0,1]=4 3427 B6R0.4 C[C@@H](O)CCCS Amb25794939 [0,1,1,0,0,0|1,0,1]=4 3428 B6R0.4 C[C@H](O)CCCCl Amb22348392 [0,1,1,0,0,0|1,0,1]=4 3429 B6R0.4 C[Si](=O)CCCN Amb22351702 [0,1,1,0,0,0|1,1,0]=4 3430 B6R0.4 C\C(\Br)=C\CCCl Amb25374563 [0,1,1,0,0,0|2,0,0]=4 3431 B6R0.4 C\C=C/CC(C)=O Amb25723218 [0,1,1,0,0,0|1,0,1]=4 3432 B6R0.4 C\C=C/CC(O)=O Amb25692581 [0,1,1,0,0,0|0,0,1]=3 3433 B6R0.4 C\C=C\CC(C)=O Amb24359011 [0,1,1,0,0,0|1,0,1]=4 3434 B6R0.4 C\C=N\CC(O)=O Amb24618330 [0,1,1,0,0,0|0,0,1]=3 3435 B6R0.4 ClC(=O)OCC#C Amb13777322 [0,1,1,0,0,0|1,0,1]=4 3436 B6R0.4 ClCCCC(=O)N Amb1138237 [0,1,1,0,0,0|1,0,0]=3 3437 B6R0.4 FCCCC(=O)O Amb17593104 [0,1,1,0,0,0|0,0,0]=2 3438 B6R0.4 N#CCCC(=O)C Amb17334046 [0,1,1,0,0,0|1,0,1]=4 3439 B6R0.4 N#CCCC(=O)Cl Amb25106570 [0,1,1,0,0,0|1,0,1]=4 3440 B6R0.4 N#CCOC(=O)Cl Amb25079539 [0,1,1,0,0,0|1,0,1]=4 3441 B6R0.4 N#CNCC(O)=O Amb25173813 [0,1,1,0,0,0|1,0,1]=4 3442 B6R0.4 N#CSCC(O)=O Amb24480976 [0,1,1,0,0,0|1,0,1]=4 3443 B6R0.4 N=CNCC(O)=O Amb24670244 [0,1,1,0,0,0|1,0,1]=4 3444 B6R0.4 NC(=N)OCCO Amb24764250 [0,1,1,0,0,0|2,0,0]=4 3445 B6R0.4 NC(=O)CCCBr Amb25779163 [0,1,1,0,0,0|1,0,0]=3 3446 B6R0.4 NC(=O)CCCO Amb20623438 [0,1,1,0,0,0|1,0,0]=3 3447 B6R0.4 NC(=O)CSCCl Amb25135617 [0,1,1,0,0,0|2,0,0]=4 3448 B6R0.4 NC(=O)NCCO Amb1146041 [0,1,1,0,0,0|2,0,0]=4 3449 B6R0.4 NC(=O)OCC#N Amb24682691 [0,1,1,0,0,0|1,0,1]=4 3450 B6R0.4 NC(=O)OCC=O Amb24446581 [0,1,1,0,0,0|1,0,1]=4 3451 B6R0.4 NC(=O)OCCBr Amb25145573 [0,1,1,0,0,0|1,0,0]=3 3452 B6R0.4 NC(=O)OCCO Amb20623788 [0,1,1,0,0,0|1,0,0]=3 3453 B6R0.4 NC(=S)CCCF Amb24667655 [0,1,1,0,0,0|1,1,0]=4 3454 B6R0.4 NC(=S)OCCO Amb24581246 [0,1,1,0,0,0|1,1,0]=4 3455 B6R0.4 NCC#CC(O)=O Amb25703096 [0,1,1,0,0,0|0,0,2]=4 3456 B6R0.4 NCCCC(=O)Cl Amb1935063 [0,1,1,0,0,0|1,0,0]=3 3457 B6R0.4 NCCCC(=O)N Amb2099583 [0,1,1,0,0,0|1,0,0]=3 3458 B6R0.4 NCCCC(=O)O Amb1935210 [0,1,1,0,0,0|0,0,0]=2 3459 B6R0.4 NCCCC(Cl)=O Amb17801145 [0,1,1,0,0,0|1,0,0]=3 3460 B6R0.4 NCCCC(N)=S Amb24479598 [0,1,1,0,0,0|1,1,0]=4 3461 B6R0.4 NCCCC(N)O Amb25063002 [0,1,1,0,0,0|1,0,1]=4 3462 B6R0.4 NCCCP(O)=O Amb22370049 [0,1,1,0,0,0|1,0,0]=3 3463 B6R0.4 NCCCS(=O)=O Amb24427014 [0,1,1,0,0,0|1,0,1]=4 3464 B6R0.4 NCCCS(O)=O Amb25185942 [0,1,1,0,0,0|1,0,0]=3 3465 B6R0.4 NCCC[N+]([O-])=O Amb18833132 [0,1,1,0,0,0|1,0,1]=4 3466 B6R0.4 NCCNC(N)=O Amb19374121 [0,1,1,0,0,0|2,0,0]=4 3467 B6R0.4 NCCOC(N)=N Amb25368790 [0,1,1,0,0,0|2,0,0]=4 3468 B6R0.4 NCCOC(N)=O Amb22059480 [0,1,1,0,0,0|1,0,0]=3 3469 B6R0.4 NCCOC(N)=O Amb24271076 [0,1,1,0,0,0|1,0,0]=3 3470 B6R0.4 NCCOS(O)=O Amb25843211 [0,1,1,0,0,0|2,0,0]=4 3471 B6R0.4 NCCO[N+]([O-])=O Amb22732697 [0,1,1,0,0,0|2,0,0]=4 3472 B6R0.4 NC\C=C/C(O)=O Amb24117018 [0,1,1,0,0,0|0,0,2]=4 3473 B6R0.4 NC\C=C\C(O)=O Amb18639655 [0,1,1,0,0,0|0,0,2]=4 3474 B6R0.4 NC\C=C\C(O)=O Amb24325004 [0,1,1,0,0,0|0,0,2]=4 3475 B6R0.4 NNCCC(N)=O Amb24406769 [0,1,1,0,0,0|2,0,0]=4 3476 B6R0.4 NOCCC(=O)O Amb17569891 [0,1,1,0,0,0|1,0,0]=3 3477 B6R0.4 O=C(Br)CCCBr Amb25724818 [0,1,1,0,0,0|1,0,0]=3 3478 B6R0.4 O=C(Br)CCCCl Amb25146320 [0,1,1,0,0,0|1,0,0]=3 3479 B6R0.4 O=C(Cl)NCCCl Amb24479815 [0,1,1,0,0,0|2,0,0]=4 3480 B6R0.4 O=C(Cl)OCCF Amb21618836 [0,1,1,0,0,0|1,0,0]=3 3481 B6R0.4 O=C(Cl)SCCCl Amb25272444 [0,1,1,0,0,0|1,1,0]=4 3482 B6R0.4 O=C(S)CCCCl Amb24683280 [0,1,1,0,0,0|0,1,0]=3 3483 B6R0.4 O=CCOC(=O)C Amb10070247 [0,1,1,0,0,0|0,0,1]=3 3484 B6R0.4 O=CNCC(=O)O Amb1911508 [0,1,1,0,0,0|1,0,1]=4 3485 B6R0.4 O=S(Cl)CCCCl Amb25791632 [0,1,1,0,0,0|2,0,0]=4 3486 B6R0.4 OB(O)CCCBr Amb24480413 [0,1,1,0,0,0|1,0,1]=4 3487 B6R0.4 OC(=O)CCC=O Amb17673897 [0,1,1,0,0,0|0,0,1]=3 3488 B6R0.4 OC(=O)CCCI Amb22295911 [0,1,1,0,0,0|0,0,0]=2 3489 B6R0.4 OC(=O)CCCP Amb24717184 [0,1,1,0,0,0|0,0,0]=2 3490 B6R0.4 OC(=O)CCNCl Amb24437846 [0,1,1,0,0,0|1,0,0]=3 3491 B6R0.4 OC(=O)CN=C=S Amb25024397 [0,1,1,0,0,0|1,0,1]=4 3492 B6R0.4 OC(=O)CSN=O Amb24368923 [0,1,1,0,0,0|2,0,0]=4 3493 B6R0.4 OC(=O)C\C=C\Br Amb24511491 [0,1,1,0,0,0|0,0,2]=4 3494 B6R0.4 OC(=O)C\C=C\Cl Amb25111871 [0,1,1,0,0,0|0,0,2]=4 3495 B6R0.4 OC(=O)C\C=C\I Amb24507704 [0,1,1,0,0,0|0,0,2]=4 3496 B6R0.4 OC(=O)\C=C\CBr Amb18646194 [0,1,1,0,0,0|0,0,2]=4 3497 B6R0.4 OC(=O)\C=C\CCl Amb23399655 [0,1,1,0,0,0|0,0,2]=4 3498 B6R0.4 OC(=O)\C=C\CF Amb24117236 [0,1,1,0,0,0|0,0,2]=4 3499 B6R0.4 OC(=O)\C=C\CI Amb25350297 [0,1,1,0,0,0|0,0,2]=4 3500 B6R0.4 OC(=O)\C=C\CS Amb18285239 [0,1,1,0,0,0|0,0,2]=4 3501 B6R0.4 OCC#CC(O)=O Amb22002375 [0,1,1,0,0,0|0,0,2]=4 3502 B6R0.4 OCCCC(=O)O Amb17615189 [0,1,1,0,0,0|0,0,0]=2 3503 B6R0.4 OCCCC(O)=O Amb18640332 [0,1,1,0,0,0|0,0,0]=2 3504 B6R0.4 OCCCC(O)O Amb22802459 [0,1,1,0,0,0|0,0,2]=4 3505 B6R0.4 OCCNS(O)=O Amb25283153 [0,1,1,0,0,0|2,0,0]=4 3506 B6R0.4 OCCOC(=O)S Amb25106059 [0,1,1,0,0,0|1,0,0]=3 3507 B6R0.4 OCCOC([S-])=S Amb25846944 [0,1,1,0,0,0|1,1,0]=4 3508 B6R0.4 OCCOP(O)=O Amb25739645 [0,1,1,0,0,0|2,0,0]=4 3509 B6R0.4 OCCOS(=O)=O Amb24686082 [0,1,1,0,0,0|2,0,0]=4 3510 B6R0.4 OCCOS(O)=O Amb17942859 [0,1,1,0,0,0|2,0,0]=4 3511 B6R0.4 ON=NCC(O)=O Amb25204101 [0,1,1,0,0,0|2,0,0]=4 3512 B6R0.4 OP(=O)OCCCl Amb24479734 [0,1,1,0,0,0|2,0,0]=4 3513 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [0,1,1,0,0,0|0,0,0]=2 3514 B6R0.4 SCCCC(=O)O Amb16185429 [0,1,1,0,0,0|0,0,0]=2 3515 B6R0.4 [C-]#[N+]CCC(N)=O Amb24411954 [0,1,1,0,0,0|1,0,1]=4 3516 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [0,1,1,0,0,0|2,0,0]=4 3517 B6R0.4 [O-]C(=O)OCCBr Amb24394548 [0,1,1,0,0,0|1,0,0]=3 3518 B6R0.4 [O-][N+](=O)CCCCl Amb25267487 [0,1,1,0,0,0|1,0,1]=4 3519 B6R0.4 [O-][N+](=O)CCCF Amb25234942 [0,1,1,0,0,0|1,0,1]=4 3520 B6R0.4 [O-][N+](=O)CCCO Amb20247690 [0,1,1,0,0,0|1,0,1]=4 3521 B6R0.5 CCCC(N)(N)O Amb24616328 [0,1,1,0,0,0|1,0,1]=4 3522 B6R0.5 CCCC(N)(O)O Amb24480396 [0,1,1,0,0,0|0,0,2]=4 3523 B6R0.5 CCCP(=O)(Cl)Cl Amb22053922 [0,1,1,0,0,0|2,0,0]=4 3524 B6R0.5 CCCP(O)(O)=O Amb22230045 [0,1,1,0,0,0|1,0,0]=3 3525 B6R0.5 CCCS(=O)(=O)Br Amb23555502 [0,1,1,0,0,0|1,0,1]=4 3526 B6R0.5 CCCS(=O)(=O)F Amb10610150 [0,1,1,0,0,0|1,0,1]=4 3527 B6R0.5 CCCS(=O)(=O)N Amb1139748 [0,1,1,0,0,0|1,0,1]=4 3528 B6R0.5 CCCS(=O)(=O)[S-] Amb22369121 [0,1,1,0,0,0|1,0,1]=4 3529 B6R0.5 CCN=S(C)(C)=O Amb25850108 [0,1,1,0,0,0|2,0,0]=4 3530 B6R0.5 CCNS(O)(=O)=O Amb19650770 [0,1,1,0,0,0|2,0,0]=4 3531 B6R0.5 CCOC(C)(Cl)Cl Amb24380355 [0,1,1,0,0,0|1,0,1]=4 3532 B6R0.5 CCOC(C)(O)O Amb25367123 [0,1,1,0,0,0|0,0,2]=4 3533 B6R0.5 CCOC([13CH3])([13CH3])[13CH3] Amb22353648 [0,1,1,0,0,0|1,0,1]=4 3534 B6R0.5 CCOP(=O)(C)[S-] Amb15772345 [0,1,1,0,0,0|1,0,0]=3 3535 B6R0.5 CCOP(C)(O)=O Amb17673498 [0,1,1,0,0,0|1,0,0]=3 3536 B6R0.5 CCOP(C)(O)=S Amb22366929 [0,1,1,0,0,0|1,0,1]=4 3537 B6R0.5 CCOP(O)(=O)F Amb24609989 [0,1,1,0,0,0|2,0,0]=4 3538 B6R0.5 CCOP(O)(O)=O Amb22230660 [0,1,1,0,0,0|2,0,0]=4 3539 B6R0.5 CCOS(=O)(=O)[O-] Amb17620116 [0,1,1,0,0,0|2,0,0]=4 3540 B6R0.5 CCOS(=O)(=O)[O-] Amb2560788 [0,1,1,0,0,0|2,0,0]=4 3541 B6R0.5 CCOS(Cl)(=O)=O Amb17940890 [0,1,1,0,0,0|2,0,0]=4 3542 B6R0.5 CCOS([O-])(=O)=O Amb22526596 [0,1,1,0,0,0|2,0,0]=4 3543 B6R0.5 CCSS(=O)(=O)C Amb17614102 [0,1,1,0,0,0|1,1,0]=4 3544 B6R0.5 COCP(O)(O)=O Amb24580709 [0,1,1,0,0,0|2,0,0]=4 3545 B6R0.5 CP(O)(=O)CCO Amb25085578 [0,1,1,0,0,0|2,0,0]=4 3546 B6R0.5 OCCP(O)(O)=O Amb22388824 [0,1,1,0,0,0|2,0,0]=4 3547 B6R0.5 OCCS(O)(=O)=O Amb22274016 [0,1,1,0,0,0|2,0,0]=4 3548 B6R0.5 OCCS(O)(=O)=O Amb22360755 [0,1,1,0,0,0|2,0,0]=4 3549 B6R0.5 OCCS(O)(=O)=O Amb22751389 [0,1,1,0,0,0|2,0,0]=4 3550 B6R0.5 OS(=O)(=O)CCBr Amb17938633 [0,1,1,0,0,0|2,0,0]=4 3551 B6R0.5 OS(=O)(=O)CCS Amb22337599 [0,1,1,0,0,0|2,0,0]=4 3552 B6R0.5 OS(=O)(=O)CCS Amb22337676 [0,1,1,0,0,0|2,0,0]=4 3553 B6R0.5 [15NH2]CCS(O)(=O)=O Amb22363139 [0,1,1,0,0,0|2,0,0]=4 3554 B6R0.6 C#CCNCCO Amb19148766 [0,1,1,0,0,0|1,0,1]=4 3555 B6R0.6 C#CCOCC=O Amb25123719 [0,1,1,0,0,0|0,0,2]=4 3556 B6R0.6 C#CCONC=O Amb25853948 [0,1,1,0,0,0|0,0,2]=4 3557 B6R0.6 C#C\C=C\CCO Amb25720784 [0,1,1,0,0,0|1,0,1]=4 3558 B6R0.6 C=C=CCCCBr Amb24479398 [0,1,1,0,0,0|2,0,0]=4 3559 B6R0.6 C=C=COCCO Amb25721997 [0,1,1,0,0,0|2,0,0]=4 3560 B6R0.6 C=CCC#CCO Amb24479025 [0,1,1,0,0,0|1,0,1]=4 3561 B6R0.6 C=CCCCC#C Amb22227961 [0,1,1,0,0,0|2,0,0]=4 3562 B6R0.6 C=CCCCC=C Amb22227760 [0,1,1,0,0,0|2,0,0]=4 3563 B6R0.6 C=CCCCC=O Amb13883672 [0,1,1,0,0,0|1,0,0]=3 3564 B6R0.6 C=CCCCCF Amb24409527 [0,1,1,0,0,0|2,0,0]=4 3565 B6R0.6 C=CCCCCN Amb18639514 [0,1,1,0,0,0|2,0,0]=4 3566 B6R0.6 C=CCCCCN Amb22899138 [0,1,1,0,0,0|2,0,0]=4 3567 B6R0.6 C=CCCCON Amb25284631 [0,1,1,0,0,0|1,0,0]=3 3568 B6R0.6 C=CCCC[Zn]Br Amb22000384 [0,1,1,0,0,0|2,0,0]=4 3569 B6R0.6 C=CCCOCO Amb22338634 [0,1,1,0,0,0|1,0,0]=3 3570 B6R0.6 C=CCNCCF Amb25062629 [0,1,1,0,0,0|2,0,0]=4 3571 B6R0.6 C=CCNCCI Amb25026445 [0,1,1,0,0,0|2,0,0]=4 3572 B6R0.6 C=CCNCCS Amb18641942 [0,1,1,0,0,0|1,1,0]=4 3573 B6R0.6 C=CCOCCI Amb24739964 [0,1,1,0,0,0|2,0,0]=4 3574 B6R0.6 C=CCOCCN Amb19033754 [0,1,1,0,0,0|2,0,0]=4 3575 B6R0.6 C=CCOCCS Amb24333486 [0,1,1,0,0,0|1,1,0]=4 3576 B6R0.6 C=CCSCC=O Amb18641509 [0,1,1,0,0,0|1,0,1]=4 3577 B6R0.6 C=CCSCCBr Amb24390288 [0,1,1,0,0,0|2,0,0]=4 3578 B6R0.6 C=CCSCCS Amb25284972 [0,1,1,0,0,0|1,1,0]=4 3579 B6R0.6 C=COCCCBr Amb25811206 [0,1,1,0,0,0|1,0,0]=3 3580 B6R0.6 C=COCCCF Amb22008255 [0,1,1,0,0,0|1,0,0]=3 3581 B6R0.6 C=COCCON Amb22001402 [0,1,1,0,0,0|2,0,0]=4 3582 B6R0.6 C=CSCCCO Amb25026486 [0,1,1,0,0,0|1,0,0]=3 3583 B6R0.6 C=C\C=C\CCO Amb24480746 [0,1,1,0,0,0|1,0,1]=4 3584 B6R0.6 CC#CCCC=O Amb24600953 [0,1,1,0,0,0|1,0,1]=4 3585 B6R0.6 CC#CCCCO Amb20242139 [0,1,1,0,0,0|1,0,1]=4 3586 B6R0.6 CC#CCNC=O Amb25146465 [0,1,1,0,0,0|1,0,1]=4 3587 B6R0.6 CCCC#CC=C Amb17673843 [0,1,1,0,0,0|2,0,0]=4 3588 B6R0.6 CCCC/C=C/Br Amb17940862 [0,1,1,0,0,0|2,0,0]=4 3589 B6R0.6 CCCCC=C=C Amb17670592 [0,1,1,0,0,0|2,0,0]=4 3590 B6R0.6 CCCCC=NN Amb25344632 [0,1,1,0,0,0|2,0,0]=4 3591 B6R0.6 CCCCCNO Amb25067859 [0,1,1,0,0,0|1,0,1]=4 3592 B6R0.6 CCCCCON Amb18122095 [0,1,1,0,0,0|1,0,1]=4 3593 B6R0.6 CCCCNC=C Amb25822786 [0,1,1,0,0,0|2,0,0]=4 3594 B6R0.6 CCCCOC#C Amb24453550 [0,1,1,0,0,0|1,0,1]=4 3595 B6R0.6 CCCCOCCl Amb22168152 [0,1,1,0,0,0|1,0,1]=4 3596 B6R0.6 CCCCOCO Amb24480826 [0,1,1,0,0,0|0,0,2]=4 3597 B6R0.6 CCCCOP=O Amb24354901 [0,1,1,0,0,0|1,0,0]=3 3598 B6R0.6 CCCC\C=C\Cl Amb25306532 [0,1,1,0,0,0|2,0,0]=4 3599 B6R0.6 CCCC\C=C\I Amb25173925 [0,1,1,0,0,0|2,0,0]=4 3600 B6R0.6 CCCNCC=C Amb22587187 [0,1,1,0,0,0|2,0,0]=4 3601 B6R0.6 CCCOCC=O Amb24421025 [0,1,1,0,0,0|0,0,0]=2 3602 B6R0.6 CCCOCNN Amb25856438 [0,1,1,0,0,0|1,0,1]=4 3603 B6R0.6 CCCONC=O Amb24374223 [0,1,1,0,0,0|0,0,0]=2 3604 B6R0.6 CCCSCC=O Amb24479810 [0,1,1,0,0,0|0,1,0]=3 3605 B6R0.6 CCC\C=C/CC Amb22734071 [0,1,1,0,0,0|2,0,0]=4 3606 B6R0.6 CCC\C=C\C#N Amb18120245 [0,1,1,0,0,0|2,0,0]=4 3607 B6R0.6 CCC\C=C\CBr Amb25293717 [0,1,1,0,0,0|2,0,0]=4 3608 B6R0.6 CCC\C=C\CC Amb19930065 [0,1,1,0,0,0|2,0,0]=4 3609 B6R0.6 CCC\C=C\CI Amb24558601 [0,1,1,0,0,0|2,0,0]=4 3610 B6R0.6 CCC\C=C\CN Amb18639526 [0,1,1,0,0,0|2,0,0]=4 3611 B6R0.6 CCNCCC=C Amb19025187 [0,1,1,0,0,0|2,0,0]=4 3612 B6R0.6 CCNCCC=O Amb25712349 [0,1,1,0,0,0|1,0,0]=3 3613 B6R0.6 CCNC\C=C/I Amb23539308 [0,1,1,0,0,0|2,0,0]=4 3614 B6R0.6 CCNC\C=C\I Amb24518608 [0,1,1,0,0,0|2,0,0]=4 3615 B6R0.6 CCNOCC=C Amb24543090 [0,1,1,0,0,0|2,0,0]=4 3616 B6R0.6 CCNOCCC Amb24423538 [0,1,1,0,0,0|1,0,1]=4 3617 B6R0.6 CCOCCC=C Amb25210333 [0,1,1,0,0,0|2,0,0]=4 3618 B6R0.6 CCOCCC=O Amb25688261 [0,1,1,0,0,0|1,0,0]=3 3619 B6R0.6 CCOCCCS Amb24479268 [0,1,1,0,0,0|1,0,1]=4 3620 B6R0.6 CCOCCNC Amb19959934 [0,1,1,0,0,0|1,0,1]=4 3621 B6R0.6 CCOCCSC Amb24396764 [0,1,1,0,0,0|1,0,1]=4 3622 B6R0.6 CCOC\C=C\Cl Amb24676600 [0,1,1,0,0,0|2,0,0]=4 3623 B6R0.6 CCONCCC Amb24416002 [0,1,1,0,0,0|1,0,1]=4 3624 B6R0.6 CCO\C=C\C=O Amb18639560 [0,1,1,0,0,0|1,0,1]=4 3625 B6R0.6 CCSC\C=C\Cl Amb24415413 [0,1,1,0,0,0|2,0,0]=4 3626 B6R0.6 CCS\C=C\C=O Amb18641909 [0,1,1,0,0,0|1,0,1]=4 3627 B6R0.6 CC\C=C/CC=O Amb18639157 [0,1,1,0,0,0|1,0,1]=4 3628 B6R0.6 CC\C=C\CC=O Amb25136370 [0,1,1,0,0,0|1,0,1]=4 3629 B6R0.6 CNCCCC=C Amb18523846 [0,1,1,0,0,0|2,0,0]=4 3630 B6R0.6 CNCCCC=O Amb25026193 [0,1,1,0,0,0|1,0,0]=3 3631 B6R0.6 CNCCCCO Amb17334049 [0,1,1,0,0,0|1,0,1]=4 3632 B6R0.6 CNCCOC=C Amb18639709 [0,1,1,0,0,0|1,0,0]=3 3633 B6R0.6 CNCCONC Amb24744491 [0,1,1,0,0,0|2,0,0]=4 3634 B6R0.6 CNCCSC=C Amb25743976 [0,1,1,0,0,0|1,1,0]=4 3635 B6R0.6 COCC#CC=O Amb25054795 [0,1,1,0,0,0|0,0,2]=4 3636 B6R0.6 COCCCC#C Amb25694831 [0,1,1,0,0,0|1,0,1]=4 3637 B6R0.6 COCCCC=C Amb24432882 [0,1,1,0,0,0|1,0,0]=3 3638 B6R0.6 COCCCCCl Amb17942999 [0,1,1,0,0,0|1,0,1]=4 3639 B6R0.6 COCCCCN Amb10610278 [0,1,1,0,0,0|1,0,1]=4 3640 B6R0.6 COCCCCO Amb17666901 [0,1,1,0,0,0|0,0,2]=4 3641 B6R0.6 COCCCCS Amb24654696 [0,1,1,0,0,0|0,1,1]=4 3642 B6R0.6 COCCCOC Amb22168275 [0,1,1,0,0,0|2,0,0]=4 3643 B6R0.6 COCCCON Amb18559290 [0,1,1,0,0,0|2,0,0]=4 3644 B6R0.6 COCCC[Mg]Cl Amb22897395 [0,1,1,0,0,0|2,0,0]=4 3645 B6R0.6 COCCC[Zn]Cl Amb22897901 [0,1,1,0,0,0|2,0,0]=4 3646 B6R0.6 COCCNC=O Amb24334241 [0,1,1,0,0,0|1,0,0]=3 3647 B6R0.6 COCCOC=C Amb21520356 [0,1,1,0,0,0|1,0,0]=3 3648 B6R0.6 COCCOCBr Amb24414243 [0,1,1,0,0,0|1,0,1]=4 3649 B6R0.6 COCCOCC Amb22052684 [0,1,1,0,0,0|1,0,1]=4 3650 B6R0.6 COCCOCI Amb24480989 [0,1,1,0,0,0|1,0,1]=4 3651 B6R0.6 COCNCCO Amb18522071 [0,1,1,0,0,0|2,0,0]=4 3652 B6R0.6 COCOCC=C Amb24385255 [0,1,1,0,0,0|2,0,0]=4 3653 B6R0.6 COCOCCO Amb23590973 [0,1,1,0,0,0|2,0,0]=4 3654 B6R0.6 COCSCCO Amb24701888 [0,1,1,0,0,0|2,0,0]=4 3655 B6R0.6 COC\C=C\C=O Amb18639577 [0,1,1,0,0,0|0,0,2]=4 3656 B6R0.6 CONCCC=C Amb22897002 [0,1,1,0,0,0|2,0,0]=4 3657 B6R0.6 CONCCCO Amb24479622 [0,1,1,0,0,0|1,0,1]=4 3658 B6R0.6 CO\C=C/CC=O Amb24741941 [0,1,1,0,0,0|0,0,2]=4 3659 B6R0.6 CO\C=C\CC=O Amb24741886 [0,1,1,0,0,0|0,0,2]=4 3660 B6R0.6 CO\C=C\CCO Amb24661187 [0,1,1,0,0,0|0,0,2]=4 3661 B6R0.6 CSCCN=C=O Amb19889355 [0,1,1,0,0,0|1,0,1]=4 3662 B6R0.6 CSCCOC=C Amb25801320 [0,1,1,0,0,0|1,0,0]=3 3663 B6R0.6 CSCCOCCl Amb25132478 [0,1,1,0,0,0|1,0,1]=4 3664 B6R0.6 C\C=C/CCCC Amb24467666 [0,1,1,0,0,0|2,0,0]=4 3665 B6R0.6 C\C=C/CCCCl Amb22732552 [0,1,1,0,0,0|2,0,0]=4 3666 B6R0.6 C\C=C/CCCO Amb17614951 [0,1,1,0,0,0|1,0,0]=3 3667 B6R0.6 C\C=C\CCCBr Amb24525194 [0,1,1,0,0,0|2,0,0]=4 3668 B6R0.6 C\C=C\CCCI Amb25837122 [0,1,1,0,0,0|2,0,0]=4 3669 B6R0.6 C\C=C\CCCN Amb25288441 [0,1,1,0,0,0|2,0,0]=4 3670 B6R0.6 C\C=C\CCCO Amb22347882 [0,1,1,0,0,0|1,0,0]=3 3671 B6R0.6 C\C=C\CCNC Amb18993047 [0,1,1,0,0,0|2,0,0]=4 3672 B6R0.6 C\C=C\CCNO Amb25245372 [0,1,1,0,0,0|1,0,1]=4 3673 B6R0.6 C\C=C\CNCC Amb24370243 [0,1,1,0,0,0|2,0,0]=4 3674 B6R0.6 C\C=C\COC=C Amb24758645 [0,1,1,0,0,0|1,0,1]=4 3675 B6R0.6 C\C=C\NCCC Amb25113340 [0,1,1,0,0,0|2,0,0]=4 3676 B6R0.6 C\C=C\OCCCl Amb25076175 [0,1,1,0,0,0|2,0,0]=4 3677 B6R0.6 C\C=C\SCCC Amb22168314 [0,1,1,0,0,0|1,1,0]=4 3678 B6R0.6 ClCCCC=C=C Amb17939722 [0,1,1,0,0,0|2,0,0]=4 3679 B6R0.6 ClCCCOCCl Amb24479881 [0,1,1,0,0,0|1,0,1]=4 3680 B6R0.6 ClCCC\C=C\Br Amb25146715 [0,1,1,0,0,0|2,0,0]=4 3681 B6R0.6 ClCCNCC=C Amb17334072 [0,1,1,0,0,0|2,0,0]=4 3682 B6R0.6 Cl\C=C\CCCCl Amb24379157 [0,1,1,0,0,0|2,0,0]=4 3683 B6R0.6 Cl\C=C\OCCCl Amb24481099 [0,1,1,0,0,0|2,0,0]=4 3684 B6R0.6 N#CCCCC=O Amb18120556 [0,1,1,0,0,0|1,0,0]=3 3685 B6R0.6 N#CCCNC=O Amb18639097 [0,1,1,0,0,0|1,0,1]=4 3686 B6R0.6 N#CSCCC=O Amb24666788 [0,1,1,0,0,0|1,0,1]=4 3687 B6R0.6 N#C\C=C\CCO Amb18639029 [0,1,1,0,0,0|1,0,1]=4 3688 B6R0.6 N=CCCCC=O Amb24690651 [0,1,1,0,0,0|1,0,0]=3 3689 B6R0.6 N=CCOCCO Amb24407453 [0,1,1,0,0,0|1,0,0]=3 3690 B6R0.6 NCCCCNO Amb24117989 [0,1,1,0,0,0|1,0,1]=4 3691 B6R0.6 NCCC\C=C\Cl Amb24479838 [0,1,1,0,0,0|2,0,0]=4 3692 B6R0.6 NCCNCC=C Amb17091015 [0,1,1,0,0,0|2,0,0]=4 3693 B6R0.6 NCCSCC=C Amb13951462 [0,1,1,0,0,0|2,0,0]=4 3694 B6R0.6 NNCCCCO Amb24692523 [0,1,1,0,0,0|1,0,1]=4 3695 B6R0.6 NOCCCC#N Amb25063875 [0,1,1,0,0,0|1,0,1]=4 3696 B6R0.6 NOCCCCF Amb22896553 [0,1,1,0,0,0|1,0,1]=4 3697 B6R0.6 NOCCCCO Amb25756966 [0,1,1,0,0,0|0,0,2]=4 3698 B6R0.6 NOCCCON Amb24711828 [0,1,1,0,0,0|2,0,0]=4 3699 B6R0.6 O=C=CCCCCl Amb25084548 [0,1,1,0,0,0|1,0,0]=3 3700 B6R0.6 O=CCCCC#C Amb17593060 [0,1,1,0,0,0|1,0,0]=3 3701 B6R0.6 O=CCCCCBr Amb18126353 [0,1,1,0,0,0|1,0,0]=3 3702 B6R0.6 O=CCCCCCl Amb18123550 [0,1,1,0,0,0|1,0,0]=3 3703 B6R0.6 O=CCCCCF Amb25725976 [0,1,1,0,0,0|1,0,0]=3 3704 B6R0.6 O=CCCCCI Amb24707459 [0,1,1,0,0,0|1,0,0]=3 3705 B6R0.6 O=CCCN=C=S Amb25081456 [0,1,1,0,0,0|0,1,1]=4 3706 B6R0.6 O=CCCNC=O Amb25087053 [0,1,1,0,0,0|0,0,2]=4 3707 B6R0.6 O=CCC\C=C\Br Amb24479765 [0,1,1,0,0,0|1,0,1]=4 3708 B6R0.6 O=CCC\C=C\C Amb17593074 [0,1,1,0,0,0|1,0,1]=4 3709 B6R0.6 O=CCNCC=O Amb24384445 [0,1,1,0,0,0|0,0,2]=4 3710 B6R0.6 O=CCOCC=O Amb18121758 [0,1,1,0,0,0|0,0,2]=4 3711 B6R0.6 O=CCOCCCl Amb24665263 [0,1,1,0,0,0|1,0,0]=3 3712 B6R0.6 O=CCSCC=O Amb18641963 [0,1,1,0,0,0|0,0,2]=4 3713 B6R0.6 O=CNCCCBr Amb25745639 [0,1,1,0,0,0|1,0,0]=3 3714 B6R0.6 O=CNCCCF Amb25092168 [0,1,1,0,0,0|1,0,0]=3 3715 B6R0.6 O=CNCCCS Amb24659838 [0,1,1,0,0,0|0,1,0]=3 3716 B6R0.6 O=COCCCBr Amb25725047 [0,1,1,0,0,0|0,0,0]=2 3717 B6R0.6 O=COCCCCl Amb24427057 [0,1,1,0,0,0|0,0,0]=2 3718 B6R0.6 O=COCCCF Amb22008204 [0,1,1,0,0,0|0,0,0]=2 3719 B6R0.6 O=COCCCI Amb25839622 [0,1,1,0,0,0|0,0,0]=2 3720 B6R0.6 O=C\C=C\CCF Amb25723268 [0,1,1,0,0,0|1,0,1]=4 3721 B6R0.6 O=S=NCCCCl Amb24523810 [0,1,1,0,0,0|2,0,0]=4 3722 B6R0.6 OCC=NCCO Amb24507433 [0,1,1,0,0,0|1,0,1]=4 3723 B6R0.6 OCCC#CC=C Amb17593058 [0,1,1,0,0,0|1,0,1]=4 3724 B6R0.6 OCCC=C=CBr Amb25211653 [0,1,1,0,0,0|1,0,1]=4 3725 B6R0.6 OCCCC=C=C Amb10605300 [0,1,1,0,0,0|1,0,0]=3 3726 B6R0.6 OCCCCC=O Amb10603837 [0,1,1,0,0,0|0,0,0]=2 3727 B6R0.6 OCCCCCBr Amb10603824 [0,1,1,0,0,0|1,0,1]=4 3728 B6R0.6 OCCCCCF Amb24479828 [0,1,1,0,0,0|1,0,1]=4 3729 B6R0.6 OCCCCCI Amb25025520 [0,1,1,0,0,0|1,0,1]=4 3730 B6R0.6 OCCCCSCl Amb24619715 [0,1,1,0,0,0|0,1,1]=4 3731 B6R0.6 OCCCOC=O Amb24733886 [0,1,1,0,0,0|0,0,0]=2 3732 B6R0.6 OCCNCCCl Amb18642158 [0,1,1,0,0,0|1,0,1]=4 3733 B6R0.6 OCCNCCCl Amb22641891 [0,1,1,0,0,0|1,0,1]=4 3734 B6R0.6 OCCNCCO Amb22035219 [0,1,1,0,0,0|0,0,2]=4 3735 B6R0.6 OCCNCCS Amb18522180 [0,1,1,0,0,0|0,1,1]=4 3736 B6R0.6 OCCOCC#C Amb16232584 [0,1,1,0,0,0|1,0,1]=4 3737 B6R0.6 OCCOCC=O Amb24060822 [0,1,1,0,0,0|0,0,0]=2 3738 B6R0.6 OCCOCCBr Amb24057456 [0,1,1,0,0,0|1,0,1]=4 3739 B6R0.6 OCCOCCF Amb17593119 [0,1,1,0,0,0|1,0,1]=4 3740 B6R0.6 OCCOCCO Amb19515789 [0,1,1,0,0,0|0,0,2]=4 3741 B6R0.6 OCCOCCO Amb22232249 [0,1,1,0,0,0|0,0,2]=4 3742 B6R0.6 OCCOCCS Amb22008751 [0,1,1,0,0,0|0,1,1]=4 3743 B6R0.6 OCCSCC=O Amb24525990 [0,1,1,0,0,0|0,0,0]=2 3744 B6R0.6 OCCSCCF Amb25261470 [0,1,1,0,0,0|1,0,1]=4 3745 B6R0.6 OCC\C=C\C=O Amb18119862 [0,1,1,0,0,0|0,0,1]=3 3746 B6R0.6 OCC\C=C\CBr Amb24608445 [0,1,1,0,0,0|1,0,1]=4 3747 B6R0.6 O\C=C\CCCO Amb24480597 [0,1,1,0,0,0|0,0,1]=3 3748 B6R0.6 O\N=C/CCCCl Amb25295218 [0,1,1,0,0,0|1,0,1]=4 3749 B6R0.6 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2]O Amb22367427 [0,1,1,0,0,0|1,0,1]=4 3750 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [0,1,1,0,0,0|2,0,0]=4 3751 B6R0.6 [N-]=[N+]=NCCCO Amb20623004 [0,1,1,0,0,0|2,0,0]=4 3752 B6R0.6 [N-]=[N+]=NCOC=O Amb24563927 [0,1,1,0,0,0|2,0,0]=4 3753 B6R0.8 CCP(=O)(Cl)CC Amb22043809 [0,1,1,0,0,0|2,0,0]=4 3754 B6R0.8 CCP(O)(=O)CC Amb22732881 [0,1,1,0,0,0|2,0,0]=4 3755 B6R0.8 CCS(=N)(=O)CC Amb22735220 [0,1,1,0,0,0|2,0,0]=4 3756 B6R0.8 CCS(=O)(=O)CC Amb17672874 [0,1,1,0,0,0|2,0,0]=4 3757 B6R0.8 CCS(=O)(=O)NC Amb1138409 [0,1,1,0,0,0|2,0,0]=4 3758 B6R0.8 CCS(=O)(=O)OC Amb22730356 [0,1,1,0,0,0|1,0,0]=3 3759 B6R0.8 COC([13CH3])([13CH3])C[13CH3] Amb22353647 [0,1,1,0,0,0|1,0,1]=4 3760 B6R0.8 COP(=O)(Cl)CCl Amb24412639 [0,1,1,0,0,0|2,0,0]=4 3761 B6R0.8 COP(=O)(Cl)SC Amb24598656 [0,1,1,0,0,0|2,0,0]=4 3762 B6R0.8 COP(=O)(OC)C Amb10068657 [0,1,1,0,0,0|2,0,0]=4 3763 B6R0.8 COP(=O)(OC)Cl Amb17613364 [0,1,1,0,0,0|2,0,0]=4 3764 B6R0.8 COP(=O)(OC)S Amb17613361 [0,1,1,0,0,0|2,0,0]=4 3765 B6R0.8 COP(=O)(OC)[O-] Amb17613358 [0,1,1,0,0,0|2,0,0]=4 3766 B6R0.8 COP(N)(=O)OC Amb17939968 [0,1,1,0,0,0|2,0,0]=4 3767 B6R0.8 COP(O)(=O)CO Amb25806602 [0,1,1,0,0,0|2,0,0]=4 3768 B6R0.8 COP(O)(=O)OC Amb17671942 [0,1,1,0,0,0|2,0,0]=4 3769 B6R0.8 COP(O)(=O)OC Amb24325380 [0,1,1,0,0,0|2,0,0]=4 3770 B6R0.8 COP([O-])(=O)SC Amb25697020 [0,1,1,0,0,0|2,0,0]=4 3771 B6R0.8 COS(=O)(=O)CCl Amb24620189 [0,1,1,0,0,0|2,0,0]=4 3772 B6R0.8 COS(=O)(=O)CO Amb25295993 [0,1,1,0,0,0|2,0,0]=4 3773 B6R0.8 [13CH3]OP(=O)(O[13CH3])S Amb17613363 [0,1,1,0,0,0|2,0,0]=4 3774 B6R0.8 [13CH3]OP(=O)(O[13CH3])[O-] Amb17613360 [0,1,1,0,0,0|2,0,0]=4 3775 B6R0.8 [13CH3]OS(=O)(=O)O[13CH3] Amb22353486 [0,1,1,0,0,0|2,0,0]=4 3776 B6R0.8 [14CH3]OS(=O)(=O)O[14CH3] Amb22733024 [0,1,1,0,0,0|2,0,0]=4 3777 B6R0.9 CC=C(CBr)OC Amb25258340 [0,1,1,0,0,0|1,0,1]=4 3778 B6R0.9 CC=C(CC)C=O Amb25235895 [0,1,1,0,0,0|1,0,0]=3 3779 B6R0.9 CC=C(CI)OC Amb25176571 [0,1,1,0,0,0|1,0,1]=4 3780 B6R0.9 CC=C(OC)OC Amb25231933 [0,1,1,0,0,0|0,0,2]=4 3781 B6R0.9 CCB(CC)OC Amb17943015 [0,1,1,0,0,0|2,0,0]=4 3782 B6R0.9 CCC(=CBr)OC Amb24400630 [0,1,1,0,0,0|1,0,0]=3 3783 B6R0.9 CCC(=CCl)SC Amb24511896 [0,1,1,0,0,0|1,1,0]=4 3784 B6R0.9 CCC(C=O)=CBr Amb25147584 [0,1,1,0,0,0|2,0,0]=4 3785 B6R0.9 CCC(C=O)OC Amb18121854 [0,1,1,0,0,0|0,0,1]=3 3786 B6R0.9 CCC(C=O)SC Amb25123224 [0,1,1,0,0,0|0,1,1]=4 3787 B6R0.9 CCC(CC)=CCl Amb25775028 [0,1,1,0,0,0|2,0,0]=4 3788 B6R0.9 CCC(CC)=NN Amb24673238 [0,1,1,0,0,0|2,0,0]=4 3789 B6R0.9 CCC(CCl)=CC Amb24519584 [0,1,1,0,0,0|2,0,0]=4 3790 B6R0.9 CCC(CCl)OC Amb24478961 [0,1,1,0,0,0|1,0,1]=4 3791 B6R0.9 CCC(CN)=CC Amb24519596 [0,1,1,0,0,0|2,0,0]=4 3792 B6R0.9 CCC(CO)OC Amb24323287 [0,1,1,0,0,0|0,0,2]=4 3793 B6R0.9 CCC(NC)=NC Amb24763487 [0,1,1,0,0,0|2,0,0]=4 3794 B6R0.9 CCC(NC)=NN Amb25786736 [0,1,1,0,0,0|2,0,0]=4 3795 B6R0.9 CCC(NC)=NO Amb24575302 [0,1,1,0,0,0|1,0,1]=4 3796 B6R0.9 CCC(OC)CN Amb2140565 [0,1,1,0,0,0|1,0,1]=4 3797 B6R0.9 CCC(OC)OC Amb22731785 [0,1,1,0,0,0|0,0,2]=4 3798 B6R0.9 CCN(CC)N=O Amb19878083 [0,1,1,0,0,0|2,0,0]=4 3799 B6R0.9 CCP(OC)OC Amb22730826 [0,1,1,0,0,0|1,0,1]=4 3800 B6R0.9 CC[SiH](OC)OC Amb25663282 [0,1,1,0,0,0|0,1,1]=4 3801 B6R0.9 CC\C(=C/C)\C=O Amb10606406 [0,1,1,0,0,0|1,0,0]=3 3802 B6R0.9 CC\C(=C\C)\C#N Amb18638703 [0,1,1,0,0,0|2,0,0]=4 3803 B6R0.9 CC\C(\C=O)=C/Br Amb25313085 [0,1,1,0,0,0|2,0,0]=4 3804 B6R0.9 CC\C(\C=O)=C/Cl Amb18124155 [0,1,1,0,0,0|2,0,0]=4 3805 B6R0.9 COC(=CCl)OC Amb25088450 [0,1,1,0,0,0|2,0,0]=4 3806 B6R0.9 COC(=CN)C=O Amb25127730 [0,1,1,0,0,0|1,0,1]=4 3807 B6R0.9 COC(C=O)OC Amb10071226 [0,1,1,0,0,0|1,0,1]=4 3808 B6R0.9 COC(C=O)SC Amb24646584 [0,1,1,0,0,0|1,0,1]=4 3809 B6R0.9 COC(CC)CC Amb25025651 [0,1,1,0,0,0|1,0,1]=4 3810 B6R0.9 COC(CO)C=O Amb18640344 [0,1,1,0,0,0|1,0,1]=4 3811 B6R0.9 CO[C@@H](CO)C=O Amb24639077 [0,1,1,0,0,0|1,0,1]=4 3812 B6R0.9 CO[SiH](CC)CC Amb25026364 [0,1,1,0,0,0|1,1,0]=4 3813 B6R0.9 CO\C(=C\O)\C=O Amb24383108 [0,1,1,0,0,0|1,0,1]=4 3814 B6R0.9 CO\C(=N/C)\CN Amb10576289 [0,1,1,0,0,0|2,0,0]=4 3815 B6R0.9 C\C=C(\CC)/C=C Amb25024610 [0,1,1,0,0,0|2,0,0]=4 3816 B6R1.4 C=C1CCC1=O Amb25747444 [0,1,0,0,1,0|0,0,1]=3 3817 B6R1.4 C=C1CCC1Br Amb25826187 [0,1,0,0,1,0|1,0,0]=3 3818 B6R1.4 C=C1CCC1I Amb24502672 [0,1,0,0,1,0|1,0,0]=3 3819 B6R1.4 C=C1CNC1=O Amb25213040 [0,1,0,0,1,0|1,0,1]=4 3820 B6R1.4 C=C1OCC1=O Amb24478475 [0,1,0,0,1,0|1,0,1]=4 3821 B6R1.4 CC1=CCC1O Amb25695658 [0,1,0,0,1,0|1,0,1]=4 3822 B6R1.4 CC1CCC1Cl Amb24711317 [0,1,0,0,1,0|1,0,1]=4 3823 B6R1.4 CC1CCC1N Amb24117460 [0,1,0,0,1,0|1,0,1]=4 3824 B6R1.4 CC1CCN1C Amb24428417 [0,1,0,0,1,0|2,0,0]=4 3825 B6R1.4 CC1CCN1N Amb25767050 [0,1,0,0,1,0|2,0,0]=4 3826 B6R1.4 CC1CNC1=O Amb24444140 [0,1,0,0,1,0|1,0,0]=3 3827 B6R1.4 CC1COC1=O Amb25794274 [0,1,0,0,1,0|0,0,0]=2 3828 B6R1.4 CC1OCC1=O Amb23456088 [0,1,0,0,1,0|1,0,0]=3 3829 B6R1.4 CC=1CCC1Br Amb25189799 [0,1,0,0,1,0|1,0,1]=4 3830 B6R1.4 CN1CCC1N Amb24107557 [0,1,0,0,1,0|2,0,0]=4 3831 B6R1.4 CN1CCC1N Amb24680260 [0,1,0,0,1,0|2,0,0]=4 3832 B6R1.4 C[C@@H]1CCC1=O Amb24334317 [0,1,0,0,1,0|0,0,0]=2 3833 B6R1.4 C[C@@H]1CC[C@@H]1O Amb25317495 [0,1,0,0,1,0|0,0,2]=4 3834 B6R1.4 C[C@@H]1CC[C@H]1Cl Amb25363292 [0,1,0,0,1,0|1,0,1]=4 3835 B6R1.4 C[C@@H]1CNC1=O Amb24568896 [0,1,0,0,1,0|1,0,0]=3 3836 B6R1.4 C[C@H]1CCC1=O Amb24333446 [0,1,0,0,1,0|0,0,0]=2 3837 B6R1.4 C[C@H]1CC[C@H]1Cl Amb24565733 [0,1,0,0,1,0|1,0,1]=4 3838 B6R1.4 C[C@H]1CC[C@H]1O Amb24556459 [0,1,0,0,1,0|0,0,2]=4 3839 B6R1.4 ClC1CCC1Br Amb24461743 [0,1,0,0,1,0|1,0,1]=4 3840 B6R1.4 Cl[C@@H]1CC[C@@H]1Cl Amb24635621 [0,1,0,0,1,0|1,0,1]=4 3841 B6R1.4 Cl[C@@H]1CC[C@H]1Br Amb25662823 [0,1,0,0,1,0|1,0,1]=4 3842 B6R1.4 Cl[C@@H]1CC[C@H]1Cl Amb25201485 [0,1,0,0,1,0|1,0,1]=4 3843 B6R1.4 Cl[C@H]1CC[C@@H]1Cl Amb25746504 [0,1,0,0,1,0|1,0,1]=4 3844 B6R1.4 FC1COC1Cl Amb24478508 [0,1,0,0,1,0|1,0,1]=4 3845 B6R1.4 F[C@@H]1CC[C@H]1Cl Amb24640864 [0,1,0,0,1,0|1,0,1]=4 3846 B6R1.4 F[C@@H]1CO[C@H]1Cl Amb25811588 [0,1,0,0,1,0|1,0,1]=4 3847 B6R1.4 F[C@H]1CC[C@H]1Cl Amb24550577 [0,1,0,0,1,0|1,0,1]=4 3848 B6R1.4 NC1CCC1=O Amb22896568 [0,1,0,0,1,0|0,0,0]=2 3849 B6R1.4 NC1CCC1O Amb19148610 [0,1,0,0,1,0|0,0,2]=4 3850 B6R1.4 NC1CCC1S Amb25350185 [0,1,0,0,1,0|0,1,1]=4 3851 B6R1.4 NC1CNC1=O Amb18832512 [0,1,0,0,1,0|1,0,0]=3 3852 B6R1.4 N[C@@H]1CC[C@@H]1N Amb25067470 [0,1,0,0,1,0|1,0,1]=4 3853 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22757952 [0,1,0,0,1,0|0,0,2]=4 3854 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22823228 [0,1,0,0,1,0|0,0,2]=4 3855 B6R1.4 N[C@@H]1CC[C@@H]1S Amb25175773 [0,1,0,0,1,0|0,1,1]=4 3856 B6R1.4 N[C@@H]1CC[C@H]1O Amb22757953 [0,1,0,0,1,0|0,0,2]=4 3857 B6R1.4 N[C@@H]1CC[C@H]1O Amb22823232 [0,1,0,0,1,0|0,0,2]=4 3858 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [0,1,0,0,1,0|1,0,0]=3 3859 B6R1.4 N[C@@H]1COC1=O Amb22748014 [0,1,0,0,1,0|0,0,0]=2 3860 B6R1.4 N[C@@H]1COC1=O Amb22757168 [0,1,0,0,1,0|0,0,0]=2 3861 B6R1.4 N[C@H]1CC[C@@H]1N Amb24571358 [0,1,0,0,1,0|1,0,1]=4 3862 B6R1.4 N[C@H]1CC[C@@H]1O Amb24579886 [0,1,0,0,1,0|0,0,2]=4 3863 B6R1.4 N[C@H]1CC[C@H]1O Amb24580190 [0,1,0,0,1,0|0,0,2]=4 3864 B6R1.4 N[C@H]1CNC1=O Amb25811302 [0,1,0,0,1,0|1,0,0]=3 3865 B6R1.4 O=C1CCC1Br Amb21964157 [0,1,0,0,1,0|0,0,0]=2 3866 B6R1.4 O=C1CCC1C Amb17593022 [0,1,0,0,1,0|0,0,0]=2 3867 B6R1.4 O=C1CCC1Cl Amb19892275 [0,1,0,0,1,0|0,0,0]=2 3868 B6R1.4 O=C1CCC1O Amb17593027 [0,1,0,0,1,0|0,0,0]=2 3869 B6R1.4 O=C1SCC1Cl Amb24502718 [0,1,0,0,1,0|0,1,0]=3 3870 B6R1.4 OC1CCC1Br Amb24473973 [0,1,0,0,1,0|0,0,2]=4 3871 B6R1.4 OC1CCC1S Amb25854751 [0,1,0,0,1,0|0,0,2]=4 3872 B6R1.4 OC1CNC1=O Amb24689689 [0,1,0,0,1,0|1,0,0]=3 3873 B6R1.4 O[C@@H]1CC[C@@H]1O Amb24505810 [0,1,0,0,1,0|0,0,2]=4 3874 B6R1.4 O[C@H]1CC[C@@H]1O Amb25746176 [0,1,0,0,1,0|0,0,2]=4 3875 B6R1.4 [NH3+][C@H]1COC1=O Amb22349488 [0,1,0,0,1,0|0,0,0]=2 3876 B6R1.5 BrC1CC(Br)C1 Amb25365221 [0,1,0,0,1,0|1,0,1]=4 3877 B6R1.5 Br[C@@H]1C[C@@H](Br)C1 Amb25184856 [0,1,0,0,1,0|1,0,1]=4 3878 B6R1.5 C=C1CC(N)C1 Amb19929922 [0,1,0,0,1,0|1,0,0]=3 3879 B6R1.5 CC1CC(=O)C1 Amb22284831 [0,1,0,0,1,0|0,0,0]=2 3880 B6R1.5 CC1CC(=O)O1 Amb13777279 [0,1,0,0,1,0|0,0,0]=2 3881 B6R1.5 CC1CC(C)O1 Amb22737240 [0,1,0,0,1,0|1,0,1]=4 3882 B6R1.5 CC1CC(N)C1 Amb20623633 [0,1,0,0,1,0|1,0,1]=4 3883 B6R1.5 CC1CC(N)C1 Amb22058941 [0,1,0,0,1,0|1,0,1]=4 3884 B6R1.5 CC1CC(O)C1 Amb22235436 [0,1,0,0,1,0|0,0,2]=4 3885 B6R1.5 CC1CN(C)C1 Amb24382741 [0,1,0,0,1,0|2,0,0]=4 3886 B6R1.5 CC1CN(N)C1 Amb25184946 [0,1,0,0,1,0|2,0,0]=4 3887 B6R1.5 CC=1CC(Br)C1 Amb25101555 [0,1,0,0,1,0|1,0,1]=4 3888 B6R1.5 CN1CC(=O)C1 Amb22292462 [0,1,0,0,1,0|1,0,0]=3 3889 B6R1.5 CN1CC(Cl)C1 Amb24355400 [0,1,0,0,1,0|2,0,0]=4 3890 B6R1.5 CN1CC(N)C1 Amb21857825 [0,1,0,0,1,0|2,0,0]=4 3891 B6R1.5 CN1CC(O)C1 Amb21960698 [0,1,0,0,1,0|2,0,0]=4 3892 B6R1.5 CN1CC(O)C1 Amb22034404 [0,1,0,0,1,0|2,0,0]=4 3893 B6R1.5 C[C@@H]1CC(=O)O1 Amb10603200 [0,1,0,0,1,0|0,0,0]=2 3894 B6R1.5 C[C@@H]1C[C@@H](C)O1 Amb24332806 [0,1,0,0,1,0|1,0,1]=4 3895 B6R1.5 C[C@@H]1C[C@@H](N)C1 Amb24665814 [0,1,0,0,1,0|1,0,1]=4 3896 B6R1.5 C[C@@H]1C[C@H](C)O1 Amb24333814 [0,1,0,0,1,0|1,0,1]=4 3897 B6R1.5 C[C@@H]1C[C@H](N)C1 Amb22746992 [0,1,0,0,1,0|1,0,1]=4 3898 B6R1.5 C[C@H]1CC(=O)N1 Amb25755939 [0,1,0,0,1,0|1,0,0]=3 3899 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [0,1,0,0,1,0|0,0,0]=2 3900 B6R1.5 ClC1CC(Br)C1 Amb24064678 [0,1,0,0,1,0|1,0,1]=4 3901 B6R1.5 Cl[C@@H]1C[C@H](Br)C1 Amb24470099 [0,1,0,0,1,0|1,0,1]=4 3902 B6R1.5 FC1CC(Cl)C1 Amb24677891 [0,1,0,0,1,0|1,0,1]=4 3903 B6R1.5 FC1CC(F)C1 Amb25808196 [0,1,0,0,1,0|1,0,1]=4 3904 B6R1.5 F[C@@H]1C[C@H](Cl)C1 Amb25108981 [0,1,0,0,1,0|1,0,1]=4 3905 B6R1.5 NC1CC(=O)C1 Amb20241928 [0,1,0,0,1,0|0,0,0]=2 3906 B6R1.5 NC1CC(=O)C1 Amb23439093 [0,1,0,0,1,0|0,0,0]=2 3907 B6R1.5 NC1CC(F)C1 Amb19515443 [0,1,0,0,1,0|1,0,1]=4 3908 B6R1.5 NC1CC(F)C1 Amb22055291 [0,1,0,0,1,0|1,0,1]=4 3909 B6R1.5 NC1CC(N)C1 Amb19516078 [0,1,0,0,1,0|1,0,1]=4 3910 B6R1.5 NC1CC(N)C1 Amb22491851 [0,1,0,0,1,0|1,0,1]=4 3911 B6R1.5 NC1CC(O)C1 Amb20670971 [0,1,0,0,1,0|0,0,2]=4 3912 B6R1.5 NC1CS(=O)C1 Amb25757983 [0,1,0,0,1,0|1,0,0]=3 3913 B6R1.5 N[C@@H]1C[C@@H](C1)O Amb10603190 [0,1,0,0,1,0|0,0,2]=4 3914 B6R1.5 N[C@@H]1C[C@@H](F)C1 Amb23440227 [0,1,0,0,1,0|1,0,1]=4 3915 B6R1.5 N[C@@H]1C[C@@H](F)C1 Amb24053525 [0,1,0,0,1,0|1,0,1]=4 3916 B6R1.5 N[C@@H]1C[C@@H](N)C1 Amb23440099 [0,1,0,0,1,0|1,0,1]=4 3917 B6R1.5 N[C@@H]1C[C@@H](N)C1 Amb23440100 [0,1,0,0,1,0|1,0,1]=4 3918 B6R1.5 N[C@@H]1C[C@@H](O)C1 Amb22231671 [0,1,0,0,1,0|0,0,2]=4 3919 B6R1.5 N[C@@H]1C[C@H](C1)O Amb10604103 [0,1,0,0,1,0|0,0,2]=4 3920 B6R1.5 N[C@@H]1C[C@H](F)C1 Amb22757506 [0,1,0,0,1,0|1,0,1]=4 3921 B6R1.5 N[C@@H]1C[C@H](F)C1 Amb24053524 [0,1,0,0,1,0|1,0,1]=4 3922 B6R1.5 N[C@@H]1C[C@H](N)C1 Amb22737491 [0,1,0,0,1,0|1,0,1]=4 3923 B6R1.5 N[C@@H]1C[C@H](N)C1 Amb23440098 [0,1,0,0,1,0|1,0,1]=4 3924 B6R1.5 N[C@@H]1C[C@H](O)C1 Amb22230425 [0,1,0,0,1,0|0,0,2]=4 3925 B6R1.5 O=C1CC(Br)C1 Amb22388498 [0,1,0,0,1,0|0,0,0]=2 3926 B6R1.5 O=C1CC(Br)N1 Amb24332152 [0,1,0,0,1,0|1,0,0]=3 3927 B6R1.5 O=C1CC(Cl)C1 Amb25087791 [0,1,0,0,1,0|0,0,0]=2 3928 B6R1.5 O=C1CC(Cl)N1 Amb24531401 [0,1,0,0,1,0|1,0,0]=3 3929 B6R1.5 O=C1CC(F)N1 Amb24588463 [0,1,0,0,1,0|1,0,0]=3 3930 B6R1.5 O=C1SC(Br)S1 Amb25706196 [0,1,0,0,1,0|1,1,0]=4 3931 B6R1.5 OC1CC(=O)C1 Amb22235480 [0,1,0,0,1,0|0,0,0]=2 3932 B6R1.5 OC1CC(Br)C1 Amb24544946 [0,1,0,0,1,0|0,0,2]=4 3933 B6R1.5 OC1CC(F)C1 Amb23439374 [0,1,0,0,1,0|0,0,2]=4 3934 B6R1.5 OC1CC(S)C1 Amb25847775 [0,1,0,0,1,0|0,0,2]=4 3935 B6R1.5 OC1CN(Cl)C1 Amb24333206 [0,1,0,0,1,0|2,0,0]=4 3936 B6R1.5 OC1CS(=O)C1 Amb25025463 [0,1,0,0,1,0|1,0,0]=3 3937 B6R1.5 O[C@@H]1C[C@@H](F)C1 Amb23440228 [0,1,0,0,1,0|0,0,2]=4 3938 B6R1.5 O[C@@H]1C[C@H](Cl)C1 Amb25065368 [0,1,0,0,1,0|0,0,2]=4 3939 B6R1.5 O[C@@H]1C[C@H](F)C1 Amb24183986 [0,1,0,0,1,0|0,0,2]=4 3940 B6R1.5 O[C@H]1CC(=O)O1 Amb25106737 [0,1,0,0,1,0|0,0,0]=2 3941 B6R1.6 BrC=C1CCC1 Amb25189864 [0,1,0,0,1,0|1,0,0]=3 3942 B6R1.6 BrCC1CCO1 Amb2383525 [0,1,0,0,1,0|1,0,1]=4 3943 B6R1.6 BrCC=1CCC1 Amb24652455 [0,1,0,0,1,0|1,0,1]=4 3944 B6R1.6 C#CC1CCC1 Amb25184959 [0,1,0,0,1,0|1,0,1]=4 3945 B6R1.6 CC=C1CNC1 Amb24729453 [0,1,0,0,1,0|2,0,0]=4 3946 B6R1.6 CCC1CCC1 Amb24394555 [0,1,0,0,1,0|1,0,1]=4 3947 B6R1.6 CN=C1CCC1 Amb24405883 [0,1,0,0,1,0|1,0,0]=3 3948 B6R1.6 CNC1CCC1 Amb18946245 [0,1,0,0,1,0|1,0,1]=4 3949 B6R1.6 CNC1CCC1 Amb19303706 [0,1,0,0,1,0|1,0,1]=4 3950 B6R1.6 ClC=C1COC1 Amb24332567 [0,1,0,0,1,0|2,0,0]=4 3951 B6R1.6 ClCC1CCO1 Amb22495451 [0,1,0,0,1,0|1,0,1]=4 3952 B6R1.6 Cl[Mg]C1CCC1 Amb22897278 [0,1,0,0,1,0|1,0,1]=4 3953 B6R1.6 IC=C1CCC1 Amb24334135 [0,1,0,0,1,0|1,0,0]=3 3954 B6R1.6 ICC1CCO1 Amb13883581 [0,1,0,0,1,0|1,0,1]=4 3955 B6R1.6 N#CC1CCC1 Amb16232994 [0,1,0,0,1,0|1,0,1]=4 3956 B6R1.6 N#CC1CCO1 Amb22270062 [0,1,0,0,1,0|1,0,1]=4 3957 B6R1.6 NCC1CCO1 Amb19895255 [0,1,0,0,1,0|1,0,1]=4 3958 B6R1.6 NN=C1CCC1 Amb25097298 [0,1,0,0,1,0|1,0,0]=3 3959 B6R1.6 NN=C1COC1 Amb23560173 [0,1,0,0,1,0|2,0,0]=4 3960 B6R1.6 NN=C1CSC1 Amb25327653 [0,1,0,0,1,0|2,0,0]=4 3961 B6R1.6 NNC1CCC1 Amb10604136 [0,1,0,0,1,0|1,0,1]=4 3962 B6R1.6 NNC1CCC1 Amb21936692 [0,1,0,0,1,0|1,0,1]=4 3963 B6R1.6 NOC1CCC1 Amb10975959 [0,1,0,0,1,0|0,0,2]=4 3964 B6R1.6 NOC1CCC1 Amb25118834 [0,1,0,0,1,0|0,0,2]=4 3965 B6R1.6 O=C=C1CCC1 Amb25332371 [0,1,0,0,1,0|0,0,0]=2 3966 B6R1.6 O=CC1CCN1 Amb25757222 [0,1,0,0,1,0|1,0,1]=4 3967 B6R1.6 O=CC1CCO1 Amb24565587 [0,1,0,0,1,0|0,0,1]=3 3968 B6R1.6 O=CC1COC1 Amb21857829 [0,1,0,0,1,0|1,0,1]=4 3969 B6R1.6 O=CC1CSC1 Amb25145476 [0,1,0,0,1,0|1,0,1]=4 3970 B6R1.6 O=CN1CCC1 Amb24431842 [0,1,0,0,1,0|1,0,0]=3 3971 B6R1.6 O=NN1CCC1 Amb24407378 [0,1,0,0,1,0|1,0,0]=3 3972 B6R1.6 OCC1CCO1 Amb21960943 [0,1,0,0,1,0|0,0,2]=4 3973 B6R1.6 OCC=1CCC1 Amb25744805 [0,1,0,0,1,0|0,0,2]=4 3974 B6R1.6 OC[C@H]1CCO1 Amb24559274 [0,1,0,0,1,0|0,0,2]=4 3975 B6R1.6 ON=C1COC1 Amb22896745 [0,1,0,0,1,0|1,0,1]=4 3976 B6R1.6 [C-]#[N+]C1CCC1 Amb19892422 [0,1,0,0,1,0|1,0,1]=4 3977 B6R1.10 BrC1(Br)CCC1 Amb24546005 [0,1,0,0,1,0|1,0,1]=4 3978 B6R1.10 CC1(C)CCO1 Amb22737237 [0,1,0,0,1,0|1,0,1]=4 3979 B6R1.10 CC1(Cl)CCC1 Amb24332327 [0,1,0,0,1,0|1,0,1]=4 3980 B6R1.10 CC1(N)CCC1 Amb19888627 [0,1,0,0,1,0|1,0,1]=4 3981 B6R1.10 CC1(O)CCC1 Amb17940165 [0,1,0,0,1,0|0,0,2]=4 3982 B6R1.10 C[Si]1(C)CCC1 Amb19893737 [0,1,0,0,1,0|1,1,0]=4 3983 B6R1.10 C[Si]1(Cl)CCC1 Amb22001053 [0,1,0,0,1,0|1,1,0]=4 3984 B6R1.10 ClC1(Cl)CCC1 Amb25773991 [0,1,0,0,1,0|1,0,1]=4 3985 B6R1.10 FC1(F)CCC1 Amb25305676 [0,1,0,0,1,0|1,0,1]=4 3986 B6R1.10 O=S1(=O)CCC1 Amb13883572 [0,1,0,0,1,0|1,0,0]=3 3987 B8R1.2 BrC=C1CCCCC1 Amb22337534 [0,1,0,0,0,1|2,0,0]=4 3988 B8R1.2 BrC=C1CCNCC1 Amb25276004 [0,1,0,0,0,1|2,0,0]=4 3989 B8R1.2 BrC=C1CCOCC1 Amb24333695 [0,1,0,0,0,1|2,0,0]=4 3990 B8R1.2 BrCC1=CCOCO1 Amb25322013 [0,1,0,0,0,1|1,0,1]=4 3991 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,1,0,0,0,1|1,0,1]=4 3992 B8R1.2 BrCC1COCCC1 Amb18178619 [0,1,0,0,0,1|1,0,1]=4 3993 B8R1.2 BrCC1COCCO1 Amb18796390 [0,1,0,0,0,1|1,0,1]=4 3994 B8R1.2 BrCC1OCCCO1 Amb10576216 [0,1,0,0,0,1|1,0,1]=4 3995 B8R1.2 BrCC=1CCCCC1 Amb23439167 [0,1,0,0,0,1|2,0,0]=4 3996 B8R1.2 BrCC=1CCOCC1 Amb24483111 [0,1,0,0,0,1|2,0,0]=4 3997 B8R1.2 C#CC1=CCCCC1 Amb1102053 [0,1,0,0,0,1|2,0,0]=4 3998 B8R1.2 C#CC1CCCCO1 Amb17673286 [0,1,0,0,0,1|1,0,1]=4 3999 B8R1.2 C#CC1COCCC1 Amb22229303 [0,1,0,0,0,1|1,0,1]=4 4000 B8R1.2 C#CC1COCCO1 Amb25834164 [0,1,0,0,0,1|1,0,1]=4 4001 B8R1.2 C#CC=1CCOCC1 Amb25078323 [0,1,0,0,0,1|2,0,0]=4 4002 B8R1.2 C#CC=1CNCCC1 Amb25079350 [0,1,0,0,0,1|2,0,0]=4 4003 B8R1.2 C1CCNC=C1C#N Amb16191903 [0,1,0,0,0,1|2,0,0]=4 4004 B8R1.2 C1CCOC=C1C=O Amb2433566 [0,1,0,0,0,1|0,0,0]=2 4005 B8R1.2 C1NCCOC1C#N Amb10604011 [0,1,0,0,0,1|1,0,1]=4 4006 B8R1.2 C1OCCC=C1C=O Amb1102766 [0,1,0,0,0,1|0,0,1]=3 4007 B8R1.2 C=CC1CNCCO1 Amb22235956 [0,1,0,0,0,1|1,0,1]=4 4008 B8R1.2 C=CC1COCCC1 Amb25100920 [0,1,0,0,0,1|1,0,1]=4 4009 B8R1.2 C=CC1OCCCO1 Amb24725153 [0,1,0,0,0,1|1,0,1]=4 4010 B8R1.2 C=CC=1CCCCC1 Amb24387238 [0,1,0,0,0,1|2,0,0]=4 4011 B8R1.2 C=CC=1CCCOC1 Amb25204352 [0,1,0,0,0,1|1,0,0]=3 4012 B8R1.2 CCC1=NCCCN1 Amb17670475 [0,1,0,0,0,1|2,0,0]=4 4013 B8R1.2 CCC1CNCCO1 Amb13951287 [0,1,0,0,0,1|1,0,1]=4 4014 B8R1.2 CCC1NCCCO1 Amb17506192 [0,1,0,0,0,1|1,0,1]=4 4015 B8R1.2 CCC=1CCCCC1 Amb25337001 [0,1,0,0,0,1|2,0,0]=4 4016 B8R1.2 CCC=1CCCCN1 Amb24481485 [0,1,0,0,0,1|2,0,0]=4 4017 B8R1.2 CCC=1CCNCC1 Amb24714735 [0,1,0,0,0,1|2,0,0]=4 4018 B8R1.2 CCC=1CNCCC1 Amb24526370 [0,1,0,0,0,1|2,0,0]=4 4019 B8R1.2 CC[C@@H]1CNCCO1 Amb22736874 [0,1,0,0,0,1|1,0,1]=4 4020 B8R1.2 CC[C@H]1CNCCO1 Amb20242973 [0,1,0,0,0,1|1,0,1]=4 4021 B8R1.2 CC[C@H]1CNCCO1 Amb22226505 [0,1,0,0,0,1|1,0,1]=4 4022 B8R1.2 CN=C1SCCCS1 Amb24066826 [0,1,0,0,0,1|1,1,0]=4 4023 B8R1.2 CNC1CNCCO1 Amb25804554 [0,1,0,0,0,1|1,0,1]=4 4024 B8R1.2 CNC1COCCC1 Amb18641845 [0,1,0,0,0,1|1,0,1]=4 4025 B8R1.2 CNC1COCCC1 Amb22231331 [0,1,0,0,0,1|1,0,1]=4 4026 B8R1.2 CNC=1CCCCN1 Amb23570622 [0,1,0,0,0,1|2,0,0]=4 4027 B8R1.2 CN[C@@H]1CCCCO1 Amb24606835 [0,1,0,0,0,1|1,0,1]=4 4028 B8R1.2 CN[C@H]1CCCCO1 Amb24634478 [0,1,0,0,0,1|1,0,1]=4 4029 B8R1.2 CN[C@H]1COCCC1 Amb24742629 [0,1,0,0,0,1|1,0,1]=4 4030 B8R1.2 COB1OCCCO1 Amb25844432 [0,1,0,0,0,1|1,0,1]=4 4031 B8R1.2 COC1=CCCCC1 Amb10601667 [0,1,0,0,0,1|1,0,1]=4 4032 B8R1.2 COC1CCCCO1 Amb21955138 [0,1,0,0,0,1|0,0,2]=4 4033 B8R1.2 COC1CNCCO1 Amb20669241 [0,1,0,0,0,1|0,0,2]=4 4034 B8R1.2 COC=1CCOCC1 Amb21927983 [0,1,0,0,0,1|1,0,1]=4 4035 B8R1.2 COC=1COCCN1 Amb25304653 [0,1,0,0,0,1|1,0,1]=4 4036 B8R1.2 CSC1=CCCCN1 Amb24671073 [0,1,0,0,0,1|1,1,0]=4 4037 B8R1.2 CSC1=NCCCN1 Amb1154745 [0,1,0,0,0,1|1,1,0]=4 4038 B8R1.2 CSC1=NCCCS1 Amb22481287 [0,1,0,0,0,1|0,2,0]=4 4039 B8R1.2 CSC1=NCCSC1 Amb13883826 [0,1,0,0,0,1|1,1,0]=4 4040 B8R1.2 CSC1CCCCO1 Amb24649762 [0,1,0,0,0,1|0,1,1]=4 4041 B8R1.2 CSC1COCCC1 Amb24447961 [0,1,0,0,0,1|0,1,1]=4 4042 B8R1.2 CSC=1COCCN1 Amb25071651 [0,1,0,0,0,1|1,1,0]=4 4043 B8R1.2 ClC=C1COCOC1 Amb24751556 [0,1,0,0,0,1|2,0,0]=4 4044 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,1,0,0,0,1|1,0,0]=3 4045 B8R1.2 ClCC1CCCOC1 Amb1102676 [0,1,0,0,0,1|1,0,1]=4 4046 B8R1.2 ClCC1CNCCO1 Amb20668892 [0,1,0,0,0,1|1,0,1]=4 4047 B8R1.2 ClCC=1CCCCC1 Amb25173836 [0,1,0,0,0,1|2,0,0]=4 4048 B8R1.2 ClCC=1CCOCC1 Amb25760202 [0,1,0,0,0,1|2,0,0]=4 4049 B8R1.2 ClC[C@@H]1CCCCO1 Amb24596063 [0,1,0,0,0,1|1,0,1]=4 4050 B8R1.2 ClC[C@@H]1CNCCO1 Amb25048095 [0,1,0,0,0,1|1,0,1]=4 4051 B8R1.2 ClN=C1CCCCC1 Amb25069376 [0,1,0,0,0,1|2,0,0]=4 4052 B8R1.2 ICC1CCCCO1 Amb24060887 [0,1,0,0,0,1|1,0,1]=4 4053 B8R1.2 ICC1CCOCO1 Amb19373646 [0,1,0,0,0,1|1,0,1]=4 4054 B8R1.2 ICC1COCCO1 Amb24061260 [0,1,0,0,0,1|1,0,1]=4 4055 B8R1.2 N#CC1=CCCCN1 Amb24524465 [0,1,0,0,0,1|2,0,0]=4 4056 B8R1.2 N#CC1CCCON1 Amb24519081 [0,1,0,0,0,1|1,0,1]=4 4057 B8R1.2 N#CC1CNCCO1 Amb19373292 [0,1,0,0,0,1|1,0,1]=4 4058 B8R1.2 N#CC1COCCC1 Amb19148306 [0,1,0,0,0,1|1,0,1]=4 4059 B8R1.2 N#CC1COCCO1 Amb22002145 [0,1,0,0,0,1|1,0,1]=4 4060 B8R1.2 N#CC1CSCCO1 Amb20622840 [0,1,0,0,0,1|1,0,1]=4 4061 B8R1.2 N#CC=1CCCOC1 Amb19319238 [0,1,0,0,0,1|1,0,0]=3 4062 B8R1.2 N#CC=1CCOCC1 Amb25277232 [0,1,0,0,0,1|2,0,0]=4 4063 B8R1.2 NCC1=CCCCC1 Amb10607847 [0,1,0,0,0,1|2,0,0]=4 4064 B8R1.2 NCC1=NCCCN1 Amb13952559 [0,1,0,0,0,1|2,0,0]=4 4065 B8R1.2 NCC1CCCCO1 Amb19372867 [0,1,0,0,0,1|1,0,1]=4 4066 B8R1.2 NCC1CCCOC1 Amb10603286 [0,1,0,0,0,1|1,0,1]=4 4067 B8R1.2 NCC1CCCOC1 Amb1092537 [0,1,0,0,0,1|1,0,1]=4 4068 B8R1.2 NCC1CCOCO1 Amb20669541 [0,1,0,0,0,1|1,0,1]=4 4069 B8R1.2 NCC1CCOCO1 Amb22157235 [0,1,0,0,0,1|1,0,1]=4 4070 B8R1.2 NCC1CNCCO1 Amb22490153 [0,1,0,0,0,1|1,0,1]=4 4071 B8R1.2 NCC1CNCCO1 Amb2369955 [0,1,0,0,0,1|1,0,1]=4 4072 B8R1.2 NCC1COCCC1 Amb22492350 [0,1,0,0,0,1|1,0,1]=4 4073 B8R1.2 NCC1COCCO1 Amb1087841 [0,1,0,0,0,1|1,0,1]=4 4074 B8R1.2 NCC1OCCCO1 Amb17226711 [0,1,0,0,0,1|1,0,1]=4 4075 B8R1.2 NCC=1CCCCC1 Amb22587029 [0,1,0,0,0,1|2,0,0]=4 4076 B8R1.2 NCC=1CCOCC1 Amb24608110 [0,1,0,0,0,1|2,0,0]=4 4077 B8R1.2 NCC=1COCCC1 Amb24329061 [0,1,0,0,0,1|1,0,1]=4 4078 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,1,0,0,0,1|1,0,1]=4 4079 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,1,0,0,0,1|1,0,1]=4 4080 B8R1.2 NC[C@@H]1CNCCO1 Amb22748803 [0,1,0,0,0,1|1,0,1]=4 4081 B8R1.2 NC[C@@H]1COCCC1 Amb24483141 [0,1,0,0,0,1|1,0,1]=4 4082 B8R1.2 NC[C@@H]1COCCO1 Amb22406261 [0,1,0,0,0,1|1,0,1]=4 4083 B8R1.2 NC[C@@H]1COCCO1 Amb24704288 [0,1,0,0,0,1|1,0,1]=4 4084 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,1,0,0,0,1|1,0,1]=4 4085 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,1,0,0,0,1|1,0,1]=4 4086 B8R1.2 NC[C@H]1CNCCO1 Amb25197821 [0,1,0,0,0,1|1,0,1]=4 4087 B8R1.2 NC[C@H]1COCCC1 Amb25849361 [0,1,0,0,0,1|1,0,1]=4 4088 B8R1.2 NC[C@H]1COCCO1 Amb22406262 [0,1,0,0,0,1|1,0,1]=4 4089 B8R1.2 NC[C@H]1COCCO1 Amb24686998 [0,1,0,0,0,1|1,0,1]=4 4090 B8R1.2 NN=C1CCOCC1 Amb24672249 [0,1,0,0,0,1|2,0,0]=4 4091 B8R1.2 NN=C1CNCCN1 Amb24561141 [0,1,0,0,0,1|2,0,0]=4 4092 B8R1.2 NN=C1COCCN1 Amb20667881 [0,1,0,0,0,1|2,0,0]=4 4093 B8R1.2 NNC1=NCCCN1 Amb10844744 [0,1,0,0,0,1|2,0,0]=4 4094 B8R1.2 NNC1=NCCCN1 Amb16231365 [0,1,0,0,0,1|2,0,0]=4 4095 B8R1.2 NNC1CCCCO1 Amb25322400 [0,1,0,0,0,1|1,0,1]=4 4096 B8R1.2 NNC1COCCC1 Amb23412249 [0,1,0,0,0,1|1,0,1]=4 4097 B8R1.2 NNC1COCCC1 Amb23412254 [0,1,0,0,0,1|1,0,1]=4 4098 B8R1.2 NNC1COCCC1 Amb23412255 [0,1,0,0,0,1|1,0,1]=4 4099 B8R1.2 NNC=1CCCCN1 Amb24119302 [0,1,0,0,0,1|2,0,0]=4 4100 B8R1.2 NOC1CCCCO1 Amb10975936 [0,1,0,0,0,1|0,0,2]=4 4101 B8R1.2 O=C=C1CCCCC1 Amb24745297 [0,1,0,0,0,1|1,0,0]=3 4102 B8R1.2 O=CC1=CCCCO1 Amb18641688 [0,1,0,0,0,1|0,0,0]=2 4103 B8R1.2 O=CC1=CSCCS1 Amb25680940 [0,1,0,0,0,1|0,1,1]=4 4104 B8R1.2 O=CC1CCCC=C1 Amb18641614 [0,1,0,0,0,1|1,0,1]=4 4105 B8R1.2 O=CC1CCCCN1 Amb20242687 [0,1,0,0,0,1|1,0,1]=4 4106 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,1,0,0,0,1|0,1,1]=4 4107 B8R1.2 O=CC1CCCNC1 Amb16232415 [0,1,0,0,0,1|1,0,1]=4 4108 B8R1.2 O=CC1CCCOS1 Amb25680953 [0,1,0,0,0,1|0,0,1]=3 4109 B8R1.2 O=CC1CCNCC1 Amb16232416 [0,1,0,0,0,1|1,0,1]=4 4110 B8R1.2 O=CC1CCNCC1 Amb22231400 [0,1,0,0,0,1|1,0,1]=4 4111 B8R1.2 O=CC1CNCCC1 Amb18833063 [0,1,0,0,0,1|1,0,1]=4 4112 B8R1.2 O=CC1CNCCN1 Amb22228910 [0,1,0,0,0,1|1,0,1]=4 4113 B8R1.2 O=CC1COCCN1 Amb18833023 [0,1,0,0,0,1|1,0,1]=4 4114 B8R1.2 O=CC1COCOC1 Amb25707583 [0,1,0,0,0,1|1,0,1]=4 4115 B8R1.2 O=CC1CSCCC1 Amb18642817 [0,1,0,0,0,1|0,1,1]=4 4116 B8R1.2 O=CC1CSCCO1 Amb25328255 [0,1,0,0,0,1|0,0,1]=3 4117 B8R1.2 O=CC1CSCCS1 Amb25218449 [0,1,0,0,0,1|0,1,1]=4 4118 B8R1.2 O=CC1OCCCO1 Amb25756192 [0,1,0,0,0,1|0,0,1]=3 4119 B8R1.2 O=CC1OCOCO1 Amb24608690 [0,1,0,0,0,1|1,0,1]=4 4120 B8R1.2 O=CC1SCCCS1 Amb25810767 [0,1,0,0,0,1|0,1,1]=4 4121 B8R1.2 O=CC=1CCCNC1 Amb25326735 [0,1,0,0,0,1|1,0,0]=3 4122 B8R1.2 O=CC=1CCNCC1 Amb24630224 [0,1,0,0,0,1|1,0,0]=3 4123 B8R1.2 O=CC=1CCOCC1 Amb18641683 [0,1,0,0,0,1|1,0,0]=3 4124 B8R1.2 O=CC=1CSCCC1 Amb18642670 [0,1,0,0,0,1|1,0,0]=3 4125 B8R1.2 O=CN1CCCC=C1 Amb22371093 [0,1,0,0,0,1|2,0,0]=4 4126 B8R1.2 O=CN1CCCCO1 Amb24332705 [0,1,0,0,0,1|1,0,0]=3 4127 B8R1.2 O=CN1CCNCC1 Amb1663437 [0,1,0,0,0,1|2,0,0]=4 4128 B8R1.2 O=C[C@@H]1CCCCO1 Amb25731797 [0,1,0,0,0,1|0,0,1]=3 4129 B8R1.2 O=C[C@@H]1CCOCO1 Amb25839349 [0,1,0,0,0,1|0,0,1]=3 4130 B8R1.2 O=C[C@@H]1COCCC1 Amb24332628 [0,1,0,0,0,1|0,0,1]=3 4131 B8R1.2 O=C[C@H]1CCC=CO1 Amb24533832 [0,1,0,0,0,1|0,0,2]=4 4132 B8R1.2 O=C[C@H]1CCCCO1 Amb25811086 [0,1,0,0,0,1|0,0,1]=3 4133 B8R1.2 O=NN1CCCCC1 Amb10604043 [0,1,0,0,0,1|2,0,0]=4 4134 B8R1.2 O=NN1CCNCC1 Amb10976905 [0,1,0,0,0,1|2,0,0]=4 4135 B8R1.2 O=[13CH]N1CCOCC1 Amb22055892 [0,1,0,0,0,1|2,0,0]=4 4136 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,1,0,0,0,1|0,0,1]=3 4137 B8R1.2 OCC1=COCCO1 Amb19319714 [0,1,0,0,0,1|0,0,2]=4 4138 B8R1.2 OCC1CCCNO1 Amb24552317 [0,1,0,0,0,1|0,0,2]=4 4139 B8R1.2 OCC1CCCOC1 Amb1093253 [0,1,0,0,0,1|0,0,2]=4 4140 B8R1.2 OCC1CNCCO1 Amb19957720 [0,1,0,0,0,1|0,0,2]=4 4141 B8R1.2 OCC1CNCCO1 Amb22490666 [0,1,0,0,0,1|0,0,2]=4 4142 B8R1.2 OCC1COCCO1 Amb10607696 [0,1,0,0,0,1|0,0,2]=4 4143 B8R1.2 OCC=1CCCCC1 Amb24122911 [0,1,0,0,0,1|1,0,1]=4 4144 B8R1.2 OCC=1CCCOC1 Amb24426430 [0,1,0,0,0,1|0,0,1]=3 4145 B8R1.2 OCC=1CCCON1 Amb25675358 [0,1,0,0,0,1|0,0,1]=3 4146 B8R1.2 OCC=1CCNCC1 Amb24105368 [0,1,0,0,0,1|1,0,1]=4 4147 B8R1.2 OCC=1CNCCC1 Amb25189014 [0,1,0,0,0,1|1,0,1]=4 4148 B8R1.2 OCC=1COCCC1 Amb24329074 [0,1,0,0,0,1|0,0,2]=4 4149 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,1,0,0,0,1|0,0,2]=4 4150 B8R1.2 OC[C@@H]1CNCCO1 Amb10067152 [0,1,0,0,0,1|0,0,2]=4 4151 B8R1.2 OC[C@@H]1CNCCO1 Amb17933818 [0,1,0,0,0,1|0,0,2]=4 4152 B8R1.2 OC[C@@H]1CNCCO1 Amb22748210 [0,1,0,0,0,1|0,0,2]=4 4153 B8R1.2 OC[C@@H]1COCCC1 Amb24413844 [0,1,0,0,0,1|0,0,2]=4 4154 B8R1.2 OC[C@@H]1COCCO1 Amb22752848 [0,1,0,0,0,1|0,0,2]=4 4155 B8R1.2 OC[C@H]1CNCCO1 Amb10067151 [0,1,0,0,0,1|0,0,2]=4 4156 B8R1.2 OC[C@H]1COCCO1 Amb25724377 [0,1,0,0,0,1|0,0,2]=4 4157 B8R1.2 ON=C1CCNCC1 Amb16226328 [0,1,0,0,0,1|1,0,1]=4 4158 B8R1.2 ON=C1CCSCC1 Amb2445012 [0,1,0,0,0,1|1,0,1]=4 4159 B8R1.2 ON=C1CNCCC1 Amb24612155 [0,1,0,0,0,1|1,0,1]=4 4160 B8R1.2 ON=C1CNCCS1 Amb25229322 [0,1,0,0,0,1|0,1,1]=4 4161 B8R1.2 ON=C1COCCC1 Amb24745113 [0,1,0,0,0,1|0,0,1]=3 4162 B8R1.2 ON=C1CSCCC1 Amb25132339 [0,1,0,0,0,1|0,1,1]=4 4163 B8R1.2 ONC1COCCC1 Amb25127355 [0,1,0,0,0,1|0,0,2]=4 4164 B8R1.2 O\N=C\1/CNCCC1 Amb25209821 [0,1,0,0,0,1|1,0,1]=4 4165 B8R1.2 SCC1CCCCO1 Amb23585661 [0,1,0,0,0,1|0,1,1]=4 4166 B8R1.2 [C-]#[N+]C1=CCCCC1 Amb10603087 [0,1,0,0,0,1|2,0,0]=4 4167 B8R1.2 [C-]#[N+]C1CCCCO1 Amb25252978 [0,1,0,0,0,1|1,0,1]=4 4168 B8R1.2 [N-]=[N+]=C1CCCCC1 Amb25785673 [0,1,0,0,0,1|2,0,0]=4 4169 B8R1.2 [SiH3]OC1CNCCO1 Amb24745607 [0,1,0,0,0,1|0,0,2]=4 4170 B8R1.3 C=C1CCC(=C)CC1 Amb22227744 [0,1,0,0,0,1|2,0,0]=4 4171 B8R1.3 C=C1CCC(=O)C=C1 Amb24416744 [0,1,0,0,0,1|1,0,1]=4 4172 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,1,0,0,0,1|1,0,0]=3 4173 B8R1.3 C=C1CCC(Br)CC1 Amb25320915 [0,1,0,0,0,1|2,0,0]=4 4174 B8R1.3 C=C1CCC(N)CC1 Amb23599023 [0,1,0,0,0,1|2,0,0]=4 4175 B8R1.3 C=C1CCC(O)C=C1 Amb25675588 [0,1,0,0,0,1|2,0,0]=4 4176 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,1,0,0,0,1|1,0,1]=4 4177 B8R1.3 CC1CC=C(C)CN1 Amb23455589 [0,1,0,0,0,1|2,0,0]=4 4178 B8R1.3 CC1CCC(=C)CC1 Amb24058250 [0,1,0,0,0,1|2,0,0]=4 4179 B8R1.3 CC1CCC(=O)C=C1 Amb24556470 [0,1,0,0,0,1|1,0,0]=3 4180 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,1,0,0,0,1|0,0,0]=2 4181 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,1,0,0,0,1|0,1,0]=3 4182 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,1,0,0,0,1|1,0,0]=3 4183 B8R1.3 CC1CCC(Br)CO1 Amb25808117 [0,1,0,0,0,1|1,0,1]=4 4184 B8R1.3 CC1CCC(Cl)CO1 Amb25774457 [0,1,0,0,0,1|1,0,1]=4 4185 B8R1.3 CC1CN=C(N)SC1 Amb25169567 [0,1,0,0,0,1|1,1,0]=4 4186 B8R1.3 CC1CNC(=N)CC1 Amb25680063 [0,1,0,0,0,1|2,0,0]=4 4187 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,1,0,0,0,1|1,0,0]=3 4188 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,1,0,0,0,1|1,0,0]=3 4189 B8R1.3 CC1CNC(C)CO1 Amb22751384 [0,1,0,0,0,1|1,0,1]=4 4190 B8R1.3 CC1CNC(N)=NC1 Amb24685625 [0,1,0,0,0,1|2,0,0]=4 4191 B8R1.3 CC1CNC(O)=NC1 Amb25268854 [0,1,0,0,0,1|1,0,1]=4 4192 B8R1.3 CC1CNC(S)=NC1 Amb25211387 [0,1,0,0,0,1|1,1,0]=4 4193 B8R1.3 CC1COC(=O)OC1 Amb21856480 [0,1,0,0,0,1|0,0,0]=2 4194 B8R1.3 CC1COC(C)CO1 Amb25738098 [0,1,0,0,0,1|1,0,1]=4 4195 B8R1.3 CC1OCC(N)CO1 Amb24358655 [0,1,0,0,0,1|1,0,1]=4 4196 B8R1.3 CC1OCC(O)CO1 Amb25761626 [0,1,0,0,0,1|1,0,1]=4 4197 B8R1.3 CC1SCC(=O)CS1 Amb25086708 [0,1,0,0,0,1|1,1,0]=4 4198 B8R1.3 CC=1CCC(=O)NC1 Amb25078192 [0,1,0,0,0,1|1,0,1]=4 4199 B8R1.3 CC=1CCC(O)CN1 Amb25700893 [0,1,0,0,0,1|2,0,0]=4 4200 B8R1.3 CC=1CC[C@@H](O)CC1 Amb25796430 [0,1,0,0,0,1|2,0,0]=4 4201 B8R1.3 CC=1NCC(N)CN1 Amb25103687 [0,1,0,0,0,1|2,0,0]=4 4202 B8R1.3 CN1CC=C(Br)CC1 Amb22728686 [0,1,0,0,0,1|2,0,0]=4 4203 B8R1.3 CN1CC=C(N)CC1 Amb25829461 [0,1,0,0,0,1|2,0,0]=4 4204 B8R1.3 CN1CCC(=C)CC1 Amb19514532 [0,1,0,0,0,1|2,0,0]=4 4205 B8R1.3 CN1CCC(=C)CC1 Amb22752768 [0,1,0,0,0,1|2,0,0]=4 4206 B8R1.3 CN1CCC(=CC1)Br Amb13888775 [0,1,0,0,0,1|2,0,0]=4 4207 B8R1.3 CN1CCC(=N)CC1 Amb25824943 [0,1,0,0,0,1|2,0,0]=4 4208 B8R1.3 CN1CCC(=O)C=C1 Amb17593148 [0,1,0,0,0,1|1,0,1]=4 4209 B8R1.3 CP1CCC(=O)CC1 Amb25767035 [0,1,0,0,0,1|1,0,0]=3 4210 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,1,0,0,0,1|1,0,0]=3 4211 B8R1.3 C[C@@H]1CC[C@@H](O)CO1 Amb25176515 [0,1,0,0,0,1|0,0,2]=4 4212 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,1,0,0,0,1|1,0,0]=3 4213 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,1,0,0,0,1|1,0,0]=3 4214 B8R1.3 C[C@@H]1CN[C@@H](C)CO1 Amb22745541 [0,1,0,0,0,1|1,0,1]=4 4215 B8R1.3 C[C@@H]1CN[C@@H](C)CO1 Amb22748917 [0,1,0,0,0,1|1,0,1]=4 4216 B8R1.3 C[C@@H]1CN[C@H](C)CO1 Amb22745542 [0,1,0,0,0,1|1,0,1]=4 4217 B8R1.3 C[C@@H]1CN[C@H](C)CO1 Amb22747293 [0,1,0,0,0,1|1,0,1]=4 4218 B8R1.3 C[C@@H]1OC[C@H](Cl)CO1 Amb25238308 [0,1,0,0,0,1|1,0,1]=4 4219 B8R1.3 C[C@H]1CCC(=O)CO1 Amb25262664 [0,1,0,0,0,1|0,0,0]=2 4220 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,1,0,0,0,1|1,0,0]=3 4221 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,1,0,0,0,1|1,0,0]=3 4222 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,1,0,0,0,1|1,0,0]=3 4223 B8R1.3 C[C@H]1CN[C@@H](C)CO1 Amb24087467 [0,1,0,0,0,1|1,0,1]=4 4224 B8R1.3 C[NH+]1CCC(=O)CC1 Amb10552693 [0,1,0,0,0,1|1,0,0]=3 4225 B8R1.3 ClC1CC=C(Cl)CC1 Amb25210464 [0,1,0,0,0,1|2,0,0]=4 4226 B8R1.3 ClC1COC(Cl)CO1 Amb24482277 [0,1,0,0,0,1|1,0,1]=4 4227 B8R1.3 NC1=NCC(Br)CS1 Amb24365959 [0,1,0,0,0,1|1,1,0]=4 4228 B8R1.3 NC1=NCC(Cl)CS1 Amb24449683 [0,1,0,0,0,1|1,1,0]=4 4229 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,1,0,0,0,1|1,0,0]=3 4230 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,1,0,0,0,1|1,0,0]=3 4231 B8R1.3 NC1CCC(=O)CC1 Amb22831860 [0,1,0,0,0,1|1,0,0]=3 4232 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,1,0,0,0,1|1,0,0]=3 4233 B8R1.3 NC1CCC(=O)NN1 Amb24456868 [0,1,0,0,0,1|1,0,0]=3 4234 B8R1.3 NC1CCS(=O)CC1 Amb18943776 [0,1,0,0,0,1|2,0,0]=4 4235 B8R1.3 NC1CCS(=O)CC1 Amb21988665 [0,1,0,0,0,1|2,0,0]=4 4236 B8R1.3 NC1CNC(=O)CC1 Amb18833034 [0,1,0,0,0,1|1,0,0]=3 4237 B8R1.3 NC1CNC(N)=NC1 Amb25310186 [0,1,0,0,0,1|2,0,0]=4 4238 B8R1.3 NC1CNC(O)=NC1 Amb25232194 [0,1,0,0,0,1|1,0,1]=4 4239 B8R1.3 NC1CNC(S)=NC1 Amb24651484 [0,1,0,0,0,1|1,1,0]=4 4240 B8R1.3 NC1COB(O)OC1 Amb24483054 [0,1,0,0,0,1|1,0,1]=4 4241 B8R1.3 NC1COC(N)CO1 Amb24505290 [0,1,0,0,0,1|1,0,1]=4 4242 B8R1.3 NC1COS(=O)OC1 Amb24564500 [0,1,0,0,0,1|1,0,0]=3 4243 B8R1.3 N[C@@H]1CNC(=O)CC1 Amb22748949 [0,1,0,0,0,1|1,0,0]=3 4244 B8R1.3 O=C1CCC(=O)CN1 Amb15692796 [0,1,0,0,0,1|1,0,0]=3 4245 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [0,1,0,0,0,1|1,0,1]=4 4246 B8R1.3 O=C1CCC(Br)C=C1 Amb24483190 [0,1,0,0,0,1|1,0,0]=3 4247 B8R1.3 O=C1CCC(Cl)NN1 Amb24749762 [0,1,0,0,0,1|1,0,0]=3 4248 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,1,0,0,0,1|1,0,0]=3 4249 B8R1.3 O=C1CCC(I)CN1 Amb25341317 [0,1,0,0,0,1|1,0,0]=3 4250 B8R1.3 O=C1CNC(=O)CC1 Amb22491034 [0,1,0,0,0,1|1,0,0]=3 4251 B8R1.3 O=C1CNC(=O)OC1 Amb24481365 [0,1,0,0,0,1|0,0,1]=3 4252 B8R1.3 O=C1CNC(=S)CN1 Amb25804364 [0,1,0,0,0,1|1,0,1]=4 4253 B8R1.3 O=C1COC(C=C1)O Amb17593180 [0,1,0,0,0,1|0,0,2]=4 4254 B8R1.3 O=C1NCC(=O)NC1 Amb1011605 [0,1,0,0,0,1|1,0,1]=4 4255 B8R1.3 O=C1NCC(Br)CN1 Amb24749834 [0,1,0,0,0,1|1,0,0]=3 4256 B8R1.3 O=S1CCC(Cl)CC1 Amb21988466 [0,1,0,0,0,1|2,0,0]=4 4257 B8R1.3 OB1OCC(O)CO1 Amb25115424 [0,1,0,0,0,1|1,0,1]=4 4258 B8R1.3 OC1CC=C(Br)CC1 Amb24353589 [0,1,0,0,0,1|2,0,0]=4 4259 B8R1.3 OC1CCC(=O)NC1 Amb10066907 [0,1,0,0,0,1|1,0,0]=3 4260 B8R1.3 OC1CCS(=O)CC1 Amb21988465 [0,1,0,0,0,1|2,0,0]=4 4261 B8R1.3 OC1CNC(=O)NC1 Amb19516674 [0,1,0,0,0,1|1,0,0]=3 4262 B8R1.3 OC1CNC(O)=NC1 Amb20001781 [0,1,0,0,0,1|1,0,1]=4 4263 B8R1.3 OC1OCC(OC1)O Amb15691939 [0,1,0,0,0,1|0,0,2]=4 4264 B8R1.3 O[C@@H]1CNC(=O)C=C1 Amb25844378 [0,1,0,0,0,1|1,0,1]=4 4265 B8R1.3 O[C@@H]1CO[C@@H](O)CC1 Amb25219273 [0,1,0,0,0,1|0,0,2]=4 4266 B8R1.3 O[C@H]1CCC(=O)C=C1 Amb25707492 [0,1,0,0,0,1|1,0,0]=3 4267 B8R1.3 O[C@H]1CNC(=O)C=C1 Amb24565407 [0,1,0,0,0,1|1,0,1]=4 4268 B8R1.3 S=C1NCC(Br)CS1 Amb24390453 [0,1,0,0,0,1|0,2,0]=4 4269 B8R1.4 C=C1CC(O)CCC1 Amb25296194 [0,1,0,0,0,1|2,0,0]=4 4270 B8R1.4 C=C1CCCC(=C)C1 Amb17940138 [0,1,0,0,0,1|2,0,0]=4 4271 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,1,0,0,0,1|1,0,0]=3 4272 B8R1.4 CC1=CC(=O)CCO1 Amb25053054 [0,1,0,0,0,1|1,0,1]=4 4273 B8R1.4 CC1=CC(=O)CCS1 Amb25092957 [0,1,0,0,0,1|1,0,1]=4 4274 B8R1.4 CC1=CC(CCC1)O Amb10844732 [0,1,0,0,0,1|2,0,0]=4 4275 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,1,0,0,0,1|0,0,1]=3 4276 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,1,0,0,0,1|0,0,2]=4 4277 B8R1.4 CC1C=C(C)CCN1 Amb24694144 [0,1,0,0,0,1|2,0,0]=4 4278 B8R1.4 CC1C=CCC(=O)N1 Amb24392943 [0,1,0,0,0,1|1,0,1]=4 4279 B8R1.4 CC1CC(=C)CCC1 Amb25237522 [0,1,0,0,0,1|2,0,0]=4 4280 B8R1.4 CC1CC(=C)CCO1 Amb25235098 [0,1,0,0,0,1|1,0,1]=4 4281 B8R1.4 CC1CC(=N)NCC1 Amb19930463 [0,1,0,0,0,1|2,0,0]=4 4282 B8R1.4 CC1CC(=O)C=CO1 Amb25173826 [0,1,0,0,0,1|1,0,1]=4 4283 B8R1.4 CC1CC(=O)C=CS1 Amb25053096 [0,1,0,0,0,1|1,0,1]=4 4284 B8R1.4 CC1CC(=O)CC=C1 Amb25713549 [0,1,0,0,0,1|1,0,1]=4 4285 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,1,0,0,0,1|1,0,0]=3 4286 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,1,0,0,0,1|1,0,0]=3 4287 B8R1.4 CC1CC(=O)NC=C1 Amb24745438 [0,1,0,0,0,1|1,0,1]=4 4288 B8R1.4 CC1CC(=O)NCC1 Amb20668125 [0,1,0,0,0,1|1,0,0]=3 4289 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [0,1,0,0,0,1|1,0,1]=4 4290 B8R1.4 CC1CC(Br)OCC1 Amb24433110 [0,1,0,0,0,1|1,0,1]=4 4291 B8R1.4 CC1CC(C)=CCN1 Amb25352197 [0,1,0,0,0,1|2,0,0]=4 4292 B8R1.4 CC1CC(Cl)OCC1 Amb24693934 [0,1,0,0,0,1|1,0,1]=4 4293 B8R1.4 CC1CC(N)=NCC1 Amb22496716 [0,1,0,0,0,1|2,0,0]=4 4294 B8R1.4 CC1CC(N)CCO1 Amb22059408 [0,1,0,0,0,1|1,0,1]=4 4295 B8R1.4 CC1CC(O)CCO1 Amb22757197 [0,1,0,0,0,1|1,0,1]=4 4296 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,1,0,0,0,1|0,0,1]=3 4297 B8R1.4 CC1CC=NC(=O)N1 Amb24580624 [0,1,0,0,0,1|1,0,1]=4 4298 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,1,0,0,0,1|1,0,0]=3 4299 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,1,0,0,0,1|1,0,0]=3 4300 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,1,0,0,0,1|0,0,0]=2 4301 B8R1.4 CC1CCCC(Cl)O1 Amb25258362 [0,1,0,0,0,1|1,0,1]=4 4302 B8R1.4 CC1CCCC(N)=N1 Amb24674080 [0,1,0,0,0,1|2,0,0]=4 4303 B8R1.4 CC1CCN=C(N)S1 Amb22228568 [0,1,0,0,0,1|1,1,0]=4 4304 B8R1.4 CC1CCNC(=N)C1 Amb17616048 [0,1,0,0,0,1|2,0,0]=4 4305 B8R1.4 CC1CCNC(=S)O1 Amb25836339 [0,1,0,0,0,1|0,1,0]=3 4306 B8R1.4 CC1CCNC(C)=N1 Amb25837033 [0,1,0,0,0,1|2,0,0]=4 4307 B8R1.4 CC1CCOB(O)O1 Amb24079673 [0,1,0,0,0,1|1,0,1]=4 4308 B8R1.4 CC1CCOC(=O)C1 Amb15693478 [0,1,0,0,0,1|0,0,0]=2 4309 B8R1.4 CC1CCOC(=S)N1 Amb24548582 [0,1,0,0,0,1|0,1,0]=3 4310 B8R1.4 CC1CCSC(=S)N1 Amb25368051 [0,1,0,0,0,1|0,2,0]=4 4311 B8R1.4 CC1CN(C)CCO1 Amb22754927 [0,1,0,0,0,1|1,0,1]=4 4312 B8R1.4 CC1CN(N)CCO1 Amb18559327 [0,1,0,0,0,1|1,0,1]=4 4313 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,1,0,0,0,1|1,0,0]=3 4314 B8R1.4 CC1CNCC(C)=C1 Amb25757457 [0,1,0,0,0,1|2,0,0]=4 4315 B8R1.4 CC1CNCC(C)O1 Amb22754920 [0,1,0,0,0,1|1,0,1]=4 4316 B8R1.4 CC1COCC(=O)C1 Amb24431094 [0,1,0,0,0,1|0,0,0]=2 4317 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,1,0,0,0,1|1,0,0]=3 4318 B8R1.4 CC1CS(=O)CCN1 Amb18124392 [0,1,0,0,0,1|2,0,0]=4 4319 B8R1.4 CC1CSCC(=O)C1 Amb23568711 [0,1,0,0,0,1|0,1,0]=3 4320 B8R1.4 CC1CSCC(=O)N1 Amb25131602 [0,1,0,0,0,1|1,0,0]=3 4321 B8R1.4 CC1NCCC(=O)C1 Amb1087926 [0,1,0,0,0,1|1,0,0]=3 4322 B8R1.4 CC1OCCC(C)=C1 Amb17689157 [0,1,0,0,0,1|2,0,0]=4 4323 B8R1.4 CC=1CC(=O)NCC1 Amb25259208 [0,1,0,0,0,1|1,0,1]=4 4324 B8R1.4 CC=1CC(=O)OCC1 Amb24751502 [0,1,0,0,0,1|0,0,1]=3 4325 B8R1.4 CC=1CC(O)CCC1 Amb25245575 [0,1,0,0,0,1|2,0,0]=4 4326 B8R1.4 CC=1CC(O)OCC1 Amb24524376 [0,1,0,0,0,1|2,0,0]=4 4327 B8R1.4 CC=1CCCC(Br)C1 Amb25108623 [0,1,0,0,0,1|2,0,0]=4 4328 B8R1.4 CC=1CCCC(N)C1 Amb18641662 [0,1,0,0,0,1|2,0,0]=4 4329 B8R1.4 CC=1CCC[C@@H](O)C1 Amb25734264 [0,1,0,0,0,1|2,0,0]=4 4330 B8R1.4 CC=1COCC(=O)C1 Amb25065804 [0,1,0,0,0,1|0,0,2]=4 4331 B8R1.4 CC=1C[C@@H](O)CCC1 Amb24619172 [0,1,0,0,0,1|2,0,0]=4 4332 B8R1.4 CC=1NC(O)CCN1 Amb25326382 [0,1,0,0,0,1|2,0,0]=4 4333 B8R1.4 CC=1NCCC(=O)N1 Amb24382048 [0,1,0,0,0,1|1,0,1]=4 4334 B8R1.4 CN1CC(=O)CCC1 Amb22304741 [0,1,0,0,0,1|1,0,0]=3 4335 B8R1.4 CN1CC(=O)CCC1 Amb22490632 [0,1,0,0,0,1|1,0,0]=3 4336 B8R1.4 CN1CC(=O)NCC1 Amb19958159 [0,1,0,0,0,1|1,0,0]=3 4337 B8R1.4 CN1CC(=O)OCC1 Amb21963307 [0,1,0,0,0,1|0,0,0]=2 4338 B8R1.4 CN1CC(=O)OCC1 Amb22491652 [0,1,0,0,0,1|0,0,0]=2 4339 B8R1.4 CN1CCC=C(C1)Br Amb10975875 [0,1,0,0,0,1|2,0,0]=4 4340 B8R1.4 CN1CCC=C(C1)Br Amb13888761 [0,1,0,0,0,1|2,0,0]=4 4341 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,1,0,0,0,1|1,0,0]=3 4342 B8R1.4 CN1CCNC(=O)N1 Amb24426756 [0,1,0,0,0,1|2,0,0]=4 4343 B8R1.4 CS=1CCCC(=O)C1 Amb25318868 [0,1,0,0,0,1|0,1,0]=3 4344 B8R1.4 C[C@@H]1CC(=O)C=CO1 Amb22748948 [0,1,0,0,0,1|1,0,1]=4 4345 B8R1.4 C[C@@H]1CC(=O)CCC1 Amb22799724 [0,1,0,0,0,1|1,0,0]=3 4346 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,1,0,0,0,1|1,0,0]=3 4347 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,1,0,0,0,1|1,0,0]=3 4348 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,1,0,0,0,1|1,0,0]=3 4349 B8R1.4 C[C@@H]1CC(=O)NCC1 Amb25739591 [0,1,0,0,0,1|1,0,0]=3 4350 B8R1.4 C[C@@H]1CC=CC(=O)N1 Amb25062539 [0,1,0,0,0,1|1,0,1]=4 4351 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,1,0,0,0,1|1,0,0]=3 4352 B8R1.4 C[C@@H]1CCCC(O)O1 Amb25680618 [0,1,0,0,0,1|0,0,2]=4 4353 B8R1.4 C[C@@H]1CCC[C@@H](O)O1 Amb25345132 [0,1,0,0,0,1|0,0,2]=4 4354 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,1,0,0,0,1|1,0,0]=3 4355 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,1,0,0,0,1|1,0,0]=3 4356 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22745550 [0,1,0,0,0,1|1,0,1]=4 4357 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22748718 [0,1,0,0,0,1|1,0,1]=4 4358 B8R1.4 C[C@@H]1COCC(=O)C1 Amb25746655 [0,1,0,0,0,1|0,0,0]=2 4359 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,1,0,0,0,1|1,0,0]=3 4360 B8R1.4 C[C@@H]1CS(=O)CCN1 Amb24695988 [0,1,0,0,0,1|2,0,0]=4 4361 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [0,1,0,0,0,1|1,0,1]=4 4362 B8R1.4 C[C@@H]1C[C@@H](O)CCO1 Amb22753040 [0,1,0,0,0,1|1,0,1]=4 4363 B8R1.4 C[C@@H]1C[C@H](Cl)OCC1 Amb24513485 [0,1,0,0,0,1|1,0,1]=4 4364 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [0,1,0,0,0,1|1,0,1]=4 4365 B8R1.4 C[C@@H]1C[C@H](O)CCO1 Amb22746391 [0,1,0,0,0,1|1,0,1]=4 4366 B8R1.4 C[C@H]1CC(=O)C=CN1 Amb25800362 [0,1,0,0,0,1|1,0,1]=4 4367 B8R1.4 C[C@H]1CC(=O)C=CO1 Amb24483279 [0,1,0,0,0,1|1,0,1]=4 4368 B8R1.4 C[C@H]1CC(=O)CCC1 Amb21618704 [0,1,0,0,0,1|1,0,0]=3 4369 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,1,0,0,0,1|1,0,0]=3 4370 B8R1.4 C[C@H]1CC(O)OCC1 Amb25810643 [0,1,0,0,0,1|0,0,2]=4 4371 B8R1.4 C[C@H]1CC=CC(=O)C1 Amb25723295 [0,1,0,0,0,1|1,0,0]=3 4372 B8R1.4 C[C@H]1CC=CC(=O)N1 Amb25326479 [0,1,0,0,0,1|1,0,1]=4 4373 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,1,0,0,0,1|0,0,1]=3 4374 B8R1.4 C[C@H]1CCCC(=O)N1 Amb25327957 [0,1,0,0,0,1|1,0,0]=3 4375 B8R1.4 C[C@H]1CCC[C@@H](O)O1 Amb25175369 [0,1,0,0,0,1|0,0,2]=4 4376 B8R1.4 C[C@H]1CN(C)CCO1 Amb25162545 [0,1,0,0,0,1|1,0,1]=4 4377 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,1,0,0,0,1|1,0,0]=3 4378 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,1,0,0,0,1|1,0,0]=3 4379 B8R1.4 C[C@H]1CNC[C@H](C)O1 Amb22406103 [0,1,0,0,0,1|1,0,1]=4 4380 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,1,0,0,0,1|1,0,0]=3 4381 B8R1.4 C[C@H]1C[C@@H](C)NCO1 Amb24515076 [0,1,0,0,0,1|1,0,1]=4 4382 B8R1.4 ClC1CSCC(Cl)O1 Amb24693281 [0,1,0,0,0,1|1,0,1]=4 4383 B8R1.4 ClC=1CCCC(Br)C1 Amb25189957 [0,1,0,0,0,1|2,0,0]=4 4384 B8R1.4 Cl[C@@H]1COC[C@@H](Cl)O1 Amb25179239 [0,1,0,0,0,1|1,0,1]=4 4385 B8R1.4 N=C1NC(=O)CCS1 Amb24666714 [0,1,0,0,0,1|1,0,1]=4 4386 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,1,0,0,0,1|1,0,0]=3 4387 B8R1.4 NC1=NC(=O)CCN1 Amb17607753 [0,1,0,0,0,1|1,0,1]=4 4388 B8R1.4 NC1CC(=O)CCC1 Amb23440459 [0,1,0,0,0,1|1,0,0]=3 4389 B8R1.4 NC1CC(=O)NC=C1 Amb10552502 [0,1,0,0,0,1|1,0,1]=4 4390 B8R1.4 NC1CC(=O)NCC1 Amb19957631 [0,1,0,0,0,1|1,0,0]=3 4391 B8R1.4 NC1CC(=O)NCC1 Amb21960626 [0,1,0,0,0,1|1,0,0]=3 4392 B8R1.4 NC1CC(=O)OCC1 Amb18641823 [0,1,0,0,0,1|0,0,0]=2 4393 B8R1.4 NC1CC(N)=NCC1 Amb25225367 [0,1,0,0,0,1|2,0,0]=4 4394 B8R1.4 NC1CC(O)COC1 Amb24526934 [0,1,0,0,0,1|0,0,2]=4 4395 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,1,0,0,0,1|1,0,0]=3 4396 B8R1.4 NC1CCNC(=S)N1 Amb25205341 [0,1,0,0,0,1|1,1,0]=4 4397 B8R1.4 NC1CNNC(=O)N1 Amb24559373 [0,1,0,0,0,1|2,0,0]=4 4398 B8R1.4 NC1CS(=O)CCC1 Amb18124391 [0,1,0,0,0,1|2,0,0]=4 4399 B8R1.4 NC=1CCCC(=N)C1 Amb25757867 [0,1,0,0,0,1|2,0,0]=4 4400 B8R1.4 NC=1CCCC(=O)N1 Amb24525241 [0,1,0,0,0,1|1,0,0]=3 4401 B8R1.4 NC=1CCNC(=O)C1 Amb22229455 [0,1,0,0,0,1|1,0,1]=4 4402 B8R1.4 NC=1CCNC(=O)N1 Amb24481491 [0,1,0,0,0,1|1,0,1]=4 4403 B8R1.4 NC=1COCC(=O)C1 Amb25785409 [0,1,0,0,0,1|0,0,2]=4 4404 B8R1.4 NC=1CONC(=O)N1 Amb24698901 [0,1,0,0,0,1|1,0,1]=4 4405 B8R1.4 NC=1NCCC(=O)N1 Amb18641724 [0,1,0,0,0,1|1,0,1]=4 4406 B8R1.4 N[C@@H]1CC(=O)NCC1 Amb25168718 [0,1,0,0,0,1|1,0,0]=3 4407 B8R1.4 N[C@H]1CC(=O)OCC1 Amb24550653 [0,1,0,0,0,1|0,0,0]=2 4408 B8R1.4 N[C@H]1CS(=O)CCC1 Amb25168909 [0,1,0,0,0,1|2,0,0]=4 4409 B8R1.4 O=C1C=C(Br)CCN1 Amb23400583 [0,1,0,0,0,1|1,0,1]=4 4410 B8R1.4 O=C1C=C(Br)CCN1 Amb23402186 [0,1,0,0,0,1|1,0,1]=4 4411 B8R1.4 O=C1C=C(Br)CCO1 Amb23400648 [0,1,0,0,0,1|0,0,1]=3 4412 B8R1.4 O=C1CC(=O)OC=C1 Amb25358147 [0,1,0,0,0,1|0,0,2]=4 4413 B8R1.4 O=C1CC(Cl)CNN1 Amb22728306 [0,1,0,0,0,1|1,0,0]=3 4414 B8R1.4 O=C1CC(F)CCC1 Amb24578309 [0,1,0,0,0,1|1,0,0]=3 4415 B8R1.4 O=C1CC(F)OCC1 Amb21927920 [0,1,0,0,0,1|1,0,0]=3 4416 B8R1.4 O=C1CC(I)CCC1 Amb24436778 [0,1,0,0,0,1|1,0,0]=3 4417 B8R1.4 O=C1CC(I)CCN1 Amb24387789 [0,1,0,0,0,1|1,0,0]=3 4418 B8R1.4 O=C1CC(I)CNN1 Amb25250615 [0,1,0,0,0,1|1,0,0]=3 4419 B8R1.4 O=C1CC(S)CCC1 Amb25205406 [0,1,0,0,0,1|1,0,0]=3 4420 B8R1.4 O=C1CCCC(=S)N1 Amb25807347 [0,1,0,0,0,1|1,0,0]=3 4421 B8R1.4 O=C1CCCC(I)=C1 Amb25706767 [0,1,0,0,0,1|1,0,0]=3 4422 B8R1.4 O=C1CCCC(S)=C1 Amb25128260 [0,1,0,0,0,1|1,0,0]=3 4423 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,1,0,0,0,1|1,0,0]=3 4424 B8R1.4 O=C1CCNC(=O)N1 Amb1042477 [0,1,0,0,0,1|1,0,1]=4 4425 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,1,0,0,0,1|0,0,1]=3 4426 B8R1.4 O=C1CCOC(=O)N1 Amb25055705 [0,1,0,0,0,1|0,0,1]=3 4427 B8R1.4 O=C1CCSC(=O)N1 Amb1150323 [0,1,0,0,0,1|0,1,1]=4 4428 B8R1.4 O=C1CCSC(Cl)=C1 Amb25053022 [0,1,0,0,0,1|1,0,1]=4 4429 B8R1.4 O=C1CNCC(=O)C1 Amb22755578 [0,1,0,0,0,1|1,0,1]=4 4430 B8R1.4 O=C1CNCC(=O)N1 Amb18641768 [0,1,0,0,0,1|1,0,1]=4 4431 B8R1.4 O=C1CNCC(=O)N1 Amb19148314 [0,1,0,0,0,1|1,0,1]=4 4432 B8R1.4 O=C1CNCC(=O)O1 Amb25834762 [0,1,0,0,0,1|0,0,1]=3 4433 B8R1.4 O=C1COCC(=O)C1 Amb22292040 [0,1,0,0,0,1|0,0,1]=3 4434 B8R1.4 O=C1COCC(=O)C1 Amb22406411 [0,1,0,0,0,1|0,0,1]=3 4435 B8R1.4 O=C1COCC(=O)N1 Amb10808497 [0,1,0,0,0,1|1,0,1]=4 4436 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,1,0,0,0,1|0,0,1]=3 4437 B8R1.4 O=C1CSCC(=O)C1 Amb2499999 [0,1,0,0,0,1|0,1,1]=4 4438 B8R1.4 O=C1NC(=S)CCN1 Amb25266952 [0,1,0,0,0,1|1,0,1]=4 4439 B8R1.4 O=C1NC(=S)CON1 Amb24481585 [0,1,0,0,0,1|1,0,1]=4 4440 B8R1.4 O=C1NOCC(=O)N1 Amb25270094 [0,1,0,0,0,1|1,0,1]=4 4441 B8R1.4 O=C1[CH-]C(=O)COC1 Amb20241003 [0,1,0,0,0,1|0,0,2]=4 4442 B8R1.4 O=S1CS(=O)CCC1 Amb22363746 [0,1,0,0,0,1|1,1,0]=4 4443 B8R1.4 O=S1C[C@@H](Cl)CCC1 Amb24533964 [0,1,0,0,0,1|2,0,0]=4 4444 B8R1.4 O=S1C[C@H](Cl)CCC1 Amb25779923 [0,1,0,0,0,1|2,0,0]=4 4445 B8R1.4 O=[13C]1CCC[13C](=O)O1 Amb17614796 [0,1,0,0,0,1|0,0,0]=2 4446 B8R1.4 O=[13C]1CCC[13C](=O)[13CH2]1 Amb17611454 [0,1,0,0,0,1|1,0,0]=3 4447 B8R1.4 O=[13C]1[13CH2][13CH2][13CH2][13C](=O)[13CH2]1 Amb17611455 [0,1,0,0,0,1|1,0,0]=3 4448 B8R1.4 OC1=CC(=O)CCC1 Amb17844413 [0,1,0,0,0,1|1,0,0]=3 4449 B8R1.4 OC1CC(=O)CCC1 Amb22754759 [0,1,0,0,0,1|1,0,0]=3 4450 B8R1.4 OC1CC(=O)CCN1 Amb24746013 [0,1,0,0,0,1|1,0,0]=3 4451 B8R1.4 OC1CC(=O)OCC1 Amb24475154 [0,1,0,0,0,1|0,0,0]=2 4452 B8R1.4 OC1CC(O)OCC1 Amb25808083 [0,1,0,0,0,1|0,0,2]=4 4453 B8R1.4 OC1CCCC(Br)=C1 Amb24606865 [0,1,0,0,0,1|2,0,0]=4 4454 B8R1.4 OC1CCCC(O)O1 Amb25048422 [0,1,0,0,0,1|0,0,2]=4 4455 B8R1.4 OC1CCNC(=O)C1 Amb10602744 [0,1,0,0,0,1|1,0,0]=3 4456 B8R1.4 OC1CNCC(=O)N1 Amb24446977 [0,1,0,0,0,1|1,0,0]=3 4457 B8R1.4 OC1CNCC(O)O1 Amb25726871 [0,1,0,0,0,1|0,0,2]=4 4458 B8R1.4 OC1NC(=S)CCN1 Amb25788994 [0,1,0,0,0,1|1,1,0]=4 4459 B8R1.4 OC=1CSCC(=O)C1 Amb25773337 [0,1,0,0,0,1|1,0,1]=4 4460 B8R1.4 O[C@@H]1CC(=O)NCC1 Amb22744924 [0,1,0,0,0,1|1,0,0]=3 4461 B8R1.4 O[C@@H]1CCNC(=O)C1 Amb17845212 [0,1,0,0,0,1|1,0,0]=3 4462 B8R1.4 O[C@@H]1COC[C@@H](O)O1 Amb25176832 [0,1,0,0,0,1|0,0,2]=4 4463 B8R1.4 O[C@@H]1CSC[C@H](O)O1 Amb25700123 [0,1,0,0,0,1|0,0,2]=4 4464 B8R1.4 O[C@H]1CC(=O)CCC1 Amb25320136 [0,1,0,0,0,1|1,0,0]=3 4465 B8R1.4 O[C@H]1CC(=O)OCC1 Amb25320391 [0,1,0,0,0,1|0,0,0]=2 4466 B8R1.4 O[C@H]1CCCC(Br)=C1 Amb25296540 [0,1,0,0,0,1|2,0,0]=4 4467 B8R1.4 S=C1CCCC(=S)N1 Amb24483049 [0,1,0,0,0,1|1,1,0]=4 4468 B8R1.4 S=C1CCSC(=O)N1 Amb2470197 [0,1,0,0,0,1|0,1,1]=4 4469 B8R1.4 [O-]C1COCC(=O)C1 Amb22739834 [0,1,0,0,0,1|0,0,0]=2 4470 B8R1.5 BrC1=CCCCC1O Amb17594500 [0,1,0,0,0,1|2,0,0]=4 4471 B8R1.5 BrC1CCCC=C1Br Amb25255682 [0,1,0,0,0,1|2,0,0]=4 4472 B8R1.5 BrC1CCCOC1Br Amb17940346 [0,1,0,0,0,1|1,0,1]=4 4473 B8R1.5 BrC1OCCOC1Br Amb25040112 [0,1,0,0,0,1|1,0,1]=4 4474 B8R1.5 Br[C@@H]1CCCCC1=O Amb16234120 [0,1,0,0,0,1|1,0,0]=3 4475 B8R1.5 C=C1CCC=CC1=O Amb25205461 [0,1,0,0,0,1|1,0,1]=4 4476 B8R1.5 C=C1CCCCC1=O Amb18561347 [0,1,0,0,0,1|1,0,0]=3 4477 B8R1.5 C=C1CCCCC1Br Amb24483250 [0,1,0,0,0,1|2,0,0]=4 4478 B8R1.5 C=C1CCCC[C@@H]1Br Amb24552422 [0,1,0,0,0,1|2,0,0]=4 4479 B8R1.5 C=C1CCCC[C@@H]1O Amb25220251 [0,1,0,0,0,1|2,0,0]=4 4480 B8R1.5 C=C1CCOCC1O Amb24363585 [0,1,0,0,0,1|2,0,0]=4 4481 B8R1.5 C=C1COCCC1=O Amb18063600 [0,1,0,0,0,1|1,0,0]=3 4482 B8R1.5 CC1=CCCCC1N Amb18641661 [0,1,0,0,0,1|2,0,0]=4 4483 B8R1.5 CC1=CCCCC1O Amb22365276 [0,1,0,0,0,1|2,0,0]=4 4484 B8R1.5 CC1=CCCC[C@H]1Br Amb24470173 [0,1,0,0,0,1|2,0,0]=4 4485 B8R1.5 CC1=CCCC[C@H]1N Amb25339311 [0,1,0,0,0,1|2,0,0]=4 4486 B8R1.5 CC1=CCCC[C@H]1O Amb25699989 [0,1,0,0,0,1|2,0,0]=4 4487 B8R1.5 CC1=CCCNC1=O Amb25127954 [0,1,0,0,0,1|1,0,1]=4 4488 B8R1.5 CC1=CCNCC1N Amb24507340 [0,1,0,0,0,1|2,0,0]=4 4489 B8R1.5 CC1=NCCCN1C Amb1035887 [0,1,0,0,0,1|2,0,0]=4 4490 B8R1.5 CC1=NOCCC1Br Amb24558565 [0,1,0,0,0,1|1,0,0]=3 4491 B8R1.5 CC1=NOCCC1Cl Amb25337048 [0,1,0,0,0,1|1,0,0]=3 4492 B8R1.5 CC1=[N+](C)CCCC1 Amb10552885 [0,1,0,0,0,1|2,0,0]=4 4493 B8R1.5 CC1C=CCCC1=O Amb25723298 [0,1,0,0,0,1|1,0,1]=4 4494 B8R1.5 CC1CC=CCC1=O Amb17593140 [0,1,0,0,0,1|1,0,1]=4 4495 B8R1.5 CC1CC=NNC1=O Amb22752103 [0,1,0,0,0,1|1,0,1]=4 4496 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,1,0,0,0,1|1,0,0]=3 4497 B8R1.5 CC1CCCC=C1C Amb22489910 [0,1,0,0,0,1|2,0,0]=4 4498 B8R1.5 CC1CCCC=C1N Amb24647647 [0,1,0,0,0,1|2,0,0]=4 4499 B8R1.5 CC1CCCCC1=C Amb25203919 [0,1,0,0,0,1|2,0,0]=4 4500 B8R1.5 CC1CCCNC1=S Amb25104722 [0,1,0,0,0,1|1,1,0]=4 4501 B8R1.5 CC1CCNNC1=O Amb25169591 [0,1,0,0,0,1|1,0,0]=3 4502 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,0,0,1|0,0,0]=2 4503 B8R1.5 CC1CNCC=C1C Amb24334427 [0,1,0,0,0,1|2,0,0]=4 4504 B8R1.5 CC1CNCCC1=C Amb25791257 [0,1,0,0,0,1|2,0,0]=4 4505 B8R1.5 CC1CNCCC1=O Amb19888361 [0,1,0,0,0,1|1,0,0]=3 4506 B8R1.5 CC1CNCCC1=O Amb22490481 [0,1,0,0,0,1|1,0,0]=3 4507 B8R1.5 CC1CNCCS1=O Amb19515549 [0,1,0,0,0,1|2,0,0]=4 4508 B8R1.5 CC1COCCC1=O Amb21856147 [0,1,0,0,0,1|1,0,0]=3 4509 B8R1.5 CC1COCCC1Cl Amb24557250 [0,1,0,0,0,1|1,0,1]=4 4510 B8R1.5 CC1COCCC1N Amb18833016 [0,1,0,0,0,1|1,0,1]=4 4511 B8R1.5 CC1COCCC1O Amb22299437 [0,1,0,0,0,1|1,0,1]=4 4512 B8R1.5 CC1COCCC1S Amb22299438 [0,1,0,0,0,1|1,0,1]=4 4513 B8R1.5 CC1COCOC1C Amb25829514 [0,1,0,0,0,1|1,0,1]=4 4514 B8R1.5 CC1COCOC1O Amb24582065 [0,1,0,0,0,1|0,0,2]=4 4515 B8R1.5 CC1NCCNC1=O Amb2189174 [0,1,0,0,0,1|1,0,0]=3 4516 B8R1.5 CC1NCCOC1O Amb25031508 [0,1,0,0,0,1|0,0,2]=4 4517 B8R1.5 CC1OCCCC1Br Amb22500038 [0,1,0,0,0,1|1,0,1]=4 4518 B8R1.5 CC1OCCCC1Cl Amb25772379 [0,1,0,0,0,1|1,0,1]=4 4519 B8R1.5 CC1OCCCC1N Amb18833013 [0,1,0,0,0,1|1,0,1]=4 4520 B8R1.5 CC1OCCNC1=O Amb19517095 [0,1,0,0,0,1|1,0,0]=3 4521 B8R1.5 CC1OCCNC1C Amb17470363 [0,1,0,0,0,1|1,0,1]=4 4522 B8R1.5 CC1SCCOC1=O Amb25255546 [0,1,0,0,0,1|0,0,0]=2 4523 B8R1.5 CC=1CCCC[N+]1[O-] Amb25340684 [0,1,0,0,0,1|2,0,0]=4 4524 B8R1.5 CC=1CCNCC1Br Amb25046045 [0,1,0,0,0,1|2,0,0]=4 4525 B8R1.5 CC=1CNCCC1C Amb18641667 [0,1,0,0,0,1|2,0,0]=4 4526 B8R1.5 CN1CCC=CC1=O Amb22500738 [0,1,0,0,0,1|1,0,1]=4 4527 B8R1.5 CN1CCCCC1=O Amb10573526 [0,1,0,0,0,1|1,0,0]=3 4528 B8R1.5 CN1CCCCC1=S Amb24712596 [0,1,0,0,0,1|1,1,0]=4 4529 B8R1.5 CN1CCCSC1=N Amb25089427 [0,1,0,0,0,1|1,1,0]=4 4530 B8R1.5 CN1CCNCC1=O Amb21955857 [0,1,0,0,0,1|1,0,0]=3 4531 B8R1.5 CN1CCOCC1=O Amb22301593 [0,1,0,0,0,1|1,0,0]=3 4532 B8R1.5 CN1CCSCC1=N Amb25190016 [0,1,0,0,0,1|2,0,0]=4 4533 B8R1.5 CN1NCCCC1=O Amb18559232 [0,1,0,0,0,1|1,0,0]=3 4534 B8R1.5 C[C@@H]1CCCCC1=O Amb25693013 [0,1,0,0,0,1|1,0,0]=3 4535 B8R1.5 C[C@@H]1CCCNC1=O Amb25694356 [0,1,0,0,0,1|1,0,0]=3 4536 B8R1.5 C[C@@H]1COCC[C@@H]1N Amb22745852 [0,1,0,0,0,1|1,0,1]=4 4537 B8R1.5 C[C@@H]1COCC[C@@H]1O Amb25272016 [0,1,0,0,0,1|1,0,1]=4 4538 B8R1.5 C[C@@H]1COCC[C@H]1N Amb23440138 [0,1,0,0,0,1|1,0,1]=4 4539 B8R1.5 C[C@@H]1NCCNC1=O Amb18203363 [0,1,0,0,0,1|1,0,0]=3 4540 B8R1.5 C[C@@H]1OCCC[C@@H]1Br Amb25336533 [0,1,0,0,0,1|1,0,1]=4 4541 B8R1.5 C[C@@H]1OCCC[C@@H]1Cl Amb24625287 [0,1,0,0,0,1|1,0,1]=4 4542 B8R1.5 C[C@@H]1OCCC[C@@H]1O Amb24618653 [0,1,0,0,0,1|0,0,2]=4 4543 B8R1.5 C[C@@H]1OCCC[C@H]1O Amb25176726 [0,1,0,0,0,1|0,0,2]=4 4544 B8R1.5 C[C@@H]1OCCNC1=O Amb24465112 [0,1,0,0,0,1|1,0,0]=3 4545 B8R1.5 C[C@@H]1OCCN[C@H]1C Amb24655090 [0,1,0,0,0,1|1,0,1]=4 4546 B8R1.5 C[C@@H]1OCOC[C@@H]1O Amb24581749 [0,1,0,0,0,1|1,0,1]=4 4547 B8R1.5 C[C@H]1COCC[C@H]1Cl Amb25249095 [0,1,0,0,0,1|1,0,1]=4 4548 B8R1.5 C[C@H]1COCC[C@H]1N Amb22736636 [0,1,0,0,0,1|1,0,1]=4 4549 B8R1.5 C[C@H]1NCCNC1=O Amb22336965 [0,1,0,0,0,1|1,0,0]=3 4550 B8R1.5 C[C@H]1OCCN[C@@H]1C Amb25291581 [0,1,0,0,0,1|1,0,1]=4 4551 B8R1.5 C[C@H]1OCCN[C@H]1C Amb25245271 [0,1,0,0,0,1|1,0,1]=4 4552 B8R1.5 ClC1CCCC=C1Cl Amb24650431 [0,1,0,0,0,1|2,0,0]=4 4553 B8R1.5 ClC1CCCCC1=O Amb1154371 [0,1,0,0,0,1|1,0,0]=3 4554 B8R1.5 ClC1CCCOC1Cl Amb25101518 [0,1,0,0,0,1|1,0,1]=4 4555 B8R1.5 ClC1OCCOC1Cl Amb17674085 [0,1,0,0,0,1|1,0,1]=4 4556 B8R1.5 ClC=1CNCCC1Cl Amb24467867 [0,1,0,0,0,1|2,0,0]=4 4557 B8R1.5 Cl[C@@H]1OCCO[C@@H]1Cl Amb25747117 [0,1,0,0,0,1|1,0,1]=4 4558 B8R1.5 Cl[C@@H]1OCCO[C@H]1Cl Amb22231660 [0,1,0,0,0,1|1,0,1]=4 4559 B8R1.5 Cl[C@@H]1SCCO[C@H]1Cl Amb25179238 [0,1,0,0,0,1|1,0,1]=4 4560 B8R1.5 Cl[C@H]1CCCO[C@H]1Cl Amb24595340 [0,1,0,0,0,1|1,0,1]=4 4561 B8R1.5 FC1CCCCC1=O Amb10605769 [0,1,0,0,0,1|1,0,0]=3 4562 B8R1.5 FC1OCCCC1Br Amb25103571 [0,1,0,0,0,1|1,0,1]=4 4563 B8R1.5 FC1OCCCC1Cl Amb25376565 [0,1,0,0,0,1|1,0,1]=4 4564 B8R1.5 FC1OCCOC1Cl Amb25054663 [0,1,0,0,0,1|1,0,1]=4 4565 B8R1.5 F[C@@H]1OCCC[C@H]1Cl Amb24654960 [0,1,0,0,0,1|1,0,1]=4 4566 B8R1.5 N=C1CCCCN1O Amb24524093 [0,1,0,0,0,1|2,0,0]=4 4567 B8R1.5 NC1=NCCCC1Br Amb24710039 [0,1,0,0,0,1|2,0,0]=4 4568 B8R1.5 NC1CCCC=C1Cl Amb18124341 [0,1,0,0,0,1|2,0,0]=4 4569 B8R1.5 NC1CCCCC1=O Amb17939051 [0,1,0,0,0,1|1,0,0]=3 4570 B8R1.5 NC1CCCCC1=O Amb22001819 [0,1,0,0,0,1|1,0,0]=3 4571 B8R1.5 NC1CCCOB1O Amb24681060 [0,1,0,0,0,1|1,0,1]=4 4572 B8R1.5 NC1CCOCC1F Amb22436824 [0,1,0,0,0,1|1,0,1]=4 4573 B8R1.5 NC1CCOCC1O Amb18198453 [0,1,0,0,0,1|0,0,2]=4 4574 B8R1.5 NC1CCONC1=O Amb22295935 [0,1,0,0,0,1|0,0,0]=2 4575 B8R1.5 NC1COCCC1=O Amb18833021 [0,1,0,0,0,1|1,0,0]=3 4576 B8R1.5 NC1COCCC1Cl Amb24550562 [0,1,0,0,0,1|1,0,1]=4 4577 B8R1.5 NC1COCCC1F Amb22490372 [0,1,0,0,0,1|1,0,1]=4 4578 B8R1.5 NC1COCCC1N Amb18202752 [0,1,0,0,0,1|1,0,1]=4 4579 B8R1.5 NC1COCCC1O Amb18198755 [0,1,0,0,0,1|1,0,1]=4 4580 B8R1.5 NC=1CCCCC1N Amb24673835 [0,1,0,0,0,1|2,0,0]=4 4581 B8R1.5 NN1CCCCC1=O Amb13952152 [0,1,0,0,0,1|1,0,0]=3 4582 B8R1.5 NN1CCCCC1=O Amb22275946 [0,1,0,0,0,1|1,0,0]=3 4583 B8R1.5 NN1CCCNC1=O Amb25343173 [0,1,0,0,0,1|1,0,0]=3 4584 B8R1.5 N[C@@H]1CCCCC1=O Amb25727179 [0,1,0,0,0,1|1,0,0]=3 4585 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,1,0,0,0,1|1,0,0]=3 4586 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,1,0,0,0,1|1,0,0]=3 4587 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb23439434 [0,1,0,0,0,1|1,0,1]=4 4588 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb25780287 [0,1,0,0,0,1|1,0,1]=4 4589 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb22406155 [0,1,0,0,0,1|0,0,2]=4 4590 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb23385312 [0,1,0,0,0,1|0,0,2]=4 4591 B8R1.5 N[C@@H]1CCOC[C@H]1F Amb23439433 [0,1,0,0,0,1|1,0,1]=4 4592 B8R1.5 N[C@@H]1CCOC[C@H]1F Amb25168837 [0,1,0,0,0,1|1,0,1]=4 4593 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb22406158 [0,1,0,0,0,1|0,0,2]=4 4594 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb23385253 [0,1,0,0,0,1|0,0,2]=4 4595 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb23385320 [0,1,0,0,0,1|1,0,1]=4 4596 B8R1.5 N[C@@H]1COCC[C@H]1N Amb24120364 [0,1,0,0,0,1|1,0,1]=4 4597 B8R1.5 N[C@@H]1COCC[C@H]1O Amb22748653 [0,1,0,0,0,1|1,0,1]=4 4598 B8R1.5 N[C@@H]1COCC[C@H]1O Amb23385302 [0,1,0,0,0,1|1,0,1]=4 4599 B8R1.5 N[C@H]1COCC[C@@H]1O Amb25231772 [0,1,0,0,0,1|1,0,1]=4 4600 B8R1.5 N[C@H]1COCC[C@H]1N Amb25231209 [0,1,0,0,0,1|1,0,1]=4 4601 B8R1.5 N[C@H]1COCC[C@H]1O Amb24617518 [0,1,0,0,0,1|1,0,1]=4 4602 B8R1.5 O=C1C=CCCC1Cl Amb25700953 [0,1,0,0,0,1|1,0,0]=3 4603 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,1,0,0,0,1|1,0,0]=3 4604 B8R1.5 O=C1CCCC=C1C Amb15693479 [0,1,0,0,0,1|1,0,0]=3 4605 B8R1.5 O=C1CCCC=C1Cl Amb24524498 [0,1,0,0,0,1|1,0,0]=3 4606 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,1,0,0,0,1|1,0,0]=3 4607 B8R1.5 O=C1CCCCC1=O Amb1154131 [0,1,0,0,0,1|1,0,0]=3 4608 B8R1.5 O=C1CCCCC1S Amb25839265 [0,1,0,0,0,1|1,0,0]=3 4609 B8R1.5 O=C1CCCC[C@@H]1Br Amb24524273 [0,1,0,0,0,1|1,0,0]=3 4610 B8R1.5 O=C1CCCC[C@@H]1Cl Amb24483264 [0,1,0,0,0,1|1,0,0]=3 4611 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,1,0,0,0,1|1,0,0]=3 4612 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,1,0,0,0,1|0,0,0]=2 4613 B8R1.5 O=C1CCNCC1Br Amb20242103 [0,1,0,0,0,1|1,0,0]=3 4614 B8R1.5 O=C1CCNCC1Br Amb21520330 [0,1,0,0,0,1|1,0,0]=3 4615 B8R1.5 O=C1CCNCC1F Amb13885958 [0,1,0,0,0,1|1,0,0]=3 4616 B8R1.5 O=C1CCNCC1F Amb22002662 [0,1,0,0,0,1|1,0,0]=3 4617 B8R1.5 O=C1CCNC[C@@H]1F Amb24670514 [0,1,0,0,0,1|1,0,0]=3 4618 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,1,0,0,0,1|1,0,0]=3 4619 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,1,0,0,0,1|1,0,0]=3 4620 B8R1.5 O=C1CCOCC1F Amb19958536 [0,1,0,0,0,1|1,0,0]=3 4621 B8R1.5 O=C1CCOC[C@@H]1Cl Amb24723222 [0,1,0,0,0,1|1,0,0]=3 4622 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,1,0,0,0,1|1,0,0]=3 4623 B8R1.5 O=C1CCSCC1Br Amb22493812 [0,1,0,0,0,1|1,0,0]=3 4624 B8R1.5 O=C1CNCCN1C Amb1834069 [0,1,0,0,0,1|1,0,0]=3 4625 B8R1.5 O=C1COC=CC1F Amb25842503 [0,1,0,0,0,1|0,0,2]=4 4626 B8R1.5 O=C1COCCC1=O Amb25712943 [0,1,0,0,0,1|0,0,1]=3 4627 B8R1.5 O=C1COCCC1Br Amb24416092 [0,1,0,0,0,1|0,0,0]=2 4628 B8R1.5 O=C1NCCC=C1F Amb24377281 [0,1,0,0,0,1|1,0,1]=4 4629 B8R1.5 O=C1NCCCC1=O Amb2445649 [0,1,0,0,0,1|1,0,0]=3 4630 B8R1.5 O=C1NCCCC1Br Amb20669047 [0,1,0,0,0,1|1,0,0]=3 4631 B8R1.5 O=C1NCCCC1Cl Amb24472253 [0,1,0,0,0,1|1,0,0]=3 4632 B8R1.5 O=C1NCCCC1F Amb13888988 [0,1,0,0,0,1|1,0,0]=3 4633 B8R1.5 O=C1NCCCC1I Amb24355271 [0,1,0,0,0,1|1,0,0]=3 4634 B8R1.5 O=C1NCCCC1N Amb1088746 [0,1,0,0,0,1|1,0,0]=3 4635 B8R1.5 O=C1NCCCC1O Amb10602315 [0,1,0,0,0,1|1,0,0]=3 4636 B8R1.5 O=C1NCCCN1C Amb10608416 [0,1,0,0,0,1|1,0,0]=3 4637 B8R1.5 O=C1NCCC[C@@H]1N Amb10603272 [0,1,0,0,0,1|1,0,0]=3 4638 B8R1.5 O=C1OC=CCC1=O Amb25373353 [0,1,0,0,0,1|0,0,2]=4 4639 B8R1.5 O=C1OCC=CC1=O Amb25116554 [0,1,0,0,0,1|0,0,2]=4 4640 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,1,0,0,0,1|0,0,0]=2 4641 B8R1.5 O=C1OCCCN1N Amb17608306 [0,1,0,0,0,1|0,0,0]=2 4642 B8R1.5 O=C1OCCNC1=O Amb24120265 [0,1,0,0,0,1|0,0,1]=3 4643 B8R1.5 O=C1SCCSC1Cl Amb25026142 [0,1,0,0,0,1|0,1,0]=3 4644 B8R1.5 O=S1CCCC[C@@H]1Cl Amb24415441 [0,1,0,0,0,1|2,0,0]=4 4645 B8R1.5 O=S1CCCC[C@H]1Br Amb25756741 [0,1,0,0,0,1|2,0,0]=4 4646 B8R1.5 OC1C=CCCC1=O Amb25346850 [0,1,0,0,0,1|1,0,1]=4 4647 B8R1.5 OC1CCCOC1=O Amb19959000 [0,1,0,0,0,1|0,0,0]=2 4648 B8R1.5 OC1CCOCC1Br Amb25122777 [0,1,0,0,0,1|1,0,1]=4 4649 B8R1.5 OC1CCOC[C@H]1Cl Amb25772762 [0,1,0,0,0,1|1,0,1]=4 4650 B8R1.5 OC1CNCCC1=O Amb24075970 [0,1,0,0,0,1|1,0,0]=3 4651 B8R1.5 OC1CNCNC1=O Amb25300748 [0,1,0,0,0,1|1,0,0]=3 4652 B8R1.5 OC1COC=CC1=O Amb25094706 [0,1,0,0,0,1|1,0,1]=4 4653 B8R1.5 OC1COCCC1O Amb23454159 [0,1,0,0,0,1|0,0,2]=4 4654 B8R1.5 OC1COCOC1O Amb24476260 [0,1,0,0,0,1|0,0,2]=4 4655 B8R1.5 OC1OCCCC1=O Amb24645841 [0,1,0,0,0,1|0,0,0]=2 4656 B8R1.5 OC1OCCCC1Br Amb24634011 [0,1,0,0,0,1|0,0,2]=4 4657 B8R1.5 OC1OCCC[C@H]1Br Amb24710193 [0,1,0,0,0,1|0,0,2]=4 4658 B8R1.5 OC1OCCOC1O Amb1199104 [0,1,0,0,0,1|0,0,2]=4 4659 B8R1.5 ON1CNCCC1=O Amb24120639 [0,1,0,0,0,1|1,0,0]=3 4660 B8R1.5 O[C@@H]1CCCC=C1Br Amb25687871 [0,1,0,0,0,1|2,0,0]=4 4661 B8R1.5 O[C@@H]1CCCNC1=O Amb22225342 [0,1,0,0,0,1|1,0,0]=3 4662 B8R1.5 O[C@@H]1CCCOC1O Amb24704773 [0,1,0,0,0,1|0,0,2]=4 4663 B8R1.5 O[C@@H]1CCOC[C@H]1Cl Amb25258051 [0,1,0,0,0,1|1,0,1]=4 4664 B8R1.5 O[C@@H]1CCOC[C@H]1F Amb25054496 [0,1,0,0,0,1|1,0,1]=4 4665 B8R1.5 O[C@@H]1COCCC1=O Amb25086646 [0,1,0,0,0,1|1,0,0]=3 4666 B8R1.5 O[C@@H]1OCCC[C@H]1Cl Amb25360183 [0,1,0,0,0,1|0,0,2]=4 4667 B8R1.5 O[C@@H]1OCCO[C@@H]1O Amb25262790 [0,1,0,0,0,1|0,0,2]=4 4668 B8R1.5 O[C@H]1CCC=CC1=O Amb25263127 [0,1,0,0,0,1|1,0,0]=3 4669 B8R1.5 O[C@H]1CCCC=C1Br Amb24505024 [0,1,0,0,0,1|2,0,0]=4 4670 B8R1.5 O[C@H]1CCCNC1=O Amb22226682 [0,1,0,0,0,1|1,0,0]=3 4671 B8R1.5 O[C@H]1COCC[C@@H]1Br Amb24595192 [0,1,0,0,0,1|0,0,2]=4 4672 B8R1.5 O[C@H]1COCC[C@@H]1O Amb24640365 [0,1,0,0,0,1|0,0,2]=4 4673 B8R1.5 O[C@H]1OCCC[C@@H]1Cl Amb24558218 [0,1,0,0,0,1|0,0,2]=4 4674 B8R1.5 S=C1OCCNC1=S Amb24612407 [0,1,0,0,0,1|0,1,1]=4 4675 B8R1.72 CC1(C)CNCCO1 Amb21960709 [0,1,0,0,0,1|1,0,1]=4 4676 B8R1.72 CC1(C)NCCCO1 Amb24562039 [0,1,0,0,0,1|1,0,1]=4 4677 B8R1.72 CC1(N)COCCC1 Amb18833019 [0,1,0,0,0,1|1,0,1]=4 4678 B8R1.72 CC1(O)COCCC1 Amb20668932 [0,1,0,0,0,1|0,0,2]=4 4679 B8R1.72 CP1(=O)CCNCC1 Amb24715796 [0,1,0,0,0,1|2,0,0]=4 4680 B8R1.72 C[Si]1(C)CCCCO1 Amb19893844 [0,1,0,0,0,1|1,1,0]=4 4681 B8R1.72 C[Si]1(C)COCCC1 Amb25745221 [0,1,0,0,0,1|1,1,0]=4 4682 B8R1.72 ClC1(Cl)COCCC1 Amb25375135 [0,1,0,0,0,1|1,0,1]=4 4683 B8R1.72 ClC1(Cl)COCCO1 Amb25201776 [0,1,0,0,0,1|1,0,1]=4 4684 B8R1.72 FC1(F)CNCCO1 Amb25135765 [0,1,0,0,0,1|1,0,1]=4 4685 B8R1.72 N=S1(=O)CCCCC1 Amb25258608 [0,1,0,0,0,1|2,0,0]=4 4686 B8R1.72 N=S1(=O)CCOCC1 Amb22169429 [0,1,0,0,0,1|2,0,0]=4 4687 B8R1.72 NC1(N)CCCCO1 Amb24451527 [0,1,0,0,0,1|1,0,1]=4 4688 B8R1.72 O=S1(=O)CCCC=C1 Amb25058323 [0,1,0,0,0,1|2,0,0]=4 4689 B8R1.72 O=S1(=O)CCCCN1 Amb10068561 [0,1,0,0,0,1|2,0,0]=4 4690 B8R1.72 O=S1(=O)CCNCC1 Amb1102302 [0,1,0,0,0,1|2,0,0]=4 4691 B8R1.72 O=S1(=O)CCNCN1 Amb15691496 [0,1,0,0,0,1|2,0,0]=4 4692 B8R1.72 O=S1(=O)COCCN1 Amb19516827 [0,1,0,0,0,1|2,0,0]=4 4693 B8R1.72 O=S1(=O)NCCCN1 Amb21857783 [0,1,0,0,0,1|2,0,0]=4 4694 B8R1.72 O=S1(=O)OCCCO1 Amb22233116 [0,1,0,0,0,1|1,0,0]=3 4695 B8R1.1 BrCC1=CC(=O)OC1 Amb17935686 [0,2,0,0,0,0|0,0,2]=4 4696 B8R1.1 C#CC1CCC(=O)N1 Amb24505237 [0,2,0,0,0,0|1,0,0]=3 4697 B8R1.1 C#CC1COC(=O)O1 Amb25056381 [0,2,0,0,0,0|1,0,0]=3 4698 B8R1.1 C#CC=1CCC(O)C1 Amb24643810 [0,2,0,0,0,0|2,0,0]=4 4699 B8R1.1 C#C[C@@H]1CCC(=O)N1 Amb25840299 [0,2,0,0,0,0|1,0,0]=3 4700 B8R1.1 C#C[C@@H]1COC(=O)N1 Amb23401461 [0,2,0,0,0,0|1,0,0]=3 4701 B8R1.1 C#C[C@H]1CC(=O)CC1 Amb24721679 [0,2,0,0,0,0|1,0,0]=3 4702 B8R1.1 C#C[C@H]1CCC(=O)N1 Amb25062993 [0,2,0,0,0,0|1,0,0]=3 4703 B8R1.1 C=C1CC(CC1)C#N Amb18641604 [0,2,0,0,0,0|2,0,0]=4 4704 B8R1.1 C=C1COC(CCl)O1 Amb25798065 [0,2,0,0,0,0|2,0,0]=4 4705 B8R1.1 C=CC1=CCC(=O)O1 Amb24695919 [0,2,0,0,0,0|0,0,2]=4 4706 B8R1.1 C=CC1=NCC(=O)O1 Amb24686009 [0,2,0,0,0,0|1,0,1]=4 4707 B8R1.1 C=CC1CC(Br)CO1 Amb24425482 [0,2,0,0,0,0|1,0,1]=4 4708 B8R1.1 C=CC1CC(O)CO1 Amb25040394 [0,2,0,0,0,0|1,0,1]=4 4709 B8R1.1 C=CC1CCC(=O)N1 Amb20622087 [0,2,0,0,0,0|1,0,0]=3 4710 B8R1.1 C=CC1CCC(O)O1 Amb22752546 [0,2,0,0,0,0|0,0,2]=4 4711 B8R1.1 C=CC1CNC(=O)C1 Amb25117425 [0,2,0,0,0,0|1,0,0]=3 4712 B8R1.1 C=CC1CNC(=O)O1 Amb25064259 [0,2,0,0,0,0|1,0,0]=3 4713 B8R1.1 C=CC1CNC(=S)O1 Amb20622116 [0,2,0,0,0,0|1,1,0]=4 4714 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,2,0,0,0,0|0,0,0]=2 4715 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,2,0,0,0,0|1,0,0]=3 4716 B8R1.1 C=CC1COC(N)=N1 Amb24366284 [0,2,0,0,0,0|2,0,0]=4 4717 B8R1.1 C=CC1CSC(=O)N1 Amb25327260 [0,2,0,0,0,0|1,1,0]=4 4718 B8R1.1 C=C[C@@H]1C=CC(=O)O1 Amb25106519 [0,2,0,0,0,0|0,0,2]=4 4719 B8R1.1 C=C[C@@H]1CNC(=S)O1 Amb22169199 [0,2,0,0,0,0|1,1,0]=4 4720 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,2,0,0,0,0|0,0,0]=2 4721 B8R1.1 C=C[C@@H]1CO[C@H](O)C1 Amb24684119 [0,2,0,0,0,0|0,0,2]=4 4722 B8R1.1 C=C[C@H]1CC(=O)CC1 Amb24524536 [0,2,0,0,0,0|1,0,0]=3 4723 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,2,0,0,0,0|0,0,0]=2 4724 B8R1.1 CC1=CCC(CO)O1 Amb24386881 [0,2,0,0,0,0|1,0,1]=4 4725 B8R1.1 CC1=NC(CBr)CO1 Amb25138721 [0,2,0,0,0,0|2,0,0]=4 4726 B8R1.1 CC1=NC(CO)CO1 Amb24527624 [0,2,0,0,0,0|2,0,0]=4 4727 B8R1.1 CC1=NCC(CBr)O1 Amb25783980 [0,2,0,0,0,0|2,0,0]=4 4728 B8R1.1 CC1=NCC(CCl)O1 Amb25706232 [0,2,0,0,0,0|2,0,0]=4 4729 B8R1.1 CC1=NCC(CF)O1 Amb25322610 [0,2,0,0,0,0|2,0,0]=4 4730 B8R1.1 CC1=NCC(CI)O1 Amb24622214 [0,2,0,0,0,0|2,0,0]=4 4731 B8R1.1 CC1CC(CBr)CO1 Amb25077494 [0,2,0,0,0,0|1,0,1]=4 4732 B8R1.1 CC1CC(CC1)=NO Amb24394648 [0,2,0,0,0,0|1,0,1]=4 4733 B8R1.1 CC1CC(CC1)C=O Amb24483120 [0,2,0,0,0,0|1,0,1]=4 4734 B8R1.1 CC1CC(CCl)CO1 Amb24630118 [0,2,0,0,0,0|1,0,1]=4 4735 B8R1.1 CC1CC(CO)OC1 Amb25856417 [0,2,0,0,0,0|0,0,2]=4 4736 B8R1.1 CC1CC(CO1)C=O Amb25296463 [0,2,0,0,0,0|1,0,1]=4 4737 B8R1.1 CC1CCC(C=O)=C1 Amb18641617 [0,2,0,0,0,0|1,0,0]=3 4738 B8R1.1 CC1CCC(CBr)=C1 Amb24483109 [0,2,0,0,0,0|2,0,0]=4 4739 B8R1.1 CC1CCC(CO)=C1 Amb24733187 [0,2,0,0,0,0|1,0,1]=4 4740 B8R1.1 CC1CCC(CO)=N1 Amb25721614 [0,2,0,0,0,0|1,0,1]=4 4741 B8R1.1 CC1CCC(CS)O1 Amb24524291 [0,2,0,0,0,0|0,1,1]=4 4742 B8R1.1 CC1CCC(O1)C=O Amb17593184 [0,2,0,0,0,0|0,0,1]=3 4743 B8R1.1 CC1CN(CC1)C=O Amb24406673 [0,2,0,0,0,0|2,0,0]=4 4744 B8R1.1 CC1COC(CCl)=N1 Amb25244383 [0,2,0,0,0,0|2,0,0]=4 4745 B8R1.1 CC=1CC(CO)CN1 Amb25204416 [0,2,0,0,0,0|2,0,0]=4 4746 B8R1.1 CC=1CCC(CO)N1 Amb24734855 [0,2,0,0,0,0|2,0,0]=4 4747 B8R1.1 CC=1C[C@H](CO)CC1 Amb24481425 [0,2,0,0,0,0|2,0,0]=4 4748 B8R1.1 CCC1=NCC(=O)O1 Amb25238829 [0,2,0,0,0,0|1,0,1]=4 4749 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,2,0,0,0,0|0,0,2]=4 4750 B8R1.1 CCC1CC(=O)C=C1 Amb25713811 [0,2,0,0,0,0|1,0,1]=4 4751 B8R1.1 CCC1CC(=O)CC1 Amb19267107 [0,2,0,0,0,0|1,0,0]=3 4752 B8R1.1 CCC1CC(=O)CS1 Amb25273070 [0,2,0,0,0,0|2,0,0]=4 4753 B8R1.1 CCC1CC(O)CO1 Amb24340231 [0,2,0,0,0,0|1,0,1]=4 4754 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,2,0,0,0,0|1,0,0]=3 4755 B8R1.1 CCC1CN=C(Cl)O1 Amb24519084 [0,2,0,0,0,0|2,0,0]=4 4756 B8R1.1 CCC1CN=C(N)O1 Amb25728217 [0,2,0,0,0,0|2,0,0]=4 4757 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,2,0,0,0,0|1,0,0]=3 4758 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,2,0,0,0,0|2,0,0]=4 4759 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,2,0,0,0,0|1,0,0]=3 4760 B8R1.1 CCC1COC(N)=N1 Amb24436270 [0,2,0,0,0,0|2,0,0]=4 4761 B8R1.1 CCC=1CC(=O)OC1 Amb24759211 [0,2,0,0,0,0|0,0,2]=4 4762 B8R1.1 CCC=1CCC(C)C1 Amb25810526 [0,2,0,0,0,0|2,0,0]=4 4763 B8R1.1 CCC=1COC(=O)C1 Amb24686984 [0,2,0,0,0,0|0,0,2]=4 4764 B8R1.1 CCN1CC(O)CO1 Amb25784992 [0,2,0,0,0,0|2,0,0]=4 4765 B8R1.1 CCN1CCC(=O)N1 Amb24716029 [0,2,0,0,0,0|2,0,0]=4 4766 B8R1.1 CCN1C[C@@H](O)CO1 Amb25253390 [0,2,0,0,0,0|2,0,0]=4 4767 B8R1.1 CCN1C[C@H](O)CO1 Amb25805375 [0,2,0,0,0,0|2,0,0]=4 4768 B8R1.1 CC[C@@H]1CC(=O)CC1 Amb25142670 [0,2,0,0,0,0|1,0,0]=3 4769 B8R1.1 CC[C@@H]1CCC(=S)N1 Amb25712485 [0,2,0,0,0,0|1,1,0]=4 4770 B8R1.1 CC[C@@H]1CNC(=O)C1 Amb25367322 [0,2,0,0,0,0|1,0,0]=3 4771 B8R1.1 CC[C@@H]1CNC(=O)O1 Amb24507830 [0,2,0,0,0,0|1,0,0]=3 4772 B8R1.1 CC[C@H]1CC(=O)CC1 Amb24614252 [0,2,0,0,0,0|1,0,0]=3 4773 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,2,0,0,0,0|0,0,0]=2 4774 B8R1.1 CC[C@H]1CNC(=O)C1 Amb24632784 [0,2,0,0,0,0|1,0,0]=3 4775 B8R1.1 CN1CCC(C=O)=N1 Amb24483066 [0,2,0,0,0,0|2,0,0]=4 4776 B8R1.1 CN1CCC(C=O)O1 Amb24333644 [0,2,0,0,0,0|1,0,1]=4 4777 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,2,0,0,0,0|1,0,0]=3 4778 B8R1.1 CNC=1CC(=O)OC1 Amb25779165 [0,2,0,0,0,0|0,0,2]=4 4779 B8R1.1 CNC=1CCC(=O)C1 Amb24377588 [0,2,0,0,0,0|1,0,1]=4 4780 B8R1.1 COC1=CCC(=O)O1 Amb24695758 [0,2,0,0,0,0|0,0,2]=4 4781 B8R1.1 COC1C=CC(=O)O1 Amb22490509 [0,2,0,0,0,0|0,0,2]=4 4782 B8R1.1 COC1CC(=O)C=C1 Amb24425404 [0,2,0,0,0,0|1,0,1]=4 4783 B8R1.1 COC1CC(=O)CC1 Amb24483163 [0,2,0,0,0,0|1,0,0]=3 4784 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,2,0,0,0,0|1,0,0]=3 4785 B8R1.1 COC1CNC(=O)C1 Amb24683870 [0,2,0,0,0,0|1,0,0]=3 4786 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,2,0,0,0,0|1,0,0]=3 4787 B8R1.1 COC1C[C@H](O)CO1 Amb25144073 [0,2,0,0,0,0|0,0,2]=4 4788 B8R1.1 COC=1CCC(=O)C1 Amb21864758 [0,2,0,0,0,0|1,0,1]=4 4789 B8R1.1 CO[C@@H]1C=CC(=O)O1 Amb25144040 [0,2,0,0,0,0|0,0,2]=4 4790 B8R1.1 CO[C@H]1CC(=O)C=C1 Amb25689601 [0,2,0,0,0,0|1,0,1]=4 4791 B8R1.1 CSC=1CCC(=O)C1 Amb24626948 [0,2,0,0,0,0|1,0,1]=4 4792 B8R1.1 C[C@@H]1CCC(C=O)=C1 Amb25839230 [0,2,0,0,0,0|1,0,0]=3 4793 B8R1.1 C[C@@H]1CCC(CO)O1 Amb24524279 [0,2,0,0,0,0|0,0,2]=4 4794 B8R1.1 C[C@@H]1CC[C@@H](CCl)O1 Amb24579524 [0,2,0,0,0,0|1,0,1]=4 4795 B8R1.1 C[C@@H]1CC[C@@H](CO)O1 Amb24712524 [0,2,0,0,0,0|0,0,2]=4 4796 B8R1.1 C[C@@H]1CC[C@H](CO)O1 Amb22886849 [0,2,0,0,0,0|0,0,2]=4 4797 B8R1.1 C[C@@H]1C[C@H](CO)CO1 Amb25176664 [0,2,0,0,0,0|1,0,1]=4 4798 B8R1.1 C[C@H]1CC(CC1)C=O Amb24483030 [0,2,0,0,0,0|1,0,1]=4 4799 B8R1.1 C[C@H]1CCC(C=O)=C1 Amb25760068 [0,2,0,0,0,0|1,0,0]=3 4800 B8R1.1 C[C@H]1CCC(CO)O1 Amb25119985 [0,2,0,0,0,0|0,0,2]=4 4801 B8R1.1 C\C=C\1/CC(N)CC1 Amb24507718 [0,2,0,0,0,0|2,0,0]=4 4802 B8R1.1 C\C=C\1/CCC(=O)O1 Amb24751500 [0,2,0,0,0,0|0,0,1]=3 4803 B8R1.1 ClC1CCC(CBr)O1 Amb25363330 [0,2,0,0,0,0|1,0,1]=4 4804 B8R1.1 ClCC1CCC(=O)O1 Amb10608418 [0,2,0,0,0,0|0,0,0]=2 4805 B8R1.1 ClCC1CNC(=O)O1 Amb1152954 [0,2,0,0,0,0|1,0,0]=3 4806 B8R1.1 FC1CC(NC1)C=O Amb10608926 [0,2,0,0,0,0|1,0,1]=4 4807 B8R1.1 N#CC1C=CC(=O)O1 Amb24481486 [0,2,0,0,0,0|0,0,2]=4 4808 B8R1.1 N#CC1CC(=O)CC1 Amb22886979 [0,2,0,0,0,0|1,0,0]=3 4809 B8R1.1 N#CC1CC(Br)CO1 Amb25237489 [0,2,0,0,0,0|1,0,1]=4 4810 B8R1.1 N#CC=1CCC(=O)C1 Amb18122621 [0,2,0,0,0,0|1,0,1]=4 4811 B8R1.1 N#CC=1CCC(Br)C1 Amb18126842 [0,2,0,0,0,0|2,0,0]=4 4812 B8R1.1 N#CC=1CCC(O)C1 Amb18123844 [0,2,0,0,0,0|2,0,0]=4 4813 B8R1.1 N#C[C@@H]1CCC(=O)N1 Amb25662472 [0,2,0,0,0,0|1,0,0]=3 4814 B8R1.1 N=C1CCC(C#N)N1 Amb24481349 [0,2,0,0,0,0|2,0,0]=4 4815 B8R1.1 N=C1CCC(CO)N1 Amb24630540 [0,2,0,0,0,0|2,0,0]=4 4816 B8R1.1 N=C1CC[C@@H](CO)N1 Amb24580264 [0,2,0,0,0,0|2,0,0]=4 4817 B8R1.1 NC1=NC(CO)CO1 Amb25233954 [0,2,0,0,0,0|2,0,0]=4 4818 B8R1.1 NC1=NCC(CBr)O1 Amb21953933 [0,2,0,0,0,0|2,0,0]=4 4819 B8R1.1 NC1CC(NC1)C=O Amb10608923 [0,2,0,0,0,0|1,0,1]=4 4820 B8R1.1 NC1CCC(=C1)C#N Amb24524262 [0,2,0,0,0,0|2,0,0]=4 4821 B8R1.1 NC1CN(CC1)C=O Amb25131292 [0,2,0,0,0,0|2,0,0]=4 4822 B8R1.1 NCC1CC(=O)CC1 Amb24644946 [0,2,0,0,0,0|1,0,0]=3 4823 B8R1.1 NCC1CC=C(Cl)C1 Amb23594525 [0,2,0,0,0,0|2,0,0]=4 4824 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,2,0,0,0,0|1,0,0]=3 4825 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,2,0,0,0,0|1,0,0]=3 4826 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,2,0,0,0,0|0,0,0]=2 4827 B8R1.1 NCC1CN=C(N)O1 Amb24674197 [0,2,0,0,0,0|2,0,0]=4 4828 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,2,0,0,0,0|1,0,0]=3 4829 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,2,0,0,0,0|1,0,0]=3 4830 B8R1.1 NCC1CNC(=O)O1 Amb23439310 [0,2,0,0,0,0|1,0,0]=3 4831 B8R1.1 NCC1COC(=O)C1 Amb22642236 [0,2,0,0,0,0|0,0,0]=2 4832 B8R1.1 NCC1CSC(=O)O1 Amb25843341 [0,2,0,0,0,0|1,0,0]=3 4833 B8R1.1 NCC=1CC(=O)ON1 Amb18833041 [0,2,0,0,0,0|1,0,1]=4 4834 B8R1.1 NCC=1COC(=O)C1 Amb24634773 [0,2,0,0,0,0|0,0,2]=4 4835 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,2,0,0,0,0|1,0,0]=3 4836 B8R1.1 NC[C@@H]1CCC(=O)O1 Amb24656037 [0,2,0,0,0,0|0,0,0]=2 4837 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,2,0,0,0,0|1,0,0]=3 4838 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,2,0,0,0,0|1,0,0]=3 4839 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,2,0,0,0,0|1,0,0]=3 4840 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,2,0,0,0,0|1,0,0]=3 4841 B8R1.1 NC[C@H]1CCC(=O)O1 Amb24376645 [0,2,0,0,0,0|0,0,0]=2 4842 B8R1.1 NNC=1COC(=O)C1 Amb18641767 [0,2,0,0,0,0|0,0,2]=4 4843 B8R1.1 N[C@H]1C[C@@H](CO)OC1 Amb25313373 [0,2,0,0,0,0|0,0,2]=4 4844 B8R1.1 O=C1C=C(CCl)CO1 Amb24481317 [0,2,0,0,0,0|0,0,2]=4 4845 B8R1.1 O=C1C=C(CF)CO1 Amb23556961 [0,2,0,0,0,0|0,0,2]=4 4846 B8R1.1 O=C1C=C(CO1)C=O Amb24417175 [0,2,0,0,0,0|0,0,2]=4 4847 B8R1.1 O=C1C=CC(CBr)O1 Amb24423424 [0,2,0,0,0,0|0,0,2]=4 4848 B8R1.1 O=C1CC(CBr)CC1 Amb24483273 [0,2,0,0,0,0|1,0,0]=3 4849 B8R1.1 O=C1CC(CBr)CN1 Amb23597459 [0,2,0,0,0,0|1,0,0]=3 4850 B8R1.1 O=C1CC(CCl)CO1 Amb25367200 [0,2,0,0,0,0|0,0,0]=2 4851 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,2,0,0,0,0|0,0,0]=2 4852 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,2,0,0,0,0|1,0,0]=3 4853 B8R1.1 O=C1CC=C(CBr)O1 Amb24469203 [0,2,0,0,0,0|0,0,2]=4 4854 B8R1.1 O=C1CCC(=C1)C=O Amb24483014 [0,2,0,0,0,0|1,0,1]=4 4855 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,2,0,0,0,0|1,0,0]=3 4856 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,2,0,0,0,0|0,0,0]=2 4857 B8R1.1 O=C1CCC(CCl)=C1 Amb24645790 [0,2,0,0,0,0|1,0,1]=4 4858 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,2,0,0,0,0|1,0,0]=3 4859 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,2,0,0,0,0|0,0,0]=2 4860 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,2,0,0,0,0|0,0,0]=2 4861 B8R1.1 O=C1CC[C@@H](CF)N1 Amb19148412 [0,2,0,0,0,0|1,0,0]=3 4862 B8R1.1 O=C1CC\C(=C\Br)\O1 Amb24605306 [0,2,0,0,0,0|0,0,1]=3 4863 B8R1.1 O=C1CC\C(=C\Cl)\O1 Amb25024821 [0,2,0,0,0,0|0,0,1]=3 4864 B8R1.1 O=C1C[C@@H](CF)CO1 Amb22746494 [0,2,0,0,0,0|0,0,0]=2 4865 B8R1.1 O=C1C[C@H](CBr)CO1 Amb24429041 [0,2,0,0,0,0|0,0,0]=2 4866 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,2,0,0,0,0|0,0,0]=2 4867 B8R1.1 O=C1NCC(C=O)N1 Amb25262428 [0,2,0,0,0,0|2,0,0]=4 4868 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,2,0,0,0,0|1,0,0]=3 4869 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,2,0,0,0,0|1,0,0]=3 4870 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,2,0,0,0,0|1,0,0]=3 4871 B8R1.1 O=C1NC[C@H](C=O)N1 Amb25114412 [0,2,0,0,0,0|2,0,0]=4 4872 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,2,0,0,0,0|1,0,0]=3 4873 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,2,0,0,0,0|1,0,0]=3 4874 B8R1.1 O=C1OC[C@H](CCl)O1 Amb25234049 [0,2,0,0,0,0|1,0,0]=3 4875 B8R1.1 O=C1O\C(\CO1)=C/Br Amb25074539 [0,2,0,0,0,0|1,0,1]=4 4876 B8R1.1 O=C1SCC(CBr)S1 Amb24376514 [0,2,0,0,0,0|1,1,0]=4 4877 B8R1.1 O=C1SC[C@@H](C=O)S1 Amb24481521 [0,2,0,0,0,0|1,1,0]=4 4878 B8R1.1 O=CC1C=CC(=O)O1 Amb24528815 [0,2,0,0,0,0|0,0,2]=4 4879 B8R1.1 O=CC1CC(=O)CC1 Amb18124240 [0,2,0,0,0,0|1,0,0]=3 4880 B8R1.1 O=CC1CC(Br)CO1 Amb22730623 [0,2,0,0,0,0|0,0,1]=3 4881 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [0,2,0,0,0,0|1,0,0]=3 4882 B8R1.1 O=CC1CCC(=O)O1 Amb18641761 [0,2,0,0,0,0|0,0,0]=2 4883 B8R1.1 O=CC1CCC(=O)S1 Amb25094339 [0,2,0,0,0,0|0,1,0]=3 4884 B8R1.1 O=CC1CNC(=O)C1 Amb24435979 [0,2,0,0,0,0|1,0,0]=3 4885 B8R1.1 O=CN1CC(=O)CC1 Amb25787488 [0,2,0,0,0,0|2,0,0]=4 4886 B8R1.1 O=CN1CC(S)CC1 Amb25337191 [0,2,0,0,0,0|2,0,0]=4 4887 B8R1.1 O=CN1CC(S)CN1 Amb20621388 [0,2,0,0,0,0|2,0,0]=4 4888 B8R1.1 O=C[C@@H]1CC(=O)CC1 Amb24481518 [0,2,0,0,0,0|1,0,0]=3 4889 B8R1.1 O=C[C@@H]1CCC(=O)O1 Amb24527426 [0,2,0,0,0,0|0,0,0]=2 4890 B8R1.1 O=C[C@@H]1CCC(=O)S1 Amb24483031 [0,2,0,0,0,0|0,1,0]=3 4891 B8R1.1 O=C[C@@H]1CNC(=O)C1 Amb24377645 [0,2,0,0,0,0|1,0,0]=3 4892 B8R1.1 O=C[C@H]1CC(=O)CC1 Amb25759704 [0,2,0,0,0,0|1,0,0]=3 4893 B8R1.1 O=C[C@H]1CCC(=O)N1 Amb24482383 [0,2,0,0,0,0|1,0,0]=3 4894 B8R1.1 O=NN1CCC(=O)N1 Amb2417179 [0,2,0,0,0,0|2,0,0]=4 4895 B8R1.1 O=S1OCC(CCl)O1 Amb24624110 [0,2,0,0,0,0|2,0,0]=4 4896 B8R1.1 O=S1OCC(CF)O1 Amb21951909 [0,2,0,0,0,0|2,0,0]=4 4897 B8R1.1 O=S1OC[C@@H](CBr)O1 Amb25834609 [0,2,0,0,0,0|2,0,0]=4 4898 B8R1.1 O=S1OC[C@H](CBr)O1 Amb24654743 [0,2,0,0,0,0|2,0,0]=4 4899 B8R1.1 O=S1OC[C@H](CCl)O1 Amb24353584 [0,2,0,0,0,0|2,0,0]=4 4900 B8R1.1 OC1CC(CC1)C=O Amb18641801 [0,2,0,0,0,0|1,0,1]=4 4901 B8R1.1 OC1CC(CI)OC1 Amb22229903 [0,2,0,0,0,0|1,0,1]=4 4902 B8R1.1 OC1CCC(CCl)O1 Amb24428834 [0,2,0,0,0,0|0,0,2]=4 4903 B8R1.1 OC1CCC(CO)O1 Amb22492783 [0,2,0,0,0,0|0,0,2]=4 4904 B8R1.1 OC1CC[C@@H](CCl)O1 Amb24446577 [0,2,0,0,0,0|0,0,2]=4 4905 B8R1.1 OC1CC[C@H](CBr)O1 Amb24390382 [0,2,0,0,0,0|0,0,2]=4 4906 B8R1.1 OC1CN(CC1)C=O Amb24501609 [0,2,0,0,0,0|2,0,0]=4 4907 B8R1.1 OC1CN(CC1)N=O Amb25781793 [0,2,0,0,0,0|2,0,0]=4 4908 B8R1.1 OC1COC(C1)CO Amb22229902 [0,2,0,0,0,0|0,0,2]=4 4909 B8R1.1 OC=1OC(CCl)CP1 Amb24481387 [0,2,0,0,0,0|1,0,1]=4 4910 B8R1.1 OCC1=CCC(O)O1 Amb25662345 [0,2,0,0,0,0|0,0,2]=4 4911 B8R1.1 OCC1CC(=O)CC1 Amb22168734 [0,2,0,0,0,0|1,0,0]=3 4912 B8R1.1 OCC1CC(=O)CO1 Amb24117838 [0,2,0,0,0,0|2,0,0]=4 4913 B8R1.1 OCC1CC(S)CO1 Amb24718475 [0,2,0,0,0,0|0,0,2]=4 4914 B8R1.1 OCC1CC=C(Cl)C1 Amb23594524 [0,2,0,0,0,0|2,0,0]=4 4915 B8R1.1 OCC1CCC(=O)N1 Amb1162732 [0,2,0,0,0,0|1,0,0]=3 4916 B8R1.1 OCC1CCC(=O)O1 Amb20240701 [0,2,0,0,0,0|0,0,0]=2 4917 B8R1.1 OCC1CN=C(S)O1 Amb25092005 [0,2,0,0,0,0|1,1,0]=4 4918 B8R1.1 OCC1CNC(=O)S1 Amb25349662 [0,2,0,0,0,0|1,1,0]=4 4919 B8R1.1 OCC1COC(=O)C1 Amb22886806 [0,2,0,0,0,0|0,0,0]=2 4920 B8R1.1 OCC1COC(=O)N1 Amb22410779 [0,2,0,0,0,0|1,0,0]=3 4921 B8R1.1 OCC1COC(=S)O1 Amb24353008 [0,2,0,0,0,0|1,1,0]=4 4922 B8R1.1 OCC1COP(=O)O1 Amb24475979 [0,2,0,0,0,0|2,0,0]=4 4923 B8R1.1 OCC1COS(=O)O1 Amb25802802 [0,2,0,0,0,0|2,0,0]=4 4924 B8R1.1 OCC1OCC(=O)O1 Amb24643063 [0,2,0,0,0,0|1,0,0]=3 4925 B8R1.1 OCC=1COC(=O)C1 Amb23557062 [0,2,0,0,0,0|0,0,2]=4 4926 B8R1.1 OC[C@@H]1CC(=O)C=C1 Amb25373368 [0,2,0,0,0,0|1,0,1]=4 4927 B8R1.1 OC[C@@H]1CC(=O)CC1 Amb22748084 [0,2,0,0,0,0|1,0,0]=3 4928 B8R1.1 OC[C@@H]1CCC(=O)N1 Amb2371840 [0,2,0,0,0,0|1,0,0]=3 4929 B8R1.1 OC[C@@H]1CCC(=O)S1 Amb24372061 [0,2,0,0,0,0|0,1,0]=3 4930 B8R1.1 OC[C@@H]1CNC(=O)C1 Amb25745471 [0,2,0,0,0,0|1,0,0]=3 4931 B8R1.1 OC[C@@H]1CNC(=O)O1 Amb24183552 [0,2,0,0,0,0|1,0,0]=3 4932 B8R1.1 OC[C@@H]1COC(=O)C1 Amb24414055 [0,2,0,0,0,0|0,0,0]=2 4933 B8R1.1 OC[C@@H]1COS(=O)O1 Amb24748538 [0,2,0,0,0,0|2,0,0]=4 4934 B8R1.1 OC[C@H]1CC(=O)C=C1 Amb25093663 [0,2,0,0,0,0|1,0,1]=4 4935 B8R1.1 OC[C@H]1CC(=O)CC1 Amb24532129 [0,2,0,0,0,0|1,0,0]=3 4936 B8R1.1 OC[C@H]1CCC(=O)S1 Amb25823343 [0,2,0,0,0,0|0,1,0]=3 4937 B8R1.1 OC[C@H]1CNC(=O)C1 Amb24515579 [0,2,0,0,0,0|1,0,0]=3 4938 B8R1.1 OC[C@H]1CNC(=O)O1 Amb22737250 [0,2,0,0,0,0|1,0,0]=3 4939 B8R1.1 OC[C@H]1CSC(=O)N1 Amb24697600 [0,2,0,0,0,0|1,1,0]=4 4940 B8R1.1 OC[C@H]1C[C@H](S)CO1 Amb24573537 [0,2,0,0,0,0|0,0,2]=4 4941 B8R1.1 O[C@@H]1CO[C@@H](C1)CO Amb22224993 [0,2,0,0,0,0|0,0,2]=4 4942 B8R1.1 O[C@@H]1CO[C@H](C1)CO Amb22224992 [0,2,0,0,0,0|0,0,2]=4 4943 B8R1.1 O[C@H]1CN(CC1)C=O Amb25771374 [0,2,0,0,0,0|2,0,0]=4 4944 B8R1.1 O[C@H]1CON(C1)C=O Amb25364785 [0,2,0,0,0,0|1,0,0]=3 4945 B8R1.1 O[C@H]1CO[C@@H](C1)CO Amb22224988 [0,2,0,0,0,0|0,0,2]=4 4946 B8R1.1 O[C@H]1CO[C@H](C1)CO Amb22224987 [0,2,0,0,0,0|0,0,2]=4 4947 B8R1.1 O[C@H]1C[C@@H](CC1)C=O Amb24617244 [0,2,0,0,0,0|1,0,1]=4 4948 B8R1.1 S=C1OC(CBr)CS1 Amb24667928 [0,2,0,0,0,0|1,1,0]=4 4949 B8R1.7 CC(=C)C1=NCCO1 Amb17772215 [0,2,0,0,0,0|2,0,0]=4 4950 B8R1.7 CC(=O)C1=CCCO1 Amb25759909 [0,2,0,0,0,0|0,0,1]=3 4951 B8R1.7 CC(=O)C1=NCCO1 Amb24481446 [0,2,0,0,0,0|1,0,0]=3 4952 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,2,0,0,0,0|1,0,1]=4 4953 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [0,2,0,0,0,0|0,0,1]=3 4954 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [0,2,0,0,0,0|1,0,1]=4 4955 B8R1.7 CC(=O)C=1CCCC1 Amb22338190 [0,2,0,0,0,0|1,0,0]=3 4956 B8R1.7 CC(=O)C=1CCCN1 Amb21962890 [0,2,0,0,0,0|1,0,0]=3 4957 B8R1.7 CC(=O)C=1CSCC1 Amb25830074 [0,2,0,0,0,0|2,0,0]=4 4958 B8R1.7 CC(=O)N1CCCN1 Amb25213247 [0,2,0,0,0,0|2,0,0]=4 4959 B8R1.7 CC(=O)N1CCCO1 Amb24354493 [0,2,0,0,0,0|1,0,0]=3 4960 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [0,2,0,0,0,0|0,0,1]=3 4961 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [0,2,0,0,0,0|0,0,1]=3 4962 B8R1.7 CC(C)=C1NCCO1 Amb24483073 [0,2,0,0,0,0|2,0,0]=4 4963 B8R1.7 CC(C)C1=NCCO1 Amb24057543 [0,2,0,0,0,0|2,0,0]=4 4964 B8R1.7 CC(C)C=1CCCC1 Amb24333121 [0,2,0,0,0,0|2,0,0]=4 4965 B8R1.7 CC(C)C=1CCCN1 Amb24053778 [0,2,0,0,0,0|2,0,0]=4 4966 B8R1.7 CC(Cl)C1=CCCO1 Amb25058501 [0,2,0,0,0,0|1,0,1]=4 4967 B8R1.7 CC(N)C1=CCCO1 Amb24555155 [0,2,0,0,0,0|1,0,1]=4 4968 B8R1.7 CC(N)C1CCCO1 Amb21955382 [0,2,0,0,0,0|1,0,1]=4 4969 B8R1.7 CC(N)C=1CCCC1 Amb18946573 [0,2,0,0,0,0|2,0,0]=4 4970 B8R1.7 CS(=O)N1CCCO1 Amb25177398 [0,2,0,0,0,0|1,0,0]=3 4971 B8R1.7 C[C@@H](N)C1CCCO1 Amb19514591 [0,2,0,0,0,0|1,0,1]=4 4972 B8R1.7 C[C@@H](O)C=1CCCC1 Amb24545891 [0,2,0,0,0,0|1,0,1]=4 4973 B8R1.7 C[C@@H](O)[C@H]1CCCO1 Amb24592408 [0,2,0,0,0,0|0,0,2]=4 4974 B8R1.7 C[C@H](N)C=1CCCC1 Amb24417670 [0,2,0,0,0,0|2,0,0]=4 4975 B8R1.7 ClC(Br)C1CCCO1 Amb25798863 [0,2,0,0,0,0|1,0,1]=4 4976 B8R1.7 ClC(Cl)C1=NCCO1 Amb22436478 [0,2,0,0,0,0|2,0,0]=4 4977 B8R1.7 NC(=N)C1CCCO1 Amb22059430 [0,2,0,0,0,0|1,0,1]=4 4978 B8R1.7 NC(=O)C1=NCCN1 Amb1068371 [0,2,0,0,0,0|2,0,0]=4 4979 B8R1.7 NC(=O)C1CCCN1 Amb1152272 [0,2,0,0,0,0|1,0,1]=4 4980 B8R1.7 NC(=O)C1CCCS1 Amb24461593 [0,2,0,0,0,0|0,1,1]=4 4981 B8R1.7 NC(=O)C1CNCO1 Amb25276465 [0,2,0,0,0,0|1,0,1]=4 4982 B8R1.7 NC(=O)C=1CCCC1 Amb20622488 [0,2,0,0,0,0|1,0,0]=3 4983 B8R1.7 NC(=O)C=1CCON1 Amb24481311 [0,2,0,0,0,0|2,0,0]=4 4984 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [0,2,0,0,0,0|2,0,0]=4 4985 B8R1.7 NC(=O)N1CCCN1 Amb24563074 [0,2,0,0,0,0|2,0,0]=4 4986 B8R1.7 NC(=O)N1CCCO1 Amb24465577 [0,2,0,0,0,0|1,0,0]=3 4987 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,2,0,0,0,0|1,0,1]=4 4988 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,2,0,0,0,0|1,0,1]=4 4989 B8R1.7 NC(=S)C1CCCO1 Amb18108094 [0,2,0,0,0,0|0,1,1]=4 4990 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [0,2,0,0,0,0|0,1,1]=4 4991 B8R1.7 O=C(Cl)C=1NCCN1 Amb25215918 [0,2,0,0,0,0|2,0,0]=4 4992 B8R1.7 O=C(Cl)[C@H]1CCCN1 Amb24655823 [0,2,0,0,0,0|1,0,1]=4 4993 B8R1.7 O=C(S)N1CCCC1 Amb25827611 [0,2,0,0,0,0|2,0,0]=4 4994 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [0,2,0,0,0,0|0,0,1]=3 4995 B8R1.7 OB(C1=CCCC1)O Amb10068948 [0,2,0,0,0,0|1,0,1]=4 4996 B8R1.7 OB(O)C1=CCCO1 Amb22168857 [0,2,0,0,0,0|0,0,2]=4 4997 B8R1.7 OB(O)C1CCCO1 Amb24317356 [0,2,0,0,0,0|0,0,2]=4 4998 B8R1.7 OC(=O)C1=CCCN1 Amb17593173 [0,2,0,0,0,0|1,0,1]=4 4999 B8R1.7 OC(=O)C1=CCCO1 Amb19148920 [0,2,0,0,0,0|0,0,1]=3 5000 B8R1.7 OC(=O)C1=CCCS1 Amb18642795 [0,2,0,0,0,0|0,1,1]=4 5001 B8R1.7 OC(=O)C1=NCCS1 Amb18642837 [0,2,0,0,0,0|1,1,0]=4 5002 B8R1.7 OC(=O)C1CCCN1 Amb22040086 [0,2,0,0,0,0|1,0,1]=4 5003 B8R1.7 OC(=O)C1CCCN1 Amb2542766 [0,2,0,0,0,0|1,0,1]=4 5004 B8R1.7 OC(=O)C1CCCS1 Amb18124363 [0,2,0,0,0,0|0,1,1]=4 5005 B8R1.7 OC(=O)C1CNCO1 Amb24359881 [0,2,0,0,0,0|1,0,1]=4 5006 B8R1.7 OC(=O)C1C[13CH2]CN1 Amb22367338 [0,2,0,0,0,0|1,0,1]=4 5007 B8R1.7 OC(=O)C1NCCO1 Amb24760849 [0,2,0,0,0,0|1,0,1]=4 5008 B8R1.7 OC(=O)C1OCCO1 Amb24349582 [0,2,0,0,0,0|1,0,1]=4 5009 B8R1.7 OC(=O)C=1CCCN1 Amb18641721 [0,2,0,0,0,0|1,0,0]=3 5010 B8R1.7 OC(=O)C=1CCOC1 Amb18124248 [0,2,0,0,0,0|2,0,0]=4 5011 B8R1.7 OC(=O)C=1CCON1 Amb24353499 [0,2,0,0,0,0|2,0,0]=4 5012 B8R1.7 OC(=O)C=1COCC1 Amb24434391 [0,2,0,0,0,0|2,0,0]=4 5013 B8R1.7 OC(=O)C=1CSCC1 Amb18642797 [0,2,0,0,0,0|2,0,0]=4 5014 B8R1.7 OC(=O)[C@H]1CCCS1 Amb24481353 [0,2,0,0,0,0|0,1,1]=4 5015 B8R1.7 O[13C](=O)C1CCCN1 Amb22367492 [0,2,0,0,0,0|1,0,1]=4 5016 B8R1.7 O[13C](=O)[13C@@H]1[13CH2][13CH2][13CH2][15NH]1 Amb19133705 [0,2,0,0,0,0|1,0,1]=4 5017 B8R1.7 O[13C](=O)[C@@H]1CCCN1 Amb22336891 [0,2,0,0,0,0|1,0,1]=4 5018 B8R1.7 [13CH3][13C](=O)C1=NCCC1 Amb17607638 [0,2,0,0,0,0|1,0,0]=3 5019 B8R1.7 [O-][N+](=O)C=1CCON1 Amb22234959 [0,2,0,0,0,0|2,0,0]=4 5020 B8R1.8 BrCCC1=NCCO1 Amb24740753 [0,2,0,0,0,0|2,0,0]=4 5021 B8R1.8 BrCCC=1CCCC1 Amb25685270 [0,2,0,0,0,0|2,0,0]=4 5022 B8R1.8 Br\C=C\C=1CCCC1 Amb25233154 [0,2,0,0,0,0|2,0,0]=4 5023 B8R1.8 C=CCC=1CCCN1 Amb24474418 [0,2,0,0,0,0|2,0,0]=4 5024 B8R1.8 C=CCN1CCCO1 Amb25796789 [0,2,0,0,0,0|2,0,0]=4 5025 B8R1.8 CCCC1CCCO1 Amb25662993 [0,2,0,0,0,0|1,0,1]=4 5026 B8R1.8 CCNC=1CCCN1 Amb24116050 [0,2,0,0,0,0|2,0,0]=4 5027 B8R1.8 CCOC1=NCCO1 Amb24595914 [0,2,0,0,0,0|1,0,1]=4 5028 B8R1.8 CCOC1CCCO1 Amb22228805 [0,2,0,0,0,0|0,0,2]=4 5029 B8R1.8 CCOC=1CCCC1 Amb22490985 [0,2,0,0,0,0|1,0,1]=4 5030 B8R1.8 CCOC=1CCCN1 Amb19943923 [0,2,0,0,0,0|1,0,1]=4 5031 B8R1.8 CNC[C@H]1CCCO1 Amb24526936 [0,2,0,0,0,0|1,0,1]=4 5032 B8R1.8 CNN=C1CCCC1 Amb24607987 [0,2,0,0,0,0|2,0,0]=4 5033 B8R1.8 CN\C=C/1\CCCO1 Amb25849244 [0,2,0,0,0,0|1,0,0]=3 5034 B8R1.8 CON=C1CCCC1 Amb25849374 [0,2,0,0,0,0|1,0,1]=4 5035 B8R1.8 ClC#CC=1CCCC1 Amb25701897 [0,2,0,0,0,0|2,0,0]=4 5036 B8R1.8 ClCC=C1CCCC1 Amb24481221 [0,2,0,0,0,0|2,0,0]=4 5037 B8R1.8 ClCCC=1CCCC1 Amb24643026 [0,2,0,0,0,0|2,0,0]=4 5038 B8R1.8 ClCOC1CCCO1 Amb25793433 [0,2,0,0,0,0|0,0,2]=4 5039 B8R1.8 N#CC=C1CCCC1 Amb17672923 [0,2,0,0,0,0|2,0,0]=4 5040 B8R1.8 N#CC=C1OCCO1 Amb17593143 [0,2,0,0,0,0|2,0,0]=4 5041 B8R1.8 N#CCC1CCCO1 Amb1102605 [0,2,0,0,0,0|1,0,1]=4 5042 B8R1.8 N#CN=C1NCCO1 Amb24309375 [0,2,0,0,0,0|2,0,0]=4 5043 B8R1.8 N#CNC=1CCCN1 Amb22436020 [0,2,0,0,0,0|2,0,0]=4 5044 B8R1.8 N#C\C=C/1\CCCN1 Amb25173832 [0,2,0,0,0,0|2,0,0]=4 5045 B8R1.8 N#C\C=C\1/CCCN1 Amb18123359 [0,2,0,0,0,0|2,0,0]=4 5046 B8R1.8 N#C\N=C\1/CCCN1 Amb19514565 [0,2,0,0,0,0|2,0,0]=4 5047 B8R1.8 NCCC1CCCO1 Amb1102677 [0,2,0,0,0,0|1,0,1]=4 5048 B8R1.8 NCCC1CCCO1 Amb13952618 [0,2,0,0,0,0|1,0,1]=4 5049 B8R1.8 NCCC=1CCCC1 Amb18641665 [0,2,0,0,0,0|2,0,0]=4 5050 B8R1.8 NNCC1=CCCO1 Amb24505186 [0,2,0,0,0,0|1,0,1]=4 5051 B8R1.8 NNCC1CCCO1 Amb10610188 [0,2,0,0,0,0|1,0,1]=4 5052 B8R1.8 NNCC1CCCO1 Amb10610215 [0,2,0,0,0,0|1,0,1]=4 5053 B8R1.8 NOCC1CCCO1 Amb17231830 [0,2,0,0,0,0|0,0,2]=4 5054 B8R1.8 NOCC=1CCCC1 Amb24729896 [0,2,0,0,0,0|1,0,1]=4 5055 B8R1.8 NOC[C@@H]1CCCO1 Amb25823965 [0,2,0,0,0,0|0,0,2]=4 5056 B8R1.8 O=C=NC1CCCS1 Amb25801239 [0,2,0,0,0,0|0,1,1]=4 5057 B8R1.8 O=CC=C1CCCC1 Amb18641613 [0,2,0,0,0,0|1,0,0]=3 5058 B8R1.8 O=CCC1CCCC1 Amb17672924 [0,2,0,0,0,0|1,0,1]=4 5059 B8R1.8 O=CCC1CCCO1 Amb18641800 [0,2,0,0,0,0|0,0,1]=3 5060 B8R1.8 O=CCC1CCCS1 Amb25195330 [0,2,0,0,0,0|0,1,1]=4 5061 B8R1.8 O=CCC1OCCO1 Amb18831794 [0,2,0,0,0,0|1,0,1]=4 5062 B8R1.8 O=CNC1CCCO1 Amb25075466 [0,2,0,0,0,0|0,0,1]=3 5063 B8R1.8 O=CNC=1CCCC1 Amb24714679 [0,2,0,0,0,0|1,0,0]=3 5064 B8R1.8 O=NN=C1NCCN1 Amb25737100 [0,2,0,0,0,0|2,0,0]=4 5065 B8R1.8 O=NN=C1NCCS1 Amb24377761 [0,2,0,0,0,0|1,1,0]=4 5066 B8R1.8 OCC=C1CCCC1 Amb25083481 [0,2,0,0,0,0|1,0,1]=4 5067 B8R1.8 OCCC1CCCO1 Amb20622383 [0,2,0,0,0,0|0,0,2]=4 5068 B8R1.8 OCCC=1CCCC1 Amb25333041 [0,2,0,0,0,0|1,0,1]=4 5069 B8R1.8 OCCN1CCCO1 Amb25094269 [0,2,0,0,0,0|1,0,1]=4 5070 B8R1.8 ONCC1CCCO1 Amb25684501 [0,2,0,0,0,0|0,0,2]=4 5071 B8R1.8 S=C=NC1CCCO1 Amb22330495 [0,2,0,0,0,0|0,1,1]=4 5072 B8R1.8 [N-]=[N+]=NC1CCCO1 Amb25707207 [0,2,0,0,0,0|1,0,1]=4 5073 B8R1.8 [N-]=[N+]=NC=1CCCC1 Amb25803999 [0,2,0,0,0,0|2,0,0]=4 5074 B8R1.8 [N-]=[N+]=NC=1CCCN1 Amb24366732 [0,2,0,0,0,0|2,0,0]=4 5075 B8R1.11 BrCN1CCCC1=S Amb10566727 [0,2,0,0,0,0|1,1,0]=4 5076 B8R1.11 C#CC1=CCCC1=O Amb25071560 [0,2,0,0,0,0|1,0,1]=4 5077 B8R1.11 C#C[C@@H]1OCC[C@@H]1Cl Amb24520205 [0,2,0,0,0,0|1,0,1]=4 5078 B8R1.11 C#C[C@H]1OCC[C@H]1Cl Amb24624692 [0,2,0,0,0,0|1,0,1]=4 5079 B8R1.11 C=C1CCCC1C=O Amb18124219 [0,2,0,0,0,0|1,0,1]=4 5080 B8R1.11 C=C1CCCC1CO Amb25065044 [0,2,0,0,0,0|2,0,0]=4 5081 B8R1.11 C=C1CCC[C@H]1CO Amb24642386 [0,2,0,0,0,0|2,0,0]=4 5082 B8R1.11 C=C=C1CCCC1=O Amb25706985 [0,2,0,0,0,0|1,0,0]=3 5083 B8R1.11 C=C=C1CCOC1=O Amb24461343 [0,2,0,0,0,0|0,0,1]=3 5084 B8R1.11 C=CC1=CCOC1=O Amb25217790 [0,2,0,0,0,0|0,0,2]=4 5085 B8R1.11 C=CC1OCCC1N Amb25080525 [0,2,0,0,0,0|1,0,1]=4 5086 B8R1.11 C=CC1OCCC1O Amb25105995 [0,2,0,0,0,0|1,0,1]=4 5087 B8R1.11 C=CN1CCCC1=O Amb15691738 [0,2,0,0,0,0|1,0,0]=3 5088 B8R1.11 C=CN1CCNC1=O Amb25840230 [0,2,0,0,0,0|2,0,0]=4 5089 B8R1.11 C=CN1CCOC1=O Amb24595910 [0,2,0,0,0,0|1,0,0]=3 5090 B8R1.11 C=CN1CCOC1=S Amb24647654 [0,2,0,0,0,0|1,1,0]=4 5091 B8R1.11 C=C[C@@H]1OCC[C@H]1Cl Amb24531903 [0,2,0,0,0,0|1,0,1]=4 5092 B8R1.11 CC1=CCCC1C=O Amb24611215 [0,2,0,0,0,0|2,0,0]=4 5093 B8R1.11 CC1=CCCC1CO Amb25804911 [0,2,0,0,0,0|2,0,0]=4 5094 B8R1.11 CC1CCC=C1C=O Amb25785594 [0,2,0,0,0,0|1,0,0]=3 5095 B8R1.11 CC1CCC=C1CBr Amb24650933 [0,2,0,0,0,0|2,0,0]=4 5096 B8R1.11 CC1CCCC1=NO Amb24469856 [0,2,0,0,0,0|1,0,1]=4 5097 B8R1.11 CC1CCCC1C=O Amb18124243 [0,2,0,0,0,0|1,0,1]=4 5098 B8R1.11 CC1CCOC1CBr Amb25043116 [0,2,0,0,0,0|1,0,1]=4 5099 B8R1.11 CC1CCOC1CO Amb25358374 [0,2,0,0,0,0|0,0,2]=4 5100 B8R1.11 CC1OCC=C1C=O Amb24722958 [0,2,0,0,0,0|2,0,0]=4 5101 B8R1.11 CC1OCCC1C=O Amb18641773 [0,2,0,0,0,0|1,0,1]=4 5102 B8R1.11 CC1OCCC1CN Amb24398461 [0,2,0,0,0,0|1,0,1]=4 5103 B8R1.11 CC1OCCC1NN Amb25696875 [0,2,0,0,0,0|1,0,1]=4 5104 B8R1.11 CC1OCCC1SC Amb25763217 [0,2,0,0,0,0|1,0,1]=4 5105 B8R1.11 CC=1CCCC1C=O Amb18641615 [0,2,0,0,0,0|1,0,0]=3 5106 B8R1.11 CC=1CCCC1CBr Amb24483119 [0,2,0,0,0,0|2,0,0]=4 5107 B8R1.11 CC=1CCCC1CC Amb22227944 [0,2,0,0,0,0|2,0,0]=4 5108 B8R1.11 CC=1CCSC1C=O Amb18642671 [0,2,0,0,0,0|0,1,1]=4 5109 B8R1.11 CCC1=CCCC1=O Amb17778667 [0,2,0,0,0,0|1,0,1]=4 5110 B8R1.11 CCC1=CCOC1=O Amb25189060 [0,2,0,0,0,0|0,0,2]=4 5111 B8R1.11 CCC1=[N+](C)CCC1 Amb10552884 [0,2,0,0,0,0|2,0,0]=4 5112 B8R1.11 CCC1CCCC1=C Amb24759653 [0,2,0,0,0,0|2,0,0]=4 5113 B8R1.11 CCC1CCCC1=O Amb16187019 [0,2,0,0,0,0|1,0,0]=3 5114 B8R1.11 CCC1CCNC1=O Amb19516780 [0,2,0,0,0,0|1,0,0]=3 5115 B8R1.11 CCC1CCNC1=S Amb24604375 [0,2,0,0,0,0|1,1,0]=4 5116 B8R1.11 CCC1CCOC1=O Amb23538353 [0,2,0,0,0,0|0,0,0]=2 5117 B8R1.11 CCC1CCOC1Br Amb24333881 [0,2,0,0,0,0|1,0,1]=4 5118 B8R1.11 CCC1CCOC1O Amb24475406 [0,2,0,0,0,0|0,0,2]=4 5119 B8R1.11 CCC1CSCC1=O Amb25143445 [0,2,0,0,0,0|2,0,0]=4 5120 B8R1.11 CCC1NCCC1=O Amb18833066 [0,2,0,0,0,0|2,0,0]=4 5121 B8R1.11 CCC1OCCC1Br Amb24333011 [0,2,0,0,0,0|1,0,1]=4 5122 B8R1.11 CCC1OCCC1Cl Amb24374611 [0,2,0,0,0,0|1,0,1]=4 5123 B8R1.11 CCC1OCCC1N Amb25702085 [0,2,0,0,0,0|1,0,1]=4 5124 B8R1.11 CCN1CCNC1=O Amb19333131 [0,2,0,0,0,0|2,0,0]=4 5125 B8R1.11 CCN1CNCC1=O Amb24391792 [0,2,0,0,0,0|2,0,0]=4 5126 B8R1.11 CC[C@@H]1OCC[C@@H]1Br Amb25233391 [0,2,0,0,0,0|1,0,1]=4 5127 B8R1.11 CC[C@@H]1OCC[C@H]1N Amb24401717 [0,2,0,0,0,0|1,0,1]=4 5128 B8R1.11 CC[C@@H]1OCC[C@H]1O Amb25246272 [0,2,0,0,0,0|1,0,1]=4 5129 B8R1.11 CC[C@H]1OCC[C@@H]1O Amb25357528 [0,2,0,0,0,0|1,0,1]=4 5130 B8R1.11 CN/1CCC\C1=N/N Amb22347555 [0,2,0,0,0,0|2,0,0]=4 5131 B8R1.11 CN1CCCC1C=O Amb21861151 [0,2,0,0,0,0|1,0,1]=4 5132 B8R1.11 CN1CCC[C@@H]1C=O Amb24474417 [0,2,0,0,0,0|1,0,1]=4 5133 B8R1.11 CN1CCC[C@H]1C=O Amb22225407 [0,2,0,0,0,0|1,0,1]=4 5134 B8R1.11 CN1CCN=C1C=O Amb24639188 [0,2,0,0,0,0|2,0,0]=4 5135 B8R1.11 CNC1=CCOC1=O Amb25678658 [0,2,0,0,0,0|0,0,2]=4 5136 B8R1.11 CNC1CCNC1=O Amb22059501 [0,2,0,0,0,0|1,0,0]=3 5137 B8R1.11 CNC1CONC1=O Amb24120339 [0,2,0,0,0,0|2,0,0]=4 5138 B8R1.11 CN[C@H]1CCSC1=O Amb25367035 [0,2,0,0,0,0|0,1,0]=3 5139 B8R1.11 COC1=NCCC1O Amb24749639 [0,2,0,0,0,0|1,0,1]=4 5140 B8R1.11 COC1CC=CC1=O Amb25266562 [0,2,0,0,0,0|1,0,1]=4 5141 B8R1.11 COC1CCCC1=O Amb24573567 [0,2,0,0,0,0|1,0,0]=3 5142 B8R1.11 COC1CCOC1O Amb24364851 [0,2,0,0,0,0|0,0,2]=4 5143 B8R1.11 COC1OCCC1=O Amb24334318 [0,2,0,0,0,0|2,0,0]=4 5144 B8R1.11 COC1SCCC1=O Amb25025575 [0,2,0,0,0,0|2,0,0]=4 5145 B8R1.11 CON1CCOC1=O Amb25769302 [0,2,0,0,0,0|1,0,0]=3 5146 B8R1.11 CO[C@@H]1OCC[C@@H]1O Amb24613572 [0,2,0,0,0,0|0,0,2]=4 5147 B8R1.11 CO[C@@H]1OCC[C@H]1Cl Amb25227813 [0,2,0,0,0,0|0,0,2]=4 5148 B8R1.11 CO[C@H]1CCOC1O Amb25344965 [0,2,0,0,0,0|0,0,2]=4 5149 B8R1.11 CSC1=CCOC1=O Amb24614865 [0,2,0,0,0,0|0,0,2]=4 5150 B8R1.11 CSC1CCCC1=O Amb25761282 [0,2,0,0,0,0|1,0,0]=3 5151 B8R1.11 CSC1CCNC1=N Amb25732589 [0,2,0,0,0,0|2,0,0]=4 5152 B8R1.11 C[C@@H]1CCC=C1C=O Amb25790586 [0,2,0,0,0,0|1,0,0]=3 5153 B8R1.11 C[C@@H]1OCC[C@@H]1CN Amb22886286 [0,2,0,0,0,0|1,0,1]=4 5154 B8R1.11 C[C@@H]1OCC[C@@H]1CN Amb24540367 [0,2,0,0,0,0|1,0,1]=4 5155 B8R1.11 C[C@@H]1OCC[C@@H]1CO Amb22886851 [0,2,0,0,0,0|1,0,1]=4 5156 B8R1.11 C[C@H]1CCC[C@@H]1C=O Amb24757729 [0,2,0,0,0,0|1,0,1]=4 5157 B8R1.11 C[C@H]1OCC[C@H]1C=O Amb25246650 [0,2,0,0,0,0|1,0,1]=4 5158 B8R1.11 C[C@H]1OCC[C@H]1CO Amb25328798 [0,2,0,0,0,0|1,0,1]=4 5159 B8R1.11 C\C=C/1\CCCC1=O Amb25205820 [0,2,0,0,0,0|1,0,0]=3 5160 B8R1.11 C\C=C/1\CCC[C@@H]1O Amb25369446 [0,2,0,0,0,0|2,0,0]=4 5161 B8R1.11 C\C=C/1\CCC[C@H]1O Amb24457783 [0,2,0,0,0,0|2,0,0]=4 5162 B8R1.11 C\C=C/1\CCOC1=O Amb24697124 [0,2,0,0,0,0|0,0,1]=3 5163 B8R1.11 ClCC=1CCCC1Br Amb25211186 [0,2,0,0,0,0|2,0,0]=4 5164 B8R1.11 F[C@@H]1CCO[C@H]1CBr Amb24610248 [0,2,0,0,0,0|1,0,1]=4 5165 B8R1.11 N#CC1=C(C)CCC1 Amb17593114 [0,2,0,0,0,0|2,0,0]=4 5166 B8R1.11 N#CC1=CCCC1Cl Amb24483191 [0,2,0,0,0,0|2,0,0]=4 5167 B8R1.11 N#CC1=CCCC1O Amb25746165 [0,2,0,0,0,0|2,0,0]=4 5168 B8R1.11 N#CC1=CCOC1=O Amb25268705 [0,2,0,0,0,0|0,0,2]=4 5169 B8R1.11 N#CC1CCNC1=O Amb24053097 [0,2,0,0,0,0|1,0,0]=3 5170 B8R1.11 N#CC1CNCC1=O Amb22297522 [0,2,0,0,0,0|2,0,0]=4 5171 B8R1.11 N#CC1COCC1=O Amb24183529 [0,2,0,0,0,0|2,0,0]=4 5172 B8R1.11 N#CC1OCCC1Br Amb24726325 [0,2,0,0,0,0|1,0,1]=4 5173 B8R1.11 N#CC1OCCC1Cl Amb25801062 [0,2,0,0,0,0|1,0,1]=4 5174 B8R1.11 N#CC=1CCCC1Cl Amb25769139 [0,2,0,0,0,0|2,0,0]=4 5175 B8R1.11 N#CN1CCNC1=O Amb25690572 [0,2,0,0,0,0|2,0,0]=4 5176 B8R1.11 NC=1CCCC1C=O Amb25063022 [0,2,0,0,0,0|1,0,0]=3 5177 B8R1.11 NC=1OCCC1C#N Amb23513634 [0,2,0,0,0,0|1,0,1]=4 5178 B8R1.11 NCC1=CCCC1=O Amb25168851 [0,2,0,0,0,0|1,0,1]=4 5179 B8R1.11 NCC1CCCC1=O Amb18833069 [0,2,0,0,0,0|1,0,0]=3 5180 B8R1.11 NCC1CCNC1=O Amb18833033 [0,2,0,0,0,0|1,0,0]=3 5181 B8R1.11 NCC1CNCC1=O Amb25168729 [0,2,0,0,0,0|2,0,0]=4 5182 B8R1.11 NCC1CSCC1=O Amb24529601 [0,2,0,0,0,0|2,0,0]=4 5183 B8R1.11 NCN1CCCC1=O Amb25064270 [0,2,0,0,0,0|1,0,0]=3 5184 B8R1.11 NCN1CCOC1=O Amb25662499 [0,2,0,0,0,0|1,0,0]=3 5185 B8R1.11 NCN1CCOC1=S Amb25810280 [0,2,0,0,0,0|1,1,0]=4 5186 B8R1.11 NC[C@H]1OCC[C@H]1S Amb24550200 [0,2,0,0,0,0|1,0,1]=4 5187 B8R1.11 N\C=C/1\CCCC1=O Amb24417382 [0,2,0,0,0,0|1,0,0]=3 5188 B8R1.11 N\C=C/1\CCOC1=O Amb24575038 [0,2,0,0,0,0|0,0,1]=3 5189 B8R1.11 O=C/1OCC\C1=C/Cl Amb24723140 [0,2,0,0,0,0|0,0,1]=3 5190 B8R1.11 O=C1CCC=C1C=O Amb18641556 [0,2,0,0,0,0|1,0,1]=4 5191 B8R1.11 O=C1CCCC1CCl Amb25111572 [0,2,0,0,0,0|1,0,0]=3 5192 B8R1.11 O=C1CCCN1CBr Amb24082678 [0,2,0,0,0,0|1,0,0]=3 5193 B8R1.11 O=C1NCCC1CBr Amb24553938 [0,2,0,0,0,0|1,0,0]=3 5194 B8R1.11 O=C1NCCC1CCl Amb25691013 [0,2,0,0,0,0|1,0,0]=3 5195 B8R1.11 O=C1OCCC1CCl Amb24649714 [0,2,0,0,0,0|0,0,0]=2 5196 B8R1.11 O=CC1=C(Cl)CCC1 Amb17593382 [0,2,0,0,0,0|1,0,0]=3 5197 B8R1.11 O=CC1CCCC1=O Amb24480732 [0,2,0,0,0,0|1,0,0]=3 5198 B8R1.11 O=CC1CCOC1=O Amb17593177 [0,2,0,0,0,0|0,0,0]=2 5199 B8R1.11 O=CC1CCSC1=O Amb25365596 [0,2,0,0,0,0|0,1,0]=3 5200 B8R1.11 O=CC=1CCCC1Br Amb18124521 [0,2,0,0,0,0|1,0,0]=3 5201 B8R1.11 O=CN1CCOC1=O Amb25246739 [0,2,0,0,0,0|1,0,0]=3 5202 B8R1.11 OC1CCC=C1C=O Amb24483009 [0,2,0,0,0,0|1,0,0]=3 5203 B8R1.11 OC1CCCN1N=O Amb25675821 [0,2,0,0,0,0|2,0,0]=4 5204 B8R1.11 OCC1=CCCC1=O Amb15693428 [0,2,0,0,0,0|1,0,1]=4 5205 B8R1.11 OCC1=CCCC1O Amb25226276 [0,2,0,0,0,0|1,0,1]=4 5206 B8R1.11 OCC1=CCOC1=O Amb25286254 [0,2,0,0,0,0|0,0,2]=4 5207 B8R1.11 OCC1CCCC1=O Amb22491993 [0,2,0,0,0,0|1,0,0]=3 5208 B8R1.11 OCC1CCNC1=O Amb22749924 [0,2,0,0,0,0|1,0,0]=3 5209 B8R1.11 OCC1CCSC1=O Amb17593391 [0,2,0,0,0,0|0,1,0]=3 5210 B8R1.11 OCC1N=COC1=O Amb24511756 [0,2,0,0,0,0|1,0,1]=4 5211 B8R1.11 OCC1NCCC1=O Amb25189929 [0,2,0,0,0,0|2,0,0]=4 5212 B8R1.11 OCC1OCCC1F Amb25808078 [0,2,0,0,0,0|0,0,2]=4 5213 B8R1.11 OCN1CCCC1=O Amb1144427 [0,2,0,0,0,0|1,0,0]=3 5214 B8R1.11 OCN1CCNC1=O Amb24761511 [0,2,0,0,0,0|2,0,0]=4 5215 B8R1.11 OCN1CCSC1=O Amb25135741 [0,2,0,0,0,0|1,1,0]=4 5216 B8R1.11 OC[C@@H]1CCOC1=O Amb24423403 [0,2,0,0,0,0|0,0,0]=2 5217 B8R1.11 OC[C@@H]1NCCC1=O Amb25202333 [0,2,0,0,0,0|2,0,0]=4 5218 B8R1.11 O[C@@H]1CCO[C@H]1CO Amb25246270 [0,2,0,0,0,0|0,0,2]=4 5219 B8R1.11 O[C@H]1CCO[C@H]1CO Amb24575535 [0,2,0,0,0,0|0,0,2]=4 5220 B8R1.11 O\C=C/1\CCOC1=O Amb24705599 [0,2,0,0,0,0|0,0,1]=3 5221 B8R1.11 O\C=C/1\CCSC1=O Amb24534026 [0,2,0,0,0,0|0,1,1]=4 5222 B8R1.11 O\N=C/1\CCCC1=O Amb24633352 [0,2,0,0,0,0|1,0,0]=3 5223 B8R1.11 [N-]=[N+]=C1CCOC1=O Amb25207854 [0,2,0,0,0,0|0,0,1]=3 5224 B8R1.11 [O-]C=C1CCCC1=O Amb19515665 [0,2,0,0,0,0|1,0,0]=3 5225 B8R1.52 CC1(C=O)OCCO1 Amb22233791 [0,2,0,0,0,0|1,0,1]=4 5226 B8R1.52 CC1(CBr)CCCO1 Amb25063926 [0,2,0,0,0,0|1,0,1]=4 5227 B8R1.52 CC1(CCCC1)C=O Amb18641706 [0,2,0,0,0,0|1,0,1]=4 5228 B8R1.52 CC1(CCCO1)C=O Amb18641803 [0,2,0,0,0,0|0,0,1]=3 5229 B8R1.52 CC1(CO)CCCO1 Amb20668849 [0,2,0,0,0,0|0,0,2]=4 5230 B8R1.52 C[C@@]1(CN)CCCO1 Amb24619582 [0,2,0,0,0,0|1,0,1]=4 5231 B8R1.52 C[C@]1(CN)CCCO1 Amb25698277 [0,2,0,0,0,0|1,0,1]=4 5232 B8R1.52 NCC1(C)CCCO1 Amb1102373 [0,2,0,0,0,0|1,0,1]=4 5233 B8R1.52 O=CC1(Br)CCCC1 Amb25758600 [0,2,0,0,0,0|1,0,1]=4 5234 B8R1.52 O=P1(CCl)OCCO1 Amb24561830 [0,2,0,0,0,0|2,0,0]=4 5235 B8R1.52 OC1(CCCC1)C=O Amb18124253 [0,2,0,0,0,0|1,0,1]=4 5236 B8R1.18 C=C1CC(O)CC1=C Amb25706042 [0,2,0,0,0,0|2,0,0]=4 5237 B8R1.18 C=C1OC(Cl)OC1=O Amb24476537 [0,2,0,0,0,0|1,0,1]=4 5238 B8R1.18 CC1=CC(=O)CC1Br Amb24552421 [0,2,0,0,0,0|1,0,1]=4 5239 B8R1.18 CC1=CC(=O)CC1Cl Amb24711398 [0,2,0,0,0,0|1,0,1]=4 5240 B8R1.18 CC1=CC(=O)CC1O Amb24633748 [0,2,0,0,0,0|1,0,1]=4 5241 B8R1.18 CC1=CC(=O)C[C@@H]1O Amb25093715 [0,2,0,0,0,0|1,0,1]=4 5242 B8R1.18 CC1=CC(=O)C[C@H]1O Amb24612700 [0,2,0,0,0,0|1,0,1]=4 5243 B8R1.18 CC1=CC(=O)OC1Br Amb25144076 [0,2,0,0,0,0|0,0,2]=4 5244 B8R1.18 CC1=CC(=O)OC1Cl Amb24601836 [0,2,0,0,0,0|0,0,2]=4 5245 B8R1.18 CC1=CC(=O)O[C@@H]1O Amb25185238 [0,2,0,0,0,0|0,0,2]=4 5246 B8R1.18 CC1=CC(Br)CC1=O Amb25775004 [0,2,0,0,0,0|1,0,1]=4 5247 B8R1.18 CC1=CC(Br)OC1=O Amb22231983 [0,2,0,0,0,0|0,0,2]=4 5248 B8R1.18 CC1=CC(C)CC1=O Amb25187953 [0,2,0,0,0,0|1,0,1]=4 5249 B8R1.18 CC1=CC(Cl)C(=O)O1 Amb24349720 [0,2,0,0,0,0|0,0,2]=4 5250 B8R1.18 CC1=CC(Cl)OC1=O Amb25662203 [0,2,0,0,0,0|0,0,2]=4 5251 B8R1.18 CC1=CC(O)CC1=O Amb25686945 [0,2,0,0,0,0|1,0,1]=4 5252 B8R1.18 CC1=CC(O)OC1=O Amb24589666 [0,2,0,0,0,0|0,0,2]=4 5253 B8R1.18 CC1=C[C@@H](C)CC1=O Amb24725285 [0,2,0,0,0,0|1,0,1]=4 5254 B8R1.18 CC1=C[C@@H](O)CC1=O Amb25706986 [0,2,0,0,0,0|1,0,1]=4 5255 B8R1.18 CC1C=C(O)C(=O)O1 Amb24332982 [0,2,0,0,0,0|0,0,2]=4 5256 B8R1.18 CC1CC(=O)C(=O)O1 Amb24524552 [0,2,0,0,0,0|0,0,1]=3 5257 B8R1.18 CC1CC(=O)C(Br)=C1 Amb24723854 [0,2,0,0,0,0|1,0,1]=4 5258 B8R1.18 CC1CC(=O)C(O)=C1 Amb25370657 [0,2,0,0,0,0|1,0,1]=4 5259 B8R1.18 CC1CC(=O)CN1C Amb20669273 [0,2,0,0,0,0|2,0,0]=4 5260 B8R1.18 CC1CC(=O)N(C1)C Amb10068268 [0,2,0,0,0,0|1,0,0]=3 5261 B8R1.18 CC1CC(=O)N(N1)C Amb16233050 [0,2,0,0,0,0|2,0,0]=4 5262 B8R1.18 CC1CC(=O)NC1=N Amb25039964 [0,2,0,0,0,0|1,0,1]=4 5263 B8R1.18 CC1CC(C)NC1=O Amb24698782 [0,2,0,0,0,0|1,0,0]=3 5264 B8R1.18 CC1CC(C)OC1O Amb25226270 [0,2,0,0,0,0|0,0,2]=4 5265 B8R1.18 CC1CC(Cl)C(O)O1 Amb25124830 [0,2,0,0,0,0|0,0,2]=4 5266 B8R1.18 CC1CC(O)C(=O)C1 Amb25143497 [0,2,0,0,0,0|1,0,0]=3 5267 B8R1.18 CC1CC(O)CC1=O Amb24752493 [0,2,0,0,0,0|1,0,0]=3 5268 B8R1.18 CC1CC(O)NC1=O Amb24377025 [0,2,0,0,0,0|1,0,0]=3 5269 B8R1.18 CC1CC(O)OC1=O Amb25283481 [0,2,0,0,0,0|0,0,0]=2 5270 B8R1.18 CC1CN(C)CC1=O Amb20622328 [0,2,0,0,0,0|2,0,0]=4 5271 B8R1.18 CC1CN(C)OC1O Amb25129773 [0,2,0,0,0,0|2,0,0]=4 5272 B8R1.18 CC1C[C@@H](N)C(=O)O1 Amb24622840 [0,2,0,0,0,0|0,0,0]=2 5273 B8R1.18 CC1NC(=O)CC1=O Amb23598276 [0,2,0,0,0,0|1,0,1]=4 5274 B8R1.18 CC1NC(=O)CC1C Amb20623595 [0,2,0,0,0,0|1,0,0]=3 5275 B8R1.18 CC1NC(=O)CC1S Amb24441528 [0,2,0,0,0,0|1,0,0]=3 5276 B8R1.18 CC1NC(=O)OC1=O Amb22236022 [0,2,0,0,0,0|1,0,1]=4 5277 B8R1.18 CC1NC(=S)CC1C Amb24532333 [0,2,0,0,0,0|1,1,0]=4 5278 B8R1.18 CC1NC(C)C(=O)N1 Amb24481399 [0,2,0,0,0,0|2,0,0]=4 5279 B8R1.18 CC1OC(=O)CC1Cl Amb24483262 [0,2,0,0,0,0|0,0,0]=2 5280 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,2,0,0,0,0|1,0,1]=4 5281 B8R1.18 CC1OC(=O)NC1C Amb25747248 [0,2,0,0,0,0|1,0,0]=3 5282 B8R1.18 CC1OC(=O)NC1N Amb24568318 [0,2,0,0,0,0|1,0,0]=3 5283 B8R1.18 CC1OC(C)CC1Cl Amb24699077 [0,2,0,0,0,0|1,0,1]=4 5284 B8R1.18 CC1OC(C)CC1N Amb24619349 [0,2,0,0,0,0|1,0,1]=4 5285 B8R1.18 CC1OC(C)CC1O Amb25238640 [0,2,0,0,0,0|1,0,1]=4 5286 B8R1.18 CC1OC(C)CC1S Amb22234723 [0,2,0,0,0,0|1,0,1]=4 5287 B8R1.18 CC1OC(N)=NC1C Amb24452888 [0,2,0,0,0,0|2,0,0]=4 5288 B8R1.18 CC1OC(O)CC1O Amb25696669 [0,2,0,0,0,0|0,0,2]=4 5289 B8R1.18 CC1SC(C)CC1=O Amb25735260 [0,2,0,0,0,0|2,0,0]=4 5290 B8R1.18 CC1SC(Cl)NC1=O Amb25360261 [0,2,0,0,0,0|2,0,0]=4 5291 B8R1.18 CC1SC(N)NC1=O Amb25837106 [0,2,0,0,0,0|2,0,0]=4 5292 B8R1.18 CC=1CC(C)C(=O)C1 Amb24647798 [0,2,0,0,0,0|1,0,1]=4 5293 B8R1.18 CC=1CC(O)CC1C Amb25854391 [0,2,0,0,0,0|2,0,0]=4 5294 B8R1.18 CC=1C[C@@H](C)C(=O)C1 Amb24686437 [0,2,0,0,0,0|1,0,1]=4 5295 B8R1.18 CC=1OC(=O)CC1Br Amb25101107 [0,2,0,0,0,0|0,0,2]=4 5296 B8R1.18 CN1CC(=O)CC1=O Amb18833080 [0,2,0,0,0,0|1,0,1]=4 5297 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [0,2,0,0,0,0|1,0,1]=4 5298 B8R1.18 CN1CC(N)CC1=O Amb19373494 [0,2,0,0,0,0|1,0,0]=3 5299 B8R1.18 CN1CC(O)CC1=O Amb22059466 [0,2,0,0,0,0|1,0,0]=3 5300 B8R1.18 CN1CS(=O)CC1=O Amb24579772 [0,2,0,0,0,0|2,0,0]=4 5301 B8R1.18 CN1C[C@@H](N)CC1=O Amb24401527 [0,2,0,0,0,0|1,0,0]=3 5302 B8R1.18 CN1C[C@H](O)CC1=O Amb25762416 [0,2,0,0,0,0|1,0,0]=3 5303 B8R1.18 C[C@@H]1CC(=O)C(Cl)=C1 Amb25821459 [0,2,0,0,0,0|1,0,1]=4 5304 B8R1.18 C[C@@H]1CC(=O)C[C@@H]1C Amb22230244 [0,2,0,0,0,0|1,0,0]=3 5305 B8R1.18 C[C@@H]1CC(=O)C[C@H]1C Amb24470272 [0,2,0,0,0,0|1,0,0]=3 5306 B8R1.18 C[C@@H]1CC(=O)N(C)C1 Amb24182041 [0,2,0,0,0,0|1,0,0]=3 5307 B8R1.18 C[C@@H]1CC(=O)NC1=O Amb25709913 [0,2,0,0,0,0|1,0,1]=4 5308 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,2,0,0,0,0|0,0,1]=3 5309 B8R1.18 C[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25288126 [0,2,0,0,0,0|0,0,0]=2 5310 B8R1.18 C[C@@H]1C[C@@H](O)C(=C)O1 Amb25284313 [0,2,0,0,0,0|1,0,0]=3 5311 B8R1.18 C[C@@H]1C[C@@H](O)C(=O)O1 Amb24615353 [0,2,0,0,0,0|0,0,0]=2 5312 B8R1.18 C[C@@H]1C[C@H](Cl)C(=O)O1 Amb24596085 [0,2,0,0,0,0|0,0,0]=2 5313 B8R1.18 C[C@@H]1C[C@H](Cl)[C@@H](O)O1 Amb24739817 [0,2,0,0,0,0|0,0,2]=4 5314 B8R1.18 C[C@@H]1C[C@H](N)C(=O)O1 Amb24760900 [0,2,0,0,0,0|0,0,0]=2 5315 B8R1.18 C[C@@H]1C[C@H](O)C(=O)O1 Amb24519690 [0,2,0,0,0,0|0,0,0]=2 5316 B8R1.18 C[C@@H]1C[C@H](O)CC1=C Amb25257138 [0,2,0,0,0,0|2,0,0]=4 5317 B8R1.18 C[C@@H]1C[C@H](O)CC1=O Amb25236934 [0,2,0,0,0,0|1,0,0]=3 5318 B8R1.18 C[C@@H]1NC(=O)CC1=O Amb18833079 [0,2,0,0,0,0|1,0,1]=4 5319 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O Amb24760967 [0,2,0,0,0,0|1,0,0]=3 5320 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1S Amb24586770 [0,2,0,0,0,0|1,0,0]=3 5321 B8R1.18 C[C@@H]1NC(=O)C[C@H]1C Amb24550340 [0,2,0,0,0,0|1,0,0]=3 5322 B8R1.18 C[C@@H]1NC(=O)C[C@H]1O Amb25203404 [0,2,0,0,0,0|1,0,0]=3 5323 B8R1.18 C[C@@H]1NC(=O)C[C@H]1S Amb24685136 [0,2,0,0,0,0|1,0,0]=3 5324 B8R1.18 C[C@@H]1NC(=O)N[C@@H]1C Amb25791194 [0,2,0,0,0,0|2,0,0]=4 5325 B8R1.18 C[C@@H]1NC(=S)OC1=O Amb24649827 [0,2,0,0,0,0|1,0,1]=4 5326 B8R1.18 C[C@@H]1OC(=N)N[C@@H]1C Amb24523145 [0,2,0,0,0,0|2,0,0]=4 5327 B8R1.18 C[C@@H]1OC(=O)C=C1O Amb25087875 [0,2,0,0,0,0|0,0,2]=4 5328 B8R1.18 C[C@@H]1OC(=O)CC1O Amb25332464 [0,2,0,0,0,0|0,0,0]=2 5329 B8R1.18 C[C@@H]1OC(=O)C[C@H]1C Amb24583426 [0,2,0,0,0,0|0,0,0]=2 5330 B8R1.18 C[C@@H]1OC(=O)C[C@H]1O Amb25328533 [0,2,0,0,0,0|0,0,0]=2 5331 B8R1.18 C[C@@H]1OC(=O)N[C@@H]1C Amb24601098 [0,2,0,0,0,0|1,0,0]=3 5332 B8R1.18 C[C@@H]1OC(=O)N[C@H]1C Amb24516825 [0,2,0,0,0,0|1,0,0]=3 5333 B8R1.18 C[C@@H]1OC(=S)N[C@H]1C Amb24746694 [0,2,0,0,0,0|1,1,0]=4 5334 B8R1.18 C[C@@H]1OC(C)C[C@H]1O Amb25176118 [0,2,0,0,0,0|1,0,1]=4 5335 B8R1.18 C[C@@H]1OC(O)C[C@H]1O Amb25177050 [0,2,0,0,0,0|0,0,2]=4 5336 B8R1.18 C[C@@H]1O[C@@H](O)C[C@H]1C Amb24597062 [0,2,0,0,0,0|0,0,2]=4 5337 B8R1.18 C[C@@H]1SC(=O)N[C@@H]1C Amb24606920 [0,2,0,0,0,0|1,1,0]=4 5338 B8R1.18 C[C@H]1C[C@@H](C)C(=O)C1 Amb24643266 [0,2,0,0,0,0|1,0,0]=3 5339 B8R1.18 C[C@H]1C[C@@H](O)C(=S)N1 Amb25259817 [0,2,0,0,0,0|1,1,0]=4 5340 B8R1.18 C[C@H]1C[C@H](Br)C(=O)O1 Amb25322131 [0,2,0,0,0,0|0,0,0]=2 5341 B8R1.18 C[C@H]1C[C@H](C)NC1=O Amb25174475 [0,2,0,0,0,0|1,0,0]=3 5342 B8R1.18 C[C@H]1C[C@H](N)C(=O)O1 Amb24538781 [0,2,0,0,0,0|0,0,0]=2 5343 B8R1.18 C[C@H]1OC(=O)C[C@@H]1C Amb25245321 [0,2,0,0,0,0|0,0,0]=2 5344 B8R1.18 C[C@H]1OC(=O)C[C@@H]1O Amb24577403 [0,2,0,0,0,0|0,0,0]=2 5345 B8R1.18 C[C@H]1OC(=O)C[C@H]1N Amb24619491 [0,2,0,0,0,0|0,0,0]=2 5346 B8R1.18 C[C@H]1OC(C)C[C@H]1O Amb24588218 [0,2,0,0,0,0|1,0,1]=4 5347 B8R1.18 C[C@H]1OC(O)C[C@@H]1C Amb24616560 [0,2,0,0,0,0|0,0,2]=4 5348 B8R1.18 C[C@H]1O[C@H](C)CC1=O Amb25744762 [0,2,0,0,0,0|2,0,0]=4 5349 B8R1.18 ClC1CC(Cl)C(Cl)O1 Amb17939999 [0,2,0,0,0,0|1,0,1]=4 5350 B8R1.18 NC1CC(=O)OC1=O Amb19929452 [0,2,0,0,0,0|0,0,1]=3 5351 B8R1.18 NC1CC(=O)OC1O Amb24745298 [0,2,0,0,0,0|0,0,0]=2 5352 B8R1.18 N[C@@H]1CC(=O)NC1=O Amb18033835 [0,2,0,0,0,0|1,0,1]=4 5353 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,2,0,0,0,0|0,0,1]=3 5354 B8R1.18 O=C1C=C(C(C1)C)C Amb16191977 [0,2,0,0,0,0|1,0,1]=4 5355 B8R1.18 O=C1CC(C(=O)N1)C Amb10609734 [0,2,0,0,0,0|1,0,1]=4 5356 B8R1.18 O=C1CC(Cl)C(Cl)=C1 Amb25101609 [0,2,0,0,0,0|1,0,1]=4 5357 B8R1.18 O=C1C[C@@H](C(=O)N1)N Amb17134612 [0,2,0,0,0,0|1,0,1]=4 5358 B8R1.18 O=C1C[C@@H](Cl)[C@H](Cl)C1 Amb25139007 [0,2,0,0,0,0|1,0,0]=3 5359 B8R1.18 O=C1C[C@H](Cl)[C@@H](Cl)C1 Amb24515104 [0,2,0,0,0,0|1,0,0]=3 5360 B8R1.18 O=C1NC(=O)CC1Br Amb25226801 [0,2,0,0,0,0|1,0,1]=4 5361 B8R1.18 O=C1NC(=O)CC1S Amb25325951 [0,2,0,0,0,0|1,0,1]=4 5362 B8R1.18 O=C1OC(=O)CC1Cl Amb24677749 [0,2,0,0,0,0|0,0,1]=3 5363 B8R1.18 O=C1OC(=O)C[C@@H]1Br Amb24558394 [0,2,0,0,0,0|0,0,1]=3 5364 B8R1.18 O=C1OC(=O)C[C@@H]1Cl Amb25837364 [0,2,0,0,0,0|0,0,1]=3 5365 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,2,0,0,0,0|1,0,0]=3 5366 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,2,0,0,0,0|1,0,0]=3 5367 B8R1.18 OC1=CC(O)CC1=O Amb24736347 [0,2,0,0,0,0|1,0,1]=4 5368 B8R1.18 OC1=CC(O)OC1=O Amb25144696 [0,2,0,0,0,0|0,0,2]=4 5369 B8R1.18 OC1C=C(Br)C(=O)O1 Amb24464564 [0,2,0,0,0,0|0,0,2]=4 5370 B8R1.18 OC1CC(=O)CC1=O Amb24330382 [0,2,0,0,0,0|1,0,1]=4 5371 B8R1.18 OC1CC(=O)CC1O Amb25834386 [0,2,0,0,0,0|1,0,0]=3 5372 B8R1.18 OC1CC(=O)N(Br)C1 Amb25215402 [0,2,0,0,0,0|1,0,0]=3 5373 B8R1.18 OC1CC(O)C=C1Br Amb24543382 [0,2,0,0,0,0|2,0,0]=4 5374 B8R1.18 OC1CP(=O)CC1O Amb24420287 [0,2,0,0,0,0|2,0,0]=4 5375 B8R1.18 OC1OC(=O)C=C1Br Amb22490504 [0,2,0,0,0,0|0,0,2]=4 5376 B8R1.18 O[C@@H]1CC(=O)OC1=O Amb25142904 [0,2,0,0,0,0|0,0,1]=3 5377 B8R1.18 O[C@H]1CC(=O)NC1=O Amb24458089 [0,2,0,0,0,0|1,0,1]=4 5378 B8R1.50 BrC1=C(Br)C(=O)OC1 Amb10067289 [0,2,0,0,0,0|0,0,2]=4 5379 B8R1.50 BrC1=C(C)CCC1=O Amb10067495 [0,2,0,0,0,0|1,0,1]=4 5380 B8R1.50 BrC1C(=O)CCC1=O Amb10975590 [0,2,0,0,0,0|1,0,1]=4 5381 B8R1.50 BrC1C(=O)COC1=O Amb17594578 [0,2,0,0,0,0|0,0,1]=3 5382 B8R1.50 C=C1C(=O)CCC1=O Amb25128928 [0,2,0,0,0,0|1,0,1]=4 5383 B8R1.50 C=C1C(N)COC1=O Amb18641720 [0,2,0,0,0,0|0,0,1]=3 5384 B8R1.50 C=C1[C@@H](N)COC1=O Amb24744705 [0,2,0,0,0,0|0,0,1]=3 5385 B8R1.50 C=C1[C@@H](O)CCC1O Amb25847884 [0,2,0,0,0,0|2,0,0]=4 5386 B8R1.50 C=C1[C@@H](O)COC1=O Amb24435902 [0,2,0,0,0,0|0,0,1]=3 5387 B8R1.50 CC1=CCC(O)C1O Amb25107667 [0,2,0,0,0,0|2,0,0]=4 5388 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,2,0,0,0,0|1,0,1]=4 5389 B8R1.50 CC1C(=O)CCN1C Amb24453852 [0,2,0,0,0,0|2,0,0]=4 5390 B8R1.50 CC1C(C)CNC1=N Amb24481323 [0,2,0,0,0,0|2,0,0]=4 5391 B8R1.50 CC1C(C)CNC1=O Amb24334186 [0,2,0,0,0,0|1,0,0]=3 5392 B8R1.50 CC1C(C)SCC1=O Amb24687046 [0,2,0,0,0,0|2,0,0]=4 5393 B8R1.50 CC1C(N)COC1=O Amb18641824 [0,2,0,0,0,0|0,0,0]=2 5394 B8R1.50 CC1C(O)CNC1=O Amb24441657 [0,2,0,0,0,0|1,0,0]=3 5395 B8R1.50 CC1C(O)COC1=O Amb25357313 [0,2,0,0,0,0|0,0,0]=2 5396 B8R1.50 CC1C(O)OCC1C Amb25802956 [0,2,0,0,0,0|0,0,2]=4 5397 B8R1.50 CC1C=CC(=O)C1C Amb25284741 [0,2,0,0,0,0|1,0,1]=4 5398 B8R1.50 CC1C=CC(=O)C1Cl Amb24634012 [0,2,0,0,0,0|1,0,1]=4 5399 B8R1.50 CC1CC=C(C)C1=O Amb17778666 [0,2,0,0,0,0|1,0,1]=4 5400 B8R1.50 CC1CCC(=O)C1=O Amb22233560 [0,2,0,0,0,0|1,0,0]=3 5401 B8R1.50 CC1CCC(=O)C1Br Amb24356701 [0,2,0,0,0,0|1,0,0]=3 5402 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,2,0,0,0,0|1,0,0]=3 5403 B8R1.50 CC1CCC(=O)C1O Amb25773264 [0,2,0,0,0,0|1,0,0]=3 5404 B8R1.50 CC1CCC(=O)N1C Amb15693449 [0,2,0,0,0,0|1,0,0]=3 5405 B8R1.50 CC1CNC(=O)C1Cl Amb24610736 [0,2,0,0,0,0|1,0,0]=3 5406 B8R1.50 CC1CNC(=S)C1O Amb24482492 [0,2,0,0,0,0|1,1,0]=4 5407 B8R1.50 CC1COC(=O)C1Cl Amb25240615 [0,2,0,0,0,0|0,0,0]=2 5408 B8R1.50 CC1COC(=O)C1N Amb24482307 [0,2,0,0,0,0|0,0,0]=2 5409 B8R1.50 CC1COC(=S)N1C Amb24524261 [0,2,0,0,0,0|1,1,0]=4 5410 B8R1.50 CC1CSC(=O)C1N Amb25169595 [0,2,0,0,0,0|0,1,0]=3 5411 B8R1.50 CC1NCC(=O)N1C Amb24742108 [0,2,0,0,0,0|2,0,0]=4 5412 B8R1.50 CC1NCN(C)C1=O Amb18641804 [0,2,0,0,0,0|2,0,0]=4 5413 B8R1.50 CC1NNC(=O)C1O Amb25739720 [0,2,0,0,0,0|2,0,0]=4 5414 B8R1.50 CC1OCC(=O)C1N Amb24601568 [0,2,0,0,0,0|2,0,0]=4 5415 B8R1.50 CC1OCC(O)C1O Amb25044548 [0,2,0,0,0,0|1,0,1]=4 5416 B8R1.50 CC1ONC(=O)C1N Amb25063865 [0,2,0,0,0,0|2,0,0]=4 5417 B8R1.50 CC1SCC(C)C1=O Amb22055131 [0,2,0,0,0,0|2,0,0]=4 5418 B8R1.50 CC1SOC(=O)C1N Amb24665733 [0,2,0,0,0,0|1,0,0]=3 5419 B8R1.50 CC=1C(=O)OCC1C Amb25859061 [0,2,0,0,0,0|0,0,2]=4 5420 B8R1.50 CC=1C(O)CCC1Cl Amb25143573 [0,2,0,0,0,0|2,0,0]=4 5421 B8R1.50 CC=1CCC(=O)C1C Amb22351730 [0,2,0,0,0,0|1,0,1]=4 5422 B8R1.50 CC=1CCC(C)C1C Amb25725570 [0,2,0,0,0,0|2,0,0]=4 5423 B8R1.50 CC=1CC[C@@H](O)C1Br Amb25260075 [0,2,0,0,0,0|2,0,0]=4 5424 B8R1.50 CC=1COC(=O)C1N Amb25025754 [0,2,0,0,0,0|0,0,2]=4 5425 B8R1.50 CC=1COC(=O)C1O Amb23571854 [0,2,0,0,0,0|0,0,2]=4 5426 B8R1.50 CN1C(=O)CCC1=S Amb24064848 [0,2,0,0,0,0|1,0,1]=4 5427 B8R1.50 CN1C(=O)COC1=O Amb21927685 [0,2,0,0,0,0|1,0,1]=4 5428 B8R1.50 CN1C(Cl)CCC1=O Amb25697191 [0,2,0,0,0,0|1,0,0]=3 5429 B8R1.50 CN1C(O)CNC1=O Amb25131298 [0,2,0,0,0,0|2,0,0]=4 5430 B8R1.50 CN1C(O)CSC1=O Amb25295689 [0,2,0,0,0,0|1,1,0]=4 5431 B8R1.50 CN1CCC(=C)C1=O Amb24457267 [0,2,0,0,0,0|1,0,1]=4 5432 B8R1.50 CN1CCC(=O)C1=O Amb24183817 [0,2,0,0,0,0|1,0,1]=4 5433 B8R1.50 CN1CCC(Br)C1=O Amb19514590 [0,2,0,0,0,0|1,0,0]=3 5434 B8R1.50 CN1CCC(N)C1=O Amb22491599 [0,2,0,0,0,0|1,0,0]=3 5435 B8R1.50 CN1CCC(O)C1=O Amb20622738 [0,2,0,0,0,0|1,0,0]=3 5436 B8R1.50 CN1CCC(S)C1=O Amb24333654 [0,2,0,0,0,0|1,0,0]=3 5437 B8R1.50 CN1CCN(C1=O)C Amb1195982 [0,2,0,0,0,0|2,0,0]=4 5438 B8R1.50 CN1CCN(N)C1=O Amb24643625 [0,2,0,0,0,0|2,0,0]=4 5439 B8R1.50 CN1CC[C@@H](N)C1=O Amb25303747 [0,2,0,0,0,0|1,0,0]=3 5440 B8R1.50 CN1CC[C@H](O)C1=O Amb24400512 [0,2,0,0,0,0|1,0,0]=3 5441 B8R1.50 CN1OC[C@@H](N)C1=O Amb25703607 [0,2,0,0,0,0|2,0,0]=4 5442 B8R1.50 CN1SCC(N)C1=O Amb25230901 [0,2,0,0,0,0|2,0,0]=4 5443 B8R1.50 CN1[C@H](O)CCC1=O Amb24684724 [0,2,0,0,0,0|1,0,0]=3 5444 B8R1.50 C[C-]1C(=O)CCC1=O Amb24458437 [0,2,0,0,0,0|1,0,1]=4 5445 B8R1.50 C[C@@H]1C(=O)CCN1C Amb18833064 [0,2,0,0,0,0|2,0,0]=4 5446 B8R1.50 C[C@@H]1C(O)OC[C@@H]1C Amb24735043 [0,2,0,0,0,0|0,0,2]=4 5447 B8R1.50 C[C@@H]1CCC(=O)C1=O Amb24357250 [0,2,0,0,0,0|1,0,0]=3 5448 B8R1.50 C[C@@H]1CCC(=O)C1C Amb25834175 [0,2,0,0,0,0|1,0,0]=3 5449 B8R1.50 C[C@@H]1CCC(=O)[C@H]1Br Amb24706631 [0,2,0,0,0,0|1,0,0]=3 5450 B8R1.50 C[C@@H]1CC[C@@H](C)C1=O Amb25293431 [0,2,0,0,0,0|1,0,0]=3 5451 B8R1.50 C[C@@H]1COC(=O)[C@H]1N Amb25216668 [0,2,0,0,0,0|0,0,0]=2 5452 B8R1.50 C[C@@H]1NNC(=O)[C@@H]1O Amb24599440 [0,2,0,0,0,0|2,0,0]=4 5453 B8R1.50 C[C@@H]1OC[C@H](O)[C@@H]1O Amb25284508 [0,2,0,0,0,0|1,0,1]=4 5454 B8R1.50 C[C@@H]1OC[C@H](O)[C@H]1O Amb25176889 [0,2,0,0,0,0|1,0,1]=4 5455 B8R1.50 C[C@@H]1[C@@H](O)COC1=O Amb25176469 [0,2,0,0,0,0|0,0,0]=2 5456 B8R1.50 C[C@H]1C(=O)CCN1C Amb25762428 [0,2,0,0,0,0|2,0,0]=4 5457 B8R1.50 C[C@H]1C=CC(=O)[C@@H]1O Amb25024971 [0,2,0,0,0,0|1,0,1]=4 5458 B8R1.50 C[C@H]1C=CC(=O)[C@H]1C Amb25373043 [0,2,0,0,0,0|1,0,1]=4 5459 B8R1.50 C[C@H]1C=CC(=O)[C@H]1Cl Amb25348042 [0,2,0,0,0,0|1,0,1]=4 5460 B8R1.50 C[C@H]1CCC(=O)C1=C Amb24737469 [0,2,0,0,0,0|1,0,0]=3 5461 B8R1.50 C[C@H]1CCC(=O)[C@H]1Br Amb25286608 [0,2,0,0,0,0|1,0,0]=3 5462 B8R1.50 C[C@H]1CCC(=O)[C@H]1C Amb24557180 [0,2,0,0,0,0|1,0,0]=3 5463 B8R1.50 C[C@H]1CCC(=O)[C@H]1Cl Amb24544320 [0,2,0,0,0,0|1,0,0]=3 5464 B8R1.50 C[C@H]1CNC(=S)[C@H]1O Amb24581277 [0,2,0,0,0,0|1,1,0]=4 5465 B8R1.50 C[C@H]1COC(=O)[C@@H]1N Amb25339475 [0,2,0,0,0,0|0,0,0]=2 5466 B8R1.50 C[C@H]1COC(=O)[C@@H]1O Amb25320667 [0,2,0,0,0,0|0,0,0]=2 5467 B8R1.50 C[C@H]1OCC(=O)[C@@H]1O Amb25026255 [0,2,0,0,0,0|2,0,0]=4 5468 B8R1.50 C[C@H]1OC[C@@H](O)[C@@H]1O Amb25239252 [0,2,0,0,0,0|1,0,1]=4 5469 B8R1.50 C[C@H]1ONC(=O)[C@H]1N Amb24514974 [0,2,0,0,0,0|2,0,0]=4 5470 B8R1.50 C[C@H]1[C@@H](C)CNC1=O Amb24761480 [0,2,0,0,0,0|1,0,0]=3 5471 B8R1.50 C[C@H]1[C@H](N)COC1=O Amb24514746 [0,2,0,0,0,0|0,0,0]=2 5472 B8R1.50 C[C@H]1[C@H](O)CCC1=O Amb24631662 [0,2,0,0,0,0|1,0,0]=3 5473 B8R1.50 C[C@H]1[C@H](O)OC[C@H]1C Amb24620807 [0,2,0,0,0,0|0,0,2]=4 5474 B8R1.50 NC1C(N)CNC1=O Amb18641832 [0,2,0,0,0,0|1,0,0]=3 5475 B8R1.50 NC1C(O)CNC1=O Amb24374633 [0,2,0,0,0,0|1,0,0]=3 5476 B8R1.50 NC1C(O)COC1=O Amb25746355 [0,2,0,0,0,0|0,0,0]=2 5477 B8R1.50 NC1CNC(=O)C1O Amb24481564 [0,2,0,0,0,0|1,0,0]=3 5478 B8R1.50 NC1COC(=O)C1O Amb24724728 [0,2,0,0,0,0|0,0,0]=2 5479 B8R1.50 NC=1C(=O)OCC1Br Amb24553799 [0,2,0,0,0,0|0,0,2]=4 5480 B8R1.50 NC=1C(=O)OCC1Cl Amb25378846 [0,2,0,0,0,0|0,0,2]=4 5481 B8R1.50 NN1C(=O)CCC1=O Amb18641764 [0,2,0,0,0,0|1,0,1]=4 5482 B8R1.50 NN1C(=O)CCC1=O Amb24323275 [0,2,0,0,0,0|1,0,1]=4 5483 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,2,0,0,0,0|1,0,0]=3 5484 B8R1.50 N[C@@H]1[C@@H](O)CNC1=O Amb24612410 [0,2,0,0,0,0|1,0,0]=3 5485 B8R1.50 N[C@@H]1[C@H](O)COC1=O Amb25260781 [0,2,0,0,0,0|0,0,0]=2 5486 B8R1.50 N[C@@H]1[C@H](O)COC1O Amb25174437 [0,2,0,0,0,0|0,0,2]=4 5487 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,2,0,0,0,0|1,0,0]=3 5488 B8R1.50 N[C@H]1CNC(=O)[C@@H]1O Amb24612411 [0,2,0,0,0,0|1,0,0]=3 5489 B8R1.50 N[C@H]1[C@@H](O)COC1=O Amb24697759 [0,2,0,0,0,0|0,0,0]=2 5490 B8R1.50 N[C@H]1[C@H](N)CNC1=O Amb24566659 [0,2,0,0,0,0|1,0,0]=3 5491 B8R1.50 N[C@H]1[C@H](O)COC1O Amb25366114 [0,2,0,0,0,0|0,0,2]=4 5492 B8R1.50 O=C1C(=O)COC1=O Amb24364125 [0,2,0,0,0,0|0,0,2]=4 5493 B8R1.50 O=C1C(Br)COC1=O Amb25760646 [0,2,0,0,0,0|0,0,1]=3 5494 B8R1.50 O=C1C(C)CCN1C Amb10068267 [0,2,0,0,0,0|1,0,0]=3 5495 B8R1.50 O=C1C(Cl)CCC1Cl Amb25102551 [0,2,0,0,0,0|1,0,0]=3 5496 B8R1.50 O=C1C(N)CCN1C Amb10607857 [0,2,0,0,0,0|1,0,0]=3 5497 B8R1.50 O=C1CCC(=O)C1F Amb24466994 [0,2,0,0,0,0|1,0,1]=4 5498 B8R1.50 O=C1CCC(=O)C1[Na] Amb25162789 [0,2,0,0,0,0|1,0,1]=4 5499 B8R1.50 O=C1OCC(Cl)=C1Cl Amb24551013 [0,2,0,0,0,0|0,0,2]=4 5500 B8R1.50 O=C1SSC(Cl)C1Cl Amb24693883 [0,2,0,0,0,0|1,1,0]=4 5501 B8R1.50 O=C1[C@@H](Cl)CC[C@@H]1Cl Amb25264929 [0,2,0,0,0,0|1,0,0]=3 5502 B8R1.50 OC1=C(O)CCC1=O Amb17593179 [0,2,0,0,0,0|1,0,1]=4 5503 B8R1.50 OC1C(=O)CCC1=O Amb24443990 [0,2,0,0,0,0|1,0,1]=4 5504 B8R1.50 OC1C(=O)COC1=O Amb25143349 [0,2,0,0,0,0|0,0,1]=3 5505 B8R1.50 OC1C(F)COC1=O Amb25831080 [0,2,0,0,0,0|0,0,0]=2 5506 B8R1.50 OC1C(O)COC1=O Amb22730078 [0,2,0,0,0,0|0,0,0]=2 5507 B8R1.50 OC1C(O)COC1O Amb24419997 [0,2,0,0,0,0|0,0,2]=4 5508 B8R1.50 OC1C=CC(=O)C1Br Amb24398644 [0,2,0,0,0,0|1,0,1]=4 5509 B8R1.50 OC1C=CC(=O)C1O Amb25285676 [0,2,0,0,0,0|1,0,1]=4 5510 B8R1.50 OC1CCC(=O)C1=O Amb24432188 [0,2,0,0,0,0|1,0,0]=3 5511 B8R1.50 OC1CCC(=O)C1O Amb24627902 [0,2,0,0,0,0|1,0,0]=3 5512 B8R1.50 OC1CCC(=O)N1C Amb17615583 [0,2,0,0,0,0|1,0,0]=3 5513 B8R1.50 OC1COC(=O)C1Br Amb24482051 [0,2,0,0,0,0|0,0,0]=2 5514 B8R1.50 OC1COC(=O)C1F Amb24529261 [0,2,0,0,0,0|0,0,0]=2 5515 B8R1.50 OC=1C(=O)CCC1Br Amb24677469 [0,2,0,0,0,0|1,0,1]=4 5516 B8R1.50 OC=1C(=O)OCC1O Amb23505710 [0,2,0,0,0,0|0,0,2]=4 5517 B8R1.50 OC=1CCC(=O)C1Br Amb25205766 [0,2,0,0,0,0|1,0,1]=4 5518 B8R1.50 OC=1CCC(=O)C1Cl Amb24378334 [0,2,0,0,0,0|1,0,1]=4 5519 B8R1.50 OC=1CCC(O)C1O Amb25745324 [0,2,0,0,0,0|1,0,1]=4 5520 B8R1.50 OC=1COC(=O)C1Cl Amb22360617 [0,2,0,0,0,0|0,0,2]=4 5521 B8R1.50 ON1C(=O)CCC1=O Amb1152089 [0,2,0,0,0,0|1,0,1]=4 5522 B8R1.50 O[C@@H]1C=CC(=O)[C@H]1Br Amb25273749 [0,2,0,0,0,0|1,0,1]=4 5523 B8R1.50 O[C@@H]1[C@@H](O)COC1=O Amb15692412 [0,2,0,0,0,0|0,0,0]=2 5524 B8R1.50 O[C@@H]1[C@@H](O)COC1O Amb24737731 [0,2,0,0,0,0|0,0,2]=4 5525 B8R1.50 O[C@@H]1[C@@H](O)CO[C@@H]1O Amb25271378 [0,2,0,0,0,0|0,0,2]=4 5526 B8R1.50 O[C@@H]1[C@H](O)COC1O Amb25280200 [0,2,0,0,0,0|0,0,2]=4 5527 B8R1.50 O[C@@H]1[C@H](O)CO[C@@H]1O Amb25176988 [0,2,0,0,0,0|0,0,2]=4 5528 B8R1.50 O[C@H]1COC(=O)[C@H]1Br Amb10067848 [0,2,0,0,0,0|0,0,0]=2 5529 B8R1.50 O[C@H]1[C@@H](O)CO[C@@H]1O Amb25235698 [0,2,0,0,0,0|0,0,2]=4 5530 B8R1.50 O[C@H]1[C@H](F)COC1=O Amb25356232 [0,2,0,0,0,0|0,0,0]=2 5531 B8R1.50 O[C@H]1[C@H](O)COC1=O Amb24609731 [0,2,0,0,0,0|0,0,0]=2 5532 B8R1.50 O[C@H]1[C@H](O)COC1O Amb24601100 [0,2,0,0,0,0|0,0,2]=4 5533 B8R1.50 O[C@H]1[C@H](O)CO[C@@H]1O Amb25176471 [0,2,0,0,0,0|0,0,2]=4 5534 B8R1.51 BrC1CCS(=O)(=O)C1 Amb2548437 [0,2,0,0,0,0|2,0,0]=4 5535 B8R1.51 CC1(C)C=CC(=O)O1 Amb24099124 [0,2,0,0,0,0|0,0,2]=4 5536 B8R1.51 CC1(C)CC(=O)CC1 Amb19516867 [0,2,0,0,0,0|1,0,0]=3 5537 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,2,0,0,0,0|2,0,0]=4 5538 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,2,0,0,0,0|2,0,0]=4 5539 B8R1.51 CC1(C)CC(=O)CS1 Amb21964095 [0,2,0,0,0,0|2,0,0]=4 5540 B8R1.51 CC1(C)CC(=O)NN1 Amb22289371 [0,2,0,0,0,0|2,0,0]=4 5541 B8R1.51 CC1(C)CC(N)CO1 Amb22434945 [0,2,0,0,0,0|1,0,1]=4 5542 B8R1.51 CC1(C)CC(O)CO1 Amb25296086 [0,2,0,0,0,0|1,0,1]=4 5543 B8R1.51 CC1(C)CCC(=N)N1 Amb25733497 [0,2,0,0,0,0|2,0,0]=4 5544 B8R1.51 CC1(C)CCC(=S)N1 Amb25827545 [0,2,0,0,0,0|1,1,0]=4 5545 B8R1.51 CC1(C)CN=C(N)C1 Amb24568278 [0,2,0,0,0,0|2,0,0]=4 5546 B8R1.51 CC1(C)CN=C(N)O1 Amb25720624 [0,2,0,0,0,0|2,0,0]=4 5547 B8R1.51 CC1(C)COC(=O)C1 Amb22284870 [0,2,0,0,0,0|0,0,0]=2 5548 B8R1.51 CC1(C)COC(=O)N1 Amb19516997 [0,2,0,0,0,0|1,0,0]=3 5549 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,2,0,0,0,0|1,0,0]=3 5550 B8R1.51 CC1(C)COC(Br)=N1 Amb25185353 [0,2,0,0,0,0|2,0,0]=4 5551 B8R1.51 CC1(C)COC(N)=N1 Amb22732038 [0,2,0,0,0,0|2,0,0]=4 5552 B8R1.51 CC1(C)COC(O)C1 Amb24717478 [0,2,0,0,0,0|0,0,2]=4 5553 B8R1.51 CC1(C)CSC(=O)O1 Amb24357776 [0,2,0,0,0,0|1,0,0]=3 5554 B8R1.51 CC1(C)NC(=O)CO1 Amb25254094 [0,2,0,0,0,0|2,0,0]=4 5555 B8R1.51 CC1(F)CNC(=O)C1 Amb24454478 [0,2,0,0,0,0|1,0,0]=3 5556 B8R1.51 CC1(N)COC(=O)C1 Amb25288591 [0,2,0,0,0,0|0,0,0]=2 5557 B8R1.51 CC1(O)CC(=O)CC1 Amb25129578 [0,2,0,0,0,0|1,0,0]=3 5558 B8R1.51 CC1(O)CCC(=O)N1 Amb24483013 [0,2,0,0,0,0|1,0,0]=3 5559 B8R1.51 CC1(O)CCC(=O)O1 Amb22338334 [0,2,0,0,0,0|0,0,0]=2 5560 B8R1.51 CC1CCS(=O)(=O)C1 Amb2548451 [0,2,0,0,0,0|2,0,0]=4 5561 B8R1.51 CC1CCS(=O)(=O)N1 Amb24556783 [0,2,0,0,0,0|2,0,0]=4 5562 B8R1.51 CC1CNS(=O)(=O)C1 Amb24117862 [0,2,0,0,0,0|2,0,0]=4 5563 B8R1.51 CC1COS(=O)(=O)O1 Amb17772236 [0,2,0,0,0,0|2,0,0]=4 5564 B8R1.51 CP1(=O)CC(=O)CC1 Amb25231314 [0,2,0,0,0,0|2,0,0]=4 5565 B8R1.51 CP1(=O)CCC(=O)O1 Amb22228817 [0,2,0,0,0,0|1,0,0]=3 5566 B8R1.51 CP1(=S)CC(=O)CC1 Amb24388618 [0,2,0,0,0,0|2,0,0]=4 5567 B8R1.51 C[C@@H]1COS(=O)(=O)O1 Amb22736783 [0,2,0,0,0,0|2,0,0]=4 5568 B8R1.51 C[C@@]1(O)CNC(=O)C1 Amb24672065 [0,2,0,0,0,0|1,0,0]=3 5569 B8R1.51 C[N+]1(C)CC(=O)CC1 Amb25735729 [0,2,0,0,0,0|2,0,0]=4 5570 B8R1.51 C[N+]1(C)CCC(O)O1 Amb25721019 [0,2,0,0,0,0|2,0,0]=4 5571 B8R1.51 ClC1CCS(=O)(=O)C1 Amb2505054 [0,2,0,0,0,0|2,0,0]=4 5572 B8R1.51 NC1CCS(=O)(=O)C1 Amb1080886 [0,2,0,0,0,0|2,0,0]=4 5573 B8R1.51 NC1CCS(=O)(=O)C1 Amb1152771 [0,2,0,0,0,0|2,0,0]=4 5574 B8R1.51 NC1CC[S+]([O-])(=O)C1 Amb17726901 [0,2,0,0,0,0|2,0,0]=4 5575 B8R1.51 NC1COS(=O)(=O)C1 Amb24548196 [0,2,0,0,0,0|1,0,0]=3 5576 B8R1.51 NC1CP(O)(=O)CC1 Amb25231215 [0,2,0,0,0,0|2,0,0]=4 5577 B8R1.51 NC1CS(=O)(=O)CC1 Amb22345691 [0,2,0,0,0,0|2,0,0]=4 5578 B8R1.51 N[C@@H]1COS(=O)(=O)C1 Amb24740749 [0,2,0,0,0,0|1,0,0]=3 5579 B8R1.51 N[C@@H]1CS(=O)(=O)CC1 Amb24563288 [0,2,0,0,0,0|2,0,0]=4 5580 B8R1.51 N[Pt]1(N)OCC(=O)O1 Amb22292028 [0,2,0,0,0,0|2,0,0]=4 5581 B8R1.51 O=C1C=CC(C1)(C)C Amb15693471 [0,2,0,0,0,0|1,0,1]=4 5582 B8R1.51 O=C1C=CC(Cl)(Cl)O1 Amb25758877 [0,2,0,0,0,0|0,0,2]=4 5583 B8R1.51 O=C1CC(F)(F)CC1 Amb21963547 [0,2,0,0,0,0|1,0,0]=3 5584 B8R1.51 O=C1CCC(O1)([2H])[2H] Amb17610398 [0,2,0,0,0,0|0,0,0]=2 5585 B8R1.51 O=C1CCS(=O)(=O)C1 Amb2373731 [0,2,0,0,0,0|2,0,0]=4 5586 B8R1.51 O=C1CCS(=O)(=O)N1 Amb25763419 [0,2,0,0,0,0|2,0,0]=4 5587 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,2,0,0,0,0|1,0,0]=3 5588 B8R1.51 O=C1COC(O1)(C)C Amb10601611 [0,2,0,0,0,0|1,0,0]=3 5589 B8R1.51 O=C1NCC(O1)(C)C Amb16202554 [0,2,0,0,0,0|1,0,0]=3 5590 B8R1.51 O=C1OCC(F)(F)O1 Amb24332045 [0,2,0,0,0,0|1,0,0]=3 5591 B8R1.51 O=S1(=O)CC(I)CC1 Amb19517046 [0,2,0,0,0,0|2,0,0]=4 5592 B8R1.51 O=S1(=O)CC([S-])CC1 Amb18526895 [0,2,0,0,0,0|2,0,0]=4 5593 B8R1.51 O=S1(=O)OCC(Cl)O1 Amb24483092 [0,2,0,0,0,0|2,0,0]=4 5594 B8R1.51 OC1CCS(=O)(=O)C1 Amb1068281 [0,2,0,0,0,0|2,0,0]=4 5595 B8R1.51 OC1CC[S+](=O)(C1)[O-] Amb10236942 [0,2,0,0,0,0|2,0,0]=4 5596 B8R1.51 OC1CSS(=O)(=O)C1 Amb25842205 [0,2,0,0,0,0|1,1,0]=4 5597 B8R1.51 O[C@@H]1CS(=O)(=O)CC1 Amb25837922 [0,2,0,0,0,0|2,0,0]=4 5598 B8R1.51 [18OH]C1CCS(=O)(=O)C1 Amb2548438 [0,2,0,0,0,0|2,0,0]=4 5599 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb2459236 [0,2,0,0,0,0|2,0,0]=4 5600 B8R1.19 CC1(C)CCC=N1=O Amb20621142 [0,2,0,0,0,0|2,0,0]=4 5601 B8R1.19 CC1(C)CCNC1=O Amb22757339 [0,2,0,0,0,0|1,0,0]=3 5602 B8R1.19 CC1(C)CCNC1=S Amb25265103 [0,2,0,0,0,0|1,1,0]=4 5603 B8R1.19 CC1(C)CCOC1O Amb24723620 [0,2,0,0,0,0|0,0,2]=4 5604 B8R1.19 CC1(C)CNNC1=O Amb25082285 [0,2,0,0,0,0|2,0,0]=4 5605 B8R1.19 CC1(C)CONC1=O Amb21927202 [0,2,0,0,0,0|2,0,0]=4 5606 B8R1.19 CC1(C)NCCC1=O Amb18833065 [0,2,0,0,0,0|2,0,0]=4 5607 B8R1.19 CC1(C)NCCC1=O Amb22264757 [0,2,0,0,0,0|2,0,0]=4 5608 B8R1.19 CC1(C)OCCC1Br Amb24467906 [0,2,0,0,0,0|1,0,1]=4 5609 B8R1.19 CC1(C)OCCC1Cl Amb24483274 [0,2,0,0,0,0|1,0,1]=4 5610 B8R1.19 CC1(C)OCCC1N Amb24459010 [0,2,0,0,0,0|1,0,1]=4 5611 B8R1.19 CC1(C)SCNC1=O Amb24540427 [0,2,0,0,0,0|2,0,0]=4 5612 B8R1.19 CC1(Cl)CC=CC1=O Amb25026512 [0,2,0,0,0,0|1,0,1]=4 5613 B8R1.19 CC1(Cl)SCCC1=O Amb24061574 [0,2,0,0,0,0|2,0,0]=4 5614 B8R1.19 CC1(N)CCCC1=O Amb24411535 [0,2,0,0,0,0|1,0,0]=3 5615 B8R1.19 CC1(N)CCNC1=O Amb18124254 [0,2,0,0,0,0|1,0,0]=3 5616 B8R1.19 CC1(N)CCOC1=O Amb24632713 [0,2,0,0,0,0|0,0,0]=2 5617 B8R1.19 CC1(O)CC=CC1=O Amb25177644 [0,2,0,0,0,0|1,0,1]=4 5618 B8R1.19 CC1(O)CCNC1=S Amb24376097 [0,2,0,0,0,0|1,1,0]=4 5619 B8R1.19 CC1(O)COCC1=O Amb24582470 [0,2,0,0,0,0|2,0,0]=4 5620 B8R1.19 CC1(O)OCCC1=O Amb25358718 [0,2,0,0,0,0|2,0,0]=4 5621 B8R1.19 CC1=NCCC1(C)C Amb24604420 [0,2,0,0,0,0|2,0,0]=4 5622 B8R1.19 CC1CCOS1(=O)=O Amb15692754 [0,2,0,0,0,0|1,0,0]=3 5623 B8R1.19 CC1OCCC1(C)N Amb24742098 [0,2,0,0,0,0|1,0,1]=4 5624 B8R1.19 CC1OCCC1(C)O Amb24726892 [0,2,0,0,0,0|1,0,1]=4 5625 B8R1.19 CN1CCCS1(=O)=O Amb19959571 [0,2,0,0,0,0|2,0,0]=4 5626 B8R1.19 C[C@@]1(O)OCCC1=O Amb25810093 [0,2,0,0,0,0|2,0,0]=4 5627 B8R1.19 C[C@@]1(O)OCC[C@@H]1Cl Amb24560208 [0,2,0,0,0,0|0,0,2]=4 5628 B8R1.19 C[C@]1(Cl)CC=CC1=O Amb25793034 [0,2,0,0,0,0|1,0,1]=4 5629 B8R1.19 O=C1CCCC1(Br)Br Amb25805410 [0,2,0,0,0,0|1,0,0]=3 5630 B8R1.19 O=C1CCCC1(Cl)Cl Amb24619625 [0,2,0,0,0,0|1,0,0]=3 5631 B8R1.19 O=C1NCCC1(C)C Amb13882829 [0,2,0,0,0,0|1,0,0]=3 5632 B8R1.19 O=C1NCCC1(F)F Amb25063682 [0,2,0,0,0,0|1,0,0]=3 5633 B8R1.19 O=C1NCCS1(=O)=O Amb24746629 [0,2,0,0,0,0|1,1,0]=4 5634 B8R1.19 O=C1OCCC1(Br)Br Amb25227692 [0,2,0,0,0,0|0,0,0]=2 5635 B8R1.19 O=C1OCCC1(C)C Amb10603955 [0,2,0,0,0,0|0,0,0]=2 5636 B8R1.19 O=S1(=O)CCCC1Cl Amb25856670 [0,2,0,0,0,0|2,0,0]=4 5637 B8R1.19 OC1CCCS1(=O)=O Amb25201898 [0,2,0,0,0,0|2,0,0]=4 5638 B8R1.19 OC1OCCC1(Cl)Cl Amb22229017 [0,2,0,0,0,0|0,0,2]=4 5639 B6R1.3 CCCC1CO1 Amb17771535 [0,0,1,1,0,0|1,0,1]=4 5640 B6R1.3 CCC[C@@H]1CO1 Amb25348803 [0,0,1,1,0,0|1,0,1]=4 5641 B6R1.3 CCC[C@H]1CO1 Amb10982593 [0,0,1,1,0,0|1,0,1]=4 5642 B6R1.8 CCC1CC1=O Amb24686409 [0,0,1,1,0,0|1,0,0]=3 5643 B6R1.8 CCC1OC1=O Amb24426509 [0,0,1,1,0,0|0,0,0]=2 5644 B6R1.8 CCC1OC1C Amb1141391 [0,0,1,1,0,0|1,0,1]=4 5645 B6R1.8 CCC1OC1Cl Amb24571837 [0,0,1,1,0,0|1,0,1]=4 5646 B6R1.8 CC[C@@H]1C[C@@H]1O Amb25026310 [0,0,1,1,0,0|1,0,1]=4 5647 B6R1.8 CC[C@@H]1O[C@@H]1Cl Amb25179251 [0,0,1,1,0,0|1,0,1]=4 5648 B6R1.9 CC1CC1(C)O Amb22157187 [0,0,1,1,0,0|1,0,1]=4 5649 B6R1.11 C=C(Br)C1CC1 Amb22583737 [0,0,1,1,0,0|2,0,0]=4 5650 B6R1.11 CC(=C)C1CC1 Amb25147701 [0,0,1,1,0,0|2,0,0]=4 5651 B6R1.11 CC(=O)C1CS1 Amb25373120 [0,0,1,1,0,0|2,0,0]=4 5652 B6R1.11 CC(=O)N1CC1 Amb17607538 [0,0,1,1,0,0|1,0,0]=3 5653 B6R1.11 CC(=O)[C@H]1CO1 Amb24628197 [0,0,1,1,0,0|2,0,0]=4 5654 B6R1.11 C[C@@H](C1CC1)O Amb13952945 [0,0,1,1,0,0|1,0,1]=4 5655 B6R1.11 C[C@H](C1CC1)O Amb13952943 [0,0,1,1,0,0|1,0,1]=4 5656 B6R1.11 FC(=O)C1CC1 Amb17673783 [0,0,1,1,0,0|1,0,0]=3 5657 B6R1.11 NC(=O)C1CC1 Amb1789460 [0,0,1,1,0,0|1,0,0]=3 5658 B6R1.11 NC(O)C1CC1 Amb22492754 [0,0,1,1,0,0|1,0,1]=4 5659 B6R1.11 N[13C](=O)[13CH]1[13CH2]O1 Amb17614804 [0,0,1,1,0,0|2,0,0]=4 5660 B6R1.11 O=S(Cl)C1CC1 Amb25662827 [0,0,1,1,0,0|2,0,0]=4 5661 B6R1.11 OB(C1CC1)O Amb2455832 [0,0,1,1,0,0|1,0,1]=4 5662 B6R1.11 OC(=O)C1CN1 Amb21864773 [0,0,1,1,0,0|1,0,0]=3 5663 B6R1.11 OC(=O)C1CS1 Amb24641854 [0,0,1,1,0,0|1,0,0]=3 5664 B6R1.11 OC(=O)[C@@H]1CN1 Amb22745452 [0,0,1,1,0,0|1,0,0]=3 5665 B6R1.11 OS(=O)C1CC1 Amb24334290 [0,0,1,1,0,0|1,0,0]=3 5666 B6R1.11 [O-]C(=O)C1CO1 Amb22492453 [0,0,1,1,0,0|1,0,1]=4 5667 B6R1.11 [O-]C(=O)[C@@H]1CO1 Amb22503671 [0,0,1,1,0,0|1,0,1]=4 5668 B6R1.11 [O-]C(=O)[C@H]1CO1 Amb22503672 [0,0,1,1,0,0|1,0,1]=4 5669 B6R1.11 [O-][N+](=O)C1CC1 Amb25768805 [0,0,1,1,0,0|1,0,1]=4 5670 B6R1.1 C1C=COCN1 Amb24550978 [0,0,1,1,0,0|2,0,0]=4 5671 B6R1.1 C1C=COCO1 Amb25368331 [0,0,1,1,0,0|2,0,0]=4 5672 B6R1.1 C1CCCC=C1 Amb22732445 [0,0,1,1,0,0|2,0,0]=4 5673 B6R1.1 C1CCCON1 Amb22586922 [0,0,1,1,0,0|1,0,1]=4 5674 B6R1.1 C1CCCOO1 Amb22734700 [0,0,1,1,0,0|0,0,2]=4 5675 B6R1.1 C1CCC[SiH2]O1 Amb24621895 [0,0,1,1,0,0|1,0,1]=4 5676 B6R1.1 C1CCN=CN1 Amb17620508 [0,0,1,1,0,0|2,0,0]=4 5677 B6R1.1 C1CCNC=C1 Amb22898834 [0,0,1,1,0,0|2,0,0]=4 5678 B6R1.1 C1CCNC=C1 Amb24389577 [0,0,1,1,0,0|2,0,0]=4 5679 B6R1.1 C1CCOCN1 Amb17506190 [0,0,1,1,0,0|1,0,1]=4 5680 B6R1.1 C1COC=CO1 Amb22043779 [0,0,1,1,0,0|2,0,0]=4 5681 B6R1.1 C1NCOC=N1 Amb24688472 [0,0,1,1,0,0|2,0,0]=4 5682 B6R1.1 O1CCC=CC1 Amb16234261 [0,0,1,1,0,0|1,0,1]=4 5683 B6R1.7 COC1(Br)CC1 Amb24742551 [0,0,1,1,0,0|1,0,1]=4 5684 B6R1.12 CC1C(C)C1=O Amb25807048 [0,0,1,1,0,0|1,0,0]=3 5685 B6R2.4 C1C2CCC21 Amb24063258 [1,0,0,1,0,0|1,0,1]=4 5686 B6R2.4 C1CC2OC21 Amb19148609 [1,0,0,1,0,0|0,0,1]=3 5687 B6R2.2 C1C2CC1C2 Amb24629578 [0,0,0,1,1,0|1,0,1]=4 5688 B8R2.2 CC12CCCC1O2 Amb22338783 [0,0,0,1,0,1|1,0,1]=4 5689 B8R2.5 O=C1CC2CCC12 Amb24614514 [0,0,0,1,0,1|1,0,0]=3 5690 B8R2.5 O=C1NC2CCC12 Amb25026050 [0,0,0,1,0,1|1,0,0]=3 5691 B8R2.5 O=C1N[C@@H]2C=C[C@H]12 Amb25174979 [0,0,0,1,0,1|1,0,1]=4 5692 B8R2.5 O=C1OC2C=CC12 Amb24751511 [0,0,0,1,0,1|0,0,1]=3 5693 B8R2.11 NC1C2OCCC21 Amb23448812 [0,0,0,1,0,1|1,0,1]=4 5694 B8R2.11 O=C1C=2CCCC21 Amb25273112 [0,0,0,1,0,1|1,0,0]=3 5695 B8R2.18 O=C1CC2CC2C1 Amb25750119 [0,0,0,1,0,1|1,0,0]=3 5696 B8R2.18 O=C1CC2OC2C1 Amb25050255 [0,0,0,1,0,1|1,0,0]=3 5697 B8R2.18 O=C1C[C@@H]2O[C@@H]2C1 Amb25768575 [0,0,0,1,0,1|1,0,0]=3 5698 B8R2.18 O=[Si]1CC2OC2C1 Amb25755778 [0,0,0,1,0,1|1,1,0]=4 5699 B8R2.23 C1NCC2CC1O2 Amb19148434 [0,0,0,1,0,1|1,0,1]=4 5700 B8R2.23 C1NCC2CC1O2 Amb22491904 [0,0,0,1,0,1|1,0,1]=4 5701 B8R2.23 C1OCC2CC1N2 Amb19374737 [0,0,0,1,0,1|1,0,1]=4 5702 B8R2.25 C1C2NCCOC21 Amb19148700 [0,0,0,1,0,1|1,0,1]=4 5703 B8R2.25 C1C2NCCOC21 Amb19148862 [0,0,0,1,0,1|1,0,1]=4 5704 B8R2.34 C1C2CNC1CO2 Amb23440287 [0,0,0,1,0,1|1,0,1]=4 5705 B8R2.34 C1NC2CC1OC2 Amb19515675 [0,0,0,1,0,1|1,0,1]=4 5706 B8R2.34 C1NC2CC1OC2 Amb22406227 [0,0,0,1,0,1|1,0,1]=4 5707 B8R2.34 C1N[C@@H]2C[C@H]1OC2 Amb22406228 [0,0,0,1,0,1|1,0,1]=4 5708 B8R2.34 C1N[C@@H]2C[C@H]1OC2 Amb22747491 [0,0,0,1,0,1|1,0,1]=4 5709 B8R2.34 C1N[C@@H]2C[C@H]1OC2 Amb23440039 [0,0,0,1,0,1|1,0,1]=4 5710 B8R2.34 C1N[C@H]2C[C@@H]1OC2 Amb22274220 [0,0,0,1,0,1|1,0,1]=4 5711 B8R2.34 C1O[C@H]2C[C@@H]1NC2 Amb10601651 [0,0,0,1,0,1|1,0,1]=4 5712 B8R2.34 C1[C@@H]2CN[C@H]1CO2 Amb23440288 [0,0,0,1,0,1|1,0,1]=4 5713 B8R2.38 Br[C@@H]1CC[C@@H]2O[C@@H]21 Amb25179039 [0,0,0,1,0,1|1,0,1]=4 5714 B8R2.38 Br[C@H]1CC[C@H]2O[C@H]21 Amb25227809 [0,0,0,1,0,1|1,0,1]=4 5715 B8R2.38 ClC1CCC2OC21 Amb24386140 [0,0,0,1,0,1|1,0,1]=4 5716 B8R2.38 O=C1C=C[C@H]2O[C@@H]12 Amb25245316 [0,0,0,1,0,1|0,0,2]=4 5717 B8R2.38 O=C1CCC2CC12 Amb22736104 [0,0,0,1,0,1|1,0,0]=3 5718 B8R2.38 O=C1CC[C@@H]2C[C@H]12 Amb24623125 [0,0,0,1,0,1|1,0,0]=3 5719 B8R2.38 O=C1CC[C@@H]2O[C@H]12 Amb25025235 [0,0,0,1,0,1|0,0,0]=2 5720 B8R2.38 O=C1CNC2CC12 Amb25104969 [0,0,0,1,0,1|1,0,0]=3 5721 B8R2.38 O=C1NCC2CC12 Amb22546330 [0,0,0,1,0,1|1,0,0]=3 5722 B8R2.38 O=C1NC[C@H]2C[C@@H]12 Amb24654659 [0,0,0,1,0,1|1,0,0]=3 5723 B8R2.38 O=C1NC[C@H]2O[C@@H]12 Amb25261527 [0,0,0,1,0,1|1,0,0]=3 5724 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,1,0,1|0,0,0]=2 5725 B8R2.38 O=C1OCC2OC12 Amb24061718 [0,0,0,1,0,1|0,0,0]=2 5726 B8R2.38 OC1CCC2OC21 Amb24361986 [0,0,0,1,0,1|0,0,2]=4 5727 B8R2.38 OC1CC[C@@H]2O[C@H]21 Amb25356348 [0,0,0,1,0,1|0,0,2]=4 5728 B8R2.38 OC1OC[C@H]2C[C@H]21 Amb25175311 [0,0,0,1,0,1|0,0,2]=4 5729 B8R2.22 C1NC2CCOC21 Amb25698754 [0,1,0,1,0,0|1,0,1]=4 5730 B8R2.27 O=C1[C@@H]2C[C@@H]1CC2 Amb25370816 [0,1,0,1,0,0|1,0,0]=3 5731 B8R2.27 O=C1[C@@H]2C[C@H]1CC2 Amb24691711 [0,1,0,1,0,0|1,0,0]=3 5732 B8R2.33 O=CC1C2CCC21 Amb24507414 [0,1,0,1,0,0|1,0,1]=4 5733 B8R2.4 O=C1CC2CC1C2 Amb24426322 [0,1,0,1,0,0|1,0,0]=3 5734 B8R2.9 CN1C2CC2C1=O Amb25363862 [0,1,0,1,0,0|1,0,0]=3 5735 B8R3.15 O=C1C2C3C1C32 Amb24689549 [0,0,0,2,0,0|1,0,0]=3 5736 B4R1.1 C1C=CN1 Amb25339223 [1,0,0,0,1,0|1,0,1]=4 5737 B4R1.1 C1CCC1 Amb17689121 [1,0,0,0,1,0|0,0,1]=3 5738 B4R1.1 C1CCS1 Amb22232204 [1,0,0,0,1,0|0,1,0]=3 5739 B4R1.1 C1NCN1 Amb25144842 [1,0,0,0,1,0|2,0,0]=4 5740 B4R1.1 C1NCO1 Amb25810994 [1,0,0,0,1,0|1,0,0]=3 5741 B4R1.1 C1OCS1 Amb24615155 [1,0,0,0,1,0|1,0,0]=3 5742 B4R1.1 c1co[nH]1 Amb25074056 [1,0,0,0,1,0|1,0,1]=4 5743 B4R1.2 BrC1CO1 Amb25145191 [0,0,0,0,2,0|1,0,1]=4 5744 B4R1.2 C=C1CC1 Amb22347889 [0,0,0,0,2,0|1,0,0]=3 5745 B4R1.2 CC1CC1 Amb24425057 [0,0,0,0,2,0|1,0,1]=4 5746 B4R1.2 CC1CO1 Amb22411582 [0,0,0,0,2,0|1,0,1]=4 5747 B4R1.2 CC=1CC1 Amb20240828 [0,0,0,0,2,0|1,0,1]=4 5748 B4R1.2 CN1CC1 Amb22729135 [0,0,0,0,2,0|2,0,0]=4 5749 B4R1.2 ClC1CC1 Amb25145387 [0,0,0,0,2,0|1,0,1]=4 5750 B4R1.2 ClC1CO1 Amb25744695 [0,0,0,0,2,0|1,0,1]=4 5751 B4R1.2 Cl[C@H]1CO1 Amb25101536 [0,0,0,0,2,0|1,0,1]=4 5752 B4R1.2 FC1CC1 Amb25145254 [0,0,0,0,2,0|1,0,1]=4 5753 B4R1.2 IC1CC1 Amb22756596 [0,0,0,0,2,0|1,0,1]=4 5754 B4R1.2 ICl1CC1 Amb22411640 [0,0,0,0,2,0|2,0,0]=4 5755 B4R1.2 NC1CO1 Amb25173628 [0,0,0,0,2,0|1,0,1]=4 5756 B4R1.2 O=C1C=C1 Amb22733856 [0,0,0,0,2,0|0,0,2]=4 5757 B4R1.2 OC1CC1 Amb22304217 [0,0,0,0,2,0|0,0,2]=4 5758 B4R1.2 SC1CC1 Amb19893337 [0,0,0,0,2,0|0,1,1]=4 5759 B4R1.2 [Mg+]C1CC1 Amb22034387 [0,0,0,0,2,0|1,0,1]=4 5760 B8R1.22 BrC1=CCCCCC1 Amb10071167 [0,0,0,0,0,2|2,0,0]=4 5761 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,0,0,2|1,0,1]=4 5762 B8R1.22 BrC1COCCOC1 Amb24421656 [0,0,0,0,0,2|1,0,1]=4 5763 B8R1.22 BrC=1COCOCC1 Amb24087656 [0,0,0,0,0,2|1,0,1]=4 5764 B8R1.22 C=C1CCCCCC1 Amb25325282 [0,0,0,0,0,2|2,0,0]=4 5765 B8R1.22 C=C1CNCCCC1 Amb24624045 [0,0,0,0,0,2|2,0,0]=4 5766 B8R1.22 C=C1CSCCSC1 Amb24694547 [0,0,0,0,0,2|1,1,0]=4 5767 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,0,0,0,0,2|1,0,0]=3 5768 B8R1.22 CC1=CCCCCN1 Amb24443923 [0,0,0,0,0,2|2,0,0]=4 5769 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,0,0,2|1,0,1]=4 5770 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,0,0,2|1,0,1]=4 5771 B8R1.22 CC1CNCCOC1 Amb18112853 [0,0,0,0,0,2|1,0,1]=4 5772 B8R1.22 CC1CNCCOC1 Amb22886318 [0,0,0,0,0,2|1,0,1]=4 5773 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,0,0,2|1,0,1]=4 5774 B8R1.22 CC1OCCCCO1 Amb22731719 [0,0,0,0,0,2|1,0,1]=4 5775 B8R1.22 CC=1CCCCCC1 Amb22227978 [0,0,0,0,0,2|2,0,0]=4 5776 B8R1.22 CC=1CCNCCN1 Amb25784814 [0,0,0,0,0,2|2,0,0]=4 5777 B8R1.22 CC=1NCCCCN1 Amb22345658 [0,0,0,0,0,2|2,0,0]=4 5778 B8R1.22 ClC1COCCOC1 Amb25712357 [0,0,0,0,0,2|1,0,1]=4 5779 B8R1.22 FC1CNCCOC1 Amb24481255 [0,0,0,0,0,2|1,0,1]=4 5780 B8R1.22 N=C1CCCCCN1 Amb22488763 [0,0,0,0,0,2|2,0,0]=4 5781 B8R1.22 N=C1CCNCCN1 Amb24481332 [0,0,0,0,0,2|2,0,0]=4 5782 B8R1.22 N=C1COCCCN1 Amb25223773 [0,0,0,0,0,2|1,0,0]=3 5783 B8R1.22 NC1CCCOCC1 Amb18832507 [0,0,0,0,0,2|1,0,1]=4 5784 B8R1.22 NC1COCCOC1 Amb20669196 [0,0,0,0,0,2|1,0,1]=4 5785 B8R1.22 NC1COCCOC1 Amb24452281 [0,0,0,0,0,2|1,0,1]=4 5786 B8R1.22 NC=1CCCCCC1 Amb24739386 [0,0,0,0,0,2|2,0,0]=4 5787 B8R1.22 NC=1CCCCCN1 Amb19514661 [0,0,0,0,0,2|2,0,0]=4 5788 B8R1.22 NC=1CSCCCN1 Amb25688170 [0,0,0,0,0,2|1,1,0]=4 5789 B8R1.22 NN1CCCOCC1 Amb25681314 [0,0,0,0,0,2|2,0,0]=4 5790 B8R1.22 N[C@@H]1CCCOCC1 Amb24476582 [0,0,0,0,0,2|1,0,1]=4 5791 B8R1.22 O=C1C=CCCC=C1 Amb22364722 [0,0,0,0,0,2|1,0,1]=4 5792 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,0,0,0,0,2|1,0,0]=3 5793 B8R1.22 O=C1C=CNCCN1 Amb24395067 [0,0,0,0,0,2|1,0,1]=4 5794 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,0,0,0,0,2|1,0,0]=3 5795 B8R1.22 O=C1CCC=CC=C1 Amb17593120 [0,0,0,0,0,2|1,0,1]=4 5796 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,0,0,0,0,2|1,0,0]=3 5797 B8R1.22 O=C1CCCCC=C1 Amb10601704 [0,0,0,0,0,2|1,0,0]=3 5798 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,0,0,0,0,2|0,1,0]=3 5799 B8R1.22 O=C1CCCCC[N-]1 Amb22053646 [0,0,0,0,0,2|1,0,0]=3 5800 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,0,0,0,0,2|1,0,0]=3 5801 B8R1.22 O=C1CCCCSC1 Amb10071767 [0,0,0,0,0,2|0,1,0]=3 5802 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,0,0,0,0,2|0,1,0]=3 5803 B8R1.22 O=C1CCOCCO1 Amb24060726 [0,0,0,0,0,2|0,0,0]=2 5804 B8R1.22 O=C1CCSC=CN1 Amb24560312 [0,0,0,0,0,2|1,0,1]=4 5805 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,0,0,0,0,2|1,0,0]=3 5806 B8R1.22 O=C1CNCCCC1 Amb22000936 [0,0,0,0,0,2|1,0,0]=3 5807 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,0,0,0,0,2|1,0,0]=3 5808 B8R1.22 O=C1CNCCNC1 Amb25259581 [0,0,0,0,0,2|1,0,0]=3 5809 B8R1.22 O=C1COCCC=C1 Amb25295282 [0,0,0,0,0,2|0,0,1]=3 5810 B8R1.22 O=C1COCCCC1 Amb25143067 [0,0,0,0,0,2|0,0,0]=2 5811 B8R1.22 O=C1COCCCN1 Amb22371065 [0,0,0,0,0,2|0,0,0]=2 5812 B8R1.22 O=C1COCCCO1 Amb24558825 [0,0,0,0,0,2|0,0,0]=2 5813 B8R1.22 O=C1COCCOC1 Amb22284314 [0,0,0,0,0,2|0,0,0]=2 5814 B8R1.22 O=C1COCOC=C1 Amb24422426 [0,0,0,0,0,2|1,0,0]=3 5815 B8R1.22 O=C1CSCCCN1 Amb25378108 [0,0,0,0,0,2|0,1,0]=3 5816 B8R1.22 O=C1NCC=CCN1 Amb25844387 [0,0,0,0,0,2|1,0,1]=4 5817 B8R1.22 O=C1NCCNCC1 Amb10069937 [0,0,0,0,0,2|1,0,0]=3 5818 B8R1.22 O=C1NCCNCC1 Amb1107713 [0,0,0,0,0,2|1,0,0]=3 5819 B8R1.22 O=C1NCCOCC1 Amb13951193 [0,0,0,0,0,2|1,0,0]=3 5820 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,0,0,0,0,2|0,0,0]=2 5821 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,0,0,0,0,2|2,0,0]=4 5822 B8R1.22 O=S1OCC=CCO1 Amb25190031 [0,0,0,0,0,2|1,0,1]=4 5823 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,0,0,2|0,0,2]=4 5824 B8R1.22 OC1CCOCCO1 Amb25687903 [0,0,0,0,0,2|0,0,2]=4 5825 B8R1.22 OC1CNCCOC1 Amb22886365 [0,0,0,0,0,2|0,0,2]=4 5826 B8R1.22 OC1CNOCCC1 Amb24748295 [0,0,0,0,0,2|0,0,2]=4 5827 B8R1.22 OC1COCOCC1 Amb24429998 [0,0,0,0,0,2|0,0,2]=4 5828 B8R1.22 O[C@@H]1CNCCOC1 Amb22325588 [0,0,0,0,0,2|0,0,2]=4 5829 B8R1.22 O[C@@H]1COCOCC1 Amb25828912 [0,0,0,0,0,2|0,0,2]=4 5830 B8R1.22 S=C1CCCCCN1 Amb1935077 [0,0,0,0,0,2|1,1,0]=4 5831 B8R1.22 S=C1CCOCCN1 Amb25836331 [0,0,0,0,0,2|1,1,0]=4 5832 B8R1.22 S=C1COCCCN1 Amb25808992 [0,0,0,0,0,2|0,1,0]=3 5833 B8R1.22 S=C1CSCCCN1 Amb25367071 [0,0,0,0,0,2|0,2,0]=4 5834 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,0,0,2|0,1,1]=4