0 B7R1.1 BrC=C1OCCO1 Amb25697137 [0,0,0,0,0,0|2,0,2]=4 1 B7R1.1 BrC[n]1ccc[n]1 Amb24557786 [0,0,0,0,0,0|3,0,1]=4 2 B7R1.1 BrCc1[nH]cc[n]1 Amb21858315 [0,0,0,0,0,0|3,0,1]=4 3 B7R1.1 BrCc1[nH]cc[n]1 Amb22284583 [0,0,0,0,0,0|3,0,1]=4 4 B7R1.1 BrCc1[n]cc[s]1 Amb21857626 [0,0,0,0,0,0|2,1,1]=4 5 B7R1.1 BrCc1c[nH]c[n]1 Amb20248272 [0,0,0,0,0,0|3,0,1]=4 6 B7R1.1 BrCc1c[nH]cc1 Amb24709962 [0,0,0,0,0,0|3,0,1]=4 7 B7R1.1 BrCc1c[nH]cn1 Amb2455859 [0,0,0,0,0,0|3,0,1]=4 8 B7R1.1 BrCc1c[n]c[s]1 Amb22491257 [0,0,0,0,0,0|2,1,1]=4 9 B7R1.1 BrCc1c[s]c[n]1 Amb22728093 [0,0,0,0,0,0|3,0,1]=4 10 B7R1.1 BrCc1cc[n][nH]1 Amb18788026 [0,0,0,0,0,0|3,0,1]=4 11 B7R1.1 BrCc1cc[n][s]1 Amb20242134 [0,0,0,0,0,0|2,1,1]=4 12 B7R1.1 BrCc1cc[n]o1 Amb19338117 [0,0,0,0,0,0|2,0,1]=3 13 B7R1.1 BrCc1cc[s][n]1 Amb24715751 [0,0,0,0,0,0|3,0,1]=4 14 B7R1.1 BrCc1ccco1 Amb21862207 [0,0,0,0,0,0|1,0,1]=2 15 B7R1.1 BrCc1cccs1 Amb10602501 [0,0,0,0,0,0|1,1,1]=3 16 B7R1.1 BrCc1cco[n]1 Amb18183486 [0,0,0,0,0,0|3,0,1]=4 17 B7R1.1 BrCc1cnco1 Amb10071196 [0,0,0,0,0,0|2,0,1]=3 18 B7R1.1 BrCc1cncs1 Amb16185415 [0,0,0,0,0,0|2,1,1]=4 19 B7R1.1 BrCc1coc[n]1 Amb24105437 [0,0,0,0,0,0|3,0,1]=4 20 B7R1.1 BrCc1cocc1 Amb21857141 [0,0,0,0,0,0|3,0,1]=4 21 B7R1.1 BrCc1cocn1 Amb10071194 [0,0,0,0,0,0|3,0,1]=4 22 B7R1.1 BrCc1ncco1 Amb10071192 [0,0,0,0,0,0|2,0,1]=3 23 B7R1.1 BrCc1nccs1 Amb10602038 [0,0,0,0,0,0|2,1,1]=4 24 B7R1.1 Br[Mg]c1[n]cc[s]1 Amb22897490 [0,0,0,0,0,0|3,1,0]=4 25 B7R1.1 Br[Mg]c1ccc[s]1 Amb22338612 [0,0,0,0,0,0|2,1,0]=3 26 B7R1.1 Br[Zn]c1[n]cc[s]1 Amb22000385 [0,0,0,0,0,0|3,1,0]=4 27 B7R1.1 Br[Zn]c1ccco1 Amb22897621 [0,0,0,0,0,0|2,0,0]=2 28 B7R1.1 Br\C=C/1\CC=CS1 Amb25050461 [0,0,0,0,0,0|1,1,1]=3 29 B7R1.1 C#C[n]1ccc[n]1 Amb25733840 [0,0,0,0,0,0|3,0,1]=4 30 B7R1.1 C#Cc1[nH]cc[n]1 Amb24122958 [0,0,0,0,0,0|3,0,1]=4 31 B7R1.1 C#Cc1[n]cc[s]1 Amb22170067 [0,0,0,0,0,0|2,1,1]=4 32 B7R1.1 C#Cc1[n]cco1 Amb24511804 [0,0,0,0,0,0|2,0,1]=3 33 B7R1.1 C#Cc1c[n]c[s]1 Amb24071349 [0,0,0,0,0,0|2,1,1]=4 34 B7R1.1 C#Cc1c[s]c[n]1 Amb22284777 [0,0,0,0,0,0|3,0,1]=4 35 B7R1.1 C#Cc1cc[n][nH]1 Amb24468960 [0,0,0,0,0,0|3,0,1]=4 36 B7R1.1 C#Cc1cc[n][s]1 Amb25138875 [0,0,0,0,0,0|2,1,1]=4 37 B7R1.1 C#Cc1cc[n]o1 Amb24339440 [0,0,0,0,0,0|2,0,1]=3 38 B7R1.1 C#Cc1ccc[nH]1 Amb24123042 [0,0,0,0,0,0|2,0,1]=3 39 B7R1.1 C#Cc1ccco1 Amb24178904 [0,0,0,0,0,0|1,0,1]=2 40 B7R1.1 C#Cc1cocc1 Amb25283258 [0,0,0,0,0,0|3,0,1]=4 41 B7R1.1 C#Cc1cscc1 Amb10603690 [0,0,0,0,0,0|3,0,1]=4 42 B7R1.1 C=CC1CC=CC1 Amb25173585 [0,0,0,0,0,0|2,0,2]=4 43 B7R1.1 C=C[n]1ccc[n]1 Amb24583489 [0,0,0,0,0,0|3,0,0]=3 44 B7R1.1 C=C[n]1cccc1 Amb25810319 [0,0,0,0,0,0|3,0,0]=3 45 B7R1.1 C=Cc1[nH]c[n][n]1 Amb25136371 [0,0,0,0,0,0|4,0,0]=4 46 B7R1.1 C=Cc1[nH]cc[n]1 Amb22002618 [0,0,0,0,0,0|3,0,0]=3 47 B7R1.1 C=Cc1[n]cc[s]1 Amb24056329 [0,0,0,0,0,0|2,1,0]=3 48 B7R1.1 C=Cc1[n]cco1 Amb24650190 [0,0,0,0,0,0|2,0,0]=2 49 B7R1.1 C=Cc1c[n]c[s]1 Amb24395972 [0,0,0,0,0,0|2,1,0]=3 50 B7R1.1 C=Cc1c[s][n][n]1 Amb25169577 [0,0,0,0,0,0|4,0,0]=4 51 B7R1.1 C=Cc1c[s]cc1 Amb22263008 [0,0,0,0,0,0|3,0,0]=3 52 B7R1.1 C=Cc1ccc[nH]1 Amb24480629 [0,0,0,0,0,0|2,0,0]=2 53 B7R1.1 C=Cc1ccco1 Amb22295842 [0,0,0,0,0,0|1,0,0]=1 54 B7R1.1 C=Cc1cocc1 Amb24056798 [0,0,0,0,0,0|3,0,0]=3 55 B7R1.1 C=Nc1c[nH]cc1 Amb24569489 [0,0,0,0,0,0|4,0,0]=4 56 B7R1.1 CCC1C=CC=C1 Amb2227637 [0,0,0,0,0,0|2,0,2]=4 57 B7R1.1 CCC=1CC=CC1 Amb24702642 [0,0,0,0,0,0|2,0,1]=3 58 B7R1.1 CCc1c[nH]c[n]1 Amb22295793 [0,0,0,0,0,0|3,0,1]=4 59 B7R1.1 CCc1c[n]c[s]1 Amb25663104 [0,0,0,0,0,0|2,1,1]=4 60 B7R1.1 CCc1c[n]co1 Amb22490969 [0,0,0,0,0,0|2,0,1]=3 61 B7R1.1 CCc1cc[nH][n]1 Amb19516891 [0,0,0,0,0,0|3,0,1]=4 62 B7R1.1 CCc1cc[n]o1 Amb22233735 [0,0,0,0,0,0|2,0,1]=3 63 B7R1.1 CCc1coc[n]1 Amb25073231 [0,0,0,0,0,0|3,0,1]=4 64 B7R1.1 CCc1cscn1 Amb13884091 [0,0,0,0,0,0|3,0,1]=4 65 B7R1.1 CCc1ncco1 Amb17399786 [0,0,0,0,0,0|2,0,1]=3 66 B7R1.1 CCc1nccs1 Amb10601013 [0,0,0,0,0,0|2,1,1]=4 67 B7R1.1 CCc1nnco1 Amb2208686 [0,0,0,0,0,0|3,0,1]=4 68 B7R1.1 CCn1cccn1 Amb1934294 [0,0,0,0,0,0|3,0,1]=4 69 B7R1.1 CN[n]1cccc1 Amb25662666 [0,0,0,0,0,0|4,0,0]=4 70 B7R1.1 CNc1[nH]cc[n]1 Amb22749656 [0,0,0,0,0,0|4,0,0]=4 71 B7R1.1 CNc1[n][n]co1 Amb24117942 [0,0,0,0,0,0|4,0,0]=4 72 B7R1.1 CNc1[n]cc[s]1 Amb22490429 [0,0,0,0,0,0|3,1,0]=4 73 B7R1.1 CNc1[n]cco1 Amb21856873 [0,0,0,0,0,0|3,0,0]=3 74 B7R1.1 CNc1c[nH]cc1 Amb18061790 [0,0,0,0,0,0|4,0,0]=4 75 B7R1.1 CNc1c[n]c[s]1 Amb22492450 [0,0,0,0,0,0|3,1,0]=4 76 B7R1.1 CNc1c[n]co1 Amb22490689 [0,0,0,0,0,0|3,0,0]=3 77 B7R1.1 CNc1c[s]cc1 Amb20620164 [0,0,0,0,0,0|4,0,0]=4 78 B7R1.1 CNc1cc[nH][n]1 Amb18281004 [0,0,0,0,0,0|4,0,0]=4 79 B7R1.1 CNc1cc[s][n]1 Amb25063572 [0,0,0,0,0,0|4,0,0]=4 80 B7R1.1 CNc1ccc[s]1 Amb18553885 [0,0,0,0,0,0|2,1,0]=3 81 B7R1.1 CNc1ccc[s]1 Amb20242012 [0,0,0,0,0,0|2,1,0]=3 82 B7R1.1 CNc1ccco1 Amb24645794 [0,0,0,0,0,0|2,0,0]=2 83 B7R1.1 CNc1cco[n]1 Amb18281002 [0,0,0,0,0,0|4,0,0]=4 84 B7R1.1 CNc1cocc1 Amb25024845 [0,0,0,0,0,0|4,0,0]=4 85 B7R1.1 COC=1CC=CN1 Amb25234141 [0,0,0,0,0,0|3,0,1]=4 86 B7R1.1 COC=1CN=CC1 Amb25208584 [0,0,0,0,0,0|4,0,0]=4 87 B7R1.1 COc1[nH]cc[n]1 Amb22011530 [0,0,0,0,0,0|4,0,0]=4 88 B7R1.1 COc1[n]cco1 Amb25810927 [0,0,0,0,0,0|3,0,0]=3 89 B7R1.1 COc1c[nH]cc1 Amb24421224 [0,0,0,0,0,0|4,0,0]=4 90 B7R1.1 COc1c[n]c[nH]1 Amb22295920 [0,0,0,0,0,0|4,0,0]=4 91 B7R1.1 COc1c[n]co1 Amb24680005 [0,0,0,0,0,0|3,0,0]=3 92 B7R1.1 COc1c[s]c[n]1 Amb20621420 [0,0,0,0,0,0|4,0,0]=4 93 B7R1.1 COc1cc[n][nH]1 Amb22899569 [0,0,0,0,0,0|4,0,0]=4 94 B7R1.1 COc1cc[s][n]1 Amb23592267 [0,0,0,0,0,0|4,0,0]=4 95 B7R1.1 COc1ccc[nH]1 Amb24478560 [0,0,0,0,0,0|3,0,0]=3 96 B7R1.1 COc1cocc1 Amb21963231 [0,0,0,0,0,0|4,0,0]=4 97 B7R1.1 COc1nccs1 Amb2447656 [0,0,0,0,0,0|3,1,0]=4 98 B7R1.1 CSc1[nH]cc[n]1 Amb19149025 [0,0,0,0,0,0|4,0,0]=4 99 B7R1.1 CSc1[n]cco1 Amb21961333 [0,0,0,0,0,0|3,0,0]=3 100 B7R1.1 CSc1c[nH]cn1 Amb13883548 [0,0,0,0,0,0|4,0,0]=4 101 B7R1.1 CSc1ccco1 Amb21961438 [0,0,0,0,0,0|2,0,0]=2 102 B7R1.1 CSc1cocc1 Amb25835877 [0,0,0,0,0,0|4,0,0]=4 103 B7R1.1 C[Mn]C=1CC=CC1 Amb19515792 [0,0,0,0,0,0|3,0,0]=3 104 B7R1.1 C[Se]c1ccsc1 Amb17779305 [0,0,0,0,0,0|4,0,0]=4 105 B7R1.1 C[SiH2]c1c[s]cc1 Amb24611076 [0,0,0,0,0,0|3,1,0]=4 106 B7R1.1 ClCC1=CCCO1 Amb24747248 [0,0,0,0,0,0|1,0,3]=4 107 B7R1.1 ClCC=1CC=CC1 Amb25359413 [0,0,0,0,0,0|2,0,1]=3 108 B7R1.1 ClC[n]1ccc[n]1 Amb25084521 [0,0,0,0,0,0|3,0,1]=4 109 B7R1.1 ClC[n]1cccc1 Amb24333990 [0,0,0,0,0,0|3,0,1]=4 110 B7R1.1 ClCc1[n]cc[s]1 Amb21857625 [0,0,0,0,0,0|2,1,1]=4 111 B7R1.1 ClCc1c[nH]cc1 Amb18221809 [0,0,0,0,0,0|3,0,1]=4 112 B7R1.1 ClCc1c[nH]cn1 Amb15701232 [0,0,0,0,0,0|3,0,1]=4 113 B7R1.1 ClCc1c[nH]cn1 Amb2455687 [0,0,0,0,0,0|3,0,1]=4 114 B7R1.1 ClCc1c[n]c[s]1 Amb18917909 [0,0,0,0,0,0|2,1,1]=4 115 B7R1.1 ClCc1c[n]c[s]1 Amb21857837 [0,0,0,0,0,0|2,1,1]=4 116 B7R1.1 ClCc1c[n]co1 Amb21520456 [0,0,0,0,0,0|2,0,1]=3 117 B7R1.1 ClCc1c[n]co1 Amb22436815 [0,0,0,0,0,0|2,0,1]=3 118 B7R1.1 ClCc1cc[nH][n]1 Amb21963521 [0,0,0,0,0,0|3,0,1]=4 119 B7R1.1 ClCc1cc[nH][n]1 Amb22001556 [0,0,0,0,0,0|3,0,1]=4 120 B7R1.1 ClCc1cc[s][n]1 Amb25113916 [0,0,0,0,0,0|3,0,1]=4 121 B7R1.1 ClCc1ccno1 Amb1090466 [0,0,0,0,0,0|2,0,1]=3 122 B7R1.1 ClCc1ccon1 Amb1087842 [0,0,0,0,0,0|3,0,1]=4 123 B7R1.1 ClCc1coc[n]1 Amb21857138 [0,0,0,0,0,0|3,0,1]=4 124 B7R1.1 ClCc1coc[n]1 Amb21857165 [0,0,0,0,0,0|3,0,1]=4 125 B7R1.1 ClCc1cscn1 Amb1154587 [0,0,0,0,0,0|3,0,1]=4 126 B7R1.1 ClCc1cscn1 Amb2371224 [0,0,0,0,0,0|3,0,1]=4 127 B7R1.1 ClCc1ncc[nH]1 Amb10844832 [0,0,0,0,0,0|3,0,1]=4 128 B7R1.1 ClCc1ncco1 Amb10602092 [0,0,0,0,0,0|2,0,1]=3 129 B7R1.1 ClCc1nccs1 Amb10603583 [0,0,0,0,0,0|2,1,1]=4 130 B7R1.1 ClCn1cccn1 Amb10601542 [0,0,0,0,0,0|3,0,1]=4 131 B7R1.1 Cl[Hg]c1ccc[s]1 Amb22360263 [0,0,0,0,0,0|2,1,0]=3 132 B7R1.1 Cl[Hg]c1cocc1 Amb22360173 [0,0,0,0,0,0|4,0,0]=4 133 B7R1.1 Cl[SiH2]c1ccc[s]1 Amb24637211 [0,0,0,0,0,0|1,2,0]=3 134 B7R1.1 Cl\C=C/1\COCO1 Amb25138746 [0,0,0,0,0,0|2,0,2]=4 135 B7R1.1 FC[n]1cccc1 Amb24605531 [0,0,0,0,0,0|3,0,1]=4 136 B7R1.1 FCc1c[n]c[nH]1 Amb24520518 [0,0,0,0,0,0|3,0,1]=4 137 B7R1.1 FCc1c[s]cc1 Amb25024865 [0,0,0,0,0,0|3,0,1]=4 138 B7R1.1 FCc1cc[nH][n]1 Amb24423479 [0,0,0,0,0,0|3,0,1]=4 139 B7R1.1 FCc1ccc[nH]1 Amb24721855 [0,0,0,0,0,0|2,0,1]=3 140 B7R1.1 FCc1ccco1 Amb24479569 [0,0,0,0,0,0|1,0,1]=2 141 B7R1.1 FOc1ccco1 Amb25208531 [0,0,0,0,0,0|2,0,0]=2 142 B7R1.1 F[SiH2]c1[n]cc[s]1 Amb25253632 [0,0,0,0,0,0|2,2,0]=4 143 B7R1.1 ICc1[n]cc[s]1 Amb24641632 [0,0,0,0,0,0|2,1,1]=4 144 B7R1.1 ICc1c[nH]c[n]1 Amb25759935 [0,0,0,0,0,0|3,0,1]=4 145 B7R1.1 ICc1c[s]c[n]1 Amb24672501 [0,0,0,0,0,0|3,0,1]=4 146 B7R1.1 ICc1c[s]cc1 Amb25317232 [0,0,0,0,0,0|3,0,1]=4 147 B7R1.1 ICc1ccc[s]1 Amb25280170 [0,0,0,0,0,0|1,1,1]=3 148 B7R1.1 ICc1ccco1 Amb24060883 [0,0,0,0,0,0|1,0,1]=2 149 B7R1.1 ICc1cocc1 Amb25131757 [0,0,0,0,0,0|3,0,1]=4 150 B7R1.1 N#CC1=CCCO1 Amb19149010 [0,0,0,0,0,0|1,0,3]=4 151 B7R1.1 N#CC=1CN=CC1 Amb25278644 [0,0,0,0,0,0|3,0,1]=4 152 B7R1.1 N#Cc1[nH]cc[n]1 Amb22406096 [0,0,0,0,0,0|3,0,1]=4 153 B7R1.1 N#Cc1[n]cc[s]1 Amb19957521 [0,0,0,0,0,0|2,1,1]=4 154 B7R1.1 N#Cc1[n]cco1 Amb19889630 [0,0,0,0,0,0|2,0,1]=3 155 B7R1.1 N#Cc1c[nH]cc1 Amb10067055 [0,0,0,0,0,0|3,0,1]=4 156 B7R1.1 N#Cc1c[n]co1 Amb21520457 [0,0,0,0,0,0|2,0,1]=3 157 B7R1.1 N#Cc1cc[n]o1 Amb22292333 [0,0,0,0,0,0|2,0,1]=3 158 B7R1.1 N#Cc1cc[s][n]1 Amb19894959 [0,0,0,0,0,0|3,0,1]=4 159 B7R1.1 N#Cc1ccco1 Amb1694826 [0,0,0,0,0,0|1,0,1]=2 160 B7R1.1 N#Cc1cccs1 Amb1154392 [0,0,0,0,0,0|1,1,1]=3 161 B7R1.1 N#Cc1ncc[nH]1 Amb10603430 [0,0,0,0,0,0|3,0,1]=4 162 B7R1.1 N=C[n]1c[n]cc1 Amb25208735 [0,0,0,0,0,0|4,0,0]=4 163 B7R1.1 N=Cc1ccc[nH]1 Amb24549298 [0,0,0,0,0,0|2,0,0]=2 164 B7R1.1 N=Nc1[nH]cc[n]1 Amb24479768 [0,0,0,0,0,0|4,0,0]=4 165 B7R1.1 NC=C1C=CC=C1 Amb24479305 [0,0,0,0,0,0|2,0,0]=2 166 B7R1.1 NCC1C=CCO1 Amb25064815 [0,0,0,0,0,0|1,0,3]=4 167 B7R1.1 NC[C@@H]1C=CCO1 Amb25831275 [0,0,0,0,0,0|1,0,3]=4 168 B7R1.1 NCc1[n][n]co1 Amb22756572 [0,0,0,0,0,0|3,0,1]=4 169 B7R1.1 NCc1[n]cco1 Amb19929809 [0,0,0,0,0,0|2,0,1]=3 170 B7R1.1 NCc1c[nH]c[n]1 Amb19374683 [0,0,0,0,0,0|3,0,1]=4 171 B7R1.1 NCc1c[nH]cc1 Amb18061787 [0,0,0,0,0,0|3,0,1]=4 172 B7R1.1 NCc1c[nH]cn1 Amb10608889 [0,0,0,0,0,0|3,0,1]=4 173 B7R1.1 NCc1c[n]c[s]1 Amb21955310 [0,0,0,0,0,0|2,1,1]=4 174 B7R1.1 NCc1c[n]co1 Amb23400902 [0,0,0,0,0,0|2,0,1]=3 175 B7R1.1 NCc1c[s]c[n]1 Amb21955307 [0,0,0,0,0,0|3,0,1]=4 176 B7R1.1 NCc1c[s]c[n]1 Amb22586640 [0,0,0,0,0,0|3,0,1]=4 177 B7R1.1 NCc1c[s]c[n]1 Amb22750751 [0,0,0,0,0,0|3,0,1]=4 178 B7R1.1 NCc1cc[nH][n]1 Amb22490711 [0,0,0,0,0,0|3,0,1]=4 179 B7R1.1 NCc1cc[n][nH]1 Amb19516111 [0,0,0,0,0,0|3,0,1]=4 180 B7R1.1 NCc1cc[n][s]1 Amb23441021 [0,0,0,0,0,0|2,1,1]=4 181 B7R1.1 NCc1cc[s][n]1 Amb18203360 [0,0,0,0,0,0|3,0,1]=4 182 B7R1.1 NCc1ccc[nH]1 Amb19957909 [0,0,0,0,0,0|2,0,1]=3 183 B7R1.1 NCc1ccc[s]1 Amb20622043 [0,0,0,0,0,0|1,1,1]=3 184 B7R1.1 NCc1ccn[nH]1 Amb1934827 [0,0,0,0,0,0|3,0,1]=4 185 B7R1.1 NCc1ccno1 Amb10604134 [0,0,0,0,0,0|2,0,1]=3 186 B7R1.1 NCc1cco[n]1 Amb20241091 [0,0,0,0,0,0|3,0,1]=4 187 B7R1.1 NCc1cnco1 Amb10604053 [0,0,0,0,0,0|2,0,1]=3 188 B7R1.1 NCc1cncs1 Amb1087821 [0,0,0,0,0,0|2,1,1]=4 189 B7R1.1 NCc1cncs1 Amb13891841 [0,0,0,0,0,0|2,1,1]=4 190 B7R1.1 NCc1cocn1 Amb10603799 [0,0,0,0,0,0|3,0,1]=4 191 B7R1.1 NCc1cscc1 Amb1140991 [0,0,0,0,0,0|3,0,1]=4 192 B7R1.1 NCc1ncc[nH]1 Amb10071398 [0,0,0,0,0,0|3,0,1]=4 193 B7R1.1 NCc1ncc[nH]1 Amb1068370 [0,0,0,0,0,0|3,0,1]=4 194 B7R1.1 NCc1ncc[nH]1 Amb16233858 [0,0,0,0,0,0|3,0,1]=4 195 B7R1.1 NCc1ncc[nH]1 Amb2154786 [0,0,0,0,0,0|3,0,1]=4 196 B7R1.1 NCc1nccs1 Amb17935776 [0,0,0,0,0,0|2,1,1]=4 197 B7R1.1 NCc1scnc1 Amb13883008 [0,0,0,0,0,0|2,1,1]=4 198 B7R1.1 NN=C1NC=CN1 Amb22490478 [0,0,0,0,0,0|4,0,0]=4 199 B7R1.1 NNc1[nH]cc[n]1 Amb18639144 [0,0,0,0,0,0|4,0,0]=4 200 B7R1.1 NNc1[nH]cc[n]1 Amb22336757 [0,0,0,0,0,0|4,0,0]=4 201 B7R1.1 NNc1[nH]cc[n]1 Amb22491294 [0,0,0,0,0,0|4,0,0]=4 202 B7R1.1 NNc1[n]cc[s]1 Amb22757179 [0,0,0,0,0,0|3,1,0]=4 203 B7R1.1 NNc1[n]cc[s]1 Amb22757202 [0,0,0,0,0,0|3,1,0]=4 204 B7R1.1 NNc1[n]cco1 Amb18120860 [0,0,0,0,0,0|3,0,0]=3 205 B7R1.1 NNc1c[n]c[s]1 Amb24097125 [0,0,0,0,0,0|3,1,0]=4 206 B7R1.1 NNc1c[n]co1 Amb25364440 [0,0,0,0,0,0|3,0,0]=3 207 B7R1.1 NNc1c[s]c[n]1 Amb24646183 [0,0,0,0,0,0|4,0,0]=4 208 B7R1.1 NNc1cc[n][nH]1 Amb24745529 [0,0,0,0,0,0|4,0,0]=4 209 B7R1.1 NNc1cc[n][s]1 Amb25291730 [0,0,0,0,0,0|3,1,0]=4 210 B7R1.1 NNc1cc[s][n]1 Amb25849845 [0,0,0,0,0,0|4,0,0]=4 211 B7R1.1 NNc1ccc[s]1 Amb18203361 [0,0,0,0,0,0|2,1,0]=3 212 B7R1.1 NNc1ccco1 Amb18203069 [0,0,0,0,0,0|2,0,0]=2 213 B7R1.1 NNc1nccs1 Amb1120140 [0,0,0,0,0,0|3,1,0]=4 214 B7R1.1 NOc1ccc[nH]1 Amb25194554 [0,0,0,0,0,0|3,0,0]=3 215 B7R1.1 NOc1ccco1 Amb24652732 [0,0,0,0,0,0|2,0,0]=2 216 B7R1.1 O=CC1=CCC=C1 Amb24437176 [0,0,0,0,0,0|1,0,1]=2 217 B7R1.1 O=CC1=CCCC1 Amb17138358 [0,0,0,0,0,0|1,0,2]=3 218 B7R1.1 O=CC1=CCCO1 Amb18120782 [0,0,0,0,0,0|0,0,2]=2 219 B7R1.1 O=CC1C=CCN1 Amb24617554 [0,0,0,0,0,0|1,0,2]=3 220 B7R1.1 O=CC1C=CCO1 Amb25347483 [0,0,0,0,0,0|0,0,2]=2 221 B7R1.1 O=CC1CC=CC1 Amb18638871 [0,0,0,0,0,0|1,0,2]=3 222 B7R1.1 O=CC1COCO1 Amb25767896 [0,0,0,0,0,0|1,0,3]=4 223 B7R1.1 O=CC=1CC=CC1 Amb25799627 [0,0,0,0,0,0|1,0,0]=1 224 B7R1.1 O=CC=1CCOC1 Amb18120774 [0,0,0,0,0,0|2,0,1]=3 225 B7R1.1 O=CN1CCCO1 Amb24470900 [0,0,0,0,0,0|1,0,3]=4 226 B7R1.1 O=CN1CNC=C1 Amb24657185 [0,0,0,0,0,0|3,0,0]=3 227 B7R1.1 O=C[C@@H]1CCCO1 Amb25338193 [0,0,0,0,0,0|0,0,4]=4 228 B7R1.1 O=C[C@H]1CCC=C1 Amb25116186 [0,0,0,0,0,0|1,0,2]=3 229 B7R1.1 O=C[C@H]1CCCO1 Amb25216742 [0,0,0,0,0,0|0,0,4]=4 230 B7R1.1 O=C[c-]1cccc1 Amb22168256 [0,0,0,0,0,0|1,0,1]=2 231 B7R1.1 O=Cc1[nH][n][n][n]1 Amb18639080 [0,0,0,0,0,0|4,0,0]=4 232 B7R1.1 O=Cc1[n][n]co1 Amb21856468 [0,0,0,0,0,0|2,0,0]=2 233 B7R1.1 O=Cc1[n]c[nH][n]1 Amb20248271 [0,0,0,0,0,0|3,0,0]=3 234 B7R1.1 O=Cc1[n]cc[s]1 Amb22275985 [0,0,0,0,0,0|1,1,0]=2 235 B7R1.1 O=Cc1c[nH][n]c1 Amb21953986 [0,0,0,0,0,0|3,0,0]=3 236 B7R1.1 O=Cc1c[nH]nc1 Amb1935136 [0,0,0,0,0,0|3,0,0]=3 237 B7R1.1 O=Cc1c[n][s][n]1 Amb18641770 [0,0,0,0,0,0|3,0,0]=3 238 B7R1.1 O=Cc1c[n]o[n]1 Amb18199365 [0,0,0,0,0,0|3,0,0]=3 239 B7R1.1 O=Cc1cc[nH][n]1 Amb22737200 [0,0,0,0,0,0|2,0,0]=2 240 B7R1.1 O=Cc1ccc[nH]1 Amb1952995 [0,0,0,0,0,0|1,0,0]=1 241 B7R1.1 O=Cc1ccc[se]1 Amb22730854 [0,0,0,0,0,0|0,1,0]=1 242 B7R1.1 O=Cc1cncs1 Amb2455730 [0,0,0,0,0,0|1,1,0]=2 243 B7R1.1 O=Cc1cscn1 Amb2455729 [0,0,0,0,0,0|2,0,0]=2 244 B7R1.1 O=Cc1ncc[nH]1 Amb2455714 [0,0,0,0,0,0|2,0,0]=2 245 B7R1.1 O=Nc1c[nH]cc1 Amb25378010 [0,0,0,0,0,0|3,0,0]=3 246 B7R1.1 O=Nc1ccc[nH]1 Amb25739902 [0,0,0,0,0,0|2,0,0]=2 247 B7R1.1 O=Nc1ccc[s]1 Amb25223543 [0,0,0,0,0,0|1,1,0]=2 248 B7R1.1 O=Nc1ccco1 Amb25746897 [0,0,0,0,0,0|1,0,0]=1 249 B7R1.1 O=Nc1cocc1 Amb25364569 [0,0,0,0,0,0|3,0,0]=3 250 B7R1.1 O=S=C1NC=CO1 Amb24539442 [0,0,0,0,0,0|2,0,0]=2 251 B7R1.1 O=S[n]1c[n]cc1 Amb20617936 [0,0,0,0,0,0|4,0,0]=4 252 B7R1.1 OC=C1C=CC=C1 Amb24644706 [0,0,0,0,0,0|1,0,1]=2 253 B7R1.1 OCC1=CCCO1 Amb25045240 [0,0,0,0,0,0|0,0,4]=4 254 B7R1.1 OCC1C=CCO1 Amb25222276 [0,0,0,0,0,0|0,0,4]=4 255 B7R1.1 OC[C@@H]1C=CCO1 Amb25169572 [0,0,0,0,0,0|0,0,4]=4 256 B7R1.1 OC[C@@H]1CC=CO1 Amb25120125 [0,0,0,0,0,0|0,0,4]=4 257 B7R1.1 OC[C@H]1C=CCO1 Amb25282911 [0,0,0,0,0,0|0,0,4]=4 258 B7R1.1 OC[C@H]1CC=CO1 Amb25058557 [0,0,0,0,0,0|0,0,4]=4 259 B7R1.1 OCc1[n]cc[s]1 Amb21857481 [0,0,0,0,0,0|1,1,2]=4 260 B7R1.1 OCc1c[nH]cc1 Amb18862403 [0,0,0,0,0,0|2,0,2]=4 261 B7R1.1 OCc1cc[nH]n1 Amb17602658 [0,0,0,0,0,0|2,0,2]=4 262 B7R1.1 OCc1cc[s][n]1 Amb22896461 [0,0,0,0,0,0|2,0,2]=4 263 B7R1.1 OCc1ccn[nH]1 Amb1099131 [0,0,0,0,0,0|2,0,2]=4 264 B7R1.1 OCc1ccns1 Amb16185717 [0,0,0,0,0,0|1,1,2]=4 265 B7R1.1 OCc1cco[n]1 Amb19515377 [0,0,0,0,0,0|2,0,2]=4 266 B7R1.1 OCc1cnco1 Amb10070754 [0,0,0,0,0,0|1,0,2]=3 267 B7R1.1 OCc1cncs1 Amb2455733 [0,0,0,0,0,0|1,1,2]=4 268 B7R1.1 OCc1cocn1 Amb10071193 [0,0,0,0,0,0|2,0,2]=4 269 B7R1.1 OCc1cscn1 Amb2455732 [0,0,0,0,0,0|2,0,2]=4 270 B7R1.1 OCc1ncco1 Amb10071191 [0,0,0,0,0,0|1,0,2]=3 271 B7R1.1 OCn1cccn1 Amb10552412 [0,0,0,0,0,0|2,0,2]=4 272 B7R1.1 ONc1[nH]cc[n]1 Amb25739881 [0,0,0,0,0,0|3,0,1]=4 273 B7R1.1 ONc1[n]cc[s]1 Amb24703503 [0,0,0,0,0,0|2,1,1]=4 274 B7R1.1 O[13CH2][13c]1[13cH]ncs1 Amb17620581 [0,0,0,0,0,0|1,1,2]=4 275 B7R1.1 O\C=C\1/C=CCS1 Amb24480659 [0,0,0,0,0,0|0,1,2]=3 276 B7R1.1 O\N=C\1/C=NC=C1 Amb24579134 [0,0,0,0,0,0|3,0,1]=4 277 B7R1.1 S=Cc1[n]cco1 Amb24541132 [0,0,0,0,0,0|1,1,0]=2 278 B7R1.1 SCc1[nH]cc[n]1 Amb25731254 [0,0,0,0,0,0|2,1,1]=4 279 B7R1.1 SCc1[n]cc[s]1 Amb25241320 [0,0,0,0,0,0|1,2,1]=4 280 B7R1.1 SCc1c[nH]c[n]1 Amb25230610 [0,0,0,0,0,0|2,1,1]=4 281 B7R1.1 SCc1cco[n]1 Amb23440702 [0,0,0,0,0,0|2,1,1]=4 282 B7R1.1 SCc1cscn1 Amb17108587 [0,0,0,0,0,0|2,1,1]=4 283 B7R1.1 [C-]#[N+]c1[n]cc[s]1 Amb25352023 [0,0,0,0,0,0|3,1,0]=4 284 B7R1.1 [C-]#[N+]c1ccc[nH]1 Amb24669375 [0,0,0,0,0,0|3,0,0]=3 285 B7R1.1 [N-]=[N+]=C1C=NC=C1 Amb24756939 [0,0,0,0,0,0|4,0,0]=4 286 B7R1.1 [NH3+]Cc1cccs1 Amb10555898 [0,0,0,0,0,0|1,1,1]=3 287 B7R1.1 c1c[nH]nc1C#N Amb10603084 [0,0,0,0,0,0|3,0,1]=4 288 B7R1.1 c1ncsc1C#N Amb10602916 [0,0,0,0,0,0|2,1,1]=4 289 B7R1.1 c1ocnc1C#N Amb10071472 [0,0,0,0,0,0|3,0,1]=4 290 B6R1.2 Bc1c[nH]c[n]1 Amb25308953 [1,0,0,0,0,0|3,0,0]=4 291 B6R1.2 Bc1c[nH]cc1 Amb24366706 [1,0,0,0,0,0|3,0,0]=4 292 B6R1.2 Bc1ccc[nH]1 Amb24529534 [1,0,0,0,0,0|2,0,0]=3 293 B6R1.2 Bc1ccc[s]1 Amb25662874 [1,0,0,0,0,0|1,1,0]=3 294 B6R1.2 Bc1cocc1 Amb24511389 [1,0,0,0,0,0|3,0,0]=4 295 B6R1.2 BrC1=CCC=N1 Amb25195406 [1,0,0,0,0,0|2,0,1]=4 296 B6R1.2 BrC1=CCCO1 Amb24322605 [1,0,0,0,0,0|1,0,2]=4 297 B6R1.2 Brc1[n]c[n]o1 Amb25376458 [1,0,0,0,0,0|3,0,0]=4 298 B6R1.2 Brc1[n]cco1 Amb19514894 [1,0,0,0,0,0|2,0,0]=3 299 B6R1.2 Brc1c[nH]cc1 Amb18243466 [1,0,0,0,0,0|3,0,0]=4 300 B6R1.2 Brc1c[nH]cn1 Amb2455858 [1,0,0,0,0,0|3,0,0]=4 301 B6R1.2 Brc1c[n]co1 Amb24058248 [1,0,0,0,0,0|2,0,0]=3 302 B6R1.2 Brc1cc[n]o1 Amb20242149 [1,0,0,0,0,0|2,0,0]=3 303 B6R1.2 Brc1cc[s][n]1 Amb18828880 [1,0,0,0,0,0|3,0,0]=4 304 B6R1.2 Brc1ccc[nH]1 Amb24065418 [1,0,0,0,0,0|2,0,0]=3 305 B6R1.2 Brc1ccc[se]1 Amb21964756 [1,0,0,0,0,0|1,1,0]=3 306 B6R1.2 Brc1ccon1 Amb13890359 [1,0,0,0,0,0|3,0,0]=4 307 B6R1.2 Brc1cncs1 Amb2455804 [1,0,0,0,0,0|2,1,0]=4 308 B6R1.2 Brc1cscn1 Amb2447456 [1,0,0,0,0,0|3,0,0]=4 309 B6R1.2 Brc1ncc[nH]1 Amb10068556 [1,0,0,0,0,0|3,0,0]=4 310 B6R1.2 Brc1ncco1 Amb10071482 [1,0,0,0,0,0|2,0,0]=3 311 B6R1.2 C=C1CC=CN1 Amb25745630 [1,0,0,0,0,0|1,0,1]=3 312 B6R1.2 C=C1OCCO1 Amb24477046 [1,0,0,0,0,0|1,0,2]=4 313 B6R1.2 CC1=CCC=C1 Amb22410851 [1,0,0,0,0,0|1,0,2]=4 314 B6R1.2 CC1=CCCO1 Amb20621083 [1,0,0,0,0,0|0,0,3]=4 315 B6R1.2 CC1C=CC=C1 Amb16224918 [1,0,0,0,0,0|1,0,2]=4 316 B6R1.2 CC1C=CC=N1 Amb25026197 [1,0,0,0,0,0|1,0,2]=4 317 B6R1.2 CC=1CN=CC1 Amb25810885 [1,0,0,0,0,0|2,0,1]=4 318 B6R1.2 C[n+]1ccc[s]1 Amb22896462 [1,0,0,0,0,0|1,1,1]=4 319 B6R1.2 C[n+]1cccs1 Amb10552415 [1,0,0,0,0,0|1,1,1]=4 320 B6R1.2 Cc1[n][n]co1 Amb20171395 [1,0,0,0,0,0|2,0,1]=4 321 B6R1.2 Cc1[n]c[n]o1 Amb25684624 [1,0,0,0,0,0|2,0,1]=4 322 B6R1.2 Cc1[n]cco1 Amb22757206 [1,0,0,0,0,0|1,0,1]=3 323 B6R1.2 Cc1c[nH]cc1 Amb10603704 [1,0,0,0,0,0|2,0,1]=4 324 B6R1.2 Cc1c[n]co1 Amb23403175 [1,0,0,0,0,0|1,0,1]=3 325 B6R1.2 Cc1cc[n][s]1 Amb22734260 [1,0,0,0,0,0|1,1,1]=4 326 B6R1.2 Cc1cc[s][n]1 Amb20621563 [1,0,0,0,0,0|2,0,1]=4 327 B6R1.2 Cc1ccco1 Amb2447070 [1,0,0,0,0,0|0,0,1]=2 328 B6R1.2 Cc1cccs1 Amb2447069 [1,0,0,0,0,0|0,1,1]=3 329 B6R1.2 Cc1ccn[nH]1 Amb2236077 [1,0,0,0,0,0|2,0,1]=4 330 B6R1.2 Cc1coc[n]1 Amb20241591 [1,0,0,0,0,0|2,0,1]=4 331 B6R1.2 Cc1cocc1 Amb2447077 [1,0,0,0,0,0|2,0,1]=4 332 B6R1.2 Cc1cscc1 Amb2447071 [1,0,0,0,0,0|2,0,1]=4 333 B6R1.2 Cc1cscn1 Amb1163532 [1,0,0,0,0,0|2,0,1]=4 334 B6R1.2 Cc1ncc[nH]1 Amb1159210 [1,0,0,0,0,0|2,0,1]=4 335 B6R1.2 Cc1ncco1 Amb17399783 [1,0,0,0,0,0|1,0,1]=3 336 B6R1.2 Cc1nccs1 Amb2455765 [1,0,0,0,0,0|1,1,1]=4 337 B6R1.2 ClC1=CCC=C1 Amb22584067 [1,0,0,0,0,0|2,0,1]=4 338 B6R1.2 ClC1C=CC=C1 Amb25780001 [1,0,0,0,0,0|2,0,1]=4 339 B6R1.2 Cl[n]1cccc1 Amb25774278 [1,0,0,0,0,0|3,0,0]=4 340 B6R1.2 Clc1[n]cco1 Amb22054705 [1,0,0,0,0,0|2,0,0]=3 341 B6R1.2 Clc1c[nH]cc1 Amb22490961 [1,0,0,0,0,0|3,0,0]=4 342 B6R1.2 Clc1c[n]c[s]1 Amb21864727 [1,0,0,0,0,0|2,1,0]=4 343 B6R1.2 Clc1cc[nH][n]1 Amb20241888 [1,0,0,0,0,0|3,0,0]=4 344 B6R1.2 Clc1cc[s][n]1 Amb21927817 [1,0,0,0,0,0|3,0,0]=4 345 B6R1.2 Clc1ccc[nH]1 Amb17672350 [1,0,0,0,0,0|2,0,0]=3 346 B6R1.2 Clc1cocc1 Amb24333769 [1,0,0,0,0,0|3,0,0]=4 347 B6R1.2 Clc1cscn1 Amb10602719 [1,0,0,0,0,0|3,0,0]=4 348 B6R1.2 Clc1ncc[nH]1 Amb10068570 [1,0,0,0,0,0|3,0,0]=4 349 B6R1.2 Clc1nccs1 Amb2455949 [1,0,0,0,0,0|2,1,0]=4 350 B6R1.2 Cn1cccn1 Amb1088902 [1,0,0,0,0,0|2,0,1]=4 351 B6R1.2 FC1=CCCO1 Amb24322815 [1,0,0,0,0,0|1,0,2]=4 352 B6R1.2 Fc1[nH]cc[n]1 Amb22436838 [1,0,0,0,0,0|3,0,0]=4 353 B6R1.2 Fc1[n]cc[s]1 Amb20621379 [1,0,0,0,0,0|2,1,0]=4 354 B6R1.2 Fc1c[nH]cn1 Amb16234263 [1,0,0,0,0,0|3,0,0]=4 355 B6R1.2 Fc1c[n]co1 Amb25364574 [1,0,0,0,0,0|2,0,0]=3 356 B6R1.2 Fc1c[s]c[n]1 Amb24097116 [1,0,0,0,0,0|3,0,0]=4 357 B6R1.2 Fc1cc[nH][n]1 Amb21858977 [1,0,0,0,0,0|3,0,0]=4 358 B6R1.2 Fc1cscc1 Amb13783621 [1,0,0,0,0,0|3,0,0]=4 359 B6R1.2 Fc1ncc[nH]1 Amb16234262 [1,0,0,0,0,0|3,0,0]=4 360 B6R1.2 IC1=CCCO1 Amb24322816 [1,0,0,0,0,0|1,0,2]=4 361 B6R1.2 IC1C=CC=C1 Amb25189843 [1,0,0,0,0,0|2,0,1]=4 362 B6R1.2 Ic1[n]cco1 Amb23439118 [1,0,0,0,0,0|2,0,0]=3 363 B6R1.2 Ic1c[nH]cc1 Amb24763803 [1,0,0,0,0,0|3,0,0]=4 364 B6R1.2 Ic1c[n]c[s]1 Amb24087561 [1,0,0,0,0,0|2,1,0]=4 365 B6R1.2 Ic1c[s]c[n]1 Amb22057367 [1,0,0,0,0,0|3,0,0]=4 366 B6R1.2 Ic1cc[nH]n1 Amb10975340 [1,0,0,0,0,0|3,0,0]=4 367 B6R1.2 Ic1cc[n][s]1 Amb25136169 [1,0,0,0,0,0|2,1,0]=4 368 B6R1.2 Ic1cc[n]o1 Amb25793636 [1,0,0,0,0,0|2,0,0]=3 369 B6R1.2 Ic1ccc[nH]1 Amb25663213 [1,0,0,0,0,0|2,0,0]=3 370 B6R1.2 Ic1ccco1 Amb17672748 [1,0,0,0,0,0|1,0,0]=2 371 B6R1.2 Ic1cnc[nH]1 Amb2455806 [1,0,0,0,0,0|3,0,0]=4 372 B6R1.2 Ic1coc[n]1 Amb24620615 [1,0,0,0,0,0|3,0,0]=4 373 B6R1.2 Ic1cocc1 Amb24686192 [1,0,0,0,0,0|3,0,0]=4 374 B6R1.2 N=C1NC=CS1 Amb22166858 [1,0,0,0,0,0|2,1,0]=4 375 B6R1.2 NC1C=CC=C1 Amb25351781 [1,0,0,0,0,0|2,0,1]=4 376 B6R1.2 NC=1C=CCN1 Amb25208790 [1,0,0,0,0,0|2,0,1]=4 377 B6R1.2 N[n]1ccc[n]1 Amb22233569 [1,0,0,0,0,0|3,0,0]=4 378 B6R1.2 Nc1[nH]cc[nH+]1 Amb10574070 [1,0,0,0,0,0|3,0,0]=4 379 B6R1.2 Nc1[n][n]co1 Amb19516986 [1,0,0,0,0,0|3,0,0]=4 380 B6R1.2 Nc1[n]c[n]o1 Amb18943952 [1,0,0,0,0,0|3,0,0]=4 381 B6R1.2 Nc1[s]cc[s+]1 Amb24479163 [1,0,0,0,0,0|2,1,0]=4 382 B6R1.2 Nc1c[nH]c[n]1 Amb20247901 [1,0,0,0,0,0|3,0,0]=4 383 B6R1.2 Nc1c[nH]c[n]1 Amb20620264 [1,0,0,0,0,0|3,0,0]=4 384 B6R1.2 Nc1c[nH]cc1 Amb18065305 [1,0,0,0,0,0|3,0,0]=4 385 B6R1.2 Nc1c[nH]cc1 Amb22491642 [1,0,0,0,0,0|3,0,0]=4 386 B6R1.2 Nc1c[n]co1 Amb21962026 [1,0,0,0,0,0|2,0,0]=3 387 B6R1.2 Nc1c[n]co1 Amb21963496 [1,0,0,0,0,0|2,0,0]=3 388 B6R1.2 Nc1c[s]c[n]1 Amb22495658 [1,0,0,0,0,0|3,0,0]=4 389 B6R1.2 Nc1c[s]cc1 Amb19515444 [1,0,0,0,0,0|3,0,0]=4 390 B6R1.2 Nc1c[s]cc1 Amb22405919 [1,0,0,0,0,0|3,0,0]=4 391 B6R1.2 Nc1cc[nH][n]1 Amb20241114 [1,0,0,0,0,0|3,0,0]=4 392 B6R1.2 Nc1cc[nH][n]1 Amb22002683 [1,0,0,0,0,0|3,0,0]=4 393 B6R1.2 Nc1cc[nH]n1 Amb2235300 [1,0,0,0,0,0|3,0,0]=4 394 B6R1.2 Nc1cc[n][s]1 Amb18203020 [1,0,0,0,0,0|2,1,0]=4 395 B6R1.2 Nc1cc[s][n]1 Amb22235783 [1,0,0,0,0,0|3,0,0]=4 396 B6R1.2 Nc1ccc[s]1 Amb21857748 [1,0,0,0,0,0|1,1,0]=3 397 B6R1.2 Nc1ccco1 Amb18203215 [1,0,0,0,0,0|1,0,0]=2 398 B6R1.2 Nc1cccs1 Amb10603635 [1,0,0,0,0,0|1,1,0]=3 399 B6R1.2 Nc1ccn[nH]1 Amb1930440 [1,0,0,0,0,0|3,0,0]=4 400 B6R1.2 Nc1ccsc1 Amb17935671 [1,0,0,0,0,0|3,0,0]=4 401 B6R1.2 Nc1coc[n]1 Amb22002224 [1,0,0,0,0,0|3,0,0]=4 402 B6R1.2 Nc1coc[n]1 Amb22284836 [1,0,0,0,0,0|3,0,0]=4 403 B6R1.2 Nc1cocc1 Amb22230735 [1,0,0,0,0,0|3,0,0]=4 404 B6R1.2 Nc1cscc1 Amb13889594 [1,0,0,0,0,0|3,0,0]=4 405 B6R1.2 Nc1cscn1 Amb10600518 [1,0,0,0,0,0|3,0,0]=4 406 B6R1.2 O=C1C=CCN1 Amb20241082 [1,0,0,0,0,0|1,0,1]=3 407 B6R1.2 O=C1C=CCS1 Amb22336458 [1,0,0,0,0,0|0,1,1]=3 408 B6R1.2 O=C1C=CN=N1 Amb22230022 [1,0,0,0,0,0|2,0,0]=3 409 B6R1.2 O=C1C=CNN1 Amb19958916 [1,0,0,0,0,0|2,0,0]=3 410 B6R1.2 O=C1C=CON1 Amb22055592 [1,0,0,0,0,0|2,0,0]=3 411 B6R1.2 O=C1C=CSN1 Amb19895016 [1,0,0,0,0,0|2,0,0]=3 412 B6R1.2 O=C1C=NC=C1 Amb25746212 [1,0,0,0,0,0|2,0,0]=3 413 B6R1.2 O=C1C=NC=N1 Amb25662161 [1,0,0,0,0,0|2,0,0]=3 414 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,0,0,0|1,0,1]=3 415 B6R1.2 O=C1CC=CN1 Amb22235167 [1,0,0,0,0,0|1,0,1]=3 416 B6R1.2 O=C1CN=CO1 Amb24333834 [1,0,0,0,0,0|1,0,1]=3 417 B6R1.2 O=C1CNC=C1 Amb22234991 [1,0,0,0,0,0|2,0,0]=3 418 B6R1.2 O=C1CNCO1 Amb24661408 [1,0,0,0,0,0|1,0,2]=4 419 B6R1.2 O=C1COC=C1 Amb24107591 [1,0,0,0,0,0|2,0,0]=3 420 B6R1.2 O=C1CSC=C1 Amb22736500 [1,0,0,0,0,0|2,0,0]=3 421 B6R1.2 O=C1CS[Ca]O1 Amb22369695 [1,0,0,0,0,0|2,0,1]=4 422 B6R1.2 O=C1N=CC=N1 Amb25138138 [1,0,0,0,0,0|2,0,0]=3 423 B6R1.2 O=C1N=CCO1 Amb25024901 [1,0,0,0,0,0|1,0,1]=3 424 B6R1.2 O=C1NC=CN1 Amb19516737 [1,0,0,0,0,0|2,0,0]=3 425 B6R1.2 O=C1NC=CO1 Amb20671008 [1,0,0,0,0,0|1,0,0]=2 426 B6R1.2 O=C1NC=CS1 Amb19271596 [1,0,0,0,0,0|1,1,0]=3 427 B6R1.2 O=C1NC=NN1 Amb20243425 [1,0,0,0,0,0|3,0,0]=4 428 B6R1.2 O=C1NN=CO1 Amb20667671 [1,0,0,0,0,0|2,0,0]=3 429 B6R1.2 O=C1NN=CS1 Amb22491285 [1,0,0,0,0,0|2,1,0]=4 430 B6R1.2 O=C1NNC=N1 Amb20239428 [1,0,0,0,0,0|3,0,0]=4 431 B6R1.2 O=C1OC=CO1 Amb20239430 [1,0,0,0,0,0|1,0,0]=2 432 B6R1.2 O=[13C]1OCCO1 Amb22338878 [1,0,0,0,0,0|1,0,2]=4 433 B6R1.2 O=[13C]1O[13CH2][13CH2]O1 Amb22351705 [1,0,0,0,0,0|1,0,2]=4 434 B6R1.2 OC1C=CC=N1 Amb24566703 [1,0,0,0,0,0|1,0,2]=4 435 B6R1.2 Oc1[n][n]co1 Amb22586631 [1,0,0,0,0,0|2,0,1]=4 436 B6R1.2 Oc1c[nH]c[n]1 Amb25147553 [1,0,0,0,0,0|2,0,1]=4 437 B6R1.2 Oc1c[nH]cc1 Amb24317462 [1,0,0,0,0,0|2,0,1]=4 438 B6R1.2 Oc1c[n]co1 Amb25301524 [1,0,0,0,0,0|1,0,1]=3 439 B6R1.2 Oc1cc[n][s]1 Amb24599867 [1,0,0,0,0,0|1,1,1]=4 440 B6R1.2 Oc1cc[n]o1 Amb25807641 [1,0,0,0,0,0|1,0,1]=3 441 B6R1.2 Oc1cc[s][n]1 Amb22371253 [1,0,0,0,0,0|2,0,1]=4 442 B6R1.2 Oc1ccco1 Amb22230736 [1,0,0,0,0,0|0,0,1]=2 443 B6R1.2 Oc1cccs1 Amb17201836 [1,0,0,0,0,0|0,1,1]=3 444 B6R1.2 Oc1ccn[nH]1 Amb17621677 [1,0,0,0,0,0|2,0,1]=4 445 B6R1.2 Oc1cco[n]1 Amb22736007 [1,0,0,0,0,0|2,0,1]=4 446 B6R1.2 Oc1cncs1 Amb10599639 [1,0,0,0,0,0|1,1,1]=4 447 B6R1.2 Oc1coc[n]1 Amb25284479 [1,0,0,0,0,0|2,0,1]=4 448 B6R1.2 Oc1cscc1 Amb16231253 [1,0,0,0,0,0|2,0,1]=4 449 B6R1.2 Oc1cscn1 Amb10600519 [1,0,0,0,0,0|2,0,1]=4 450 B6R1.2 On1cccn1 Amb10067876 [1,0,0,0,0,0|2,0,1]=4 451 B6R1.2 Pc1[nH]cc[n]1 Amb25132165 [1,0,0,0,0,0|3,0,0]=4 452 B6R1.2 S=C1C=CSS1 Amb19132030 [1,0,0,0,0,0|1,2,0]=4 453 B6R1.2 S=C1CC=CO1 Amb25365370 [1,0,0,0,0,0|0,1,1]=3 454 B6R1.2 S=C1CCC=C1 Amb25147777 [1,0,0,0,0,0|1,1,1]=4 455 B6R1.2 S=C1NC=CN1 Amb19148165 [1,0,0,0,0,0|2,1,0]=4 456 B6R1.2 S=C1NC=CO1 Amb21936248 [1,0,0,0,0,0|1,1,0]=3 457 B6R1.2 S=C1NC=CS1 Amb22492748 [1,0,0,0,0,0|1,2,0]=4 458 B6R1.2 S=C1SC=CS1 Amb20001458 [1,0,0,0,0,0|1,2,0]=4 459 B6R1.2 S=c1scc[nH]1 Amb10552375 [1,0,0,0,0,0|1,2,0]=4 460 B6R1.2 Sc1c[n]c[nH]1 Amb24723086 [1,0,0,0,0,0|2,1,0]=4 461 B6R1.2 Sc1c[n]c[s]1 Amb24090165 [1,0,0,0,0,0|1,2,0]=4 462 B6R1.2 Sc1c[s]c[n]1 Amb24099741 [1,0,0,0,0,0|2,1,0]=4 463 B6R1.2 Sc1ccc[nH]1 Amb25833767 [1,0,0,0,0,0|1,1,0]=3 464 B6R1.2 Sc1cscc1 Amb16232450 [1,0,0,0,0,0|2,1,0]=4 465 B6R1.2 Sc1nccs1 Amb1137208 [1,0,0,0,0,0|1,2,0]=4 466 B6R1.2 [13CH3]c1ccco1 Amb22367321 [1,0,0,0,0,0|0,0,1]=2 467 B6R1.2 [Li]C1C=CC=C1 Amb22054138 [1,0,0,0,0,0|2,0,1]=4 468 B6R1.2 [Li]c1cccs1 Amb17939215 [1,0,0,0,0,0|1,1,0]=3 469 B6R1.2 [Mn]C=1CC=CC1 Amb22169701 [1,0,0,0,0,0|2,0,0]=3 470 B6R1.2 [NH3+]c1[nH]cc[n]1 Amb22730013 [1,0,0,0,0,0|3,0,0]=4 471 B6R1.2 [Na]C1C=CC=C1 Amb22338129 [1,0,0,0,0,0|2,0,1]=4 472 B6R1.2 [SiH3]c1[n]cc[s]1 Amb24085062 [1,0,0,0,0,0|1,2,0]=4 473 B6R1.2 [SiH3]c1ccco1 Amb24511582 [1,0,0,0,0,0|0,1,0]=2 474 B6R1.2 [Tl]C1C=CC=C1 Amb22338319 [1,0,0,0,0,0|2,0,1]=4 475 B8R1.1 Brc1c[n]c(CBr)o1 Amb25132633 [0,1,0,0,0,0|2,0,1]=4 476 B8R1.1 Brc1c[s]c(c1)[Mg]Br Amb22897329 [0,1,0,0,0,0|2,1,0]=4 477 B8R1.1 Brc1cc(CBr)o[n]1 Amb22233936 [0,1,0,0,0,0|2,0,1]=4 478 B8R1.1 Brc1cc(CI)[s]c1 Amb24354485 [0,1,0,0,0,0|1,1,1]=4 479 B8R1.1 Brc1cc(on1)C=O Amb10602266 [0,1,0,0,0,0|1,0,0]=2 480 B8R1.1 Brc1cc(sc1)C=O Amb1806177 [0,1,0,0,0,0|0,1,0]=2 481 B8R1.1 Brc1ccc(CBr)[s]1 Amb22735998 [0,1,0,0,0,0|1,1,1]=4 482 B8R1.1 Brc1ccc(CBr)o1 Amb22498773 [0,1,0,0,0,0|1,0,1]=3 483 B8R1.1 Brc1ccc(CI)[s]1 Amb25080467 [0,1,0,0,0,0|1,1,1]=4 484 B8R1.1 Brc1ccc([Mg]Br)[s]1 Amb22897555 [0,1,0,0,0,0|2,1,0]=4 485 B8R1.1 Brc1ccc([s]1)[Zn]Br Amb22000379 [0,1,0,0,0,0|2,1,0]=4 486 B8R1.1 Brc1ccc(o1)C#N Amb1058729 [0,1,0,0,0,0|1,0,1]=3 487 B8R1.1 Brc1ccc(o1)C=O Amb1153092 [0,1,0,0,0,0|0,0,0]=1 488 B8R1.1 Brc1ccc(s1)C=C Amb17594904 [0,1,0,0,0,0|1,1,0]=3 489 B8R1.1 Brc1ccc(s1)C=O Amb1161542 [0,1,0,0,0,0|0,1,0]=2 490 B8R1.1 Brc1cn(nc1)C=C Amb10608116 [0,1,0,0,0,0|3,0,0]=4 491 B8R1.1 Brc1cnc(s1)C=O Amb10606154 [0,1,0,0,0,0|1,1,0]=3 492 B8R1.1 Brc1coc(CBr)c1 Amb25113984 [0,1,0,0,0,0|1,0,1]=3 493 B8R1.1 Brc1csc(n1)C=O Amb2447476 [0,1,0,0,0,0|1,1,0]=3 494 B8R1.1 Brc1nc(co1)C=O Amb10067556 [0,1,0,0,0,0|2,0,0]=3 495 B8R1.1 Brc1nc(cs1)C=O Amb10067250 [0,1,0,0,0,0|2,0,0]=3 496 B8R1.1 Brc1ncc(o1)C=O Amb10067561 [0,1,0,0,0,0|1,0,0]=2 497 B8R1.1 Brc1ncc(s1)C=O Amb2455702 [0,1,0,0,0,0|1,1,0]=3 498 B8R1.1 C#Cc1[n]cc(Br)o1 Amb25682488 [0,1,0,0,0,0|2,0,1]=4 499 B8R1.1 C#Cc1[n]cc(N)o1 Amb24527680 [0,1,0,0,0,0|2,0,1]=4 500 B8R1.1 C#Cc1cc(Br)c[s]1 Amb25063735 [0,1,0,0,0,0|1,1,1]=4 501 B8R1.1 C#Cc1cc(Br)co1 Amb24518887 [0,1,0,0,0,0|1,0,1]=3 502 B8R1.1 C#Cc1ccc(Br)o1 Amb25132971 [0,1,0,0,0,0|1,0,1]=3 503 B8R1.1 C#Cc1ccc(Cl)[s]1 Amb21964540 [0,1,0,0,0,0|1,1,1]=4 504 B8R1.1 C#Cc1ccc(F)[s]1 Amb24269206 [0,1,0,0,0,0|1,1,1]=4 505 B8R1.1 C=C1CCC(=C1)C=C Amb24432658 [0,1,0,0,0,0|2,0,1]=4 506 B8R1.1 C=CC1=CCC(=O)O1 Amb24695919 [0,1,0,0,0,0|1,0,1]=3 507 B8R1.1 C=CC1=COC(=S)N1 Amb25260432 [0,1,0,0,0,0|3,0,0]=4 508 B8R1.1 C=CC1=NCC(=O)O1 Amb24686009 [0,1,0,0,0,0|2,0,1]=4 509 B8R1.1 C=CC=1BC(N)=CC1 Amb25113952 [0,1,0,0,0,0|2,0,0]=3 510 B8R1.1 C=C[C@@H]1C=CC(=O)O1 Amb25106519 [0,1,0,0,0,0|1,0,1]=3 511 B8R1.1 C=C[n]1cc(N)c[n]1 Amb25253102 [0,1,0,0,0,0|3,0,0]=4 512 B8R1.1 C=C[n]1ccc(N)[n]1 Amb25142437 [0,1,0,0,0,0|3,0,0]=4 513 B8R1.1 C=Cc1[n]c(Br)c[s]1 Amb22748648 [0,1,0,0,0,0|2,1,0]=4 514 B8R1.1 C=Cc1[n]cc(Cl)[s]1 Amb24475132 [0,1,0,0,0,0|2,1,0]=4 515 B8R1.1 C=Cc1[n]cc(I)[s]1 Amb25343803 [0,1,0,0,0,0|2,1,0]=4 516 B8R1.1 C=Cc1[n]cc(N)[s]1 Amb24615898 [0,1,0,0,0,0|2,1,0]=4 517 B8R1.1 C=Cc1[n]cc(N)o1 Amb24518672 [0,1,0,0,0,0|2,0,0]=3 518 B8R1.1 C=Cc1c[n]c(N)[s]1 Amb22235493 [0,1,0,0,0,0|2,1,0]=4 519 B8R1.1 C=Cc1cc(Br)c[s]1 Amb25742529 [0,1,0,0,0,0|1,1,0]=3 520 B8R1.1 C=Cc1ccc(Br)o1 Amb25264206 [0,1,0,0,0,0|1,0,0]=2 521 B8R1.1 C=Cc1ccc(Cl)o1 Amb25684642 [0,1,0,0,0,0|1,0,0]=2 522 B8R1.1 C=Cc1ccc(N)[nH]1 Amb24610963 [0,1,0,0,0,0|2,0,0]=3 523 B8R1.1 C=Cc1ccc(N)[s]1 Amb25312448 [0,1,0,0,0,0|1,1,0]=3 524 B8R1.1 CC1C=C(C=O)N=N1 Amb24693002 [0,1,0,0,0,0|2,0,1]=4 525 B8R1.1 CC1CCC(C=O)=C1 Amb18641617 [0,1,0,0,0,0|1,0,2]=4 526 B8R1.1 CC=1CC(=CC1)C#N Amb22229825 [0,1,0,0,0,0|2,0,1]=4 527 B8R1.1 CC=1CC(C=O)=CC1 Amb22229827 [0,1,0,0,0,0|1,0,0]=2 528 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,1,0,0,0,0|1,0,2]=4 529 B8R1.1 CCc1[n]cc(Br)o1 Amb25709768 [0,1,0,0,0,0|2,0,1]=4 530 B8R1.1 CCc1[n]cc(N)o1 Amb18559669 [0,1,0,0,0,0|2,0,1]=4 531 B8R1.1 CCc1c[n]c(Br)o1 Amb25830436 [0,1,0,0,0,0|2,0,1]=4 532 B8R1.1 CCc1c[n]c(I)o1 Amb24543344 [0,1,0,0,0,0|2,0,1]=4 533 B8R1.1 CCc1c[n]c(N)o1 Amb18947812 [0,1,0,0,0,0|2,0,1]=4 534 B8R1.1 CCc1c[n]c(S)o1 Amb24483103 [0,1,0,0,0,0|2,0,1]=4 535 B8R1.1 CCc1cc(Br)[n]o1 Amb24417269 [0,1,0,0,0,0|2,0,1]=4 536 B8R1.1 CCc1cc(Br)c[s]1 Amb20619491 [0,1,0,0,0,0|1,1,1]=4 537 B8R1.1 CCc1cc(C)c[nH]1 Amb17672338 [0,1,0,0,0,0|2,0,1]=4 538 B8R1.1 CCc1cc(Cl)[n]o1 Amb24483200 [0,1,0,0,0,0|2,0,1]=4 539 B8R1.1 CCc1cc(Cl)c[s]1 Amb25120850 [0,1,0,0,0,0|1,1,1]=4 540 B8R1.1 CCc1cc(N)c[nH]1 Amb18676431 [0,1,0,0,0,0|2,0,1]=4 541 B8R1.1 CCc1cc(N)c[s]1 Amb18143965 [0,1,0,0,0,0|1,1,1]=4 542 B8R1.1 CCc1cc(O)[n]o1 Amb22754624 [0,1,0,0,0,0|2,0,1]=4 543 B8R1.1 CCc1cc(no1)N Amb10552510 [0,1,0,0,0,0|2,0,1]=4 544 B8R1.1 CCc1ccc(C)[nH]1 Amb17672339 [0,1,0,0,0,0|2,0,1]=4 545 B8R1.1 CCc1ccc(Cl)[s]1 Amb25811685 [0,1,0,0,0,0|1,1,1]=4 546 B8R1.1 CCc1ccc(I)[s]1 Amb24332471 [0,1,0,0,0,0|1,1,1]=4 547 B8R1.1 CCc1ccc(N)[nH]1 Amb18676453 [0,1,0,0,0,0|2,0,1]=4 548 B8R1.1 CCc1ccc(O)[s]1 Amb20617898 [0,1,0,0,0,0|1,1,1]=4 549 B8R1.1 CCc1ccc(S)s1 Amb17939214 [0,1,0,0,0,0|1,1,1]=4 550 B8R1.1 CCc1ccc(o1)Br Amb10600653 [0,1,0,0,0,0|1,0,1]=3 551 B8R1.1 CCc1ccc(o1)N Amb10600654 [0,1,0,0,0,0|1,0,1]=3 552 B8R1.1 CCc1ccc(s1)Br Amb10600651 [0,1,0,0,0,0|1,1,1]=4 553 B8R1.1 CCc1ccc(s1)C Amb15691670 [0,1,0,0,0,0|1,1,1]=4 554 B8R1.1 CCc1ccc(s1)N Amb10600652 [0,1,0,0,0,0|1,1,1]=4 555 B8R1.1 CNc1cc(Br)[n]o1 Amb25245070 [0,1,0,0,0,0|3,0,0]=4 556 B8R1.1 CNc1cc(Br)c[s]1 Amb18565046 [0,1,0,0,0,0|2,1,0]=4 557 B8R1.1 CNc1ccc(Br)[s]1 Amb18055073 [0,1,0,0,0,0|2,1,0]=4 558 B8R1.1 CNc1ccc(Cl)[s]1 Amb18055066 [0,1,0,0,0,0|2,1,0]=4 559 B8R1.1 COC1=CC(=O)CO1 Amb25831195 [0,1,0,0,0,0|2,0,1]=4 560 B8R1.1 COC1=CCC(=O)O1 Amb24695758 [0,1,0,0,0,0|2,0,1]=4 561 B8R1.1 COC1C=CC(=O)O1 Amb22490509 [0,1,0,0,0,0|2,0,1]=4 562 B8R1.1 CO[C@@H]1C=CC(=O)O1 Amb25144040 [0,1,0,0,0,0|2,0,1]=4 563 B8R1.1 COc1cc(Br)c[s]1 Amb25827956 [0,1,0,0,0,0|2,1,0]=4 564 B8R1.1 COc1cc(Br)co1 Amb25204360 [0,1,0,0,0,0|2,0,0]=3 565 B8R1.1 COc1cc(I)c[s]1 Amb25663329 [0,1,0,0,0,0|2,1,0]=4 566 B8R1.1 COc1cc(no1)N Amb10602950 [0,1,0,0,0,0|3,0,0]=4 567 B8R1.1 COc1ccc(Br)[nH]1 Amb18191033 [0,1,0,0,0,0|3,0,0]=4 568 B8R1.1 COc1ccc(Br)[s]1 Amb18190248 [0,1,0,0,0,0|2,1,0]=4 569 B8R1.1 COc1ccc(F)o1 Amb25783067 [0,1,0,0,0,0|2,0,0]=3 570 B8R1.1 COc1ccc(I)o1 Amb25304106 [0,1,0,0,0,0|2,0,0]=3 571 B8R1.1 COc1ccc(N)[s]1 Amb18202776 [0,1,0,0,0,0|2,1,0]=4 572 B8R1.1 COc1ccc(N)o1 Amb18203371 [0,1,0,0,0,0|2,0,0]=3 573 B8R1.1 CSc1[n]c(Br)co1 Amb25662577 [0,1,0,0,0,0|3,0,0]=4 574 B8R1.1 CSc1cc(Br)c[s]1 Amb25844408 [0,1,0,0,0,0|2,1,0]=4 575 B8R1.1 CSc1cc(Br)co1 Amb24728302 [0,1,0,0,0,0|2,0,0]=3 576 B8R1.1 CSc1cc(N)c[s]1 Amb25180115 [0,1,0,0,0,0|2,1,0]=4 577 B8R1.1 CSc1ccc(C)s1 Amb17672797 [0,1,0,0,0,0|2,1,0]=4 578 B8R1.1 CSc1ccc(I)[s]1 Amb24616101 [0,1,0,0,0,0|2,1,0]=4 579 B8R1.1 CSc1ccc(N)[nH]1 Amb18203243 [0,1,0,0,0,0|3,0,0]=4 580 B8R1.1 CSc1ccc(o1)C Amb10070287 [0,1,0,0,0,0|2,0,0]=3 581 B8R1.1 C[C@@H]1C=C[C@@H](C=O)O1 Amb24573367 [0,1,0,0,0,0|0,0,2]=3 582 B8R1.1 C[C@@H]1CCC(C=O)=C1 Amb25839230 [0,1,0,0,0,0|1,0,2]=4 583 B8R1.1 C[C@H]1CCC(C=O)=C1 Amb25760068 [0,1,0,0,0,0|1,0,2]=4 584 B8R1.1 C[n]1c[n]c(C=C)c1 Amb24444057 [0,1,0,0,0,0|3,0,0]=4 585 B8R1.1 C[n]1cc(C=C)cc1 Amb25144090 [0,1,0,0,0,0|3,0,0]=4 586 B8R1.1 C[n]1cc(cc1)N=O Amb25377423 [0,1,0,0,0,0|3,0,0]=4 587 B8R1.1 C\C=C\1/C=CC(=O)O1 Amb24558315 [0,1,0,0,0,0|1,0,0]=2 588 B8R1.1 C\C=C\1/CCC(=O)O1 Amb24751500 [0,1,0,0,0,0|1,0,2]=4 589 B8R1.1 C\N=C\1/C=CC(=O)O1 Amb24707968 [0,1,0,0,0,0|2,0,0]=3 590 B8R1.1 Cc1[nH][n]c(C=O)[n]1 Amb24572240 [0,1,0,0,0,0|3,0,0]=4 591 B8R1.1 Cc1[nH]cc(C=S)[n]1 Amb25253227 [0,1,0,0,0,0|2,1,0]=4 592 B8R1.1 Cc1[n][n]c(C=O)o1 Amb22011678 [0,1,0,0,0,0|2,0,0]=3 593 B8R1.1 Cc1[n]c(C=C)c[s]1 Amb24097145 [0,1,0,0,0,0|3,0,0]=4 594 B8R1.1 Cc1[n]c(C=C)o[n]1 Amb25731392 [0,1,0,0,0,0|3,0,0]=4 595 B8R1.1 Cc1[n]cc(C#N)o1 Amb23437345 [0,1,0,0,0,0|2,0,1]=4 596 B8R1.1 Cc1[n]cc(CCl)o1 Amb23437341 [0,1,0,0,0,0|2,0,1]=4 597 B8R1.1 Cc1[n]cc(CN)o1 Amb23437344 [0,1,0,0,0,0|2,0,1]=4 598 B8R1.1 Cc1[n]cc(o1)SC Amb24742037 [0,1,0,0,0,0|3,0,0]=4 599 B8R1.1 Cc1c[n]c(C#N)o1 Amb25080137 [0,1,0,0,0,0|2,0,1]=4 600 B8R1.1 Cc1c[n]c(CC)o1 Amb25312627 [0,1,0,0,0,0|2,0,1]=4 601 B8R1.1 Cc1c[n]c(CCl)o1 Amb19375353 [0,1,0,0,0,0|2,0,1]=4 602 B8R1.1 Cc1c[n]c(CO)o1 Amb22039458 [0,1,0,0,0,0|1,0,2]=4 603 B8R1.1 Cc1c[n]c(NC)o1 Amb24689223 [0,1,0,0,0,0|3,0,0]=4 604 B8R1.1 Cc1c[s]c(CC)c1 Amb25270747 [0,1,0,0,0,0|1,1,1]=4 605 B8R1.1 Cc1cc(C#C)o[n]1 Amb25772961 [0,1,0,0,0,0|2,0,1]=4 606 B8R1.1 Cc1cc(C=C)c[s]1 Amb25345455 [0,1,0,0,0,0|3,0,0]=4 607 B8R1.1 Cc1cc(C=O)c[nH]1 Amb18833125 [0,1,0,0,0,0|2,0,0]=3 608 B8R1.1 Cc1cc(C=O)oc1 Amb18124164 [0,1,0,0,0,0|0,0,0]=1 609 B8R1.1 Cc1cc(CBr)[s]c1 Amb25363165 [0,1,0,0,0,0|1,1,1]=4 610 B8R1.1 Cc1cc(CC)o[n]1 Amb24524276 [0,1,0,0,0,0|2,0,1]=4 611 B8R1.1 Cc1cc(CN)[s]c1 Amb22496138 [0,1,0,0,0,0|1,1,1]=4 612 B8R1.1 Cc1cc(CN)o[n]1 Amb22284238 [0,1,0,0,0,0|2,0,1]=4 613 B8R1.1 Cc1cc(CO)o[n]1 Amb24094149 [0,1,0,0,0,0|1,0,2]=4 614 B8R1.1 Cc1cc(CO)oc1 Amb24066149 [0,1,0,0,0,0|0,0,2]=3 615 B8R1.1 Cc1cc(NN)o[n]1 Amb25127850 [0,1,0,0,0,0|3,0,0]=4 616 B8R1.1 Cc1cc([nH]c1)CO Amb10069985 [0,1,0,0,0,0|1,0,2]=4 617 B8R1.1 Cc1cc([nH]n1)C=O Amb1935250 [0,1,0,0,0,0|2,0,0]=3 618 B8R1.1 Cc1cc(on1)C#N Amb15701525 [0,1,0,0,0,0|2,0,1]=4 619 B8R1.1 Cc1cc(on1)CN Amb10610510 [0,1,0,0,0,0|2,0,1]=4 620 B8R1.1 Cc1cc(on1)CN Amb1911547 [0,1,0,0,0,0|2,0,1]=4 621 B8R1.1 Cc1cc(sc1)C=O Amb2447336 [0,1,0,0,0,0|0,1,0]=2 622 B8R1.1 Cc1ccc(C=C)[nH]1 Amb25090830 [0,1,0,0,0,0|2,0,0]=3 623 B8R1.1 Cc1ccc(C=C)o1 Amb22126655 [0,1,0,0,0,0|1,0,0]=2 624 B8R1.1 Cc1ccc(CBr)[nH]1 Amb24502253 [0,1,0,0,0,0|2,0,1]=4 625 B8R1.1 Cc1ccc(CBr)[s]1 Amb18325317 [0,1,0,0,0,0|1,1,1]=4 626 B8R1.1 Cc1ccc(CC)o1 Amb22235241 [0,1,0,0,0,0|1,0,1]=3 627 B8R1.1 Cc1ccc(CCl)[nH]1 Amb25315059 [0,1,0,0,0,0|2,0,1]=4 628 B8R1.1 Cc1ccc(CI)o1 Amb25853805 [0,1,0,0,0,0|1,0,1]=3 629 B8R1.1 Cc1ccc(CN)[nH]1 Amb23148016 [0,1,0,0,0,0|2,0,1]=4 630 B8R1.1 Cc1ccc(CO)[nH]1 Amb23149153 [0,1,0,0,0,0|1,0,2]=4 631 B8R1.1 Cc1ccc(NC)[s]1 Amb24715157 [0,1,0,0,0,0|2,1,0]=4 632 B8R1.1 Cc1ccc(NN)[nH]1 Amb24122408 [0,1,0,0,0,0|3,0,0]=4 633 B8R1.1 Cc1ccc(NN)[s]1 Amb22504634 [0,1,0,0,0,0|2,1,0]=4 634 B8R1.1 Cc1ccc(OC)[s]1 Amb25108498 [0,1,0,0,0,0|2,1,0]=4 635 B8R1.1 Cc1ccc([nH]1)C#N Amb17622030 [0,1,0,0,0,0|2,0,1]=4 636 B8R1.1 Cc1ccc([nH]1)OC Amb24122404 [0,1,0,0,0,0|3,0,0]=4 637 B8R1.1 Cc1ccc([s]1)[Zn]Br Amb22000502 [0,1,0,0,0,0|2,1,0]=4 638 B8R1.1 Cc1ccc(o1)C#N Amb1152445 [0,1,0,0,0,0|1,0,1]=3 639 B8R1.1 Cc1ccc(o1)C=O Amb1151338 [0,1,0,0,0,0|0,0,0]=1 640 B8R1.1 Cc1ccc(o1)CBr Amb16234119 [0,1,0,0,0,0|1,0,1]=3 641 B8R1.1 Cc1ccc(o1)CN Amb1124819 [0,1,0,0,0,0|1,0,1]=3 642 B8R1.1 Cc1ccc(o1)CO Amb1856157 [0,1,0,0,0,0|0,0,2]=3 643 B8R1.1 Cc1ccc(s1)C=O Amb2447398 [0,1,0,0,0,0|0,1,0]=2 644 B8R1.1 Cc1coc(C#C)[n]1 Amb25270459 [0,1,0,0,0,0|2,0,1]=4 645 B8R1.1 Cc1coc(C#N)[n]1 Amb24596197 [0,1,0,0,0,0|2,0,1]=4 646 B8R1.1 Cc1coc(CC)c1 Amb24451308 [0,1,0,0,0,0|1,0,1]=3 647 B8R1.1 Cc1coc(CN)[n]1 Amb18221697 [0,1,0,0,0,0|2,0,1]=4 648 B8R1.1 Cc1coc(CN)[n]1 Amb22886200 [0,1,0,0,0,0|2,0,1]=4 649 B8R1.1 Cc1coc(CO)[n]1 Amb24718309 [0,1,0,0,0,0|1,0,2]=4 650 B8R1.1 Cc1coc(NC)[n]1 Amb24401063 [0,1,0,0,0,0|3,0,0]=4 651 B8R1.1 Cc1coc(NN)[n]1 Amb18641723 [0,1,0,0,0,0|3,0,0]=4 652 B8R1.1 Cc1coc([n]1)SC Amb24734394 [0,1,0,0,0,0|3,0,0]=4 653 B8R1.1 Cc1ncc([nH]1)C=O Amb16191969 [0,1,0,0,0,0|2,0,0]=3 654 B8R1.1 Cc1ncc(o1)CBr Amb10071205 [0,1,0,0,0,0|2,0,1]=4 655 B8R1.1 Cc1ncc(o1)CN Amb10071207 [0,1,0,0,0,0|2,0,1]=4 656 B8R1.1 Cc1ncc(o1)CO Amb10071203 [0,1,0,0,0,0|1,0,2]=4 657 B8R1.1 ClC=1C=C\C(\C1)=C\Cl Amb24523705 [0,1,0,0,0,0|2,0,0]=3 658 B8R1.1 ClCc1[n]c(Br)co1 Amb25125913 [0,1,0,0,0,0|2,0,1]=4 659 B8R1.1 ClCc1cc(no1)Br Amb2455697 [0,1,0,0,0,0|2,0,1]=4 660 B8R1.1 ClCc1ccc(s1)Cl Amb1105441 [0,1,0,0,0,0|1,1,1]=4 661 B8R1.1 Clc1c[nH]c(CCl)c1 Amb24704458 [0,1,0,0,0,0|2,0,1]=4 662 B8R1.1 Clc1cc(CBr)o[n]1 Amb24407827 [0,1,0,0,0,0|2,0,1]=4 663 B8R1.1 Clc1cc([nH]c1)C=O Amb10601712 [0,1,0,0,0,0|1,0,0]=2 664 B8R1.1 Clc1ccc(C=C)s1 Amb17672604 [0,1,0,0,0,0|1,1,0]=3 665 B8R1.1 Clc1ccc(CBr)[s]1 Amb19375092 [0,1,0,0,0,0|1,1,1]=4 666 B8R1.1 Clc1ccc(CBr)o1 Amb24452907 [0,1,0,0,0,0|1,0,1]=3 667 B8R1.1 Clc1ccc(CCl)o1 Amb24433248 [0,1,0,0,0,0|1,0,1]=3 668 B8R1.1 Clc1ccc(CI)[s]1 Amb24481391 [0,1,0,0,0,0|1,1,1]=4 669 B8R1.1 Clc1ccc([Mg]Br)[s]1 Amb22000363 [0,1,0,0,0,0|2,1,0]=4 670 B8R1.1 Clc1ccc([s]1)SCl Amb24756847 [0,1,0,0,0,0|2,1,0]=4 671 B8R1.1 Clc1ccc([s]1)[Zn]Br Amb22000383 [0,1,0,0,0,0|2,1,0]=4 672 B8R1.1 Clc1ccc(o1)C=O Amb1157854 [0,1,0,0,0,0|0,0,0]=1 673 B8R1.1 Clc1ccc(o1)[Hg]Cl Amb22360222 [0,1,0,0,0,0|2,0,0]=3 674 B8R1.1 Clc1ccc(s1)C=O Amb1159320 [0,1,0,0,0,0|0,1,0]=2 675 B8R1.1 Clc1cn(nc1)C=C Amb13777413 [0,1,0,0,0,0|3,0,0]=4 676 B8R1.1 Clc1cnc(s1)C=O Amb10071211 [0,1,0,0,0,0|1,1,0]=3 677 B8R1.1 Clc1nc(cs1)C=O Amb10067275 [0,1,0,0,0,0|2,0,0]=3 678 B8R1.1 Clc1ncc(s1)C=O Amb2407120 [0,1,0,0,0,0|1,1,0]=3 679 B8R1.1 Cn1ccc(n1)C=O Amb1945611 [0,1,0,0,0,0|2,0,0]=3 680 B8R1.1 FCc1[n]cc(Br)o1 Amb25270260 [0,1,0,0,0,0|2,0,1]=4 681 B8R1.1 Fc1ccc(CBr)[s]1 Amb24270964 [0,1,0,0,0,0|1,1,1]=4 682 B8R1.1 Fc1ccc(CCl)[s]1 Amb24054148 [0,1,0,0,0,0|1,1,1]=4 683 B8R1.1 Fc1ccc(s1)C=O Amb10249047 [0,1,0,0,0,0|0,1,0]=2 684 B8R1.1 Ic1ccc(o1)C=O Amb1669363 [0,1,0,0,0,0|0,0,0]=1 685 B8R1.1 Ic1cn(nc1)C=C Amb10608135 [0,1,0,0,0,0|3,0,0]=4 686 B8R1.1 N#CC1C=CC(=O)O1 Amb24481486 [0,1,0,0,0,0|1,0,2]=4 687 B8R1.1 N#Cc1cc(Br)c[nH]1 Amb19517039 [0,1,0,0,0,0|2,0,1]=4 688 B8R1.1 N#Cc1cc(Br)co1 Amb24446618 [0,1,0,0,0,0|1,0,1]=3 689 B8R1.1 N#Cc1cc(Cl)c[nH]1 Amb18124313 [0,1,0,0,0,0|2,0,1]=4 690 B8R1.1 N#Cc1cc(Cl)c[s]1 Amb21857072 [0,1,0,0,0,0|1,1,1]=4 691 B8R1.1 N#Cc1cc(Cl)co1 Amb23537459 [0,1,0,0,0,0|1,0,1]=3 692 B8R1.1 N#Cc1cc(F)c[s]1 Amb22490413 [0,1,0,0,0,0|1,1,1]=4 693 B8R1.1 N#Cc1cc(I)c[nH]1 Amb22498193 [0,1,0,0,0,0|2,0,1]=4 694 B8R1.1 N#Cc1cc(I)c[s]1 Amb24679382 [0,1,0,0,0,0|1,1,1]=4 695 B8R1.1 N#Cc1cc(O)c[s]1 Amb25851080 [0,1,0,0,0,0|1,1,1]=4 696 B8R1.1 N#Cc1ccc(Br)[nH]1 Amb21857252 [0,1,0,0,0,0|2,0,1]=4 697 B8R1.1 N#Cc1ccc(Cl)o1 Amb18642557 [0,1,0,0,0,0|1,0,1]=3 698 B8R1.1 N#Cc1ccc(F)[s]1 Amb18642494 [0,1,0,0,0,0|1,1,1]=4 699 B8R1.1 N#Cc1ccc(F)o1 Amb24623154 [0,1,0,0,0,0|1,0,1]=3 700 B8R1.1 N#Cc1ccc(I)[nH]1 Amb22498445 [0,1,0,0,0,0|2,0,1]=4 701 B8R1.1 N#Cc1ccc(I)[s]1 Amb21964152 [0,1,0,0,0,0|1,1,1]=4 702 B8R1.1 N#Cc1ccc(I)o1 Amb22052210 [0,1,0,0,0,0|1,0,1]=3 703 B8R1.1 NCC1=CC(=O)NO1 Amb18833042 [0,1,0,0,0,0|2,0,1]=4 704 B8R1.1 NCC=1CC=C(Br)C1 Amb25197825 [0,1,0,0,0,0|2,0,1]=4 705 B8R1.1 NCc1c[n]c(Cl)o1 Amb25376952 [0,1,0,0,0,0|2,0,1]=4 706 B8R1.1 NCc1cc(Br)[n]o1 Amb19957482 [0,1,0,0,0,0|2,0,1]=4 707 B8R1.1 NCc1cc(Br)[n]o1 Amb22489854 [0,1,0,0,0,0|2,0,1]=4 708 B8R1.1 NCc1cc(Br)c[nH]1 Amb18908986 [0,1,0,0,0,0|2,0,1]=4 709 B8R1.1 NCc1cc(Br)c[s]1 Amb22388572 [0,1,0,0,0,0|1,1,1]=4 710 B8R1.1 NCc1cc(Cl)c[nH]1 Amb18251131 [0,1,0,0,0,0|2,0,1]=4 711 B8R1.1 NCc1cc(Cl)c[s]1 Amb18251310 [0,1,0,0,0,0|1,1,1]=4 712 B8R1.1 NCc1cc(Cl)co1 Amb23537475 [0,1,0,0,0,0|1,0,1]=3 713 B8R1.1 NCc1cc(cs1)Br Amb10067673 [0,1,0,0,0,0|1,1,1]=4 714 B8R1.1 NCc1cc(no1)Br Amb10067252 [0,1,0,0,0,0|2,0,1]=4 715 B8R1.1 NCc1cc(no1)O Amb17618160 [0,1,0,0,0,0|2,0,1]=4 716 B8R1.1 NCc1ccc(Br)o1 Amb22500479 [0,1,0,0,0,0|1,0,1]=3 717 B8R1.1 NCc1ccc(Cl)[s]1 Amb22739673 [0,1,0,0,0,0|1,1,1]=4 718 B8R1.1 NCc1ccc(F)[s]1 Amb23440031 [0,1,0,0,0,0|1,1,1]=4 719 B8R1.1 NCc1ccc(F)[s]1 Amb24054066 [0,1,0,0,0,0|1,1,1]=4 720 B8R1.1 NCc1ccc(I)[s]1 Amb25763380 [0,1,0,0,0,0|1,1,1]=4 721 B8R1.1 NCc1ccc(S)[s]1 Amb25703112 [0,1,0,0,0,0|1,1,1]=4 722 B8R1.1 NCc1ccc(o1)Br Amb1099320 [0,1,0,0,0,0|1,0,1]=3 723 B8R1.1 NCc1ccc(s1)N Amb17477843 [0,1,0,0,0,0|1,1,1]=4 724 B8R1.1 NNc1ccc(Br)[s]1 Amb18190243 [0,1,0,0,0,0|2,1,0]=4 725 B8R1.1 Nc1[nH]c(C=O)c[n]1 Amb22494572 [0,1,0,0,0,0|2,0,0]=3 726 B8R1.1 Nc1[n][n]c(C=O)[s]1 Amb19515511 [0,1,0,0,0,0|2,1,0]=4 727 B8R1.1 Nc1[n][n]c(C=O)o1 Amb18833085 [0,1,0,0,0,0|2,0,0]=3 728 B8R1.1 Nc1[n]c(C=O)c[s]1 Amb21964509 [0,1,0,0,0,0|2,0,0]=3 729 B8R1.1 Nc1[n]c(C=O)c[s]1 Amb22757537 [0,1,0,0,0,0|2,0,0]=3 730 B8R1.1 Nc1[n]cc(C=O)o1 Amb23400983 [0,1,0,0,0,0|1,0,0]=2 731 B8R1.1 Nc1[n]cc(CO)o1 Amb25104500 [0,1,0,0,0,0|1,0,2]=4 732 B8R1.1 Nc1c[n]c(C=O)[nH]1 Amb18833108 [0,1,0,0,0,0|2,0,0]=3 733 B8R1.1 Nc1cc(C#N)[s]c1 Amb18642138 [0,1,0,0,0,0|1,1,1]=4 734 B8R1.1 Nc1cc(C#N)[s]c1 Amb22491051 [0,1,0,0,0,0|1,1,1]=4 735 B8R1.1 Nc1cc(C#N)o[n]1 Amb18833128 [0,1,0,0,0,0|2,0,1]=4 736 B8R1.1 Nc1cc(C=O)[nH][n]1 Amb21960884 [0,1,0,0,0,0|2,0,0]=3 737 B8R1.1 Nc1cc(C=O)[s]c1 Amb18679453 [0,1,0,0,0,0|0,1,0]=2 738 B8R1.1 Nc1cc(C=O)c[s]1 Amb18145783 [0,1,0,0,0,0|2,0,0]=3 739 B8R1.1 Nc1cc(C=O)co1 Amb18681236 [0,1,0,0,0,0|2,0,0]=3 740 B8R1.1 Nc1cc(C=O)oc1 Amb18833113 [0,1,0,0,0,0|0,0,0]=1 741 B8R1.1 Nc1cc(CO)o[n]1 Amb18124249 [0,1,0,0,0,0|1,0,2]=4 742 B8R1.1 Nc1ccc(C#N)o1 Amb18203412 [0,1,0,0,0,0|1,0,1]=3 743 B8R1.1 Nc1ccc(C=O)[nH]1 Amb18203402 [0,1,0,0,0,0|1,0,0]=2 744 B8R1.1 Nc1ccc(C=O)[s]1 Amb18202442 [0,1,0,0,0,0|0,1,0]=2 745 B8R1.1 Nc1ccc(C=O)o1 Amb18833112 [0,1,0,0,0,0|0,0,0]=1 746 B8R1.1 Nc1ccc(CO)[s]1 Amb25743937 [0,1,0,0,0,0|0,1,2]=4 747 B8R1.1 Nc1ccc(CS)o1 Amb24365127 [0,1,0,0,0,0|0,1,1]=3 748 B8R1.1 Nc1ccc(N=O)[s]1 Amb24481305 [0,1,0,0,0,0|1,1,0]=3 749 B8R1.1 Nc1ccc([s]1)SN Amb24061436 [0,1,0,0,0,0|2,1,0]=4 750 B8R1.1 Nc1ccc(s1)C#N Amb17477844 [0,1,0,0,0,0|1,1,1]=4 751 B8R1.1 Nc1coc(CO)[n]1 Amb25699026 [0,1,0,0,0,0|1,0,2]=4 752 B8R1.1 O=C1C=C(C=O)ON1 Amb22498283 [0,1,0,0,0,0|1,0,0]=2 753 B8R1.1 O=C1C=C(C=O)SS1 Amb25736224 [0,1,0,0,0,0|1,1,0]=3 754 B8R1.1 O=C1C=C(CO1)C=O Amb24417175 [0,1,0,0,0,0|2,0,0]=3 755 B8R1.1 O=C1C=CC(CBr)O1 Amb24423424 [0,1,0,0,0,0|1,0,2]=4 756 B8R1.1 O=C1C=C\C(=C/Br)\S1 Amb25025140 [0,1,0,0,0,0|1,1,0]=3 757 B8R1.1 O=C1C=C\C(=C/Cl)\S1 Amb25745343 [0,1,0,0,0,0|1,1,0]=3 758 B8R1.1 O=C1C=C\C(=C\Br)\O1 Amb25102498 [0,1,0,0,0,0|1,0,0]=2 759 B8R1.1 O=C1C=C\C(=C\Br)\S1 Amb25258329 [0,1,0,0,0,0|1,1,0]=3 760 B8R1.1 O=C1CC(C=O)=NN1 Amb18203380 [0,1,0,0,0,0|2,0,1]=4 761 B8R1.1 O=C1CC=C(CBr)O1 Amb24469203 [0,1,0,0,0,0|1,0,2]=4 762 B8R1.1 O=C1CCC(=C1)C=O Amb24483014 [0,1,0,0,0,0|1,0,1]=3 763 B8R1.1 O=C1CC\C(=C\Br)\O1 Amb24605306 [0,1,0,0,0,0|1,0,2]=4 764 B8R1.1 O=C1CC\C(=C\Cl)\O1 Amb25024821 [0,1,0,0,0,0|1,0,2]=4 765 B8R1.1 O=C1N=CC(C=O)=N1 Amb24476589 [0,1,0,0,0,0|2,0,0]=3 766 B8R1.1 O=C1NC=C(C=O)N1 Amb21858198 [0,1,0,0,0,0|2,0,0]=3 767 B8R1.1 O=C1NC=C(CCl)O1 Amb24603386 [0,1,0,0,0,0|2,0,1]=4 768 B8R1.1 O=C1OC(CBr)=CO1 Amb22491256 [0,1,0,0,0,0|2,0,1]=4 769 B8R1.1 O=C1OC(CCl)=CO1 Amb25226799 [0,1,0,0,0,0|2,0,1]=4 770 B8R1.1 O=C1O\C(\CO1)=C/Br Amb25074539 [0,1,0,0,0,0|2,0,1]=4 771 B8R1.1 O=CC1=CC(=S)SS1 Amb25766555 [0,1,0,0,0,0|1,1,0]=3 772 B8R1.1 O=CC1=CSC(=S)N1 Amb25263915 [0,1,0,0,0,0|2,0,0]=3 773 B8R1.1 O=CC1C=CC(=O)O1 Amb24528815 [0,1,0,0,0,0|0,0,1]=2 774 B8R1.1 O=CC1CCC(=O)O1 Amb18641761 [0,1,0,0,0,0|0,0,3]=4 775 B8R1.1 O=C[C@@H]1CCC(=O)O1 Amb24527426 [0,1,0,0,0,0|0,0,3]=4 776 B8R1.1 O=Cc1[nH]c(Br)c[n]1 Amb22494846 [0,1,0,0,0,0|2,0,0]=3 777 B8R1.1 O=Cc1[nH]cc(I)[n]1 Amb24444037 [0,1,0,0,0,0|2,0,0]=3 778 B8R1.1 O=Cc1[n][n]c(Br)[s]1 Amb23402889 [0,1,0,0,0,0|2,1,0]=4 779 B8R1.1 O=Cc1[n][n]c(Cl)[s]1 Amb23402888 [0,1,0,0,0,0|2,1,0]=4 780 B8R1.1 O=Cc1[n]c(Br)[n]o1 Amb25269884 [0,1,0,0,0,0|2,0,0]=3 781 B8R1.1 O=Cc1[n]c(Cl)[n]o1 Amb25216403 [0,1,0,0,0,0|2,0,0]=3 782 B8R1.1 O=Cc1c[nH]c(Br)c1 Amb22372253 [0,1,0,0,0,0|2,0,0]=3 783 B8R1.1 O=Cc1c[nH]c(F)[n]1 Amb24577082 [0,1,0,0,0,0|2,0,0]=3 784 B8R1.1 O=Cc1c[nH]c(I)c1 Amb22751313 [0,1,0,0,0,0|2,0,0]=3 785 B8R1.1 O=Cc1c[nH]c(S)[n]1 Amb24460249 [0,1,0,0,0,0|2,0,0]=3 786 B8R1.1 O=Cc1c[n](Br)c[n]1 Amb20248185 [0,1,0,0,0,0|2,0,0]=3 787 B8R1.1 O=Cc1c[n]c(Cl)[nH]1 Amb22495512 [0,1,0,0,0,0|2,0,0]=3 788 B8R1.1 O=Cc1c[n]c(Cl)o1 Amb24628339 [0,1,0,0,0,0|1,0,0]=2 789 B8R1.1 O=Cc1c[n]c(S)[s]1 Amb24086914 [0,1,0,0,0,0|1,1,0]=3 790 B8R1.1 O=Cc1c[s]c(Cl)c1 Amb18644303 [0,1,0,0,0,0|2,0,0]=3 791 B8R1.1 O=Cc1c[s]c(F)c1 Amb18203204 [0,1,0,0,0,0|2,0,0]=3 792 B8R1.1 O=Cc1c[s]c(I)c1 Amb22749349 [0,1,0,0,0,0|2,0,0]=3 793 B8R1.1 O=Cc1cc(Br)[nH][n]1 Amb18191591 [0,1,0,0,0,0|2,0,0]=3 794 B8R1.1 O=Cc1cc(Cl)[nH][n]1 Amb18202944 [0,1,0,0,0,0|2,0,0]=3 795 B8R1.1 O=Cc1cc(Cl)[n]o1 Amb24078706 [0,1,0,0,0,0|1,0,0]=2 796 B8R1.1 O=Cc1cc(Cl)c[s]1 Amb18644304 [0,1,0,0,0,0|0,1,0]=2 797 B8R1.1 O=Cc1cc(Cl)co1 Amb18642825 [0,1,0,0,0,0|0,0,0]=1 798 B8R1.1 O=Cc1cc(F)c[nH]1 Amb18833082 [0,1,0,0,0,0|1,0,0]=2 799 B8R1.1 O=Cc1cc(F)c[s]1 Amb18832536 [0,1,0,0,0,0|0,1,0]=2 800 B8R1.1 O=Cc1cc(F)co1 Amb18833044 [0,1,0,0,0,0|0,0,0]=1 801 B8R1.1 O=Cc1cc(I)c[nH]1 Amb21964579 [0,1,0,0,0,0|1,0,0]=2 802 B8R1.1 O=Cc1cc(I)c[s]1 Amb21962048 [0,1,0,0,0,0|0,1,0]=2 803 B8R1.1 O=Cc1cc(I)co1 Amb24678241 [0,1,0,0,0,0|0,0,0]=1 804 B8R1.1 O=Cc1ccc(Br)[nH]1 Amb18647726 [0,1,0,0,0,0|1,0,0]=2 805 B8R1.1 O=Cc1ccc(Cl)[nH]1 Amb18642733 [0,1,0,0,0,0|1,0,0]=2 806 B8R1.1 O=Cc1ccc(F)[nH]1 Amb18833084 [0,1,0,0,0,0|1,0,0]=2 807 B8R1.1 O=Cc1ccc(F)o1 Amb18203364 [0,1,0,0,0,0|0,0,0]=1 808 B8R1.1 O=Cc1ccc(I)[nH]1 Amb22498190 [0,1,0,0,0,0|1,0,0]=2 809 B8R1.1 O=Cc1ccc(I)[s]1 Amb20621479 [0,1,0,0,0,0|0,1,0]=2 810 B8R1.1 O=Cc1ccn(c1)C Amb2413661 [0,1,0,0,0,0|2,0,0]=3 811 B8R1.1 O=Cc1cnn(c1)C Amb1062067 [0,1,0,0,0,0|3,0,0]=4 812 B8R1.1 O=Cc1coc(Br)c1 Amb18146214 [0,1,0,0,0,0|2,0,0]=3 813 B8R1.1 O=Cc1coc(Cl)c1 Amb24452187 [0,1,0,0,0,0|2,0,0]=3 814 B8R1.1 O=Cc1coc(F)c1 Amb18833046 [0,1,0,0,0,0|2,0,0]=3 815 B8R1.1 O=Cc1coc(I)c1 Amb25223500 [0,1,0,0,0,0|2,0,0]=3 816 B8R1.1 O=Cc1coc(c1)C Amb2447062 [0,1,0,0,0,0|2,0,0]=3 817 B8R1.1 O=Cc1csc(c1)Br Amb1111482 [0,1,0,0,0,0|2,0,0]=3 818 B8R1.1 OCC1=COC(=O)O1 Amb25214922 [0,1,0,0,0,0|1,0,2]=4 819 B8R1.1 OCc1cc(Br)c[nH]1 Amb22233860 [0,1,0,0,0,0|1,0,2]=4 820 B8R1.1 OCc1cc(Br)co1 Amb21857563 [0,1,0,0,0,0|0,0,2]=3 821 B8R1.1 OCc1cc(Cl)[n]o1 Amb24099300 [0,1,0,0,0,0|1,0,2]=4 822 B8R1.1 OCc1cc(Cl)c[nH]1 Amb24457009 [0,1,0,0,0,0|1,0,2]=4 823 B8R1.1 OCc1cc(Cl)c[s]1 Amb23439217 [0,1,0,0,0,0|0,1,2]=4 824 B8R1.1 OCc1cc(Cl)co1 Amb23537660 [0,1,0,0,0,0|0,0,2]=3 825 B8R1.1 OCc1cc(F)co1 Amb24735910 [0,1,0,0,0,0|0,0,2]=3 826 B8R1.1 OCc1cc(I)c[nH]1 Amb22498450 [0,1,0,0,0,0|1,0,2]=4 827 B8R1.1 OCc1cc(I)co1 Amb24516430 [0,1,0,0,0,0|0,0,2]=3 828 B8R1.1 OCc1cc(no1)Br Amb2455736 [0,1,0,0,0,0|1,0,2]=4 829 B8R1.1 OCc1ccc(Cl)o1 Amb22498874 [0,1,0,0,0,0|0,0,2]=3 830 B8R1.1 OCc1ccc(F)[s]1 Amb19892820 [0,1,0,0,0,0|0,1,2]=4 831 B8R1.1 OCc1ccc(F)o1 Amb24696625 [0,1,0,0,0,0|0,0,2]=3 832 B8R1.1 OCc1ccc(o1)Br Amb1111133 [0,1,0,0,0,0|0,0,2]=3 833 B8R1.1 OCc1ccc(s1)Br Amb1110302 [0,1,0,0,0,0|0,1,2]=4 834 B8R1.1 OCc1cnc(o1)Br Amb10067560 [0,1,0,0,0,0|1,0,2]=4 835 B8R1.1 O\N=C\1/C=CC(=O)N1 Amb24481583 [0,1,0,0,0,0|2,0,1]=4 836 B8R1.1 Oc1[n]cc(C=O)[s]1 Amb18832574 [0,1,0,0,0,0|1,1,0]=3 837 B8R1.1 Oc1cc(C=O)[s][n]1 Amb24602987 [0,1,0,0,0,0|1,1,0]=3 838 B8R1.1 Oc1cc(CO)o[n]1 Amb24331438 [0,1,0,0,0,0|1,0,2]=4 839 B8R1.1 Oc1cc(CS)oc1 Amb25330756 [0,1,0,0,0,0|0,1,1]=3 840 B8R1.1 Oc1cc(on1)CCl Amb2444789 [0,1,0,0,0,0|2,0,1]=4 841 B8R1.1 Oc1ccc(C=O)[s]1 Amb24741796 [0,1,0,0,0,0|0,1,0]=2 842 B8R1.1 Oc1ccc(CO)o1 Amb25142895 [0,1,0,0,0,0|0,0,2]=3 843 B8R1.1 Oc1ccc(N=O)o1 Amb24610956 [0,1,0,0,0,0|1,0,0]=2 844 B8R1.1 S=Cc1[n]c(Br)c[s]1 Amb21927786 [0,1,0,0,0,0|1,2,0]=4 845 B8R1.1 SCc1cc(Br)c[s]1 Amb24483181 [0,1,0,0,0,0|0,2,1]=4 846 B8R1.1 SCc1cc(Cl)co1 Amb25765416 [0,1,0,0,0,0|0,1,1]=3 847 B8R1.1 SCc1cc(I)co1 Amb25310706 [0,1,0,0,0,0|0,1,1]=3 848 B8R1.1 SCc1ccc(Br)o1 Amb24702374 [0,1,0,0,0,0|0,1,1]=3 849 B8R1.7 C=C(Cl)c1ccc[s]1 Amb24511598 [0,1,0,0,0,0|1,1,0]=3 850 B8R1.7 C=C(N)c1ccc[nH]1 Amb24566747 [0,1,0,0,0,0|2,0,0]=3 851 B8R1.7 C=C(N)c1ccco1 Amb25025940 [0,1,0,0,0,0|1,0,0]=2 852 B8R1.7 C=C(O)c1ccc[s]1 Amb24061433 [0,1,0,0,0,0|0,1,1]=3 853 B8R1.7 CB(C)c1ccc[s]1 Amb25196684 [0,1,0,0,0,0|2,1,0]=4 854 B8R1.7 CC(=C)c1[n]cc[s]1 Amb22489593 [0,1,0,0,0,0|2,1,0]=4 855 B8R1.7 CC(=C)c1c[n]c[nH]1 Amb25224114 [0,1,0,0,0,0|3,0,0]=4 856 B8R1.7 CC(=C)c1c[n]c[s]1 Amb25687634 [0,1,0,0,0,0|2,1,0]=4 857 B8R1.7 CC(=C)c1c[n]co1 Amb25364289 [0,1,0,0,0,0|2,0,0]=3 858 B8R1.7 CC(=C)c1c[s]c[n]1 Amb24549327 [0,1,0,0,0,0|3,0,0]=4 859 B8R1.7 CC(=C)c1cc[nH][n]1 Amb25226062 [0,1,0,0,0,0|3,0,0]=4 860 B8R1.7 CC(=C)c1ccco1 Amb24532306 [0,1,0,0,0,0|1,0,0]=2 861 B8R1.7 CC(=N)c1ccc[nH]1 Amb25377507 [0,1,0,0,0,0|2,0,0]=3 862 B8R1.7 CC(=N)c1ccc[s]1 Amb25223960 [0,1,0,0,0,0|1,1,0]=3 863 B8R1.7 CC(=O)C1=CCCO1 Amb25759909 [0,1,0,0,0,0|0,0,2]=3 864 B8R1.7 CC(=O)C1=CCN=N1 Amb25689687 [0,1,0,0,0,0|2,0,1]=4 865 B8R1.7 CC(=O)C1=C[CH-]C=C1 Amb2227554 [0,1,0,0,0,0|1,0,1]=3 866 B8R1.7 CC(=O)C1=NCCO1 Amb24481446 [0,1,0,0,0,0|1,0,2]=4 867 B8R1.7 CC(=O)C1C=CC=C1 Amb25358886 [0,1,0,0,0,0|1,0,1]=3 868 B8R1.7 CC(=O)C1C=CC=N1 Amb24645738 [0,1,0,0,0,0|1,0,1]=3 869 B8R1.7 CC(=O)C1CCC=C1 Amb25373909 [0,1,0,0,0,0|1,0,2]=4 870 B8R1.7 CC(=O)C=1C=CCC1 Amb24334264 [0,1,0,0,0,0|1,0,1]=3 871 B8R1.7 CC(=O)C=1CCCC1 Amb22338190 [0,1,0,0,0,0|1,0,2]=4 872 B8R1.7 CC(=O)C=1CSCC1 Amb25830074 [0,1,0,0,0,0|2,0,1]=4 873 B8R1.7 CC(=O)N1CC=CC1 Amb24502401 [0,1,0,0,0,0|2,0,1]=4 874 B8R1.7 CC(=O)[n+]1c[nH]cc1 Amb25277175 [0,1,0,0,0,0|3,0,0]=4 875 B8R1.7 CC(=O)[n]1c[n]c[n]1 Amb22584191 [0,1,0,0,0,0|3,0,0]=4 876 B8R1.7 CC(=O)[n]1cc[n][n]1 Amb25212531 [0,1,0,0,0,0|3,0,0]=4 877 B8R1.7 CC(=O)c1[n][n][n]o1 Amb25798453 [0,1,0,0,0,0|3,0,0]=4 878 B8R1.7 CC(=O)c1[n]c[n]o1 Amb25119390 [0,1,0,0,0,0|2,0,0]=3 879 B8R1.7 CC(=O)c1[n]cco1 Amb19958429 [0,1,0,0,0,0|1,0,0]=2 880 B8R1.7 CC(=O)c1c[nH]c[n]1 Amb20241216 [0,1,0,0,0,0|2,0,0]=3 881 B8R1.7 CC(=O)c1c[n][n][nH]1 Amb18149040 [0,1,0,0,0,0|3,0,0]=4 882 B8R1.7 CC(=O)c1c[n][s][n]1 Amb25810147 [0,1,0,0,0,0|3,0,0]=4 883 B8R1.7 CC(=O)c1c[n]co1 Amb24737064 [0,1,0,0,0,0|1,0,0]=2 884 B8R1.7 CC(=O)c1c[n]o[n]1 Amb18833096 [0,1,0,0,0,0|3,0,0]=4 885 B8R1.7 CC(=O)c1c[n]oc1 Amb21963372 [0,1,0,0,0,0|3,0,0]=4 886 B8R1.7 CC(=O)c1c[s][n][n]1 Amb18203245 [0,1,0,0,0,0|3,0,0]=4 887 B8R1.7 CC(=O)c1cc[n]o1 Amb20242198 [0,1,0,0,0,0|1,0,0]=2 888 B8R1.7 CC(=O)c1cc[s][n]1 Amb25044341 [0,1,0,0,0,0|2,0,0]=3 889 B8R1.7 CC(=O)c1ccc[nH]1 Amb1151321 [0,1,0,0,0,0|1,0,0]=2 890 B8R1.7 CC(=O)c1ccc[se]1 Amb17673999 [0,1,0,0,0,0|0,1,0]=2 891 B8R1.7 CC(=O)c1ccns1 Amb13883508 [0,1,0,0,0,0|1,1,0]=3 892 B8R1.7 CC(=O)c1cco[n]1 Amb20242197 [0,1,0,0,0,0|2,0,0]=3 893 B8R1.7 CC(=O)c1cnc[nH]1 Amb17593129 [0,1,0,0,0,0|2,0,0]=3 894 B8R1.7 CC(=O)c1cnns1 Amb17772366 [0,1,0,0,0,0|2,1,0]=4 895 B8R1.7 CC(=O)c1coc[n]1 Amb18833111 [0,1,0,0,0,0|2,0,0]=3 896 B8R1.7 CC(=O)c1cocc1 Amb2440799 [0,1,0,0,0,0|2,0,0]=3 897 B8R1.7 CC(=O)c1ncn[nH]1 Amb15701508 [0,1,0,0,0,0|3,0,0]=4 898 B8R1.7 CC(=S)c1cc[nH]c1 Amb24700443 [0,1,0,0,0,0|2,1,0]=4 899 B8R1.7 CC(=S)c1ccc[nH]1 Amb24481346 [0,1,0,0,0,0|1,1,0]=3 900 B8R1.7 CC(=S)c1ccco1 Amb25223522 [0,1,0,0,0,0|0,1,0]=2 901 B8R1.7 CC(C)=C1C=CC=C1 Amb22043296 [0,1,0,0,0,0|2,0,0]=3 902 B8R1.7 CC(C)C=1CC=CC1 Amb22227970 [0,1,0,0,0,0|2,0,1]=4 903 B8R1.7 CC(C)c1c[n]co1 Amb24641479 [0,1,0,0,0,0|2,0,1]=4 904 B8R1.7 CC(C)c1ccc[nH]1 Amb17666650 [0,1,0,0,0,0|2,0,1]=4 905 B8R1.7 CC(C)c1ccco1 Amb22168231 [0,1,0,0,0,0|1,0,1]=3 906 B8R1.7 CC(C)c1cccs1 Amb17689449 [0,1,0,0,0,0|1,1,1]=4 907 B8R1.7 CC(Cl)c1ccc[nH]1 Amb20615921 [0,1,0,0,0,0|2,0,1]=4 908 B8R1.7 CC(N)c1c[n]co1 Amb22233789 [0,1,0,0,0,0|2,0,1]=4 909 B8R1.7 CC(N)c1cc[n]o1 Amb22496526 [0,1,0,0,0,0|2,0,1]=4 910 B8R1.7 CC(O)c1ccc[nH]1 Amb20618684 [0,1,0,0,0,0|1,0,2]=4 911 B8R1.7 CC(c1ccco1)Cl Amb17138373 [0,1,0,0,0,0|1,0,1]=3 912 B8R1.7 CC(c1ccco1)N Amb1154062 [0,1,0,0,0,0|1,0,1]=3 913 B8R1.7 CC(c1cccs1)Br Amb17447081 [0,1,0,0,0,0|1,1,1]=4 914 B8R1.7 CC(c1cccs1)Cl Amb17138413 [0,1,0,0,0,0|1,1,1]=4 915 B8R1.7 CC(c1cccs1)N Amb1790688 [0,1,0,0,0,0|1,1,1]=4 916 B8R1.7 CC(c1ncco1)C Amb17399790 [0,1,0,0,0,0|2,0,1]=4 917 B8R1.7 CN(C)c1ccco1 Amb24655902 [0,1,0,0,0,0|2,0,0]=3 918 B8R1.7 CS(=O)[n]1cccc1 Amb24691728 [0,1,0,0,0,0|3,0,0]=4 919 B8R1.7 CS(=O)c1[n]cc[s]1 Amb25236339 [0,1,0,0,0,0|2,1,0]=4 920 B8R1.7 CS(=O)c1c[nH]cc1 Amb25082099 [0,1,0,0,0,0|3,0,0]=4 921 B8R1.7 CS(=O)c1c[s]cc1 Amb24759235 [0,1,0,0,0,0|3,0,0]=4 922 B8R1.7 CS(=O)c1ccco1 Amb25208644 [0,1,0,0,0,0|1,0,0]=2 923 B8R1.7 C[C@@H](N)c1[n]cco1 Amb19374517 [0,1,0,0,0,0|2,0,1]=4 924 B8R1.7 C[C@@H](N)c1c[n]co1 Amb22748747 [0,1,0,0,0,0|2,0,1]=4 925 B8R1.7 C[C@@H](N)c1ccc[s]1 Amb19514729 [0,1,0,0,0,0|1,1,1]=4 926 B8R1.7 C[C@@H](c1ccc[nH]1)O Amb13953007 [0,1,0,0,0,0|1,0,2]=4 927 B8R1.7 C[C@@H](c1ccco1)N Amb13952985 [0,1,0,0,0,0|1,0,1]=3 928 B8R1.7 C[C@@H](c1cccs1)N Amb13952997 [0,1,0,0,0,0|1,1,1]=4 929 B8R1.7 C[C@@H](c1cccs1)O Amb13952996 [0,1,0,0,0,0|0,1,2]=4 930 B8R1.7 C[C@H](c1ccc[nH]1)O Amb13953008 [0,1,0,0,0,0|1,0,2]=4 931 B8R1.7 C[C@H](c1ccco1)N Amb13952986 [0,1,0,0,0,0|1,0,1]=3 932 B8R1.7 C[C@H](c1cccs1)N Amb13952998 [0,1,0,0,0,0|1,1,1]=4 933 B8R1.7 C[C@H](c1cccs1)O Amb10603205 [0,1,0,0,0,0|0,1,2]=4 934 B8R1.7 C[S+](C)c1ccc[nH]1 Amb25055802 [0,1,0,0,0,0|3,0,0]=4 935 B8R1.7 ClB(Cl)c1ccc[s]1 Amb24637200 [0,1,0,0,0,0|2,1,0]=4 936 B8R1.7 ClC(=O)C1NC=CS1 Amb16232722 [0,1,0,0,0,0|1,1,1]=4 937 B8R1.7 ClC(=O)c1cccs1 Amb1157175 [0,1,0,0,0,0|0,1,0]=2 938 B8R1.7 ClC(=O)c1nocn1 Amb16230808 [0,1,0,0,0,0|3,0,0]=4 939 B8R1.7 ClC(=O)n1cccc1 Amb17938699 [0,1,0,0,0,0|2,0,0]=3 940 B8R1.7 ClC(Cl)c1[n]cco1 Amb22277100 [0,1,0,0,0,0|2,0,1]=4 941 B8R1.7 ClC(Cl)c1ccco1 Amb25373858 [0,1,0,0,0,0|1,0,1]=3 942 B8R1.7 ClP(Cl)c1ccc[nH]1 Amb24724775 [0,1,0,0,0,0|3,0,0]=4 943 B8R1.7 ClP(Cl)c1ccco1 Amb24530199 [0,1,0,0,0,0|2,0,0]=3 944 B8R1.7 FB(F)c1ccc[s]1 Amb25336805 [0,1,0,0,0,0|2,1,0]=4 945 B8R1.7 FC(F)c1ccc[nH]1 Amb20669755 [0,1,0,0,0,0|2,0,1]=4 946 B8R1.7 N=C(O)c1coc[n]1 Amb21928044 [0,1,0,0,0,0|2,0,1]=4 947 B8R1.7 NC(=N)c1[nH]cc[n]1 Amb23439452 [0,1,0,0,0,0|3,0,0]=4 948 B8R1.7 NC(=N)c1[nH]cc[n]1 Amb24105782 [0,1,0,0,0,0|3,0,0]=4 949 B8R1.7 NC(=N)c1[nH]cc[n]1 Amb24183568 [0,1,0,0,0,0|3,0,0]=4 950 B8R1.7 NC(=N)c1[n]cc[s]1 Amb17934257 [0,1,0,0,0,0|2,1,0]=4 951 B8R1.7 NC(=N)c1[n]cc[s]1 Amb17934258 [0,1,0,0,0,0|2,1,0]=4 952 B8R1.7 NC(=N)c1[n]cco1 Amb25735054 [0,1,0,0,0,0|2,0,0]=3 953 B8R1.7 NC(=N)c1c[n]c[s]1 Amb18255775 [0,1,0,0,0,0|2,1,0]=4 954 B8R1.7 NC(=N)c1c[n]co1 Amb25200229 [0,1,0,0,0,0|2,0,0]=3 955 B8R1.7 NC(=N)c1cc[nH]c1 Amb18893396 [0,1,0,0,0,0|3,0,0]=4 956 B8R1.7 NC(=N)c1cc[s][n]1 Amb24612332 [0,1,0,0,0,0|3,0,0]=4 957 B8R1.7 NC(=N)c1ccc[nH]1 Amb22736696 [0,1,0,0,0,0|2,0,0]=3 958 B8R1.7 NC(=N)c1ccco1 Amb13952844 [0,1,0,0,0,0|1,0,0]=2 959 B8R1.7 NC(=N)c1ccoc1 Amb24388876 [0,1,0,0,0,0|3,0,0]=4 960 B8R1.7 NC(=N)c1coc[n]1 Amb24481562 [0,1,0,0,0,0|3,0,0]=4 961 B8R1.7 NC(=N)n1cccn1 Amb10604060 [0,1,0,0,0,0|3,0,0]=4 962 B8R1.7 NC(=N)n1cccn1 Amb17619662 [0,1,0,0,0,0|3,0,0]=4 963 B8R1.7 NC(=O)C1CC=CC1 Amb10068010 [0,1,0,0,0,0|1,0,2]=4 964 B8R1.7 NC(=O)C1CC=CO1 Amb24334594 [0,1,0,0,0,0|0,0,2]=3 965 B8R1.7 NC(=O)C1CCC=C1 Amb25063981 [0,1,0,0,0,0|1,0,2]=4 966 B8R1.7 NC(=O)C=1CCCC1 Amb20622488 [0,1,0,0,0,0|1,0,2]=4 967 B8R1.7 NC(=O)N1CC=CS1 Amb25743095 [0,1,0,0,0,0|1,1,1]=4 968 B8R1.7 NC(=O)[C@@H]1C=CCN1 Amb22801274 [0,1,0,0,0,0|1,0,2]=4 969 B8R1.7 NC(=O)[C@H]1C=CCN1 Amb24386015 [0,1,0,0,0,0|1,0,2]=4 970 B8R1.7 NC(=O)[n]1c[n]c[n]1 Amb24621879 [0,1,0,0,0,0|3,0,0]=4 971 B8R1.7 NC(=O)[n]1c[n]cc1 Amb25225129 [0,1,0,0,0,0|3,0,0]=4 972 B8R1.7 NC(=O)c1[n][n]c[s]1 Amb23437055 [0,1,0,0,0,0|2,1,0]=4 973 B8R1.7 NC(=O)c1[n]cco1 Amb21963562 [0,1,0,0,0,0|1,0,0]=2 974 B8R1.7 NC(=O)c1[n]co[n]1 Amb25169588 [0,1,0,0,0,0|3,0,0]=4 975 B8R1.7 NC(=O)c1c[nH][n][n]1 Amb20668375 [0,1,0,0,0,0|3,0,0]=4 976 B8R1.7 NC(=O)c1c[n][s]c1 Amb24681476 [0,1,0,0,0,0|3,0,0]=4 977 B8R1.7 NC(=O)c1c[n]c[s]1 Amb19514920 [0,1,0,0,0,0|1,1,0]=3 978 B8R1.7 NC(=O)c1c[n]co1 Amb22000976 [0,1,0,0,0,0|1,0,0]=2 979 B8R1.7 NC(=O)c1c[n]oc1 Amb25340416 [0,1,0,0,0,0|3,0,0]=4 980 B8R1.7 NC(=O)c1cc[nH]c1 Amb18893397 [0,1,0,0,0,0|2,0,0]=3 981 B8R1.7 NC(=O)c1cc[n][s]1 Amb24409499 [0,1,0,0,0,0|1,1,0]=3 982 B8R1.7 NC(=O)c1cc[s][n]1 Amb25224962 [0,1,0,0,0,0|2,0,0]=3 983 B8R1.7 NC(=O)c1ccc[nH]1 Amb10068201 [0,1,0,0,0,0|1,0,0]=2 984 B8R1.7 NC(=O)c1cco[n]1 Amb20630182 [0,1,0,0,0,0|2,0,0]=3 985 B8R1.7 NC(=O)c1coc[n]1 Amb21857139 [0,1,0,0,0,0|2,0,0]=3 986 B8R1.7 NC(=O)c1n[nH]cn1 Amb1773102 [0,1,0,0,0,0|3,0,0]=4 987 B8R1.7 NC(=O)n1cccc1 Amb17938700 [0,1,0,0,0,0|2,0,0]=3 988 B8R1.7 NC(=O)n1cccn1 Amb10601901 [0,1,0,0,0,0|2,0,0]=3 989 B8R1.7 NC(=O)n1cccn1 Amb10603437 [0,1,0,0,0,0|2,0,0]=3 990 B8R1.7 NC(=S)[n]1cccc1 Amb24531760 [0,1,0,0,0,0|2,1,0]=4 991 B8R1.7 NC(=S)c1[nH]cc[n]1 Amb22753996 [0,1,0,0,0,0|2,1,0]=4 992 B8R1.7 NC(=S)c1[n]cco1 Amb24074267 [0,1,0,0,0,0|1,1,0]=3 993 B8R1.7 NC(=S)c1c[n]c[s]1 Amb18255776 [0,1,0,0,0,0|1,2,0]=4 994 B8R1.7 NC(=S)c1c[n]co1 Amb21928050 [0,1,0,0,0,0|1,1,0]=3 995 B8R1.7 NC(=S)c1cc[nH]c1 Amb18893325 [0,1,0,0,0,0|2,1,0]=4 996 B8R1.7 NC(=S)c1cc[n][nH]1 Amb20670279 [0,1,0,0,0,0|2,1,0]=4 997 B8R1.7 NC(=S)c1ccc[nH]1 Amb21948859 [0,1,0,0,0,0|1,1,0]=3 998 B8R1.7 NC(=S)c1ccco1 Amb2099744 [0,1,0,0,0,0|0,1,0]=2 999 B8R1.7 NC(=S)c1cccs1 Amb1152349 [0,1,0,0,0,0|0,2,0]=3 1000 B8R1.7 NC(=S)c1cco[n]1 Amb25378762 [0,1,0,0,0,0|2,1,0]=4 1001 B8R1.7 NC(=S)c1cocn1 Amb13890530 [0,1,0,0,0,0|2,1,0]=4 1002 B8R1.7 NC(=S)c1cscc1 Amb1154612 [0,1,0,0,0,0|2,1,0]=4 1003 B8R1.7 NC(=S)c1cscn1 Amb10068447 [0,1,0,0,0,0|2,1,0]=4 1004 B8R1.7 NC(=S)n1cccn1 Amb2429874 [0,1,0,0,0,0|2,1,0]=4 1005 B8R1.7 NC(N)=C1C=CC=N1 Amb25711339 [0,1,0,0,0,0|2,0,0]=3 1006 B8R1.7 NC(N)=C1C=NC=C1 Amb25123927 [0,1,0,0,0,0|3,0,0]=4 1007 B8R1.7 NS(=O)c1c[s]cc1 Amb25208430 [0,1,0,0,0,0|3,0,0]=4 1008 B8R1.7 NS(=O)c1ccc[nH]1 Amb24516116 [0,1,0,0,0,0|2,0,0]=3 1009 B8R1.7 NS(=O)c1ccco1 Amb25216299 [0,1,0,0,0,0|1,0,0]=2 1010 B8R1.7 O=C(Br)c1c[s]c[n]1 Amb25745645 [0,1,0,0,0,0|2,0,0]=3 1011 B8R1.7 O=C(Br)c1cc[s]c1 Amb24062599 [0,1,0,0,0,0|2,0,0]=3 1012 B8R1.7 O=C(Br)c1ccc[nH]1 Amb24465473 [0,1,0,0,0,0|1,0,0]=2 1013 B8R1.7 O=C(Br)c1ccco1 Amb24093659 [0,1,0,0,0,0|0,0,0]=1 1014 B8R1.7 O=C(Cl)C1=CCC=N1 Amb24518840 [0,1,0,0,0,0|1,0,1]=3 1015 B8R1.7 O=C(Cl)C1CC=CC1 Amb24371090 [0,1,0,0,0,0|1,0,2]=4 1016 B8R1.7 O=C(Cl)[n]1ccc[n]1 Amb22886609 [0,1,0,0,0,0|2,0,0]=3 1017 B8R1.7 O=C(Cl)c1[nH]c[n][n]1 Amb25327131 [0,1,0,0,0,0|3,0,0]=4 1018 B8R1.7 O=C(Cl)c1c[nH][n]c1 Amb18949229 [0,1,0,0,0,0|3,0,0]=4 1019 B8R1.7 O=C(Cl)c1c[n][s][n]1 Amb23588580 [0,1,0,0,0,0|3,0,0]=4 1020 B8R1.7 O=C(Cl)c1c[n][s]c1 Amb24079653 [0,1,0,0,0,0|3,0,0]=4 1021 B8R1.7 O=C(Cl)c1cc[nH][n]1 Amb18523731 [0,1,0,0,0,0|2,0,0]=3 1022 B8R1.7 O=C(Cl)c1cc[s][n]1 Amb24062131 [0,1,0,0,0,0|2,0,0]=3 1023 B8R1.7 O=C(Cl)c1ccc[nH]1 Amb24090836 [0,1,0,0,0,0|1,0,0]=2 1024 B8R1.7 O=C(Cl)c1cco[n]1 Amb18279434 [0,1,0,0,0,0|2,0,0]=3 1025 B8R1.7 O=C(Cl)c1coc[n]1 Amb23440854 [0,1,0,0,0,0|2,0,0]=3 1026 B8R1.7 O=C(F)c1ccco1 Amb25223795 [0,1,0,0,0,0|0,0,0]=1 1027 B8R1.7 O=C(F)c1ccoc1 Amb24579234 [0,1,0,0,0,0|2,0,0]=3 1028 B8R1.7 O=N(=O)[n]1ccc[n]1 Amb20621869 [0,1,0,0,0,0|3,0,0]=4 1029 B8R1.7 O=N(=O)c1[nH]cc[n]1 Amb20621827 [0,1,0,0,0,0|3,0,0]=4 1030 B8R1.7 O=N(=O)c1cc[nH]n1 Amb2454367 [0,1,0,0,0,0|3,0,0]=4 1031 B8R1.7 O=N(=O)c1ccc[s]1 Amb20621934 [0,1,0,0,0,0|1,1,0]=3 1032 B8R1.7 O=N(=O)c1ccn[nH]1 Amb10234913 [0,1,0,0,0,0|3,0,0]=4 1033 B8R1.7 O=S(Cl)c1c[nH]c[n]1 Amb24646432 [0,1,0,0,0,0|3,0,0]=4 1034 B8R1.7 O=S(Cl)c1ccc[nH]1 Amb24518856 [0,1,0,0,0,0|2,0,0]=3 1035 B8R1.7 O=S(Cl)c1ccc[s]1 Amb18563780 [0,1,0,0,0,0|1,1,0]=3 1036 B8R1.7 OB(O)c1[cH-]ccc1 Amb24121492 [0,1,0,0,0,0|2,0,1]=4 1037 B8R1.7 OB(O)c1[cH-]ccc1 Amb24121494 [0,1,0,0,0,0|2,0,1]=4 1038 B8R1.7 OB(O)c1[cH-]ccc1 Amb24122588 [0,1,0,0,0,0|2,0,1]=4 1039 B8R1.7 OB(O)c1[cH-]ccc1 Amb24122589 [0,1,0,0,0,0|2,0,1]=4 1040 B8R1.7 OB(O)c1[n]cco1 Amb20242285 [0,1,0,0,0,0|2,0,1]=4 1041 B8R1.7 OB(O)c1c[n]co1 Amb20248129 [0,1,0,0,0,0|2,0,1]=4 1042 B8R1.7 OB(O)c1ccc[nH]1 Amb20247926 [0,1,0,0,0,0|2,0,1]=4 1043 B8R1.7 OB(c1ccc[se]1)O Amb10070609 [0,1,0,0,0,0|1,1,1]=4 1044 B8R1.7 OB(c1ccco1)O Amb2235054 [0,1,0,0,0,0|1,0,1]=3 1045 B8R1.7 OC(=O)C1=CC=CC1 Amb10574923 [0,1,0,0,0,0|1,0,0]=2 1046 B8R1.7 OC(=O)C1=CCCN1 Amb17593173 [0,1,0,0,0,0|1,0,2]=4 1047 B8R1.7 OC(=O)C1=CCCO1 Amb19148920 [0,1,0,0,0,0|0,0,2]=3 1048 B8R1.7 OC(=O)C1=CCCS1 Amb18642795 [0,1,0,0,0,0|0,1,2]=4 1049 B8R1.7 OC(=O)C1=CN=S=N1 Amb17798585 [0,1,0,0,0,0|3,0,0]=4 1050 B8R1.7 OC(=O)C1=CSCS1 Amb25330178 [0,1,0,0,0,0|1,1,1]=4 1051 B8R1.7 OC(=O)C1C=CCN1 Amb22899488 [0,1,0,0,0,0|1,0,2]=4 1052 B8R1.7 OC(=O)C1C=CCO1 Amb18641762 [0,1,0,0,0,0|0,0,2]=3 1053 B8R1.7 OC(=O)C1C=CCS1 Amb18642794 [0,1,0,0,0,0|0,1,2]=4 1054 B8R1.7 OC(=O)C1CCC=C1 Amb18641680 [0,1,0,0,0,0|1,0,2]=4 1055 B8R1.7 OC(=O)C1CSC=C1 Amb18642796 [0,1,0,0,0,0|2,0,1]=4 1056 B8R1.7 OC(=O)C=1C=CCN1 Amb25178644 [0,1,0,0,0,0|1,0,1]=3 1057 B8R1.7 OC(=O)C=1CC=CC1 Amb24553923 [0,1,0,0,0,0|1,0,0]=2 1058 B8R1.7 OC(=O)C=1CC=NN1 Amb22235538 [0,1,0,0,0,0|2,0,1]=4 1059 B8R1.7 OC(=O)C=1CCOC1 Amb18124248 [0,1,0,0,0,0|2,0,1]=4 1060 B8R1.7 OC(=O)C=1CN=CN1 Amb22229764 [0,1,0,0,0,0|2,0,1]=4 1061 B8R1.7 OC(=O)C=1COCC1 Amb24434391 [0,1,0,0,0,0|2,0,1]=4 1062 B8R1.7 OC(=O)C=1CSCC1 Amb18642797 [0,1,0,0,0,0|2,0,1]=4 1063 B8R1.7 OC(=O)[C@@H]1C=CCN1 Amb22750611 [0,1,0,0,0,0|1,0,2]=4 1064 B8R1.7 OC(=O)[C@H]1C=CCN1 Amb19515991 [0,1,0,0,0,0|1,0,2]=4 1065 B8R1.7 OC(=O)[C@H]1CCC=C1 Amb25304679 [0,1,0,0,0,0|1,0,2]=4 1066 B8R1.7 OC(=O)[C@H]1NCC=C1 Amb16183937 [0,1,0,0,0,0|1,0,2]=4 1067 B8R1.7 OC(=O)[n]1c[n]cc1 Amb19861089 [0,1,0,0,0,0|3,0,0]=4 1068 B8R1.7 OC(=O)c1[n][n]c[s]1 Amb20241053 [0,1,0,0,0,0|2,1,0]=4 1069 B8R1.7 OC(=O)c1[n][n]co1 Amb21964326 [0,1,0,0,0,0|2,0,0]=3 1070 B8R1.7 OC(=O)c1[n]c[n][s]1 Amb18203206 [0,1,0,0,0,0|2,1,0]=4 1071 B8R1.7 OC(=O)c1[n]cco1 Amb22899196 [0,1,0,0,0,0|1,0,0]=2 1072 B8R1.7 OC(=O)c1c[nH]cn1 Amb1969735 [0,1,0,0,0,0|2,0,0]=3 1073 B8R1.7 OC(=O)c1c[nH]nc1 Amb10610070 [0,1,0,0,0,0|3,0,0]=4 1074 B8R1.7 OC(=O)c1c[nH]nc1 Amb1934821 [0,1,0,0,0,0|3,0,0]=4 1075 B8R1.7 OC(=O)c1c[n][n]o1 Amb24651283 [0,1,0,0,0,0|2,0,0]=3 1076 B8R1.7 OC(=O)c1c[s]c[n]1 Amb21953919 [0,1,0,0,0,0|2,0,0]=3 1077 B8R1.7 OC(=O)c1cc[nH]c1 Amb17942956 [0,1,0,0,0,0|2,0,0]=3 1078 B8R1.7 OC(=O)c1cc[s][n]1 Amb19894963 [0,1,0,0,0,0|2,0,0]=3 1079 B8R1.7 OC(=O)c1ccc[nH]1 Amb1154382 [0,1,0,0,0,0|1,0,0]=2 1080 B8R1.7 OC(=O)c1ccc[pH]1 Amb24690352 [0,1,0,0,0,0|1,0,0]=2 1081 B8R1.7 OC(=O)c1ccc[s]1 Amb22730855 [0,1,0,0,0,0|0,1,0]=2 1082 B8R1.7 OC(=O)c1ccn[nH]1 Amb1301347 [0,1,0,0,0,0|2,0,0]=3 1083 B8R1.7 OC(=O)c1ccno1 Amb1152220 [0,1,0,0,0,0|1,0,0]=2 1084 B8R1.7 OC(=O)c1ccns1 Amb1091955 [0,1,0,0,0,0|1,1,0]=3 1085 B8R1.7 OC(=O)c1cn[nH]n1 Amb17622050 [0,1,0,0,0,0|3,0,0]=4 1086 B8R1.7 OC(=O)c1cnco1 Amb1158212 [0,1,0,0,0,0|1,0,0]=2 1087 B8R1.7 OC(=O)c1cncs1 Amb1158214 [0,1,0,0,0,0|1,1,0]=3 1088 B8R1.7 OC(=O)c1cnsn1 Amb1091970 [0,1,0,0,0,0|3,0,0]=4 1089 B8R1.7 OC(=O)c1cocn1 Amb10071584 [0,1,0,0,0,0|2,0,0]=3 1090 B8R1.7 OC(=O)c1cscc1 Amb1156673 [0,1,0,0,0,0|2,0,0]=3 1091 B8R1.7 OC(=O)c1cscn1 Amb17039667 [0,1,0,0,0,0|2,0,0]=3 1092 B8R1.7 OC(=O)c1cscn1 Amb2455731 [0,1,0,0,0,0|2,0,0]=3 1093 B8R1.7 OC(=O)c1n[nH]cn1 Amb1088840 [0,1,0,0,0,0|3,0,0]=4 1094 B8R1.7 OC(=S)[n]1cccc1 Amb24060867 [0,1,0,0,0,0|2,0,1]=4 1095 B8R1.7 OC(=S)c1c[n]c[s]1 Amb24756433 [0,1,0,0,0,0|1,1,1]=4 1096 B8R1.7 OC(=S)c1c[s]c[n]1 Amb24099736 [0,1,0,0,0,0|2,0,1]=4 1097 B8R1.7 OC(=S)c1ccco1 Amb20621386 [0,1,0,0,0,0|0,0,1]=2 1098 B8R1.7 OC(O)c1ccc[s]1 Amb25220947 [0,1,0,0,0,0|0,1,2]=4 1099 B8R1.7 OC(O)c1ccco1 Amb25745778 [0,1,0,0,0,0|0,0,2]=3 1100 B8R1.7 OS(=O)c1c[nH]cc1 Amb18221892 [0,1,0,0,0,0|3,0,0]=4 1101 B8R1.7 OS(=O)c1ccc[nH]1 Amb24651386 [0,1,0,0,0,0|2,0,0]=3 1102 B8R1.7 OS(=O)c1ccc[s]1 Amb18063457 [0,1,0,0,0,0|1,1,0]=3 1103 B8R1.7 S=C(Cl)c1ccc[s]1 Amb25223491 [0,1,0,0,0,0|0,2,0]=3 1104 B8R1.7 SC(=S)c1c[nH]cn1 Amb16232212 [0,1,0,0,0,0|2,1,0]=4 1105 B8R1.7 SC(=S)c1ccco1 Amb25024360 [0,1,0,0,0,0|0,1,0]=2 1106 B8R1.7 [2H]C(=O)c1c[nH]c[n]1 Amb22365981 [0,1,0,0,0,0|2,0,0]=3 1107 B8R1.7 [O-]C(=O)c1[n]cco1 Amb19889813 [0,1,0,0,0,0|1,0,0]=2 1108 B8R1.7 [O-]C(=O)c1ccco1 Amb22748857 [0,1,0,0,0,0|0,0,0]=1 1109 B8R1.7 [O-]C(=O)c1ccco1 Amb22753185 [0,1,0,0,0,0|0,0,0]=1 1110 B8R1.7 [O-]C(=O)c1cccs1 Amb10067272 [0,1,0,0,0,0|0,1,0]=2 1111 B8R1.7 [O-]C(=O)c1cccs1 Amb10071470 [0,1,0,0,0,0|0,1,0]=2 1112 B8R1.7 [O-]C(=O)c1cncs1 Amb13951709 [0,1,0,0,0,0|1,1,0]=3 1113 B8R1.7 [O-]C(=O)c1coc[n]1 Amb24104266 [0,1,0,0,0,0|2,0,0]=3 1114 B8R1.7 [O-]C(=O)c1cscn1 Amb13951445 [0,1,0,0,0,0|2,0,0]=3 1115 B8R1.7 [O-]C(=O)c1nccs1 Amb1102733 [0,1,0,0,0,0|1,1,0]=3 1116 B8R1.7 [O-]S(=O)c1ccc[s]1 Amb19944454 [0,1,0,0,0,0|1,1,0]=3 1117 B8R1.7 [O-][N+](=O)c1[n][n]co1 Amb22551856 [0,1,0,0,0,0|3,0,0]=4 1118 B8R1.7 [O-][N+](=O)c1c[n-]cn1 Amb10574184 [0,1,0,0,0,0|3,0,0]=4 1119 B8R1.7 [O-][N+](=O)c1c[nH]cn1 Amb1102136 [0,1,0,0,0,0|3,0,0]=4 1120 B8R1.7 [O-][N+](=O)c1ccc[nH]1 Amb19958161 [0,1,0,0,0,0|2,0,0]=3 1121 B8R1.7 [O-][N+](=O)c1ccco1 Amb10573954 [0,1,0,0,0,0|1,0,0]=2 1122 B8R1.7 [O-][N+](=O)c1cccs1 Amb1208024 [0,1,0,0,0,0|1,1,0]=3 1123 B8R1.7 [O-][N+](=O)c1cncs1 Amb10070705 [0,1,0,0,0,0|2,1,0]=4 1124 B8R1.7 [O-][N+](=O)c1cocc1 Amb24433237 [0,1,0,0,0,0|3,0,0]=4 1125 B8R1.7 [O-][N+](=O)c1nccs1 Amb10573893 [0,1,0,0,0,0|2,1,0]=4 1126 B8R1.8 BrC#Cc1cccs1 Amb17940364 [0,1,0,0,0,0|1,1,1]=4 1127 B8R1.8 BrCCc1ccc[nH]1 Amb25312927 [0,1,0,0,0,0|2,0,1]=4 1128 B8R1.8 BrCCc1ccco1 Amb22752866 [0,1,0,0,0,0|1,0,1]=3 1129 B8R1.8 BrCCc1cccs1 Amb16234134 [0,1,0,0,0,0|1,1,1]=4 1130 B8R1.8 Br\C=C/c1ccc[s]1 Amb25286558 [0,1,0,0,0,0|1,1,0]=3 1131 B8R1.8 Br\C=C/c1ccco1 Amb24505348 [0,1,0,0,0,0|1,0,0]=2 1132 B8R1.8 Br\C=C/c1cocc1 Amb25213806 [0,1,0,0,0,0|3,0,0]=4 1133 B8R1.8 Br\C=C\c1ccc[s]1 Amb25305690 [0,1,0,0,0,0|1,1,0]=3 1134 B8R1.8 C#CSc1ccc[s]1 Amb25270779 [0,1,0,0,0,0|1,1,1]=4 1135 B8R1.8 C(c1ccno1)C#N Amb1106087 [0,1,0,0,0,0|2,0,1]=4 1136 B8R1.8 C(c1cnco1)C#N Amb10071197 [0,1,0,0,0,0|2,0,1]=4 1137 B8R1.8 C=C=Cc1ccc[s]1 Amb25258062 [0,1,0,0,0,0|1,1,0]=3 1138 B8R1.8 C=CCc1[nH]cc[n]1 Amb22733979 [0,1,0,0,0,0|3,0,0]=4 1139 B8R1.8 C=CCc1c[nH]cc1 Amb24426386 [0,1,0,0,0,0|3,0,0]=4 1140 B8R1.8 C=CCc1c[s]c[n]1 Amb24737039 [0,1,0,0,0,0|3,0,0]=4 1141 B8R1.8 C=CCc1cc[nH][n]1 Amb24353819 [0,1,0,0,0,0|3,0,0]=4 1142 B8R1.8 C=CCc1cc[s][n]1 Amb25804826 [0,1,0,0,0,0|3,0,0]=4 1143 B8R1.8 C=CCc1ccc[nH]1 Amb25075519 [0,1,0,0,0,0|2,0,0]=3 1144 B8R1.8 C=CCc1cocc1 Amb24729373 [0,1,0,0,0,0|3,0,0]=4 1145 B8R1.8 C=CNc1ccco1 Amb24516221 [0,1,0,0,0,0|1,0,0]=2 1146 B8R1.8 C=CSc1ccc[nH]1 Amb24481497 [0,1,0,0,0,0|2,0,0]=3 1147 B8R1.8 C=NC=C1NC=CS1 Amb24086582 [0,1,0,0,0,0|2,1,0]=4 1148 B8R1.8 C=N\C=C/1\NC=CS1 Amb24566939 [0,1,0,0,0,0|2,1,0]=4 1149 B8R1.8 CC#Cc1ccco1 Amb24596672 [0,1,0,0,0,0|1,0,1]=3 1150 B8R1.8 CCCc1ccco1 Amb10070288 [0,1,0,0,0,0|1,0,1]=3 1151 B8R1.8 CCNc1[n]cco1 Amb25744100 [0,1,0,0,0,0|2,0,1]=4 1152 B8R1.8 CCNc1ccc[s]1 Amb18055004 [0,1,0,0,0,0|1,1,1]=4 1153 B8R1.8 CCOc1ccc[nH]1 Amb22756799 [0,1,0,0,0,0|2,0,1]=4 1154 B8R1.8 CCOc1ccco1 Amb25222294 [0,1,0,0,0,0|1,0,1]=3 1155 B8R1.8 CCSc1cccs1 Amb17845323 [0,1,0,0,0,0|1,1,1]=4 1156 B8R1.8 CN=Cc1c[n]c[nH]1 Amb24481510 [0,1,0,0,0,0|3,0,0]=4 1157 B8R1.8 CNCc1cc[n]o1 Amb22831413 [0,1,0,0,0,0|2,0,1]=4 1158 B8R1.8 CNCc1ccco1 Amb1153202 [0,1,0,0,0,0|1,0,1]=3 1159 B8R1.8 CNCc1cccs1 Amb1152299 [0,1,0,0,0,0|1,1,1]=4 1160 B8R1.8 COCc1ccc[nH]1 Amb24715907 [0,1,0,0,0,0|1,0,2]=4 1161 B8R1.8 COCc1ccc[s]1 Amb25169518 [0,1,0,0,0,0|0,1,2]=4 1162 B8R1.8 COCc1ccco1 Amb24116969 [0,1,0,0,0,0|0,0,2]=3 1163 B8R1.8 CSCc1ccc[nH]1 Amb25082991 [0,1,0,0,0,0|1,1,1]=4 1164 B8R1.8 C[SiH2]Oc1ccco1 Amb25025922 [0,1,0,0,0,0|1,1,0]=3 1165 B8R1.8 C\C=C\c1[nH]cc[n]1 Amb25127941 [0,1,0,0,0,0|3,0,0]=4 1166 B8R1.8 C\C=C\c1c[n]co1 Amb25746946 [0,1,0,0,0,0|2,0,0]=3 1167 B8R1.8 C\C=C\c1ccco1 Amb25375449 [0,1,0,0,0,0|1,0,0]=2 1168 B8R1.8 C\N=C\c1c[nH]cc1 Amb24621844 [0,1,0,0,0,0|3,0,0]=4 1169 B8R1.8 C\N=C\c1ccco1 Amb25186851 [0,1,0,0,0,0|1,0,0]=2 1170 B8R1.8 ClC#Cc1ccc[s]1 Amb24578988 [0,1,0,0,0,0|1,1,1]=4 1171 B8R1.8 ClCCc1ccco1 Amb24555129 [0,1,0,0,0,0|1,0,1]=3 1172 B8R1.8 ClCSc1[n]cco1 Amb24731778 [0,1,0,0,0,0|2,0,1]=4 1173 B8R1.8 ClC[SiH2]c1ccc[s]1 Amb25060138 [0,1,0,0,0,0|1,1,1]=4 1174 B8R1.8 ClC[SiH2]c1ccco1 Amb24481375 [0,1,0,0,0,0|1,0,1]=3 1175 B8R1.8 ClSCc1ccco1 Amb24708258 [0,1,0,0,0,0|0,1,1]=3 1176 B8R1.8 Cl[Mg]Cc1ccco1 Amb20242525 [0,1,0,0,0,0|1,0,1]=3 1177 B8R1.8 Cl\C=C/c1ccco1 Amb25746738 [0,1,0,0,0,0|1,0,0]=2 1178 B8R1.8 Cl\C=C\c1ccc[s]1 Amb24635042 [0,1,0,0,0,0|1,1,0]=3 1179 B8R1.8 ICCc1ccc[s]1 Amb25106538 [0,1,0,0,0,0|1,1,1]=4 1180 B8R1.8 I\C=C\c1ccc[s]1 Amb25663240 [0,1,0,0,0,0|1,1,0]=3 1181 B8R1.8 I\C=C\c1ccco1 Amb24697510 [0,1,0,0,0,0|1,0,0]=2 1182 B8R1.8 I\C=C\c1cocc1 Amb25351902 [0,1,0,0,0,0|3,0,0]=4 1183 B8R1.8 N#CCc1[cH-]ccc1 Amb24122587 [0,1,0,0,0,0|2,0,1]=4 1184 B8R1.8 N#CCc1[n]cco1 Amb22055989 [0,1,0,0,0,0|2,0,1]=4 1185 B8R1.8 N#CCc1ccc[nH]1 Amb19372852 [0,1,0,0,0,0|2,0,1]=4 1186 B8R1.8 N#CSc1ccc[nH]1 Amb24435226 [0,1,0,0,0,0|2,0,1]=4 1187 B8R1.8 N#CSc1ccco1 Amb24676937 [0,1,0,0,0,0|1,0,1]=3 1188 B8R1.8 N#C[Hg]c1ccco1 Amb22360264 [0,1,0,0,0,0|1,0,1]=3 1189 B8R1.8 N(c1nncs1)C=O Amb10566470 [0,1,0,0,0,0|2,1,0]=4 1190 B8R1.8 N=CCc1c[n]c[nH]1 Amb25163733 [0,1,0,0,0,0|3,0,0]=4 1191 B8R1.8 NCCc1ccc[nH]1 Amb18281448 [0,1,0,0,0,0|2,0,1]=4 1192 B8R1.8 NCCc1ccc[nH]1 Amb22497242 [0,1,0,0,0,0|2,0,1]=4 1193 B8R1.8 NCCc1ccc[nH]1 Amb22751407 [0,1,0,0,0,0|2,0,1]=4 1194 B8R1.8 NCCc1ccco1 Amb1080943 [0,1,0,0,0,0|1,0,1]=3 1195 B8R1.8 NCCc1ccco1 Amb22587649 [0,1,0,0,0,0|1,0,1]=3 1196 B8R1.8 NCCc1cccs1 Amb1073690 [0,1,0,0,0,0|1,1,1]=4 1197 B8R1.8 NN=Cc1c[n]c[s]1 Amb25271172 [0,1,0,0,0,0|2,1,0]=4 1198 B8R1.8 NN=Cc1c[s]c[n]1 Amb24718122 [0,1,0,0,0,0|3,0,0]=4 1199 B8R1.8 NNCc1ccc[nH]1 Amb19664692 [0,1,0,0,0,0|2,0,1]=4 1200 B8R1.8 NNCc1ccc[s]1 Amb22587449 [0,1,0,0,0,0|1,1,1]=4 1201 B8R1.8 NOCc1cc[n]o1 Amb24483082 [0,1,0,0,0,0|1,0,2]=4 1202 B8R1.8 NOCc1ccc[s]1 Amb25189036 [0,1,0,0,0,0|0,1,2]=4 1203 B8R1.8 NOCc1ccco1 Amb25141783 [0,1,0,0,0,0|0,0,2]=3 1204 B8R1.8 N\C=C\C=1BC=CC1 Amb24482577 [0,1,0,0,0,0|2,0,0]=3 1205 B8R1.8 N\C=C\c1[nH]cc[n]1 Amb24103439 [0,1,0,0,0,0|3,0,0]=4 1206 B8R1.8 N\C=C\c1[n]cc[s]1 Amb24103433 [0,1,0,0,0,0|2,1,0]=4 1207 B8R1.8 N\C=C\c1[n]cco1 Amb24696858 [0,1,0,0,0,0|2,0,0]=3 1208 B8R1.8 N\C=C\c1c[n]c[nH]1 Amb24103440 [0,1,0,0,0,0|3,0,0]=4 1209 B8R1.8 N\C=C\c1c[n]c[s]1 Amb24103442 [0,1,0,0,0,0|2,1,0]=4 1210 B8R1.8 N\C=C\c1ccc[s]1 Amb25745218 [0,1,0,0,0,0|1,1,0]=3 1211 B8R1.8 N\N=C\c1c[nH]cc1 Amb25185315 [0,1,0,0,0,0|3,0,0]=4 1212 B8R1.8 N\N=C\c1ccc[nH]1 Amb25090365 [0,1,0,0,0,0|2,0,0]=3 1213 B8R1.8 N\N=C\c1ccco1 Amb24370911 [0,1,0,0,0,0|1,0,0]=2 1214 B8R1.8 O=C=CC1C=CC=N1 Amb24516508 [0,1,0,0,0,0|1,0,1]=3 1215 B8R1.8 O=C=Cc1c[s]cc1 Amb25216263 [0,1,0,0,0,0|2,0,0]=3 1216 B8R1.8 O=C=Cc1ccco1 Amb25025665 [0,1,0,0,0,0|0,0,0]=1 1217 B8R1.8 O=C=Nc1c[nH]cc1 Amb18061859 [0,1,0,0,0,0|2,0,1]=4 1218 B8R1.8 O=C=Nc1c[n]co1 Amb25276160 [0,1,0,0,0,0|1,0,1]=3 1219 B8R1.8 O=C=Nc1c[s]c[n]1 Amb18280925 [0,1,0,0,0,0|2,0,1]=4 1220 B8R1.8 O=C=Nc1cc[nH][n]1 Amb18279569 [0,1,0,0,0,0|2,0,1]=4 1221 B8R1.8 O=C=Nc1cc[n]o1 Amb18061875 [0,1,0,0,0,0|1,0,1]=3 1222 B8R1.8 O=CCC1CC=CC1 Amb18641620 [0,1,0,0,0,0|1,0,2]=4 1223 B8R1.8 O=CCC1COC=C1 Amb25086590 [0,1,0,0,0,0|2,0,1]=4 1224 B8R1.8 O=CC[n]1c[n]cc1 Amb24580294 [0,1,0,0,0,0|3,0,0]=4 1225 B8R1.8 O=CC[n]1cccc1 Amb18203408 [0,1,0,0,0,0|2,0,0]=3 1226 B8R1.8 O=CCc1[n][n]co1 Amb22886659 [0,1,0,0,0,0|2,0,0]=3 1227 B8R1.8 O=CCc1[n]c[s][n]1 Amb24545600 [0,1,0,0,0,0|3,0,0]=4 1228 B8R1.8 O=CCc1c[nH][n]c1 Amb25216022 [0,1,0,0,0,0|3,0,0]=4 1229 B8R1.8 O=CCc1c[nH]c[n]1 Amb18124130 [0,1,0,0,0,0|2,0,0]=3 1230 B8R1.8 O=CCc1c[n][s][n]1 Amb24548593 [0,1,0,0,0,0|3,0,0]=4 1231 B8R1.8 O=CCc1c[n]co1 Amb24653904 [0,1,0,0,0,0|1,0,0]=2 1232 B8R1.8 O=CCc1c[n]oc1 Amb24502003 [0,1,0,0,0,0|3,0,0]=4 1233 B8R1.8 O=CCc1c[s]c[n]1 Amb24469342 [0,1,0,0,0,0|2,0,0]=3 1234 B8R1.8 O=CCc1ccc[nH]1 Amb24763675 [0,1,0,0,0,0|1,0,0]=2 1235 B8R1.8 O=CCc1ccco1 Amb17089526 [0,1,0,0,0,0|0,0,0]=1 1236 B8R1.8 O=CCc1cccs1 Amb17089527 [0,1,0,0,0,0|0,1,0]=2 1237 B8R1.8 O=CCc1cocc1 Amb18641576 [0,1,0,0,0,0|2,0,0]=3 1238 B8R1.8 O=CNC1CC=CC1 Amb25031497 [0,1,0,0,0,0|1,0,2]=4 1239 B8R1.8 O=CNC1CCC=C1 Amb24658259 [0,1,0,0,0,0|1,0,2]=4 1240 B8R1.8 O=CNC=1CCCC1 Amb24714679 [0,1,0,0,0,0|1,0,2]=4 1241 B8R1.8 O=CNc1[nH]c[n][n]1 Amb25709834 [0,1,0,0,0,0|3,0,0]=4 1242 B8R1.8 O=CNc1c[nH][n][n]1 Amb24714683 [0,1,0,0,0,0|3,0,0]=4 1243 B8R1.8 O=CNc1c[n][s]c1 Amb25730573 [0,1,0,0,0,0|3,0,0]=4 1244 B8R1.8 O=CNc1c[n]c[nH]1 Amb25178740 [0,1,0,0,0,0|2,0,0]=3 1245 B8R1.8 O=CNc1c[s]c[n]1 Amb24086332 [0,1,0,0,0,0|2,0,0]=3 1246 B8R1.8 O=CNc1nccs1 Amb10561672 [0,1,0,0,0,0|1,1,0]=3 1247 B8R1.8 O=COc1[nH]cc[n]1 Amb25187018 [0,1,0,0,0,0|2,0,0]=3 1248 B8R1.8 O=COc1ccc[nH]1 Amb24756546 [0,1,0,0,0,0|1,0,0]=2 1249 B8R1.8 O=C\C=C/1\C=CSS1 Amb25136967 [0,1,0,0,0,0|1,1,0]=3 1250 B8R1.8 O=[C-][Fe+]C1C=CC=C1 Amb24325233 [0,1,0,0,0,0|1,0,2]=4 1251 B8R1.8 OCCC=1CC=CC1 Amb25795365 [0,1,0,0,0,0|1,0,2]=4 1252 B8R1.8 OCCc1ccc[nH]1 Amb17593146 [0,1,0,0,0,0|1,0,2]=4 1253 B8R1.8 OCCc1ccco1 Amb17089516 [0,1,0,0,0,0|0,0,2]=3 1254 B8R1.8 OCCc1cccs1 Amb2099445 [0,1,0,0,0,0|0,1,2]=4 1255 B8R1.8 ON=Cc1c[n]c[nH]1 Amb24394914 [0,1,0,0,0,0|2,0,1]=4 1256 B8R1.8 ON=Cc1c[n]c[s]1 Amb24469825 [0,1,0,0,0,0|1,1,1]=4 1257 B8R1.8 ON=Cc1c[s]c[n]1 Amb25074840 [0,1,0,0,0,0|2,0,1]=4 1258 B8R1.8 ONCc1ccc[nH]1 Amb25071150 [0,1,0,0,0,0|1,0,2]=4 1259 B8R1.8 ONCc1ccc[s]1 Amb23449451 [0,1,0,0,0,0|0,1,2]=4 1260 B8R1.8 ONCc1ccco1 Amb23449450 [0,1,0,0,0,0|0,0,2]=3 1261 B8R1.8 O\C=C/C=1[BH2-][O+]=CC1 Amb25225381 [0,1,0,0,0,0|2,0,1]=4 1262 B8R1.8 O\C=C\C=1[BH2-][O+]=CC1 Amb24583060 [0,1,0,0,0,0|2,0,1]=4 1263 B8R1.8 O\N=C/c1ccco1 Amb10068736 [0,1,0,0,0,0|0,0,1]=2 1264 B8R1.8 O\N=C\C=1CC=CC1 Amb24748669 [0,1,0,0,0,0|1,0,1]=3 1265 B8R1.8 O\N=C\c1[n]cc[s]1 Amb22736216 [0,1,0,0,0,0|1,1,1]=4 1266 B8R1.8 O\N=C\c1c[nH]c[n]1 Amb21953000 [0,1,0,0,0,0|2,0,1]=4 1267 B8R1.8 O\N=C\c1c[nH]cc1 Amb22491065 [0,1,0,0,0,0|2,0,1]=4 1268 B8R1.8 O\N=C\c1c[n]c[s]1 Amb24524534 [0,1,0,0,0,0|1,1,1]=4 1269 B8R1.8 S=C=Nc1ccco1 Amb24743299 [0,1,0,0,0,0|0,1,1]=3 1270 B8R1.8 S=CC=C1NC=CN1 Amb24743737 [0,1,0,0,0,0|2,1,0]=4 1271 B8R1.8 S=CNc1c[s]cc1 Amb24616004 [0,1,0,0,0,0|2,1,0]=4 1272 B8R1.8 SCCc1ccco1 Amb24511324 [0,1,0,0,0,0|0,1,1]=3 1273 B8R1.8 SCCc1cccs1 Amb17399886 [0,1,0,0,0,0|0,2,1]=4 1274 B8R1.8 [C-]#[N+]Cc1ccco1 Amb1981056 [0,1,0,0,0,0|1,0,1]=3 1275 B8R1.8 [N-]=[N+]=Cc1cocc1 Amb25221829 [0,1,0,0,0,0|3,0,0]=4 1276 B8R1.8 [N-]=[N+]=Nc1ccc[s]1 Amb25756826 [0,1,0,0,0,0|2,1,0]=4 1277 B8R1.8 [O-][N+]#Cc1ccc[s]1 Amb25195389 [0,1,0,0,0,0|0,1,2]=4 1278 B8R1.11 BrCc1[s]ccc1I Amb25327114 [0,1,0,0,0,0|1,1,1]=4 1279 B8R1.11 Brc1cc[s]c1CBr Amb25793641 [0,1,0,0,0,0|1,1,1]=4 1280 B8R1.11 Brc1ccoc1CBr Amb24539408 [0,1,0,0,0,0|1,0,1]=3 1281 B8R1.11 Brc1ccoc1[Zn]Br Amb22898070 [0,1,0,0,0,0|2,0,0]=3 1282 B8R1.11 Brc1cscc1C=O Amb2447130 [0,1,0,0,0,0|2,0,0]=3 1283 B8R1.11 C#Cc1[s]ccc1Br Amb25063906 [0,1,0,0,0,0|1,1,1]=4 1284 B8R1.11 C#Cc1[s]ccc1Cl Amb24360339 [0,1,0,0,0,0|1,1,1]=4 1285 B8R1.11 C=C/1N=CS\C1=C/Br Amb24467771 [0,1,0,0,0,0|2,1,0]=4 1286 B8R1.11 C=C[n]1cccc1O Amb25377348 [0,1,0,0,0,0|3,0,0]=4 1287 B8R1.11 C=Cc1cc[s]c1Br Amb25268334 [0,1,0,0,0,0|3,0,0]=4 1288 B8R1.11 C=Cc1occc1Br Amb24350839 [0,1,0,0,0,0|1,0,0]=2 1289 B8R1.11 CC1=CCCC1C=O Amb24611215 [0,1,0,0,0,0|1,0,2]=4 1290 B8R1.11 CC1=NC=SC1C=O Amb25273478 [0,1,0,0,0,0|1,1,1]=4 1291 B8R1.11 CC1CCC=C1C=O Amb25785594 [0,1,0,0,0,0|1,0,2]=4 1292 B8R1.11 CC1OCC=C1C=O Amb24722958 [0,1,0,0,0,0|2,0,1]=4 1293 B8R1.11 CC=1CCCC1C=O Amb18641615 [0,1,0,0,0,0|1,0,2]=4 1294 B8R1.11 CC=1CCSC1C=O Amb18642671 [0,1,0,0,0,0|0,1,2]=4 1295 B8R1.11 CCc1[nH]ccc1C Amb17938705 [0,1,0,0,0,0|2,0,1]=4 1296 B8R1.11 CCc1[s]ccc1Cl Amb25025710 [0,1,0,0,0,0|1,1,1]=4 1297 B8R1.11 CCc1[s]ccc1N Amb18642543 [0,1,0,0,0,0|1,1,1]=4 1298 B8R1.11 CCc1ccc[n]1C Amb25746861 [0,1,0,0,0,0|2,0,1]=4 1299 B8R1.11 CCc1ccc[n]1N Amb20621247 [0,1,0,0,0,0|2,0,1]=4 1300 B8R1.11 CCc1o[n]cc1N Amb18203377 [0,1,0,0,0,0|2,0,1]=4 1301 B8R1.11 CCc1occc1F Amb25223961 [0,1,0,0,0,0|1,0,1]=3 1302 B8R1.11 CNc1[s]ccc1N Amb21857339 [0,1,0,0,0,0|2,1,0]=4 1303 B8R1.11 CNc1ccc[n]1C Amb25718849 [0,1,0,0,0,0|3,0,0]=4 1304 B8R1.11 COc1[s]ccc1Br Amb24082781 [0,1,0,0,0,0|2,1,0]=4 1305 B8R1.11 COc1[s]ccc1Cl Amb25342492 [0,1,0,0,0,0|2,1,0]=4 1306 B8R1.11 COc1[s]ccc1N Amb19895576 [0,1,0,0,0,0|2,1,0]=4 1307 B8R1.11 COc1ccc[n]1C Amb25124314 [0,1,0,0,0,0|3,0,0]=4 1308 B8R1.11 COc1occc1Br Amb25063328 [0,1,0,0,0,0|2,0,0]=3 1309 B8R1.11 CSc1[s]ccc1O Amb25239140 [0,1,0,0,0,0|2,1,0]=4 1310 B8R1.11 CSc1ccc[n]1C Amb24332974 [0,1,0,0,0,0|3,0,0]=4 1311 B8R1.11 C[C@@H]1C=CC[C@H]1C=O Amb25339612 [0,1,0,0,0,0|1,0,2]=4 1312 B8R1.11 C[C@@H]1CCC=C1C=O Amb25790586 [0,1,0,0,0,0|1,0,2]=4 1313 B8R1.11 C[n]1[n]c[n]c1C=O Amb18124223 [0,1,0,0,0,0|3,0,0]=4 1314 B8R1.11 C[n]1c[n]cc1N=O Amb25224915 [0,1,0,0,0,0|3,0,0]=4 1315 B8R1.11 C[n]1cccc1CBr Amb22301108 [0,1,0,0,0,0|2,0,1]=4 1316 B8R1.11 C[n]1cccc1CCl Amb22301109 [0,1,0,0,0,0|2,0,1]=4 1317 B8R1.11 C[n]1cccc1CI Amb22301110 [0,1,0,0,0,0|2,0,1]=4 1318 B8R1.11 C[n]1cccc1CN Amb21959692 [0,1,0,0,0,0|2,0,1]=4 1319 B8R1.11 C[n]1cccc1CS Amb22301111 [0,1,0,0,0,0|1,1,1]=4 1320 B8R1.11 C[n]1cccc1C[O-] Amb22411415 [0,1,0,0,0,0|1,0,2]=4 1321 B8R1.11 C\C=C/1\CC=CC1=O Amb25044340 [0,1,0,0,0,0|2,0,0]=3 1322 B8R1.11 C\C=C/1\OC=CC1=O Amb25217811 [0,1,0,0,0,0|1,0,0]=2 1323 B8R1.11 C\C=C\1/CC=CC1=O Amb25189062 [0,1,0,0,0,0|2,0,0]=3 1324 B8R1.11 Cc1[nH]ccc1C=O Amb18123871 [0,1,0,0,0,0|2,0,0]=3 1325 B8R1.11 Cc1[n][nH]cc1C=O Amb19884073 [0,1,0,0,0,0|3,0,0]=4 1326 B8R1.11 Cc1[n][n][nH]c1C=O Amb18685866 [0,1,0,0,0,0|3,0,0]=4 1327 B8R1.11 Cc1[n][s][n]c1C=O Amb18642600 [0,1,0,0,0,0|3,0,0]=4 1328 B8R1.11 Cc1[n]coc1CBr Amb22268316 [0,1,0,0,0,0|2,0,1]=4 1329 B8R1.11 Cc1[n]coc1CI Amb22268293 [0,1,0,0,0,0|2,0,1]=4 1330 B8R1.11 Cc1[n]coc1CS Amb22268324 [0,1,0,0,0,0|1,1,1]=4 1331 B8R1.11 Cc1[n]coc1OC Amb22044262 [0,1,0,0,0,0|3,0,0]=4 1332 B8R1.11 Cc1c[nH]cc1C=O Amb18203407 [0,1,0,0,0,0|2,0,0]=3 1333 B8R1.11 Cc1c[n]oc1CBr Amb25675743 [0,1,0,0,0,0|2,0,1]=4 1334 B8R1.11 Cc1c[n]oc1CO Amb24467683 [0,1,0,0,0,0|1,0,2]=4 1335 B8R1.11 Cc1c[s]cc1C=C Amb25746142 [0,1,0,0,0,0|3,0,0]=4 1336 B8R1.11 Cc1cc[nH]c1C#N Amb18122561 [0,1,0,0,0,0|2,0,1]=4 1337 B8R1.11 Cc1cc[s]c1C#C Amb22489883 [0,1,0,0,0,0|1,1,1]=4 1338 B8R1.11 Cc1cc[s]c1C=C Amb24532317 [0,1,0,0,0,0|1,1,0]=3 1339 B8R1.11 Cc1cc[s]c1CBr Amb18325320 [0,1,0,0,0,0|1,1,1]=4 1340 B8R1.11 Cc1cc[s]c1CC Amb25069402 [0,1,0,0,0,0|1,1,1]=4 1341 B8R1.11 Cc1cc[s]c1CS Amb24526885 [0,1,0,0,0,0|0,2,1]=4 1342 B8R1.11 Cc1cc[s]c1OC Amb25064766 [0,1,0,0,0,0|2,1,0]=4 1343 B8R1.11 Cc1cc[s]c1[Zn]Br Amb22000458 [0,1,0,0,0,0|2,1,0]=4 1344 B8R1.11 Cc1ccoc1C#N Amb25352891 [0,1,0,0,0,0|1,0,1]=3 1345 B8R1.11 Cc1ccoc1CBr Amb18183895 [0,1,0,0,0,0|1,0,1]=3 1346 B8R1.11 Cc1cn[nH]c1C=O Amb10789272 [0,1,0,0,0,0|2,0,0]=3 1347 B8R1.11 Cc1cocc1C=O Amb18641606 [0,1,0,0,0,0|2,0,0]=3 1348 B8R1.11 Cc1cscc1C=O Amb2447064 [0,1,0,0,0,0|2,0,0]=3 1349 B8R1.11 Cc1ncoc1C#N Amb17843583 [0,1,0,0,0,0|2,0,1]=4 1350 B8R1.11 Cc1ncoc1CCl Amb17399824 [0,1,0,0,0,0|2,0,1]=4 1351 B8R1.11 Cc1ncoc1CN Amb17399791 [0,1,0,0,0,0|2,0,1]=4 1352 B8R1.11 Cc1oc[n]c1C=C Amb24482090 [0,1,0,0,0,0|3,0,0]=4 1353 B8R1.11 Cc1occc1C=O Amb2447043 [0,1,0,0,0,0|2,0,0]=3 1354 B8R1.11 Cc1sccc1C=O Amb10069337 [0,1,0,0,0,0|2,0,0]=3 1355 B8R1.11 ClC/1=CC=C\C1=C\Cl Amb25798374 [0,1,0,0,0,0|2,0,0]=3 1356 B8R1.11 ClCc1[s]ccc1I Amb25327164 [0,1,0,0,0,0|1,1,1]=4 1357 B8R1.11 ClCc1sccc1Br Amb10610432 [0,1,0,0,0,0|1,1,1]=4 1358 B8R1.11 Clc1cc[s]c1CCl Amb24620455 [0,1,0,0,0,0|1,1,1]=4 1359 B8R1.11 Clc1cc[s]c1CI Amb25246606 [0,1,0,0,0,0|1,1,1]=4 1360 B8R1.11 Clc1cn[nH]c1C=O Amb10789278 [0,1,0,0,0,0|2,0,0]=3 1361 B8R1.11 Clc1snnc1C=O Amb10067983 [0,1,0,0,0,0|3,0,0]=4 1362 B8R1.11 Cn1cncc1C=O Amb2455726 [0,1,0,0,0,0|2,0,0]=3 1363 B8R1.11 Cn1nccc1C=O Amb1946120 [0,1,0,0,0,0|2,0,0]=3 1364 B8R1.11 Ic1cscc1C=O Amb10066908 [0,1,0,0,0,0|2,0,0]=3 1365 B8R1.11 N#Cc1[nH]ccc1Cl Amb24763743 [0,1,0,0,0,0|2,0,1]=4 1366 B8R1.11 N#Cc1[nH]ccc1I Amb22498189 [0,1,0,0,0,0|2,0,1]=4 1367 B8R1.11 N#Cc1[nH]ccc1O Amb25662089 [0,1,0,0,0,0|2,0,1]=4 1368 B8R1.11 N#Cc1[s]ccc1O Amb18642297 [0,1,0,0,0,0|1,1,1]=4 1369 B8R1.11 N=Cc1[n]coc1S Amb25364474 [0,1,0,0,0,0|3,0,0]=4 1370 B8R1.11 N=Cc1cc[nH]c1O Amb24639516 [0,1,0,0,0,0|3,0,0]=4 1371 B8R1.11 N=Cc1cc[s]c1O Amb25364248 [0,1,0,0,0,0|3,0,0]=4 1372 B8R1.11 N=Cc1cc[s]c1S Amb24564159 [0,1,0,0,0,0|3,0,0]=4 1373 B8R1.11 NC=1CCCC1C=O Amb25063022 [0,1,0,0,0,0|1,0,2]=4 1374 B8R1.11 NCc1[s]ccc1Br Amb18280696 [0,1,0,0,0,0|1,1,1]=4 1375 B8R1.11 NCc1[s]ccc1Cl Amb22406102 [0,1,0,0,0,0|1,1,1]=4 1376 B8R1.11 NCc1[s]ccc1F Amb22642190 [0,1,0,0,0,0|1,1,1]=4 1377 B8R1.11 NCc1ccc[n]1N Amb24542688 [0,1,0,0,0,0|2,0,1]=4 1378 B8R1.11 NCc1o[n]cc1Cl Amb25746473 [0,1,0,0,0,0|2,0,1]=4 1379 B8R1.11 NCc1occc1Br Amb18191028 [0,1,0,0,0,0|1,0,1]=3 1380 B8R1.11 NCc1sccc1Br Amb13951625 [0,1,0,0,0,0|1,1,1]=4 1381 B8R1.11 NCc1sccc1C Amb1128389 [0,1,0,0,0,0|1,1,1]=4 1382 B8R1.11 NCc1sccc1Cl Amb10069119 [0,1,0,0,0,0|1,1,1]=4 1383 B8R1.11 NNc1[s]ccc1Br Amb24523151 [0,1,0,0,0,0|2,1,0]=4 1384 B8R1.11 NNc1occc1Br Amb24445422 [0,1,0,0,0,0|2,0,0]=3 1385 B8R1.11 N[n]1cccc1C#N Amb18203413 [0,1,0,0,0,0|2,0,1]=4 1386 B8R1.11 N[n]1cccc1C#N Amb19958421 [0,1,0,0,0,0|2,0,1]=4 1387 B8R1.11 N[n]1cccc1C=O Amb22496148 [0,1,0,0,0,0|1,0,0]=2 1388 B8R1.11 N\C=C/1\C=CNC1=O Amb24708433 [0,1,0,0,0,0|3,0,0]=4 1389 B8R1.11 N\C=C/1\C=COC1=S Amb25223810 [0,1,0,0,0,0|3,0,0]=4 1390 B8R1.11 N\C=C/1\N=CNC1=O Amb24596677 [0,1,0,0,0,0|3,0,0]=4 1391 B8R1.11 N\C=C/1\N=CSC1=O Amb25376762 [0,1,0,0,0,0|3,0,0]=4 1392 B8R1.11 Nc1[nH][n]cc1C=O Amb18203395 [0,1,0,0,0,0|3,0,0]=4 1393 B8R1.11 Nc1[s]c[n]c1C=O Amb24527710 [0,1,0,0,0,0|2,0,0]=3 1394 B8R1.11 Nc1[s]ccc1C=O Amb18522221 [0,1,0,0,0,0|2,0,0]=3 1395 B8R1.11 Nc1[s]ccc1C=S Amb24394323 [0,1,0,0,0,0|2,1,0]=4 1396 B8R1.11 Nc1c[n][nH]c1C=O Amb22495428 [0,1,0,0,0,0|2,0,0]=3 1397 B8R1.11 Nc1cc[nH]c1C#N Amb22751192 [0,1,0,0,0,0|2,0,1]=4 1398 B8R1.11 Nc1cc[s]c1C#N Amb18642210 [0,1,0,0,0,0|1,1,1]=4 1399 B8R1.11 Nc1cc[s]c1C#N Amb22233883 [0,1,0,0,0,0|1,1,1]=4 1400 B8R1.11 Nc1cc[s]c1C=O Amb18202433 [0,1,0,0,0,0|0,1,0]=2 1401 B8R1.11 Nc1cc[s]c1C=S Amb25383386 [0,1,0,0,0,0|0,2,0]=3 1402 B8R1.11 Nc1cc[s]c1CN Amb18251119 [0,1,0,0,0,0|1,1,1]=4 1403 B8R1.11 Nc1ccoc1C#N Amb18122708 [0,1,0,0,0,0|1,0,1]=3 1404 B8R1.11 Nc1ccoc1C=O Amb18203397 [0,1,0,0,0,0|0,0,0]=1 1405 B8R1.11 Nc1ccoc1C=S Amb25790738 [0,1,0,0,0,0|0,1,0]=2 1406 B8R1.11 Nc1cocc1C=O Amb18203396 [0,1,0,0,0,0|2,0,0]=3 1407 B8R1.11 Nc1occc1C=O Amb18833110 [0,1,0,0,0,0|2,0,0]=3 1408 B8R1.11 O=C1CCC=C1C=O Amb18641556 [0,1,0,0,0,0|1,0,2]=4 1409 B8R1.11 O=CC1=C(Cl)CCC1 Amb17593382 [0,1,0,0,0,0|1,0,2]=4 1410 B8R1.11 O=CC1=CC=CC1[Na] Amb24646434 [0,1,0,0,0,0|1,0,0]=2 1411 B8R1.11 O=CC1=NN=CC1Br Amb18191587 [0,1,0,0,0,0|2,0,1]=4 1412 B8R1.11 O=CC1OC=CC1=O Amb25301009 [0,1,0,0,0,0|0,0,1]=2 1413 B8R1.11 O=CC=1CCCC1Br Amb18124521 [0,1,0,0,0,0|1,0,2]=4 1414 B8R1.11 O=CN1CC=CC1=O Amb25377327 [0,1,0,0,0,0|2,0,0]=3 1415 B8R1.11 O=Cc1[nH][n]cc1I Amb22899602 [0,1,0,0,0,0|2,0,0]=3 1416 B8R1.11 O=Cc1[nH]ccc1Br Amb16232050 [0,1,0,0,0,0|1,0,0]=2 1417 B8R1.11 O=Cc1[nH]ccc1Cl Amb18124328 [0,1,0,0,0,0|1,0,0]=2 1418 B8R1.11 O=Cc1[nH]ccc1I Amb22498188 [0,1,0,0,0,0|1,0,0]=2 1419 B8R1.11 O=Cc1[n][nH]cc1I Amb22498765 [0,1,0,0,0,0|2,0,0]=3 1420 B8R1.11 O=Cc1[n][s]cc1Br Amb24682820 [0,1,0,0,0,0|2,0,0]=3 1421 B8R1.11 O=Cc1[n]c[nH]c1Br Amb18191582 [0,1,0,0,0,0|2,0,0]=3 1422 B8R1.11 O=Cc1[n]c[nH]c1Cl Amb18203190 [0,1,0,0,0,0|2,0,0]=3 1423 B8R1.11 O=Cc1[n]c[nH]c1I Amb24637250 [0,1,0,0,0,0|2,0,0]=3 1424 B8R1.11 O=Cc1[n]c[s]c1Br Amb23402177 [0,1,0,0,0,0|2,0,0]=3 1425 B8R1.11 O=Cc1[n]c[s]c1Cl Amb23402182 [0,1,0,0,0,0|2,0,0]=3 1426 B8R1.11 O=Cc1[n]c[s]c1S Amb24099743 [0,1,0,0,0,0|2,0,0]=3 1427 B8R1.11 O=Cc1[n]coc1Cl Amb25279107 [0,1,0,0,0,0|2,0,0]=3 1428 B8R1.11 O=Cc1[n]occ1Cl Amb18199353 [0,1,0,0,0,0|2,0,0]=3 1429 B8R1.11 O=Cc1[s][n]cc1Br Amb25350452 [0,1,0,0,0,0|1,1,0]=3 1430 B8R1.11 O=Cc1[s]c[n]c1Br Amb22304735 [0,1,0,0,0,0|1,1,0]=3 1431 B8R1.11 O=Cc1[s]ccc1F Amb18832537 [0,1,0,0,0,0|0,1,0]=2 1432 B8R1.11 O=Cc1c[nH]cc1I Amb22751312 [0,1,0,0,0,0|2,0,0]=3 1433 B8R1.11 O=Cc1c[n][nH]c1Br Amb23454721 [0,1,0,0,0,0|3,0,0]=4 1434 B8R1.11 O=Cc1c[n][nH]c1Cl Amb18203189 [0,1,0,0,0,0|3,0,0]=4 1435 B8R1.11 O=Cc1c[n]oc1Br Amb18191109 [0,1,0,0,0,0|3,0,0]=4 1436 B8R1.11 O=Cc1c[s]cc1F Amb18203205 [0,1,0,0,0,0|2,0,0]=3 1437 B8R1.11 O=Cc1cc[nH]c1Cl Amb18203207 [0,1,0,0,0,0|2,0,0]=3 1438 B8R1.11 O=Cc1cc[nH]c1I Amb22751311 [0,1,0,0,0,0|2,0,0]=3 1439 B8R1.11 O=Cc1cc[s]c1F Amb18203203 [0,1,0,0,0,0|2,0,0]=3 1440 B8R1.11 O=Cc1cc[s]c1S Amb18201998 [0,1,0,0,0,0|2,0,0]=3 1441 B8R1.11 O=Cc1ccoc1Cl Amb18202950 [0,1,0,0,0,0|2,0,0]=3 1442 B8R1.11 O=Cc1ccoc1F Amb18833045 [0,1,0,0,0,0|2,0,0]=3 1443 B8R1.11 O=Cc1cocc1Cl Amb18202959 [0,1,0,0,0,0|2,0,0]=3 1444 B8R1.11 O=Cc1cocc1F Amb18833047 [0,1,0,0,0,0|2,0,0]=3 1445 B8R1.11 O=Cc1nccn1C Amb1107787 [0,1,0,0,0,0|2,0,0]=3 1446 B8R1.11 O=Cc1o[n]cc1Br Amb18191116 [0,1,0,0,0,0|1,0,0]=2 1447 B8R1.11 O=Cc1o[n]cc1Cl Amb18199347 [0,1,0,0,0,0|1,0,0]=2 1448 B8R1.11 O=Cc1occc1Br Amb2447448 [0,1,0,0,0,0|0,0,0]=1 1449 B8R1.11 O=Cc1occc1Cl Amb18202965 [0,1,0,0,0,0|0,0,0]=1 1450 B8R1.11 O=Cc1occc1F Amb18203365 [0,1,0,0,0,0|0,0,0]=1 1451 B8R1.11 O=Cc1occc1I Amb25089234 [0,1,0,0,0,0|0,0,0]=1 1452 B8R1.11 OC1=CCC=C1C=O Amb25770502 [0,1,0,0,0,0|1,0,1]=3 1453 B8R1.11 OC1C=CCC1C=O Amb24633447 [0,1,0,0,0,0|1,0,2]=4 1454 B8R1.11 OC1CCC=C1C=O Amb24483009 [0,1,0,0,0,0|1,0,2]=4 1455 B8R1.11 OC[C@@H]1OC=CC1=O Amb17678799 [0,1,0,0,0,0|0,0,3]=4 1456 B8R1.11 OC[C@H]1OC=CC1=O Amb25319926 [0,1,0,0,0,0|0,0,3]=4 1457 B8R1.11 OCc1[nH]ccc1Cl Amb24401060 [0,1,0,0,0,0|1,0,2]=4 1458 B8R1.11 OCc1[s]ccc1Br Amb18330307 [0,1,0,0,0,0|0,1,2]=4 1459 B8R1.11 OCc1[s]ccc1Cl Amb21961457 [0,1,0,0,0,0|0,1,2]=4 1460 B8R1.11 OCc1[s]ccc1F Amb22490780 [0,1,0,0,0,0|0,1,2]=4 1461 B8R1.11 OCc1[s]ccc1I Amb25366864 [0,1,0,0,0,0|0,1,2]=4 1462 B8R1.11 OCc1occc1Br Amb22498871 [0,1,0,0,0,0|0,0,2]=3 1463 B8R1.11 OCc1sccc1N Amb10067607 [0,1,0,0,0,0|0,1,2]=4 1464 B8R1.11 O[C@H]1C=CC[C@H]1C=O Amb24633297 [0,1,0,0,0,0|1,0,2]=4 1465 B8R1.11 O\C=C/1\N=COC1=O Amb25850590 [0,1,0,0,0,0|2,0,1]=4 1466 B8R1.11 O\C=C/1\OC=CC1=O Amb24579097 [0,1,0,0,0,0|0,0,1]=2 1467 B8R1.11 Oc1[nH][n]cc1C=O Amb25743396 [0,1,0,0,0,0|3,0,0]=4 1468 B8R1.11 Oc1ccc[n]1C=O Amb24549430 [0,1,0,0,0,0|2,0,0]=3 1469 B8R1.11 Oc1ccoc1CS Amb25849935 [0,1,0,0,0,0|0,1,1]=3 1470 B8R1.11 SCc1occc1Br Amb24717193 [0,1,0,0,0,0|0,1,1]=3 1471 B8R1.11 SCc1occc1I Amb25085081 [0,1,0,0,0,0|0,1,1]=3 1472 B8R1.52 CC1(COC=C1)C=O Amb25366150 [0,1,0,0,0,0|2,0,1]=4 1473 B6R0.1 C/C(CO)=C\C=C Amb17843900 [0,0,1,0,0,0|1,0,2]=4 1474 B6R0.1 C=C(CC#C)C=O Amb25211313 [0,0,1,0,0,0|1,0,2]=4 1475 B6R0.1 C=C(CC#N)C=O Amb25119202 [0,0,1,0,0,0|2,0,1]=4 1476 B6R0.1 C=C(CCO)C=O Amb25278289 [0,0,1,0,0,0|2,0,1]=4 1477 B6R0.1 C=CC(=C)CC=O Amb18120478 [0,0,1,0,0,0|3,0,0]=4 1478 B6R0.1 C=CC(=O)OC=C Amb22231745 [0,0,1,0,0,0|2,0,0]=3 1479 B6R0.1 C=CC(=O)\C=C/Cl Amb24619851 [0,0,1,0,0,0|2,0,1]=4 1480 B6R0.1 C=CC(=O)\C=C\Br Amb24655019 [0,0,1,0,0,0|2,0,1]=4 1481 B6R0.1 C=CCC(=C)C=O Amb18120415 [0,0,1,0,0,0|1,0,0]=2 1482 B6R0.1 C=CCC(=C)CBr Amb24692702 [0,0,1,0,0,0|2,0,1]=4 1483 B6R0.1 C=CCC(=C)CN Amb24551059 [0,0,1,0,0,0|2,0,1]=4 1484 B6R0.1 C=CCC(=C)CO Amb25854150 [0,0,1,0,0,0|1,0,2]=4 1485 B6R0.1 C=CCC(Br)C=O Amb18645751 [0,0,1,0,0,0|1,0,2]=4 1486 B6R0.1 C=CCC(I)C=O Amb25231227 [0,0,1,0,0,0|1,0,2]=4 1487 B6R0.1 C=CCC(O)C=O Amb25356720 [0,0,1,0,0,0|0,0,2]=3 1488 B6R0.1 C=CC[C@@H](F)C=O Amb25205853 [0,0,1,0,0,0|1,0,2]=4 1489 B6R0.1 C=CC[C@H](O)C=O Amb25813766 [0,0,1,0,0,0|0,0,2]=3 1490 B6R0.1 C=CC\C(\Cl)=C/Cl Amb24656131 [0,0,1,0,0,0|2,0,1]=4 1491 B6R0.1 C=COC(=O)CBr Amb22732072 [0,0,1,0,0,0|2,0,1]=4 1492 B6R0.1 C=COC(=O)CCl Amb22045210 [0,0,1,0,0,0|2,0,1]=4 1493 B6R0.1 C=COC(=O)CI Amb17934194 [0,0,1,0,0,0|2,0,1]=4 1494 B6R0.1 C=C\C(\Br)=C\C=O Amb25289229 [0,0,1,0,0,0|3,0,0]=4 1495 B6R0.1 C=C\C=C(/Br)\C=O Amb25277164 [0,0,1,0,0,0|1,0,0]=2 1496 B6R0.1 C=C\C=C(\Br)/C=O Amb18126250 [0,0,1,0,0,0|1,0,0]=2 1497 B6R0.1 CC(C=O)=C=CCl Amb25765240 [0,0,1,0,0,0|2,0,1]=4 1498 B6R0.1 CC(C=O)=CC#C Amb25223797 [0,0,1,0,0,0|1,0,2]=4 1499 B6R0.1 CC(C=O)C=C=C Amb25103278 [0,0,1,0,0,0|1,0,2]=4 1500 B6R0.1 CCCC(=C)C=O Amb18639170 [0,0,1,0,0,0|1,0,2]=4 1501 B6R0.1 CCOC(=C)C=O Amb18639586 [0,0,1,0,0,0|0,0,2]=3 1502 B6R0.1 CCOC(=S)C=O Amb25746370 [0,0,1,0,0,0|1,0,2]=4 1503 B6R0.1 CC\C=C(/Br)\C=O Amb25278288 [0,0,1,0,0,0|1,0,2]=4 1504 B6R0.1 CC\C=C(/F)\C=O Amb25122538 [0,0,1,0,0,0|1,0,2]=4 1505 B6R0.1 CC\C=C(\Br)/C=O Amb18645748 [0,0,1,0,0,0|1,0,2]=4 1506 B6R0.1 CC\C=C(\Cl)/C=O Amb18640561 [0,0,1,0,0,0|1,0,2]=4 1507 B6R0.1 CN(CC=C)C=O Amb25169499 [0,0,1,0,0,0|2,0,1]=4 1508 B6R0.1 CNC(=O)OC=C Amb24334277 [0,0,1,0,0,0|3,0,0]=4 1509 B6R0.1 CN\C=C(\C)/C=O Amb24641474 [0,0,1,0,0,0|2,0,1]=4 1510 B6R0.1 CO\C=C(\C)/C=O Amb25358935 [0,0,1,0,0,0|2,0,1]=4 1511 B6R0.1 C\C(\C=C)=C/C=O Amb25695541 [0,0,1,0,0,0|3,0,0]=4 1512 B6R0.1 C\C(\C=C)=C\C=O Amb18638879 [0,0,1,0,0,0|3,0,0]=4 1513 B6R0.1 C\C(\C=CCl)=C\Cl Amb25059094 [0,0,1,0,0,0|3,0,0]=4 1514 B6R0.1 C\C(\C=O)=C/C#C Amb25026695 [0,0,1,0,0,0|1,0,2]=4 1515 B6R0.1 C\C(\C=O)=C/C#N Amb18120199 [0,0,1,0,0,0|2,0,1]=4 1516 B6R0.1 C\C(\C=O)=C/C=C Amb24559820 [0,0,1,0,0,0|1,0,0]=2 1517 B6R0.1 C\C(\C=O)=C/CCl Amb18122638 [0,0,1,0,0,0|2,0,1]=4 1518 B6R0.1 C\C(\C=O)=C\C=C Amb18638851 [0,0,1,0,0,0|1,0,0]=2 1519 B6R0.1 C\C(\C=O)=C\CC Amb18120867 [0,0,1,0,0,0|1,0,2]=4 1520 B6R0.1 C\C(\C=O)=C\CO Amb18639610 [0,0,1,0,0,0|2,0,1]=4 1521 B6R0.1 C\C(\CBr)=C\C=C Amb24655132 [0,0,1,0,0,0|2,0,1]=4 1522 B6R0.1 C\C(\CC)=C/C=C Amb24480536 [0,0,1,0,0,0|2,0,1]=4 1523 B6R0.1 C\C(\CN)=C\C=C Amb25173819 [0,0,1,0,0,0|2,0,1]=4 1524 B6R0.1 C\C(\CO)=C\C=C Amb25229626 [0,0,1,0,0,0|1,0,2]=4 1525 B6R0.1 C\C=C(/C)\C=C/Br Amb24333920 [0,0,1,0,0,0|3,0,0]=4 1526 B6R0.1 C\C=C(/C)\C=C\C Amb22731156 [0,0,1,0,0,0|2,0,1]=4 1527 B6R0.1 C\C=C(/C)\CC=C Amb24479822 [0,0,1,0,0,0|2,0,1]=4 1528 B6R0.1 C\C=C(/F)\C=CCl Amb25146709 [0,0,1,0,0,0|3,0,0]=4 1529 B6R0.1 C\C=C(\C)/C=CCl Amb25210874 [0,0,1,0,0,0|3,0,0]=4 1530 B6R0.1 C\C=C(\C)/CC=C Amb24099383 [0,0,1,0,0,0|2,0,1]=4 1531 B6R0.1 C\C=C(\F)/C=CCl Amb25026569 [0,0,1,0,0,0|3,0,0]=4 1532 B6R0.1 C\C=C/C(/C)=C\Cl Amb24425554 [0,0,1,0,0,0|2,0,1]=4 1533 B6R0.1 C\C=C\C(=O)C=C Amb25745529 [0,0,1,0,0,0|1,0,2]=4 1534 B6R0.1 C\C=C\C(Cl)=CBr Amb25179235 [0,0,1,0,0,0|2,0,1]=4 1535 B6R0.1 C\C=C\C(O)C=C Amb24684907 [0,0,1,0,0,0|1,0,2]=4 1536 B6R0.1 ClC=C(Cl)\C=C\Cl Amb24448394 [0,0,1,0,0,0|3,0,0]=4 1537 B6R0.1 N#C\C=C(/Br)\C=O Amb18126224 [0,0,1,0,0,0|2,0,1]=4 1538 B6R0.1 O=C\C(\Cl)=C/CCl Amb18124535 [0,0,1,0,0,0|2,0,1]=4 1539 B6R0.1 O[C@@H](CC=O)C=O Amb25169555 [0,0,1,0,0,0|1,0,2]=4 1540 B6R0.1 O[C@H](CC=O)C=O Amb25373324 [0,0,1,0,0,0|1,0,2]=4 1541 B6R0.6 Br\C=C\C=C\C=O Amb16233577 [0,0,1,0,0,0|1,0,0]=2 1542 B6R0.6 C#C\C=C/C=CBr Amb24365394 [0,0,1,0,0,0|2,0,1]=4 1543 B6R0.6 C=CC#CCC=O Amb25063131 [0,0,1,0,0,0|1,0,2]=4 1544 B6R0.6 C=CC=C=CCO Amb25296077 [0,0,1,0,0,0|1,0,2]=4 1545 B6R0.6 C=CC=C\C=C\Br Amb24595200 [0,0,1,0,0,0|2,0,0]=3 1546 B6R0.6 C=CC=C\C=C\O Amb25788961 [0,0,1,0,0,0|1,0,0]=2 1547 B6R0.6 C=CCCCC=O Amb13883672 [0,0,1,0,0,0|1,0,2]=4 1548 B6R0.6 C=CCC\C=C\Br Amb25811421 [0,0,1,0,0,0|2,0,1]=4 1549 B6R0.6 C=CCSCC=O Amb18641509 [0,0,1,0,0,0|0,1,2]=4 1550 B6R0.6 C=CC\C=C\C=O Amb18120424 [0,0,1,0,0,0|1,0,1]=3 1551 B6R0.6 C=C\C=C\CC=C Amb24758163 [0,0,1,0,0,0|2,0,1]=4 1552 B6R0.6 C=C\C=C\CCO Amb24480746 [0,0,1,0,0,0|1,0,2]=4 1553 B6R0.6 C=C\C=C\N=C=O Amb24514482 [0,0,1,0,0,0|2,0,1]=4 1554 B6R0.6 C=C\C=C\NC=O Amb24332749 [0,0,1,0,0,0|2,0,0]=3 1555 B6R0.6 CC=C=CCC=O Amb24579458 [0,0,1,0,0,0|1,0,2]=4 1556 B6R0.6 CCO\C=C\C=O Amb18639560 [0,0,1,0,0,0|2,0,1]=4 1557 B6R0.6 CCS\C=C\C=O Amb18641909 [0,0,1,0,0,0|2,0,1]=4 1558 B6R0.6 CC\C=C/CC=O Amb18639157 [0,0,1,0,0,0|1,0,2]=4 1559 B6R0.6 CC\C=C\C=CCl Amb25211158 [0,0,1,0,0,0|2,0,1]=4 1560 B6R0.6 CC\C=C\CC=O Amb25136370 [0,0,1,0,0,0|1,0,2]=4 1561 B6R0.6 COC\C=C\C=O Amb18639577 [0,0,1,0,0,0|2,0,1]=4 1562 B6R0.6 CO\C=C/CC=O Amb24741941 [0,0,1,0,0,0|2,0,1]=4 1563 B6R0.6 CO\C=C\CC=O Amb24741886 [0,0,1,0,0,0|2,0,1]=4 1564 B6R0.6 C\C=C/C=C/C=O Amb25095226 [0,0,1,0,0,0|1,0,0]=2 1565 B6R0.6 C\C=C/C=C\C=O Amb25827595 [0,0,1,0,0,0|1,0,0]=2 1566 B6R0.6 C\C=C\C#CC=O Amb25169581 [0,0,1,0,0,0|1,0,2]=4 1567 B6R0.6 C\C=C\C=C/C=O Amb25270064 [0,0,1,0,0,0|1,0,0]=2 1568 B6R0.6 C\C=C\C=CC#N Amb25238391 [0,0,1,0,0,0|2,0,1]=4 1569 B6R0.6 C\C=C\C=C\C=C Amb25843234 [0,0,1,0,0,0|2,0,0]=3 1570 B6R0.6 C\C=C\C=C\CC Amb25145643 [0,0,1,0,0,0|2,0,1]=4 1571 B6R0.6 C\C=C\C=C\CN Amb18639062 [0,0,1,0,0,0|2,0,1]=4 1572 B6R0.6 C\C=C\C=C\CN Amb24117256 [0,0,1,0,0,0|2,0,1]=4 1573 B6R0.6 C\C=C\CCC=C Amb22734684 [0,0,1,0,0,0|2,0,1]=4 1574 B6R0.6 C\C=C\COC=C Amb24758645 [0,0,1,0,0,0|3,0,0]=4 1575 B6R0.6 C\C=C\S\C=C\C Amb24108499 [0,0,1,0,0,0|1,1,1]=4 1576 B6R0.6 ClC=C\C=C\CCl Amb25252938 [0,0,1,0,0,0|2,0,1]=4 1577 B6R0.6 Cl\C=C\C=C/CCl Amb25347938 [0,0,1,0,0,0|2,0,1]=4 1578 B6R0.6 N#CC\C=C\C=O Amb25073805 [0,0,1,0,0,0|1,0,2]=4 1579 B6R0.6 N#C\C=C/C=C\Br Amb24381689 [0,0,1,0,0,0|2,0,1]=4 1580 B6R0.6 N#C\C=C/NC=O Amb25734735 [0,0,1,0,0,0|2,0,1]=4 1581 B6R0.6 N#C\C=C\NC=O Amb24585025 [0,0,1,0,0,0|2,0,1]=4 1582 B6R0.6 N\C=C\C=CC=N Amb24479787 [0,0,1,0,0,0|2,0,0]=3 1583 B6R0.6 N\C=C\C=C\C=O Amb25702448 [0,0,1,0,0,0|1,0,0]=2 1584 B6R0.6 O=CC=C=CC=O Amb25690570 [0,0,1,0,0,0|0,0,2]=3 1585 B6R0.6 O=CCC\C=C\Br Amb24479765 [0,0,1,0,0,0|1,0,2]=4 1586 B6R0.6 O=CCC\C=C\C Amb17593074 [0,0,1,0,0,0|1,0,2]=4 1587 B6R0.6 O=CCOCC=O Amb18121758 [0,0,1,0,0,0|1,0,2]=4 1588 B6R0.6 O=CC\C=C\C=O Amb17593064 [0,0,1,0,0,0|0,0,2]=3 1589 B6R0.6 O=C\C=C\C#CBr Amb24334189 [0,0,1,0,0,0|1,0,2]=4 1590 B6R0.6 O=C\C=C\C=C/Cl Amb25270002 [0,0,1,0,0,0|1,0,0]=2 1591 B6R0.6 O=C\C=C\C=C=O Amb25024653 [0,0,1,0,0,0|0,0,2]=3 1592 B6R0.6 O=C\C=C\CCF Amb25723268 [0,0,1,0,0,0|1,0,2]=4 1593 B6R0.6 O=C\C=C\N=C=O Amb24759068 [0,0,1,0,0,0|1,0,2]=4 1594 B6R0.6 O=C\C=C\N=C=S Amb24679314 [0,0,1,0,0,0|1,1,1]=4 1595 B6R0.6 O=C\C=C\NC=O Amb24427624 [0,0,1,0,0,0|1,0,1]=3 1596 B6R0.6 OCC\C=C\C=O Amb18119862 [0,0,1,0,0,0|0,0,2]=3 1597 B6R0.6 OC\C=C\C=C\Cl Amb25697166 [0,0,1,0,0,0|1,0,1]=3 1598 B6R0.6 O\C=C\C=C/C=O Amb25804174 [0,0,1,0,0,0|0,0,0]=1 1599 B6R0.6 O\N=C\C=CC=O Amb25326694 [0,0,1,0,0,0|1,0,0]=2 1600 B6R0.6 [O-]\C=C\C=C\C=O Amb17619483 [0,0,1,0,0,0|0,0,1]=2 1601 B6R0.9 C=CB(C=C)C=C Amb25264953 [0,0,1,0,0,0|3,0,0]=4 1602 B6R0.9 C=CP(C=C)C=C Amb17621146 [0,0,1,0,0,0|3,0,0]=4 1603 B6R0.9 C=C[Sb](C=C)C=C Amb22231733 [0,0,1,0,0,0|3,0,0]=4 1604 B6R0.9 C=C[SiH](C=C)C=C Amb22730744 [0,0,1,0,0,0|2,1,0]=4 1605 B6R0.9 C=C\C(\CCl)=C/Cl Amb25026187 [0,0,1,0,0,0|3,0,0]=4 1606 B6R0.9 C=C\C(\CCl)=C\Cl Amb24616265 [0,0,1,0,0,0|3,0,0]=4 1607 B6R0.9 CC=C(C=O)C=O Amb18120778 [0,0,1,0,0,0|2,0,1]=4 1608 B6R0.9 CC=C(CC)C=O Amb25235895 [0,0,1,0,0,0|1,0,2]=4 1609 B6R0.9 CCC(C=O)=CBr Amb25147584 [0,0,1,0,0,0|2,0,1]=4 1610 B6R0.9 CC\C(=C/C)\C=O Amb10606406 [0,0,1,0,0,0|1,0,2]=4 1611 B6R0.9 CC\C(\C=C)=C/Br Amb24523667 [0,0,1,0,0,0|2,0,1]=4 1612 B6R0.9 CC\C(\C=O)=C/Br Amb25313085 [0,0,1,0,0,0|2,0,1]=4 1613 B6R0.9 CC\C(\C=O)=C/Cl Amb18124155 [0,0,1,0,0,0|2,0,1]=4 1614 B6R0.9 COC(=CN)C=O Amb25127730 [0,0,1,0,0,0|1,0,1]=3 1615 B6R0.9 COC(C=O)C=O Amb24622474 [0,0,1,0,0,0|1,0,2]=4 1616 B6R0.9 CO[C@@H](C=C)C=O Amb24531697 [0,0,1,0,0,0|0,0,2]=3 1617 B6R0.9 CO\C(=C\O)\C=O Amb24383108 [0,0,1,0,0,0|1,0,1]=3 1618 B6R0.9 CSC(=CO)C=O Amb24513218 [0,0,1,0,0,0|1,1,1]=4 1619 B6R0.9 C\C=C(\C=C)/C=O Amb25223057 [0,0,1,0,0,0|1,0,1]=3 1620 B6R0.9 C\C=C(\CC)/C=C Amb25024610 [0,0,1,0,0,0|2,0,1]=4 1621 B6R0.9 C\C=C(\CO)/C=C Amb25810653 [0,0,1,0,0,0|3,0,0]=4 1622 B6R0.9 N#C\C(\C=O)=C/Cl Amb25290191 [0,0,1,0,0,0|3,0,0]=4 1623 B6R0.9 N=C\C(=C\O)\C=O Amb24386481 [0,0,1,0,0,0|3,0,0]=4 1624 B6R0.9 N\C=C(\C=O)/C#N Amb25169586 [0,0,1,0,0,0|3,0,0]=4 1625 B8R2.11 O=C1C=2CCCC21 Amb25273112 [0,0,0,1,0,0|1,0,2]=4 1626 B6R1.6 O=CC1CCO1 Amb24565587 [0,0,0,0,1,0|0,0,3]=4 1627 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [0,0,0,0,0,1|2,0,1]=4 1628 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [0,0,0,0,0,1|2,0,1]=4 1629 B8R1.2 BrCc1c[n]cc[n]1 Amb22498353 [0,0,0,0,0,1|2,0,1]=4 1630 B8R1.2 BrCc1cc[n]c[n]1 Amb21963500 [0,0,0,0,0,1|2,0,1]=4 1631 B8R1.2 BrCc1cc[n]c[n]1 Amb22235520 [0,0,0,0,0,1|2,0,1]=4 1632 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [0,0,0,0,0,1|2,0,1]=4 1633 B8R1.2 BrCc1ccc[n][n]1 Amb22234747 [0,0,0,0,0,1|2,0,1]=4 1634 B8R1.2 BrCc1cccc[n]1 Amb22751621 [0,0,0,0,0,1|2,0,1]=4 1635 B8R1.2 BrCc1cccnn1 Amb10070423 [0,0,0,0,0,1|2,0,1]=4 1636 B8R1.2 BrCc1cnccn1 Amb16185761 [0,0,0,0,0,1|2,0,1]=4 1637 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [0,0,0,0,0,1|2,0,1]=4 1638 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [0,0,0,0,0,1|3,0,0]=4 1639 B8R1.2 Br[Mg]c1[n]ccc[n]1 Amb22897398 [0,0,0,0,0,1|3,0,0]=4 1640 B8R1.2 Br[Mg]c1cc[n]cc1 Amb22897371 [0,0,0,0,0,1|3,0,0]=4 1641 B8R1.2 Br[Mg]c1cccc[n]1 Amb22000542 [0,0,0,0,0,1|3,0,0]=4 1642 B8R1.2 Br[Zn]c1[n]ccc[n]1 Amb22897779 [0,0,0,0,0,1|3,0,0]=4 1643 B8R1.2 Br[Zn]c1cc[n]cc1 Amb22897889 [0,0,0,0,0,1|3,0,0]=4 1644 B8R1.2 Br[Zn]c1cccc[n]1 Amb22000378 [0,0,0,0,0,1|3,0,0]=4 1645 B8R1.2 Br[Zn]c1cccnc1 Amb13890843 [0,0,0,0,0,1|3,0,0]=4 1646 B8R1.2 C#Cc1[n]ccc[n]1 Amb19957825 [0,0,0,0,0,1|2,0,1]=4 1647 B8R1.2 C#Cc1c[n]cc[n]1 Amb19895048 [0,0,0,0,0,1|2,0,1]=4 1648 B8R1.2 C#Cc1cc[n]c[n]1 Amb20670972 [0,0,0,0,0,1|2,0,1]=4 1649 B8R1.2 C#Cc1ccc[n][n]1 Amb23439062 [0,0,0,0,0,1|2,0,1]=4 1650 B8R1.2 C#Cc1cccnc1 Amb10067163 [0,0,0,0,0,1|2,0,1]=4 1651 B8R1.2 C#Cc1ccncc1 Amb13891877 [0,0,0,0,0,1|2,0,1]=4 1652 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [0,0,0,0,0,1|2,0,1]=4 1653 B8R1.2 C1CCOC=C1C=O Amb2433566 [0,0,0,0,0,1|0,0,3]=4 1654 B8R1.2 C1OCCC=C1C=O Amb1102766 [0,0,0,0,0,1|0,0,2]=3 1655 B8R1.2 C=C[n+]1ccccc1 Amb10552726 [0,0,0,0,0,1|3,0,0]=4 1656 B8R1.2 C=C[n+]1ccccc1 Amb10552768 [0,0,0,0,0,1|3,0,0]=4 1657 B8R1.2 C=C[n+]1ccccc1 Amb10552769 [0,0,0,0,0,1|3,0,0]=4 1658 B8R1.2 C=C[n+]1ccccc1 Amb10552775 [0,0,0,0,0,1|3,0,0]=4 1659 B8R1.2 C=Cc1[n]ccc[n]1 Amb23411991 [0,0,0,0,0,1|2,0,0]=3 1660 B8R1.2 C=Cc1c[n]c[n]c1 Amb24056355 [0,0,0,0,0,1|3,0,0]=4 1661 B8R1.2 C=Cc1cc[n]c[n]1 Amb24056360 [0,0,0,0,0,1|2,0,0]=3 1662 B8R1.2 C=Cc1ccc[n][n]1 Amb25026421 [0,0,0,0,0,1|2,0,0]=3 1663 B8R1.2 C=Cc1ccccc1 Amb22337033 [0,0,0,0,0,1|2,0,0]=3 1664 B8R1.2 C=Cc1ccccc1 Amb22337871 [0,0,0,0,0,1|2,0,0]=3 1665 B8R1.2 C=Cc1ccccc1 Amb22337937 [0,0,0,0,0,1|2,0,0]=3 1666 B8R1.2 C=Cc1ccccc1 Amb22338204 [0,0,0,0,0,1|2,0,0]=3 1667 B8R1.2 C=Cc1ccccc1 Amb22338475 [0,0,0,0,0,1|2,0,0]=3 1668 B8R1.2 C=Cc1ccccc1 Amb22351316 [0,0,0,0,0,1|2,0,0]=3 1669 B8R1.2 C=Cc1ccccc1 Amb22731028 [0,0,0,0,0,1|2,0,0]=3 1670 B8R1.2 C=Cc1ccccc1 Amb22733123 [0,0,0,0,0,1|2,0,0]=3 1671 B8R1.2 C=Cc1cccnc1 Amb10071930 [0,0,0,0,0,1|2,0,0]=3 1672 B8R1.2 C=Nc1ccccc1 Amb24605672 [0,0,0,0,0,1|3,0,0]=4 1673 B8R1.2 CCC1=CCC=CN1 Amb24524490 [0,0,0,0,0,1|2,0,1]=4 1674 B8R1.2 CCC=1CC=CCC1 Amb22227940 [0,0,0,0,0,1|2,0,1]=4 1675 B8R1.2 CCc1[n]ccc[n]1 Amb24095641 [0,0,0,0,0,1|2,0,1]=4 1676 B8R1.2 CCc1c[n]cc[n]1 Amb20620291 [0,0,0,0,0,1|2,0,1]=4 1677 B8R1.2 CCc1cc[n]c[n]1 Amb20242304 [0,0,0,0,0,1|2,0,1]=4 1678 B8R1.2 CCc1ccccc1 Amb22336270 [0,0,0,0,0,1|2,0,1]=4 1679 B8R1.2 CCc1ccccc1 Amb22366965 [0,0,0,0,0,1|2,0,1]=4 1680 B8R1.2 CCc1ccccc1 Amb2447474 [0,0,0,0,0,1|2,0,1]=4 1681 B8R1.2 CNc1c[n]cc[n]1 Amb22292455 [0,0,0,0,0,1|3,0,0]=4 1682 B8R1.2 CNc1cc[n]c[n]1 Amb18944730 [0,0,0,0,0,1|3,0,0]=4 1683 B8R1.2 CNc1ccc[n][n]1 Amb18947507 [0,0,0,0,0,1|3,0,0]=4 1684 B8R1.2 CNc1cnccn1 Amb1102655 [0,0,0,0,0,1|3,0,0]=4 1685 B8R1.2 COC1=CCC=CC1 Amb10842162 [0,0,0,0,0,1|3,0,0]=4 1686 B8R1.2 COC=1CCC=CC1 Amb22348084 [0,0,0,0,0,1|3,0,0]=4 1687 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [0,0,0,0,0,1|3,0,0]=4 1688 B8R1.2 CO[13c]1ccccc1 Amb22362658 [0,0,0,0,0,1|3,0,0]=4 1689 B8R1.2 COc1cc[n]cc1 Amb24079672 [0,0,0,0,0,1|3,0,0]=4 1690 B8R1.2 COc1cccnc1 Amb10573360 [0,0,0,0,0,1|3,0,0]=4 1691 B8R1.2 COc1ccncn1 Amb15692928 [0,0,0,0,0,1|3,0,0]=4 1692 B8R1.2 CPc1ccccc1 Amb25341327 [0,0,0,0,0,1|3,0,0]=4 1693 B8R1.2 CSc1[n]ccc[n]1 Amb22295856 [0,0,0,0,0,1|3,0,0]=4 1694 B8R1.2 CSc1c[n]ccc1 Amb24087396 [0,0,0,0,0,1|3,0,0]=4 1695 B8R1.2 CSc1cc[n]cc1 Amb24103013 [0,0,0,0,0,1|3,0,0]=4 1696 B8R1.2 CSc1ccc[n][n]1 Amb24473964 [0,0,0,0,0,1|3,0,0]=4 1697 B8R1.2 CSc1cccc[n]1 Amb24081200 [0,0,0,0,0,1|3,0,0]=4 1698 B8R1.2 CSc1ncccn1 Amb2455862 [0,0,0,0,0,1|3,0,0]=4 1699 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [0,0,0,0,0,1|2,0,1]=4 1700 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [0,0,0,0,0,1|2,1,0]=4 1701 B8R1.2 ClC=C1C=COC=C1 Amb24470181 [0,0,0,0,0,1|2,0,0]=3 1702 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [0,0,0,0,0,1|2,0,1]=4 1703 B8R1.2 ClCc1cc[n]c[n]1 Amb21864735 [0,0,0,0,0,1|2,0,1]=4 1704 B8R1.2 ClCc1cc[n]c[n]1 Amb22491514 [0,0,0,0,0,1|2,0,1]=4 1705 B8R1.2 ClCc1ccc[n][n]1 Amb21960122 [0,0,0,0,0,1|2,0,1]=4 1706 B8R1.2 ClCc1ccc[n][n]1 Amb22000870 [0,0,0,0,0,1|2,0,1]=4 1707 B8R1.2 ClCc1cccc[n]1 Amb22489454 [0,0,0,0,0,1|2,0,1]=4 1708 B8R1.2 ClCc1ccccc1 Amb22363332 [0,0,0,0,0,1|2,0,1]=4 1709 B8R1.2 ClCc1ccncc1 Amb1933717 [0,0,0,0,0,1|2,0,1]=4 1710 B8R1.2 ClCc1cnccn1 Amb15741173 [0,0,0,0,0,1|2,0,1]=4 1711 B8R1.2 ClNc1cccc[n]1 Amb24481501 [0,0,0,0,0,1|3,0,0]=4 1712 B8R1.2 ClSc1[n]ccc[n]1 Amb24061353 [0,0,0,0,0,1|3,0,0]=4 1713 B8R1.2 ClSc1cc[n]cc1 Amb24099593 [0,0,0,0,0,1|3,0,0]=4 1714 B8R1.2 ClSc1ccccc1 Amb10575597 [0,0,0,0,0,1|3,0,0]=4 1715 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [0,0,0,0,0,1|2,0,1]=4 1716 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [0,0,0,0,0,1|2,1,0]=4 1717 B8R1.2 FCc1[n]ccc[n]1 Amb25746002 [0,0,0,0,0,1|2,0,1]=4 1718 B8R1.2 FCc1c[n]ccc1 Amb25259171 [0,0,0,0,0,1|2,0,1]=4 1719 B8R1.2 FCc1cc[n]cc1 Amb22372287 [0,0,0,0,0,1|2,0,1]=4 1720 B8R1.2 FCc1cccc[n]1 Amb24093657 [0,0,0,0,0,1|2,0,1]=4 1721 B8R1.2 FCc1ccccc1 Amb10838335 [0,0,0,0,0,1|2,0,1]=4 1722 B8R1.2 FNc1cccc[n]1 Amb25320751 [0,0,0,0,0,1|3,0,0]=4 1723 B8R1.2 FSc1ccccc1 Amb25198589 [0,0,0,0,0,1|3,0,0]=4 1724 B8R1.2 ICc1cc[n]cc1 Amb22489735 [0,0,0,0,0,1|2,0,1]=4 1725 B8R1.2 ICc1cc[n]cc1 Amb22748952 [0,0,0,0,0,1|2,0,1]=4 1726 B8R1.2 ICc1cccnc1 Amb10602162 [0,0,0,0,0,1|2,0,1]=4 1727 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [0,0,0,0,0,1|3,0,0]=4 1728 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [0,0,0,0,0,1|3,0,0]=4 1729 B8R1.2 I[Se]c1ccccc1 Amb10601593 [0,0,0,0,0,1|3,0,0]=4 1730 B8R1.2 N#CC=1CC=CNC1 Amb24505083 [0,0,0,0,0,1|2,0,1]=4 1731 B8R1.2 N#Cc1ccccc1 Amb21864642 [0,0,0,0,0,1|2,0,1]=4 1732 B8R1.2 N#Cc1ccccc1 Amb22167299 [0,0,0,0,0,1|2,0,1]=4 1733 B8R1.2 N#Cc1cccnc1 Amb1792577 [0,0,0,0,0,1|2,0,1]=4 1734 B8R1.2 N#Cc1ccncn1 Amb13884090 [0,0,0,0,0,1|2,0,1]=4 1735 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [0,0,0,0,0,1|3,0,0]=4 1736 B8R1.2 N#[N+]c1cccnc1 Amb17674245 [0,0,0,0,0,1|3,0,0]=4 1737 B8R1.2 N=Cc1c[n]ccc1 Amb24062509 [0,0,0,0,0,1|2,0,0]=3 1738 B8R1.2 N=Cc1cccc[n]1 Amb24081259 [0,0,0,0,0,1|2,0,0]=3 1739 B8R1.2 N=Nc1[n]ccc[n]1 Amb24104343 [0,0,0,0,0,1|3,0,0]=4 1740 B8R1.2 N=Nc1cc[n]c[n]1 Amb24091443 [0,0,0,0,0,1|3,0,0]=4 1741 B8R1.2 N=Nc1cccc[n]1 Amb24104371 [0,0,0,0,0,1|3,0,0]=4 1742 B8R1.2 NCC1=CC=CCO1 Amb25128002 [0,0,0,0,0,1|1,0,1]=3 1743 B8R1.2 NCc1[n]ccc[n]1 Amb20668380 [0,0,0,0,0,1|2,0,1]=4 1744 B8R1.2 NCc1[n]ccc[n]1 Amb22267718 [0,0,0,0,0,1|2,0,1]=4 1745 B8R1.2 NCc1[n]ccc[n]1 Amb22491384 [0,0,0,0,0,1|2,0,1]=4 1746 B8R1.2 NCc1cc[n]cc1 Amb20620293 [0,0,0,0,0,1|2,0,1]=4 1747 B8R1.2 NCc1cc[n]cc1 Amb20622010 [0,0,0,0,0,1|2,0,1]=4 1748 B8R1.2 NCc1ccc[n][n]1 Amb24183396 [0,0,0,0,0,1|2,0,1]=4 1749 B8R1.2 NCc1cccc[n]1 Amb20620292 [0,0,0,0,0,1|2,0,1]=4 1750 B8R1.2 NCc1cccc[n]1 Amb22274458 [0,0,0,0,0,1|2,0,1]=4 1751 B8R1.2 NCc1ccccc1 Amb19958612 [0,0,0,0,0,1|2,0,1]=4 1752 B8R1.2 NCc1ccccc1 Amb22052549 [0,0,0,0,0,1|2,0,1]=4 1753 B8R1.2 NCc1ccccc1 Amb23459863 [0,0,0,0,0,1|2,0,1]=4 1754 B8R1.2 NCc1ccccc1 Amb24325406 [0,0,0,0,0,1|2,0,1]=4 1755 B8R1.2 NCc1cccnc1 Amb1481403 [0,0,0,0,0,1|2,0,1]=4 1756 B8R1.2 NCc1cccnc1 Amb2189172 [0,0,0,0,0,1|2,0,1]=4 1757 B8R1.2 NCc1ccncc1 Amb1156526 [0,0,0,0,0,1|2,0,1]=4 1758 B8R1.2 NCc1cnccn1 Amb10067734 [0,0,0,0,0,1|2,0,1]=4 1759 B8R1.2 NCc1cnccn1 Amb1099257 [0,0,0,0,0,1|2,0,1]=4 1760 B8R1.2 NCc1ncccn1 Amb10068909 [0,0,0,0,0,1|2,0,1]=4 1761 B8R1.2 NCc1ncccn1 Amb1139642 [0,0,0,0,0,1|2,0,1]=4 1762 B8R1.2 NCc1nccnc1 Amb10068908 [0,0,0,0,0,1|2,0,1]=4 1763 B8R1.2 NNc1[n]ccc[n]1 Amb22587655 [0,0,0,0,0,1|3,0,0]=4 1764 B8R1.2 NNc1cc[n]c[n]1 Amb22011554 [0,0,0,0,0,1|3,0,0]=4 1765 B8R1.2 NNc1cc[n]c[n]1 Amb22757340 [0,0,0,0,0,1|3,0,0]=4 1766 B8R1.2 NNc1cc[n]cc1 Amb19893272 [0,0,0,0,0,1|3,0,0]=4 1767 B8R1.2 NNc1cccc[n]1 Amb22494294 [0,0,0,0,0,1|3,0,0]=4 1768 B8R1.2 NNc1ccccc1 Amb22002446 [0,0,0,0,0,1|3,0,0]=4 1769 B8R1.2 NNc1ccccc1 Amb22166856 [0,0,0,0,0,1|3,0,0]=4 1770 B8R1.2 NNc1ccccc1 Amb22731573 [0,0,0,0,0,1|3,0,0]=4 1771 B8R1.2 NNc1ccccn1 Amb1104567 [0,0,0,0,0,1|3,0,0]=4 1772 B8R1.2 NNc1cccnc1 Amb10177783 [0,0,0,0,0,1|3,0,0]=4 1773 B8R1.2 NNc1cccnc1 Amb16192849 [0,0,0,0,0,1|3,0,0]=4 1774 B8R1.2 NNc1cccnc1 Amb2092671 [0,0,0,0,0,1|3,0,0]=4 1775 B8R1.2 NNc1cccnn1 Amb16185786 [0,0,0,0,0,1|3,0,0]=4 1776 B8R1.2 NNc1cccnn1 Amb16231295 [0,0,0,0,0,1|3,0,0]=4 1777 B8R1.2 NNc1cnccn1 Amb1111598 [0,0,0,0,0,1|3,0,0]=4 1778 B8R1.2 NNc1ncccn1 Amb1114665 [0,0,0,0,0,1|3,0,0]=4 1779 B8R1.2 NNc1ncccn1 Amb2182937 [0,0,0,0,0,1|3,0,0]=4 1780 B8R1.2 NOc1cccc[n]1 Amb24101187 [0,0,0,0,0,1|3,0,0]=4 1781 B8R1.2 NOc1ccccc1 Amb18123833 [0,0,0,0,0,1|3,0,0]=4 1782 B8R1.2 NOc1ccccc1 Amb22231364 [0,0,0,0,0,1|3,0,0]=4 1783 B8R1.2 NSc1[n]ccc[n]1 Amb24061351 [0,0,0,0,0,1|3,0,0]=4 1784 B8R1.2 NSc1cc[n]cc1 Amb24575022 [0,0,0,0,0,1|3,0,0]=4 1785 B8R1.2 NSc1cccc[n]1 Amb24061291 [0,0,0,0,0,1|3,0,0]=4 1786 B8R1.2 N\N=C\1/C=CC=CN1 Amb22732534 [0,0,0,0,0,1|3,0,0]=4 1787 B8R1.2 O=Bc1ccccc1 Amb25221658 [0,0,0,0,0,1|2,0,0]=3 1788 B8R1.2 O=CC1=CCCCO1 Amb18641688 [0,0,0,0,0,1|0,0,2]=3 1789 B8R1.2 O=CC1=CCNC=C1 Amb24598254 [0,0,0,0,0,1|1,0,1]=3 1790 B8R1.2 O=CC1=CSCCS1 Amb25680940 [0,0,0,0,0,1|0,1,2]=4 1791 B8R1.2 O=CC1C=CC=CO1 Amb25053141 [0,0,0,0,0,1|0,0,1]=2 1792 B8R1.2 O=CC1C=COC=C1 Amb18641607 [0,0,0,0,0,1|1,0,1]=3 1793 B8R1.2 O=CC1CCCC=C1 Amb18641614 [0,0,0,0,0,1|1,0,2]=4 1794 B8R1.2 O=CC=1CCCNC1 Amb25326735 [0,0,0,0,0,1|1,0,2]=4 1795 B8R1.2 O=CC=1CCNCC1 Amb24630224 [0,0,0,0,0,1|1,0,2]=4 1796 B8R1.2 O=CC=1CCOCC1 Amb18641683 [0,0,0,0,0,1|1,0,2]=4 1797 B8R1.2 O=CC=1CSCCC1 Amb18642670 [0,0,0,0,0,1|0,1,2]=4 1798 B8R1.2 O=CN1CC=CCC1 Amb24448208 [0,0,0,0,0,1|2,0,1]=4 1799 B8R1.2 O=CN1CCCC=C1 Amb22371093 [0,0,0,0,0,1|2,0,1]=4 1800 B8R1.2 O=CN1CCOC=C1 Amb22371094 [0,0,0,0,0,1|2,0,1]=4 1801 B8R1.2 O=CN1CCSC=C1 Amb24390740 [0,0,0,0,0,1|2,0,1]=4 1802 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [0,0,0,0,0,1|1,0,0]=2 1803 B8R1.2 O=C[C@H]1CCC=CO1 Amb24533832 [0,0,0,0,0,1|0,0,2]=3 1804 B8R1.2 O=Cc1[n][n]cc[n]1 Amb25662574 [0,0,0,0,0,1|2,0,0]=3 1805 B8R1.2 O=Cc1[n]c[n]c[n]1 Amb24409104 [0,0,0,0,0,1|2,0,0]=3 1806 B8R1.2 O=Cc1c[n][n]c[n]1 Amb18833127 [0,0,0,0,0,1|2,0,0]=3 1807 B8R1.2 O=Cc1cc[n]cc1 Amb20672039 [0,0,0,0,0,1|1,0,0]=2 1808 B8R1.2 O=Cc1cncnc1 Amb2235993 [0,0,0,0,0,1|2,0,0]=3 1809 B8R1.2 O=Nc1[n]ccc[n]1 Amb24084910 [0,0,0,0,0,1|2,0,0]=3 1810 B8R1.2 O=Nc1c[n]c[n]c1 Amb24071635 [0,0,0,0,0,1|3,0,0]=4 1811 B8R1.2 O=Nc1c[n]cc[n]1 Amb24601195 [0,0,0,0,0,1|2,0,0]=3 1812 B8R1.2 O=Nc1cc[n]c[n]1 Amb24070598 [0,0,0,0,0,1|2,0,0]=3 1813 B8R1.2 O=S=C1C=CC=CN1 Amb25679690 [0,0,0,0,0,1|2,0,0]=3 1814 B8R1.2 O=S=C1C=CNC=C1 Amb24606190 [0,0,0,0,0,1|2,0,0]=3 1815 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [0,0,0,0,0,1|1,0,0]=2 1816 B8R1.2 O=[I]c1ccccc1 Amb15692855 [0,0,0,0,0,1|2,0,0]=3 1817 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [0,0,0,0,0,1|1,0,2]=4 1818 B8R1.2 OCc1c[n]ccc1 Amb20622013 [0,0,0,0,0,1|1,0,2]=4 1819 B8R1.2 OCc1c[n]ccc1 Amb22434305 [0,0,0,0,0,1|1,0,2]=4 1820 B8R1.2 OCc1cc[n]cc1 Amb24183964 [0,0,0,0,0,1|1,0,2]=4 1821 B8R1.2 OCc1ccccn1 Amb16231923 [0,0,0,0,0,1|1,0,2]=4 1822 B8R1.2 OCc1ccncc1 Amb16231990 [0,0,0,0,0,1|1,0,2]=4 1823 B8R1.2 ONc1cc[n]c[n]1 Amb25802402 [0,0,0,0,0,1|2,0,1]=4 1824 B8R1.2 ONc1cccc[n]1 Amb25057797 [0,0,0,0,0,1|2,0,1]=4 1825 B8R1.2 ONc1ccccc1 Amb17672282 [0,0,0,0,0,1|2,0,1]=4 1826 B8R1.2 ONc1ccccc1 Amb22445293 [0,0,0,0,0,1|2,0,1]=4 1827 B8R1.2 OSc1cccc[n]1 Amb24061294 [0,0,0,0,0,1|2,0,1]=4 1828 B8R1.2 OSc1ccccc1 Amb25200260 [0,0,0,0,0,1|2,0,1]=4 1829 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [0,0,0,0,0,1|1,0,2]=4 1830 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [0,0,0,0,0,1|1,0,2]=4 1831 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [0,0,0,0,0,1|2,0,1]=4 1832 B8R1.2 S=Cc1cc[n]c[n]1 Amb24437755 [0,0,0,0,0,1|1,1,0]=3 1833 B8R1.2 S=Nc1c[n]ccc1 Amb24085398 [0,0,0,0,0,1|2,1,0]=4 1834 B8R1.2 S=Nc1cccc[n]1 Amb24101381 [0,0,0,0,0,1|2,1,0]=4 1835 B8R1.2 SCc1c[n]ccc1 Amb21984718 [0,0,0,0,0,1|1,1,1]=4 1836 B8R1.2 SCc1cc[n]c[n]1 Amb24099658 [0,0,0,0,0,1|1,1,1]=4 1837 B8R1.2 SCc1cc[n]cc1 Amb22008603 [0,0,0,0,0,1|1,1,1]=4 1838 B8R1.2 SCc1cccc[n]1 Amb20622005 [0,0,0,0,0,1|1,1,1]=4 1839 B8R1.2 SSc1[n]ccc[n]1 Amb24061352 [0,0,0,0,0,1|2,1,0]=4 1840 B8R1.2 SSc1cccc[n]1 Amb24061331 [0,0,0,0,0,1|2,1,0]=4 1841 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [0,0,0,0,0,1|2,0,1]=4 1842 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [0,0,0,0,0,1|2,0,1]=4 1843 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [0,0,0,0,0,1|2,0,1]=4 1844 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [0,0,0,0,0,1|2,0,1]=4 1845 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [0,0,0,0,0,1|2,0,1]=4 1846 B8R1.2 [C-]#[N+]c1cccc[n]1 Amb25840846 [0,0,0,0,0,1|3,0,0]=4 1847 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [0,0,0,0,0,1|3,0,0]=4 1848 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [0,0,0,0,0,1|3,0,0]=4 1849 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [0,0,0,0,0,1|2,0,1]=4 1850 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [0,0,0,0,0,1|2,0,1]=4 1851 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [0,0,0,0,0,1|3,0,0]=4 1852 B8R1.2 [Na]Oc1ccccn1 Amb10552457 [0,0,0,0,0,1|3,0,0]=4 1853 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [0,0,0,0,0,1|3,0,0]=4 1854 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [0,0,0,0,0,1|1,0,2]=4 1855 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [0,0,0,0,0,1|2,0,1]=4 1856 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [0,0,0,0,0,1|3,0,0]=4 1857 B8R1.2 c1ccnnc1C#N Amb13884089 [0,0,0,0,0,1|2,0,1]=4 1858 B5R0.1 C/C=C/C(C)=O Amb17940030 [1,0,1,0,0,0|1,0,1]=4 1859 B5R0.1 C=C(Cl)\C=C\Cl Amb24525152 [1,0,1,0,0,0|2,0,0]=4 1860 B5R0.1 C=C=CC(O)=O Amb24391957 [1,0,1,0,0,0|0,0,1]=3 1861 B5R0.1 C=CNC(N)=O Amb25082241 [1,0,1,0,0,0|2,0,0]=4 1862 B5R0.1 CC(=C)CC=C Amb22347764 [1,0,1,0,0,0|1,0,1]=4 1863 B5R0.1 CC(=C)\C=C/C Amb22733448 [1,0,1,0,0,0|1,0,1]=4 1864 B5R0.1 CC(=C)\C=C/Cl Amb25123259 [1,0,1,0,0,0|2,0,0]=4 1865 B5R0.1 CC(=C)\C=C\Br Amb25242010 [1,0,1,0,0,0|2,0,0]=4 1866 B5R0.1 CC(=C)\C=C\Cl Amb24526409 [1,0,1,0,0,0|2,0,0]=4 1867 B5R0.1 CC(=C)\C=C\I Amb25299248 [1,0,1,0,0,0|2,0,0]=4 1868 B5R0.1 CC(=O)C=C=C Amb23447108 [1,0,1,0,0,0|1,0,1]=4 1869 B5R0.1 CC(=O)NC=C Amb24323579 [1,0,1,0,0,0|1,0,1]=4 1870 B5R0.1 CC(=O)OC=C Amb21618930 [1,0,1,0,0,0|0,0,1]=3 1871 B5R0.1 CC(=O)OC=C Amb22338143 [1,0,1,0,0,0|0,0,1]=3 1872 B5R0.1 CC(=O)OC=C Amb22338476 [1,0,1,0,0,0|0,0,1]=3 1873 B5R0.1 CC(=O)OC=C Amb22366845 [1,0,1,0,0,0|0,0,1]=3 1874 B5R0.1 CC(=O)OC=O Amb25283525 [1,0,1,0,0,0|1,0,1]=4 1875 B5R0.1 CC(=O)O[13CH]=[13CH2] Amb22351356 [1,0,1,0,0,0|0,0,1]=3 1876 B5R0.1 CC(=O)\C=C/N Amb25147403 [1,0,1,0,0,0|2,0,0]=4 1877 B5R0.1 CC(=O)\C=C\Br Amb25803449 [1,0,1,0,0,0|2,0,0]=4 1878 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [1,0,1,0,0,0|2,0,0]=4 1879 B5R0.1 CC(=O)\C=C\I Amb25269482 [1,0,1,0,0,0|2,0,0]=4 1880 B5R0.1 CC(C)=CC=C Amb22229813 [1,0,1,0,0,0|1,0,1]=4 1881 B5R0.1 CC=CC(C)=O Amb24061083 [1,0,1,0,0,0|1,0,1]=4 1882 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,1,0,0,0|1,0,1]=4 1883 B5R0.1 C\C=C\C(C)=C Amb22733185 [1,0,1,0,0,0|1,0,1]=4 1884 B5R0.1 C\C=C\C([O-])=O Amb22231404 [1,0,1,0,0,0|0,0,2]=4 1885 B5R0.1 NC(=O)CC=C Amb17610156 [1,0,1,0,0,0|1,0,1]=4 1886 B5R0.1 NC(=O)OC=C Amb17621270 [1,0,1,0,0,0|1,0,0]=3 1887 B5R0.1 NC(=O)\C=C/Br Amb25715916 [1,0,1,0,0,0|2,0,0]=4 1888 B5R0.1 NC(=O)\C=C\Cl Amb10552376 [1,0,1,0,0,0|2,0,0]=4 1889 B5R0.1 N\C=C/C(N)=O Amb22489591 [1,0,1,0,0,0|2,0,0]=4 1890 B5R0.1 N\N=C\C(O)=O Amb25703365 [1,0,1,0,0,0|2,0,0]=4 1891 B5R0.1 O=C(Cl)\C=C/Br Amb24391538 [1,0,1,0,0,0|2,0,0]=4 1892 B5R0.1 O=C(Cl)\C=C\Br Amb24512115 [1,0,1,0,0,0|2,0,0]=4 1893 B5R0.1 O=C(Cl)\C=C\Cl Amb25025493 [1,0,1,0,0,0|2,0,0]=4 1894 B5R0.1 OC(=O)C=C=O Amb24671304 [1,0,1,0,0,0|1,0,1]=4 1895 B5R0.1 OC(=O)CC=O Amb22169407 [1,0,1,0,0,0|1,0,1]=4 1896 B5R0.1 OC(=O)\C=C/Br Amb18644453 [1,0,1,0,0,0|1,0,0]=3 1897 B5R0.1 OC(=O)\C=C\F Amb24417763 [1,0,1,0,0,0|1,0,0]=3 1898 B5R0.1 OC(=O)\C=C\I Amb20242758 [1,0,1,0,0,0|1,0,0]=3 1899 B5R0.1 ON=CC(O)=O Amb25046587 [1,0,1,0,0,0|2,0,0]=4 1900 B5R0.1 O\N=C/C(=O)O Amb10601571 [1,0,1,0,0,0|2,0,0]=4 1901 B5R0.1 O\N=C\C(O)=O Amb20671938 [1,0,1,0,0,0|2,0,0]=4 1902 B5R0.1 [N-]=[N+]=CC(O)=O Amb24333367 [1,0,1,0,0,0|2,0,0]=4 1903 B5R0.1 [O-]\C=C\C(=O)C Amb15772268 [1,0,1,0,0,0|2,0,0]=4 1904 B5R0.1 [O-]\C=C\C(=O)C Amb2228039 [1,0,1,0,0,0|2,0,0]=4 1905 B5R0.2 C=C/C=C/C=C Amb17939040 [1,0,1,0,0,0|1,0,0]=3 1906 B5R0.2 C=CC#CC=C Amb24671264 [1,0,1,0,0,0|1,0,1]=4 1907 B5R0.2 C=CCOC=O Amb22051694 [1,0,1,0,0,0|0,0,1]=3 1908 B5R0.2 C=CC\C=C\I Amb24634661 [1,0,1,0,0,0|1,0,1]=4 1909 B5R0.2 C=COCC=C Amb17933943 [1,0,1,0,0,0|0,0,1]=3 1910 B5R0.2 C=CS\C=C\Br Amb24408571 [1,0,1,0,0,0|1,1,0]=4 1911 B5R0.2 C=C\C=C/C=O Amb25248524 [1,0,1,0,0,0|0,0,0]=2 1912 B5R0.2 C=C\C=C\C#N Amb17593012 [1,0,1,0,0,0|1,0,1]=4 1913 B5R0.2 C=C\C=C\CBr Amb24350542 [1,0,1,0,0,0|1,0,1]=4 1914 B5R0.2 C=C\C=C\CCl Amb24401492 [1,0,1,0,0,0|1,0,1]=4 1915 B5R0.2 CC=C\C=C/Cl Amb25025604 [1,0,1,0,0,0|1,0,1]=4 1916 B5R0.2 CC=C\C=C\I Amb24333865 [1,0,1,0,0,0|1,0,1]=4 1917 B5R0.2 CC\C=C/C=C Amb25025160 [1,0,1,0,0,0|1,0,1]=4 1918 B5R0.2 CN\C=C\C=C Amb24560684 [1,0,1,0,0,0|2,0,0]=4 1919 B5R0.2 CN\C=C\C=O Amb24564349 [1,0,1,0,0,0|1,0,1]=4 1920 B5R0.2 COC=CC=C Amb22348083 [1,0,1,0,0,0|2,0,0]=4 1921 B5R0.2 CO\C=C\C=C Amb22733914 [1,0,1,0,0,0|2,0,0]=4 1922 B5R0.2 CS\C=C\C=O Amb25811358 [1,0,1,0,0,0|1,0,1]=4 1923 B5R0.2 C\C=C/CC=O Amb24728871 [1,0,1,0,0,0|0,0,2]=4 1924 B5R0.2 C\C=C\C=CBr Amb24519249 [1,0,1,0,0,0|1,0,1]=4 1925 B5R0.2 C\C=C\C=CCl Amb25025018 [1,0,1,0,0,0|1,0,1]=4 1926 B5R0.2 C\C=C\C=CN Amb25025494 [1,0,1,0,0,0|1,0,1]=4 1927 B5R0.2 C\C=C\C=C\N Amb25811440 [1,0,1,0,0,0|1,0,1]=4 1928 B5R0.2 ClC=C\C=C\Cl Amb24527807 [1,0,1,0,0,0|2,0,0]=4 1929 B5R0.2 Cl\C=C\C=C\Cl Amb25102528 [1,0,1,0,0,0|2,0,0]=4 1930 B5R0.2 N#C\C=C/C=O Amb24741012 [1,0,1,0,0,0|1,0,1]=4 1931 B5R0.2 N#C\C=C\C=O Amb25172387 [1,0,1,0,0,0|1,0,1]=4 1932 B5R0.2 N\C=C\CC=O Amb24706738 [1,0,1,0,0,0|1,0,1]=4 1933 B5R0.2 O=CC\C=C\Cl Amb24571938 [1,0,1,0,0,0|1,0,1]=4 1934 B5R0.2 O=CN\C=C/[S-] Amb25108259 [1,0,1,0,0,0|1,1,0]=4 1935 B5R0.2 O=C\C=C\C#C Amb17593013 [1,0,1,0,0,0|0,0,2]=4 1936 B5R0.2 O=C\C=C\C=O Amb17593019 [1,0,1,0,0,0|0,0,1]=3 1937 B5R0.2 O=C\C=C\CBr Amb18124626 [1,0,1,0,0,0|1,0,1]=4 1938 B5R0.2 O=C\C=C\CCl Amb18122401 [1,0,1,0,0,0|1,0,1]=4 1939 B5R0.2 O=C\C=C\CF Amb24569288 [1,0,1,0,0,0|1,0,1]=4 1940 B5R0.2 OC=C\C=C\O Amb25024941 [1,0,1,0,0,0|0,0,1]=3 1941 B5R0.2 OC\C=C\C=O Amb24356008 [1,0,1,0,0,0|0,0,1]=3 1942 B5R0.2 ON=CCC=O Amb25744688 [1,0,1,0,0,0|1,0,1]=4 1943 B5R0.2 ON=CNC=O Amb25130798 [1,0,1,0,0,0|2,0,0]=4 1944 B5R0.2 O\N=C\CC=O Amb24640219 [1,0,1,0,0,0|1,0,1]=4 1945 B5R0.3 BrCC(=O)C=C Amb10602446 [1,0,1,0,0,0|2,0,0]=4 1946 B5R0.3 C=C(C=C)C=C Amb25025458 [1,0,1,0,0,0|1,0,0]=3 1947 B5R0.3 C=C(C=O)C#C Amb25811095 [1,0,1,0,0,0|0,0,2]=4 1948 B5R0.3 C=C(C=O)C#N Amb25300417 [1,0,1,0,0,0|1,0,1]=4 1949 B5R0.3 C=C(C=O)N=O Amb24640223 [1,0,1,0,0,0|2,0,0]=4 1950 B5R0.3 C=C(CCl)C=O Amb25173687 [1,0,1,0,0,0|1,0,1]=4 1951 B5R0.3 C=CC(=C)CBr Amb24451750 [1,0,1,0,0,0|1,0,1]=4 1952 B5R0.3 C=CC(=C)CCl Amb25698288 [1,0,1,0,0,0|1,0,1]=4 1953 B5R0.3 C=CC(=C)CI Amb24333877 [1,0,1,0,0,0|1,0,1]=4 1954 B5R0.3 C=CC(=C)CO Amb25146300 [1,0,1,0,0,0|0,0,2]=4 1955 B5R0.3 C=CC(=O)C#N Amb25834324 [1,0,1,0,0,0|2,0,0]=4 1956 B5R0.3 C=CC(=O)C=C Amb22265893 [1,0,1,0,0,0|1,0,0]=3 1957 B5R0.3 C=CC(=O)CI Amb24645771 [1,0,1,0,0,0|2,0,0]=4 1958 B5R0.3 C=CC(=O)CN Amb24334239 [1,0,1,0,0,0|2,0,0]=4 1959 B5R0.3 C=CC(=O)NN Amb25134207 [1,0,1,0,0,0|2,0,0]=4 1960 B5R0.3 C=CC(=O)O[K] Amb22363270 [1,0,1,0,0,0|1,0,0]=3 1961 B5R0.3 C=CC(=O)O[Na] Amb22336198 [1,0,1,0,0,0|1,0,0]=3 1962 B5R0.3 C=CC(F)C=O Amb24552239 [1,0,1,0,0,0|1,0,1]=4 1963 B5R0.3 C=CC(O)C=O Amb25066575 [1,0,1,0,0,0|0,0,1]=3 1964 B5R0.3 C=C[C@H](O)C=O Amb24677118 [1,0,1,0,0,0|0,0,1]=3 1965 B5R0.3 C=C\C(\Br)=C/Cl Amb24594925 [1,0,1,0,0,0|2,0,0]=4 1966 B5R0.3 C=C\C(\Cl)=C/Br Amb25250443 [1,0,1,0,0,0|2,0,0]=4 1967 B5R0.3 C=C\C(\Cl)=C/Cl Amb24652618 [1,0,1,0,0,0|2,0,0]=4 1968 B5R0.3 CC(C=C)C=O Amb25737956 [1,0,1,0,0,0|0,0,2]=4 1969 B5R0.3 CC(C=O)=CBr Amb25262258 [1,0,1,0,0,0|1,0,1]=4 1970 B5R0.3 CC(C=O)=CCl Amb24333882 [1,0,1,0,0,0|1,0,1]=4 1971 B5R0.3 CCC(=C)C=O Amb17940102 [1,0,1,0,0,0|0,0,2]=4 1972 B5R0.3 COC(=O)C=C Amb22336504 [1,0,1,0,0,0|0,0,1]=3 1973 B5R0.3 COC(=O)C=C Amb22338013 [1,0,1,0,0,0|0,0,1]=3 1974 B5R0.3 COC(=O)C=C Amb22351400 [1,0,1,0,0,0|0,0,1]=3 1975 B5R0.3 COC(=O)C=C Amb22353461 [1,0,1,0,0,0|0,0,1]=3 1976 B5R0.3 C\C(=C/O)\C=O Amb25276378 [1,0,1,0,0,0|1,0,1]=4 1977 B5R0.3 C\C(=C\N)\C=O Amb24090370 [1,0,1,0,0,0|1,0,1]=4 1978 B5R0.3 C\C(\C=C)=C/I Amb24652456 [1,0,1,0,0,0|1,0,1]=4 1979 B5R0.3 C\C(\C=C)=C\Cl Amb24751401 [1,0,1,0,0,0|1,0,1]=4 1980 B5R0.3 C\C(\C=C)=C\I Amb24512122 [1,0,1,0,0,0|1,0,1]=4 1981 B5R0.3 C\C(\C=C)=C\N Amb24560866 [1,0,1,0,0,0|1,0,1]=4 1982 B5R0.3 C\C(\C=C)=C\O Amb25808114 [1,0,1,0,0,0|0,0,2]=4 1983 B5R0.3 C\C(\C=O)=C/Cl Amb25275130 [1,0,1,0,0,0|1,0,1]=4 1984 B5R0.3 C\C(\C=O)=C/I Amb25326015 [1,0,1,0,0,0|1,0,1]=4 1985 B5R0.3 C\C(\C=O)=C\Cl Amb18640380 [1,0,1,0,0,0|1,0,1]=4 1986 B5R0.3 C\C=C(/Br)\C=O Amb24478125 [1,0,1,0,0,0|1,0,1]=4 1987 B5R0.3 C\C=C(/C)\C=C Amb22347881 [1,0,1,0,0,0|1,0,1]=4 1988 B5R0.3 C\C=C(/Cl)\C=O Amb18122386 [1,0,1,0,0,0|1,0,1]=4 1989 B5R0.3 C\C=C(/F)\C=O Amb24391675 [1,0,1,0,0,0|1,0,1]=4 1990 B5R0.3 C\C=C(\Br)/C=O Amb18124612 [1,0,1,0,0,0|1,0,1]=4 1991 B5R0.3 C\C=C(\C)/C=C Amb24099382 [1,0,1,0,0,0|1,0,1]=4 1992 B5R0.3 C\C=C(\C)/C=O Amb24333046 [1,0,1,0,0,0|0,0,2]=4 1993 B5R0.3 C\C=C(\Cl)/C=O Amb24753590 [1,0,1,0,0,0|1,0,1]=4 1994 B5R0.3 C\C=C(\F)/C=O Amb25746394 [1,0,1,0,0,0|1,0,1]=4 1995 B5R0.3 O=CC(=O)C=O Amb17593025 [1,0,1,0,0,0|1,0,1]=4 1996 B5R0.3 O=CC(C=O)O Amb17615780 [1,0,1,0,0,0|1,0,1]=4 1997 B5R0.3 O=C\C(\Br)=C/Cl Amb24649105 [1,0,1,0,0,0|2,0,0]=4 1998 B5R0.3 O=C\C(\Cl)=C/Cl Amb25810027 [1,0,1,0,0,0|2,0,0]=4 1999 B5R0.3 O=C\C(\Cl)=C\Cl Amb18124305 [1,0,1,0,0,0|2,0,0]=4 2000 B5R0.3 O\C=C(/Br)\C=O Amb24478132 [1,0,1,0,0,0|2,0,0]=4 2001 B5R0.3 O\C=C(/I)\C=O Amb25226806 [1,0,1,0,0,0|2,0,0]=4 2002 B5R0.3 O\C=C(\Br)/C=O Amb24333812 [1,0,1,0,0,0|2,0,0]=4 2003 B5R0.3 O\C=C(\O)/C=O Amb22731841 [1,0,1,0,0,0|1,0,0]=3 2004 B5R0.3 O\C=C(\S)/C=O Amb24573083 [1,0,1,0,0,0|1,1,0]=4 2005 B5R0.3 [O-]\C=C(/F)\C=O Amb22735681 [1,0,1,0,0,0|2,0,0]=4 2006 B5R1.1 C1=NC=C[NH2+]1 Amb25368421 [2,0,0,0,0,0|2,0,0]=4 2007 B5R1.1 C1C=CC=C1 Amb17938994 [2,0,0,0,0,0|1,0,0]=3 2008 B5R1.1 C1NC=CO1 Amb20242493 [2,0,0,0,0,0|1,0,1]=4 2009 B5R1.1 [C-]=1CC=CC1 Amb22231445 [2,0,0,0,0,0|1,0,1]=4 2010 B5R1.1 [cH-]1cccc1 Amb20246770 [2,0,0,0,0,0|1,0,0]=3 2011 B5R1.1 [cH-]1cccc1 Amb22049508 [2,0,0,0,0,0|1,0,0]=3 2012 B5R1.1 [cH-]1cccc1 Amb22338182 [2,0,0,0,0,0|1,0,0]=3 2013 B5R1.1 [cH-]1cccc1 Amb22338370 [2,0,0,0,0,0|1,0,0]=3 2014 B5R1.1 [cH-]1cccc1 Amb22338811 [2,0,0,0,0,0|1,0,0]=3 2015 B5R1.1 [cH-]1cccc1 Amb22351489 [2,0,0,0,0,0|1,0,0]=3 2016 B5R1.1 [cH-]1cccc1 Amb22351987 [2,0,0,0,0,0|1,0,0]=3 2017 B5R1.1 [cH-]1cccc1 Amb22351988 [2,0,0,0,0,0|1,0,0]=3 2018 B5R1.1 [cH-]1cccc1 Amb22351989 [2,0,0,0,0,0|1,0,0]=3 2019 B5R1.1 [cH-]1cccc1 Amb22353219 [2,0,0,0,0,0|1,0,0]=3 2020 B5R1.1 [cH-]1cccc1 Amb22363310 [2,0,0,0,0,0|1,0,0]=3 2021 B5R1.1 c1[15n]cc[15nH]1 Amb17616032 [2,0,0,0,0,0|2,0,0]=4 2022 B5R1.1 c1[nH]cc[n]1 Amb24324982 [2,0,0,0,0,0|2,0,0]=4 2023 B5R1.1 c1[nH]cc[n]1 Amb24325148 [2,0,0,0,0,0|2,0,0]=4 2024 B5R1.1 c1[nH]cc[p]1 Amb24334574 [2,0,0,0,0,0|2,0,0]=4 2025 B5R1.1 c1c[15n][13cH][15nH]1 Amb22338981 [2,0,0,0,0,0|2,0,0]=4 2026 B5R1.1 c1c[n]o[n]1 Amb25024407 [2,0,0,0,0,0|2,0,0]=4 2027 B5R1.1 c1ccns1 Amb1090456 [2,0,0,0,0,0|1,1,0]=4 2028 B5R1.1 c1ncc[nH]1 Amb16192914 [2,0,0,0,0,0|2,0,0]=4 2029 B5R1.1 c:1:c:c:c:[Te]1 Amb22731086 [2,0,0,0,0,0|0,1,0]=3 2030 B5R1.1 o1cnnc1 Amb10552366 [2,0,0,0,0,0|2,0,0]=4 2031 B7R0.2 CC(=CC(O)=O)C=O Amb25378040 [0,1,1,0,0,0|2,0,0]=4 2032 B7R0.2 CC(=O)OC(=C)C=C Amb25694419 [0,1,1,0,0,0|1,0,1]=4 2033 B7R0.2 CC(=O)OC(=C)C=O Amb25695435 [0,1,1,0,0,0|0,0,1]=3 2034 B7R0.2 CC(=O)\C=C(/O)\C=C Amb24339287 [0,1,1,0,0,0|1,0,1]=4 2035 B7R0.2 CC(=O)\C=C(\C)/C=O Amb18641689 [0,1,1,0,0,0|1,0,1]=4 2036 B7R0.2 CC(=O)\C=C(\O)/C=C Amb24553056 [0,1,1,0,0,0|1,0,1]=4 2037 B7R0.2 CC(C)=CC(=O)C=O Amb24418075 [0,1,1,0,0,0|0,0,2]=4 2038 B7R0.2 C\C(=C/C(O)=O)\C=O Amb25138216 [0,1,1,0,0,0|2,0,0]=4 2039 B7R0.2 C\C(=C\C(O)=O)\C=O Amb24579433 [0,1,1,0,0,0|2,0,0]=4 2040 B7R0.2 C\C(\C=O)=C\C(C)=C Amb18641616 [0,1,1,0,0,0|1,0,0]=3 2041 B7R0.2 OC(=O)\C=C(/Cl)\C=O Amb24452824 [0,1,1,0,0,0|2,0,0]=4 2042 B7R0.3 C=CCCC(=C)C=O Amb25800063 [0,1,1,0,0,0|1,0,0]=3 2043 B7R0.3 C=CCOC(=C)C=O Amb18641684 [0,1,1,0,0,0|0,0,0]=2 2044 B7R0.3 C=CCOC(=O)C=O Amb18641760 [0,1,1,0,0,0|1,0,0]=3 2045 B7R0.3 CC(C=O)OCC=C Amb24482104 [0,1,1,0,0,0|0,0,2]=4 2046 B7R0.3 CCCOC(=C)C=O Amb24483012 [0,1,1,0,0,0|0,0,2]=4 2047 B7R0.3 CCO\C=C(/O)\C=O Amb25326136 [0,1,1,0,0,0|0,0,2]=4 2048 B7R0.3 CCO\C=C(\O)/C=O Amb25195281 [0,1,1,0,0,0|0,0,2]=4 2049 B7R0.3 C\C(=C/Br)\C=C\C=O Amb24483114 [0,1,1,0,0,0|2,0,0]=4 2050 B7R0.3 C\C(=C/Cl)\C=C\C=O Amb25742912 [0,1,1,0,0,0|2,0,0]=4 2051 B7R0.3 C\C(\C=O)=C/CC=C Amb18123725 [0,1,1,0,0,0|1,0,0]=3 2052 B7R0.3 C\C=C(/Br)\C=C\C=O Amb25768073 [0,1,1,0,0,0|2,0,0]=4 2053 B7R0.3 C\C=C(\C)/C=C/C=O Amb24483010 [0,1,1,0,0,0|2,0,0]=4 2054 B7R0.3 C\C=C(\C)/C=CC=O Amb24585180 [0,1,1,0,0,0|2,0,0]=4 2055 B7R0.3 C\C=C/CC(=C)C=O Amb25785570 [0,1,1,0,0,0|1,0,0]=3 2056 B7R0.3 C\C=C\C=C(/C)\C=O Amb25311292 [0,1,1,0,0,0|1,0,0]=3 2057 B7R0.3 C\C=C\C=C(\C)/C=O Amb18124218 [0,1,1,0,0,0|1,0,0]=3 2058 B7R0.3 O=CC(Cl)=CCC=O Amb24745897 [0,1,1,0,0,0|1,0,1]=4 2059 B7R0.3 O=C\C=C/C(/Cl)=C/Cl Amb24474485 [0,1,1,0,0,0|2,0,0]=4 2060 B7R0.3 O=C\C=C/C(=O)C=O Amb25743044 [0,1,1,0,0,0|0,0,1]=3 2061 B7R0.3 O=C\C=C\C(Br)C=O Amb24483154 [0,1,1,0,0,0|1,0,1]=4 2062 B7R0.3 O=C\C=C\C(Cl)C=O Amb25173630 [0,1,1,0,0,0|1,0,1]=4 2063 B7R0.3 O\C=C\C=C(/Br)\C=O Amb25690541 [0,1,1,0,0,0|1,0,0]=3 2064 B7R0.3 O\C=C\C=C(/Cl)\C=O Amb25683477 [0,1,1,0,0,0|1,0,0]=3 2065 B7R0.5 C=C(CC=C)C(O)=O Amb18641687 [0,1,1,0,0,0|1,0,0]=3 2066 B7R0.5 C=CC[C@@H](O)C(O)=O Amb24548731 [0,1,1,0,0,0|0,0,2]=4 2067 B7R0.5 C=C\C=C(/Cl)\C(O)=O Amb18642910 [0,1,1,0,0,0|1,0,0]=3 2068 B7R0.5 C=C\C=C(/F)\C(O)=O Amb24402288 [0,1,1,0,0,0|1,0,0]=3 2069 B7R0.5 C=C\C=C(\N)/C(O)=O Amb25306109 [0,1,1,0,0,0|1,0,0]=3 2070 B7R0.5 CC(=C)C(=O)OC=C Amb22045212 [0,1,1,0,0,0|2,0,0]=4 2071 B7R0.5 CC(=CC=O)C(N)=O Amb24548847 [0,1,1,0,0,0|2,0,0]=4 2072 B7R0.5 CC(=O)C(=C)CC=C Amb25043218 [0,1,1,0,0,0|1,0,0]=3 2073 B7R0.5 CC(=O)C(=C)\C=C\C Amb25712751 [0,1,1,0,0,0|1,0,1]=4 2074 B7R0.5 CC(=O)C(=O)\C=C\C Amb24625395 [0,1,1,0,0,0|0,0,2]=4 2075 B7R0.5 CC(=O)C(=O)\C=C\[O-] Amb25340571 [0,1,1,0,0,0|1,0,1]=4 2076 B7R0.5 CC(=O)[C@H](O)CC=C Amb24662420 [0,1,1,0,0,0|0,0,2]=4 2077 B7R0.5 CC(=O)\C(\C)=C/C=O Amb18641685 [0,1,1,0,0,0|2,0,0]=4 2078 B7R0.5 CC(=O)\C(\C)=C\C=C Amb24518382 [0,1,1,0,0,0|1,0,0]=3 2079 B7R0.5 CC(=O)\C(\Cl)=C\C=C Amb24594261 [0,1,1,0,0,0|1,0,0]=3 2080 B7R0.5 CC(=O)\C(\O)=C/NC Amb24515912 [0,1,1,0,0,0|1,0,1]=4 2081 B7R0.5 CCOC(=C)C(O)=O Amb18641872 [0,1,1,0,0,0|0,0,2]=4 2082 B7R0.5 C\C(=C/C=C)\C(O)=O Amb25258956 [0,1,1,0,0,0|1,0,0]=3 2083 B7R0.5 C\C=C/C(O)C(C)=O Amb24526785 [0,1,1,0,0,0|0,0,2]=4 2084 B7R0.5 C\C=C\C(=O)C(O)=O Amb24568283 [0,1,1,0,0,0|0,0,2]=4 2085 B7R0.5 C\C=C\C(O)C(O)=O Amb24481382 [0,1,1,0,0,0|0,0,2]=4 2086 B7R0.5 C\C=C\[C@H](O)C(C)=O Amb25287343 [0,1,1,0,0,0|0,0,2]=4 2087 B7R0.5 OC(=O)C(=O)\C=C\O Amb24699120 [0,1,1,0,0,0|1,0,1]=4 2088 B7R0.5 OC(=O)C(O)=CC=O Amb25339531 [0,1,1,0,0,0|1,0,0]=3 2089 B7R0.5 OC(=O)\C(\Br)=C\C=O Amb25242509 [0,1,1,0,0,0|2,0,0]=4 2090 B7R0.5 OC(=O)\C(\O)=C\C=O Amb25082413 [0,1,1,0,0,0|1,0,0]=3 2091 B7R0.7 C\C=C\C(C)=CC=O Amb24566188 [0,1,1,0,0,0|1,0,1]=4 2092 B7R0.7 C\C=C\C(\C)=C\C=O Amb25800848 [0,1,1,0,0,0|1,0,1]=4 2093 B7R0.10 C=CC(O)C(=C)C=O Amb24481508 [0,1,1,0,0,0|1,0,0]=3 2094 B7R0.10 C=CC(O)C(O)C=O Amb25318889 [0,1,1,0,0,0|0,0,2]=4 2095 B7R0.10 C=C[C@@H](O)[C@@H](O)C=O Amb24383182 [0,1,1,0,0,0|0,0,2]=4 2096 B7R0.10 C=C[C@@H](O)[C@H](O)C=O Amb24444427 [0,1,1,0,0,0|0,0,2]=4 2097 B7R0.10 C=C[C@H](O)[C@@H](O)C=O Amb25733477 [0,1,1,0,0,0|0,0,2]=4 2098 B7R0.10 C\C(\C=O)=C(\C)/C=O Amb25758523 [0,1,1,0,0,0|2,0,0]=4 2099 B7R0.10 O=C(C=O)\C(\Cl)=C\Cl Amb18124724 [0,1,1,0,0,0|1,0,1]=4 2100 B7R0.10 OC(C=O)=C(Br)C=O Amb24611575 [0,1,1,0,0,0|1,0,0]=3 2101 B7R0.11 CC(O)(CC=C)C=O Amb25063326 [0,1,1,0,0,0|0,0,2]=4 2102 B7R0.12 C=CCC(C=O)=C=C Amb24557447 [0,1,1,0,0,0|1,0,0]=3 2103 B7R0.12 C=CCC(CO)C=O Amb18641802 [0,1,1,0,0,0|0,0,2]=4 2104 B7R0.12 C=CC\C(\C=O)=C\Cl Amb25172910 [0,1,1,0,0,0|1,0,0]=3 2105 B7R0.12 C=CC\C(\CO)=C/Cl Amb25074610 [0,1,1,0,0,0|1,0,1]=4 2106 B7R0.12 C=CC\C(\CO)=C/F Amb25142858 [0,1,1,0,0,0|1,0,1]=4 2107 B7R0.12 CC=C(C=O)OCC Amb25254197 [0,1,1,0,0,0|0,0,2]=4 2108 B7R0.12 CCO\C(=C\O)\C=O Amb24483034 [0,1,1,0,0,0|0,0,2]=4 2109 B7R0.12 CC\C(=C/C=O)\C=O Amb25182852 [0,1,1,0,0,0|2,0,0]=4 2110 B7R0.12 C\C=C(\C=O)/C=C/C Amb25758758 [0,1,1,0,0,0|1,0,1]=4 2111 B7R0.12 C\C=C(\C=O)/OCC Amb25743397 [0,1,1,0,0,0|0,0,2]=4 2112 B7R0.1 BC=CC=CC=CN Amb24622514 [0,1,1,0,0,0|2,0,0]=4 2113 B7R0.1 C#C\C=C\C=C\C=O Amb24483025 [0,1,1,0,0,0|1,0,0]=3 2114 B7R0.1 C#C\C=N\C=C\C=O Amb24481558 [0,1,1,0,0,0|1,0,1]=4 2115 B7R0.1 C=CC=C\C=C\CBr Amb24627093 [0,1,1,0,0,0|2,0,0]=4 2116 B7R0.1 C=CC=C\C=C\CO Amb25136336 [0,1,1,0,0,0|1,0,0]=3 2117 B7R0.1 C=CCC=C\C=C\Cl Amb24549928 [0,1,1,0,0,0|2,0,0]=4 2118 B7R0.1 C=CC\C=C/C=C/Cl Amb25778307 [0,1,1,0,0,0|2,0,0]=4 2119 B7R0.1 C=C\C=C/CCC=O Amb24526453 [0,1,1,0,0,0|1,0,1]=4 2120 B7R0.1 C=C\C=C\C=C/C=O Amb25678638 [0,1,1,0,0,0|1,0,0]=3 2121 B7R0.1 C=C\C=C\C=CC=O Amb25302366 [0,1,1,0,0,0|1,0,0]=3 2122 B7R0.1 C=C\C=C\C=C\C=O Amb24334581 [0,1,1,0,0,0|1,0,0]=3 2123 B7R0.1 C=C\C=C\CCC=O Amb18641618 [0,1,1,0,0,0|1,0,1]=4 2124 B7R0.1 C=C\C=C\CNC=O Amb24516041 [0,1,1,0,0,0|1,0,1]=4 2125 B7R0.1 C=C\C=N\C=CC=O Amb24642996 [0,1,1,0,0,0|1,0,0]=3 2126 B7R0.1 CC\C=C/C=C/C=O Amb25040049 [0,1,1,0,0,0|1,0,0]=3 2127 B7R0.1 CC\C=C/C=C\C=O Amb24666726 [0,1,1,0,0,0|1,0,0]=3 2128 B7R0.1 CC\C=C\C=C\CO Amb17614885 [0,1,1,0,0,0|1,0,1]=4 2129 B7R0.1 CO\C=C\C=CCO Amb25024935 [0,1,1,0,0,0|0,0,2]=4 2130 B7R0.1 CO\C=C\CCC=O Amb18641790 [0,1,1,0,0,0|0,0,2]=4 2131 B7R0.1 C\C=C\C=C/C=C\Br Amb25169520 [0,1,1,0,0,0|2,0,0]=4 2132 B7R0.1 C\C=C\C=C\C=N\O Amb24710705 [0,1,1,0,0,0|1,0,0]=3 2133 B7R0.1 C\C=C\C=C\N=C=O Amb24566111 [0,1,1,0,0,0|1,0,1]=4 2134 B7R0.1 C\C=C\COCC=O Amb24579425 [0,1,1,0,0,0|0,0,2]=4 2135 B7R0.1 C\C=C\C\C=C\C=O Amb24722156 [0,1,1,0,0,0|1,0,0]=3 2136 B7R0.1 ClC=CC=CC=CCl Amb24617319 [0,1,1,0,0,0|2,0,0]=4 2137 B7R0.1 ClC=CC=C\C=C\Cl Amb24334117 [0,1,1,0,0,0|2,0,0]=4 2138 B7R0.1 N#CC=C\C=C\C=O Amb24568010 [0,1,1,0,0,0|1,0,0]=3 2139 B7R0.1 N#C\C=C\C=C\C=O Amb18122617 [0,1,1,0,0,0|1,0,0]=3 2140 B7R0.1 O=CC=C\C=C\C=O Amb25209344 [0,1,1,0,0,0|0,0,1]=3 2141 B7R0.1 O=CC=C\C=C\CBr Amb24614651 [0,1,1,0,0,0|1,0,0]=3 2142 B7R0.1 O=CC=C\C=C\CCl Amb25810586 [0,1,1,0,0,0|1,0,0]=3 2143 B7R0.1 O=CCC=C\C=C\Br Amb24691351 [0,1,1,0,0,0|1,0,0]=3 2144 B7R0.1 O=CCC\C=C/C=O Amb24453308 [0,1,1,0,0,0|0,0,2]=4 2145 B7R0.1 O=CCC\C=C\C=O Amb18124241 [0,1,1,0,0,0|0,0,2]=4 2146 B7R0.1 O=CC\C=C\C=CBr Amb24533959 [0,1,1,0,0,0|1,0,0]=3 2147 B7R0.1 O=C\C=C/C=C\C=O Amb25046710 [0,1,1,0,0,0|0,0,1]=3 2148 B7R0.1 O=C\C=C\C=C/C=O Amb17593128 [0,1,1,0,0,0|0,0,1]=3 2149 B7R0.1 O=C\C=C\C=C\CBr Amb25241523 [0,1,1,0,0,0|1,0,0]=3 2150 B7R0.1 OCCC\C=C\C=O Amb25734444 [0,1,1,0,0,0|0,0,2]=4 2151 B7R0.1 OCC\C=C\C=CCl Amb24512121 [0,1,1,0,0,0|1,0,1]=4 2152 B7R0.1 OC\C=C/CCC=O Amb25827491 [0,1,1,0,0,0|0,0,2]=4 2153 B7R0.1 OC\C=C\C#CC=O Amb25746037 [0,1,1,0,0,0|0,0,2]=4 2154 B7R0.1 OC\C=C\C=CCO Amb25278646 [0,1,1,0,0,0|0,0,2]=4 2155 B7R0.4 Br\C=C/C=C/C(=O)C Amb10066945 [0,1,1,0,0,0|1,0,0]=3 2156 B7R0.4 C=CC\C=C\C(O)=O Amb18641681 [0,1,1,0,0,0|1,0,1]=4 2157 B7R0.4 C=C\C=C\CC(N)=O Amb25848874 [0,1,1,0,0,0|1,0,1]=4 2158 B7R0.4 CC(=C)C\C=C\C=O Amb18640955 [0,1,1,0,0,0|1,0,1]=4 2159 B7R0.4 CC(=O)C=CC=CBr Amb24081602 [0,1,1,0,0,0|1,0,0]=3 2160 B7R0.4 CC(=O)C\C=C\C=C Amb24711717 [0,1,1,0,0,0|1,0,1]=4 2161 B7R0.4 CC(=O)C\C=C\CO Amb24583096 [0,1,1,0,0,0|0,0,2]=4 2162 B7R0.4 CC(=O)NOCC=C Amb25189056 [0,1,1,0,0,0|1,0,1]=4 2163 B7R0.4 CC(=O)N\C=C\C=C Amb25709129 [0,1,1,0,0,0|2,0,0]=4 2164 B7R0.4 CC(=O)N\C=C\C=O Amb18124245 [0,1,1,0,0,0|1,0,1]=4 2165 B7R0.4 CC(=O)O/C=C/C=C Amb17673774 [0,1,1,0,0,0|2,0,0]=4 2166 B7R0.4 CC(=O)O\C=C\C=O Amb25237598 [0,1,1,0,0,0|1,0,1]=4 2167 B7R0.4 CC(=O)SC\C=C\O Amb24371969 [0,1,1,0,0,0|1,0,1]=4 2168 B7R0.4 CC(=O)S\C=C\C=O Amb24668965 [0,1,1,0,0,0|1,0,1]=4 2169 B7R0.4 CC(=O)S\C=C\CO Amb25098660 [0,1,1,0,0,0|1,0,1]=4 2170 B7R0.4 CC(=O)\C=C\C=C/Cl Amb25745342 [0,1,1,0,0,0|1,0,0]=3 2171 B7R0.4 CC(=O)\C=C\C=CBr Amb24627229 [0,1,1,0,0,0|1,0,0]=3 2172 B7R0.4 CC(=O)\C=C\C=CCl Amb25179030 [0,1,1,0,0,0|1,0,0]=3 2173 B7R0.4 CC(=O)\C=C\C=C\Br Amb25675765 [0,1,1,0,0,0|1,0,0]=3 2174 B7R0.4 CC(O)C\C=C\C=O Amb18641799 [0,1,1,0,0,0|0,0,2]=4 2175 B7R0.4 CC(O)\C=C\C=C\Cl Amb25359620 [0,1,1,0,0,0|1,0,1]=4 2176 B7R0.4 C[C@@H](O)C\C=C\C=O Amb25310809 [0,1,1,0,0,0|0,0,2]=4 2177 B7R0.4 C\C(\Br)=C/C=C/C=O Amb25309575 [0,1,1,0,0,0|1,0,0]=3 2178 B7R0.4 C\C(\Br)=C\C=CCO Amb24334089 [0,1,1,0,0,0|1,0,1]=4 2179 B7R0.4 C\C(\O)=C\C=C/C=O Amb25096071 [0,1,1,0,0,0|0,0,0]=2 2180 B7R0.4 C\C(\O)=C\C=CC=O Amb24741180 [0,1,1,0,0,0|0,0,0]=2 2181 B7R0.4 C\C=C/C=C\C(C)=O Amb24538831 [0,1,1,0,0,0|1,0,0]=3 2182 B7R0.4 C\C=C\C=C/C(C)O Amb22342426 [0,1,1,0,0,0|1,0,1]=4 2183 B7R0.4 C\C=C\C=CB(O)O Amb25316384 [0,1,1,0,0,0|2,0,0]=4 2184 B7R0.4 C\C=C\C=C[C@H](C)O Amb24475166 [0,1,1,0,0,0|1,0,1]=4 2185 B7R0.4 C\C=C\C=C\C(=O)C Amb17593137 [0,1,1,0,0,0|1,0,0]=3 2186 B7R0.4 C\C=C\C=C\C(=O)Cl Amb17142857 [0,1,1,0,0,0|1,0,0]=3 2187 B7R0.4 C\C=C\C=C\C(=O)N Amb17142853 [0,1,1,0,0,0|1,0,0]=3 2188 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [0,1,1,0,0,0|1,0,0]=3 2189 B7R0.4 C\C=C\C=C\C(N)=N Amb24667853 [0,1,1,0,0,0|2,0,0]=4 2190 B7R0.4 C\C=C\C=C\C([O-])=O Amb19957956 [0,1,1,0,0,0|1,0,0]=3 2191 B7R0.4 C\C=C\C=C\C([O-])=O Amb22735151 [0,1,1,0,0,0|1,0,0]=3 2192 B7R0.4 C\C=C\OCC(C)=O Amb24481479 [0,1,1,0,0,0|0,0,2]=4 2193 B7R0.4 O=CC=CC=C(Cl)Cl Amb24559244 [0,1,1,0,0,0|1,0,0]=3 2194 B7R0.4 OC(=O)C\C=C\C=C Amb17593152 [0,1,1,0,0,0|1,0,1]=4 2195 B7R0.4 OC(=O)C\C=C\C=O Amb24437944 [0,1,1,0,0,0|0,0,1]=3 2196 B7R0.4 OC(=O)\C=C\C=CCl Amb24562254 [0,1,1,0,0,0|1,0,0]=3 2197 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [0,1,1,0,0,0|0,0,2]=4 2198 B7R0.4 OC\C=C\C=C(Cl)Cl Amb24706187 [0,1,1,0,0,0|1,0,1]=4 2199 B7R0.15 C=N\C(=C\N)\C(N)=O Amb24534094 [0,1,1,0,0,0|2,0,0]=4 2200 B7R0.15 CC(=O)C(=CO)OC Amb24631186 [0,1,1,0,0,0|1,0,1]=4 2201 B7R0.15 CC(=O)\C(=C/C)\OC Amb25086645 [0,1,1,0,0,0|0,0,2]=4 2202 B7R0.15 CC(=O)\C(=C/O)\OC Amb25065808 [0,1,1,0,0,0|1,0,1]=4 2203 B7R0.15 CC=C(OC)C(N)=O Amb24612424 [0,1,1,0,0,0|0,0,2]=4 2204 B7R0.15 CC=C(OC)C(O)=O Amb25793698 [0,1,1,0,0,0|0,0,2]=4 2205 B7R0.15 COC(=CO)C(O)=O Amb25730461 [0,1,1,0,0,0|1,0,1]=4 2206 B7R0.15 COC(C=C)C(O)=O Amb18641874 [0,1,1,0,0,0|0,0,2]=4 2207 B7R0.15 CO\C(=C/Br)\C(O)=O Amb25189037 [0,1,1,0,0,0|1,0,1]=4 2208 B7R0.15 C\C=C(/OC)\C(N)=O Amb24681019 [0,1,1,0,0,0|0,0,2]=4 2209 B7R0.15 C\C=C(/OC)\C(O)=O Amb18124260 [0,1,1,0,0,0|0,0,2]=4 2210 B7R0.15 C\C=C(\C=C)/C(N)=O Amb25276462 [0,1,1,0,0,0|1,0,1]=4 2211 B7R0.18 COC(C)(C=C)C=O Amb24666725 [0,1,1,0,0,0|0,0,2]=4 2212 B7R1.2 BrC1=CC(=O)OC1 Amb10067500 [1,1,0,0,0,0|0,0,1]=3 2213 B7R1.2 Brc1[n]c(Br)co1 Amb25836715 [1,1,0,0,0,0|2,0,0]=4 2214 B7R1.2 Brc1c[nH]c(Br)c1 Amb24514321 [1,1,0,0,0,0|2,0,0]=4 2215 B7R1.2 Brc1cc(I)[s]c1 Amb24320667 [1,1,0,0,0,0|1,1,0]=4 2216 B7R1.2 Brc1ccc(Br)[se]1 Amb24323652 [1,1,0,0,0,0|1,1,0]=4 2217 B7R1.2 Brc1ccc(Br)o1 Amb19651339 [1,1,0,0,0,0|1,0,0]=3 2218 B7R1.2 Brc1ccc(I)o1 Amb24632285 [1,1,0,0,0,0|1,0,0]=3 2219 B7R1.2 Brc1ccc(o1)[2H] Amb10597228 [1,1,0,0,0,0|1,0,0]=3 2220 B7R1.2 Brc1ccc(s1)Br Amb2447247 [1,1,0,0,0,0|1,1,0]=4 2221 B7R1.2 Brc1ccc(s1)[2H] Amb10597227 [1,1,0,0,0,0|1,1,0]=4 2222 B7R1.2 Brc1coc(Br)c1 Amb20241410 [1,1,0,0,0,0|1,0,0]=3 2223 B7R1.2 Brc1csc(c1)Cl Amb10602627 [1,1,0,0,0,0|1,1,0]=4 2224 B7R1.2 Brc1noc(c1)C Amb10603673 [1,1,0,0,0,0|1,0,1]=4 2225 B7R1.2 C=C1C=CC(=O)O1 Amb22001002 [1,1,0,0,0,0|0,0,0]=2 2226 B7R1.2 C=C1CC(=O)C=C1 Amb24553656 [1,1,0,0,0,0|1,0,0]=3 2227 B7R1.2 C=C1CC(=O)OC1 Amb24589821 [1,1,0,0,0,0|0,0,2]=4 2228 B7R1.2 C=C1COC(=O)N1 Amb24541155 [1,1,0,0,0,0|1,0,1]=4 2229 B7R1.2 C=C1COC(=O)O1 Amb20248769 [1,1,0,0,0,0|1,0,1]=4 2230 B7R1.2 CC1=CC(=N)NO1 Amb22330538 [1,1,0,0,0,0|1,0,1]=4 2231 B7R1.2 CC1=CC(=O)C=C1 Amb24364191 [1,1,0,0,0,0|1,0,0]=3 2232 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [1,1,0,0,0,0|0,0,2]=4 2233 B7R1.2 CC1=CC(=O)N=N1 Amb20621717 [1,1,0,0,0,0|2,0,0]=4 2234 B7R1.2 CC1=CC(=O)NN1 Amb19770794 [1,1,0,0,0,0|2,0,0]=4 2235 B7R1.2 CC1=CC(=O)NO1 Amb19338707 [1,1,0,0,0,0|1,0,1]=4 2236 B7R1.2 CC1=CC(=S)CO1 Amb25026404 [1,1,0,0,0,0|0,0,2]=4 2237 B7R1.2 CC1=CCC(=O)N1 Amb24119179 [1,1,0,0,0,0|1,0,1]=4 2238 B7R1.2 CC1=CNC(=O)N1 Amb20667076 [1,1,0,0,0,0|2,0,0]=4 2239 B7R1.2 CC1=CNC(=O)O1 Amb22298623 [1,1,0,0,0,0|1,0,0]=3 2240 B7R1.2 CC1=COC(=N)N1 Amb20637145 [1,1,0,0,0,0|2,0,0]=4 2241 B7R1.2 CC1=COC(=O)O1 Amb24693155 [1,1,0,0,0,0|1,0,0]=3 2242 B7R1.2 CC1=CSC(=O)N1 Amb19372452 [1,1,0,0,0,0|1,1,0]=4 2243 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [1,1,0,0,0,0|2,0,0]=4 2244 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [1,1,0,0,0,0|2,0,0]=4 2245 B7R1.2 CC1C=CC(=O)N1 Amb25248060 [1,1,0,0,0,0|1,0,1]=4 2246 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [1,1,0,0,0,0|0,0,1]=3 2247 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [1,1,0,0,0,0|0,1,1]=4 2248 B7R1.2 CC=1C=NC(=O)N1 Amb24754157 [1,1,0,0,0,0|2,0,0]=4 2249 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [1,1,0,0,0,0|1,0,1]=4 2250 B7R1.2 CC=1CC(=O)ON1 Amb22274079 [1,1,0,0,0,0|1,0,1]=4 2251 B7R1.2 CC=1CNC(=O)C1 Amb24479892 [1,1,0,0,0,0|1,0,1]=4 2252 B7R1.2 CC=1COC(=O)C1 Amb22002703 [1,1,0,0,0,0|0,0,1]=3 2253 B7R1.2 CC=1NOC(=O)N1 Amb22491279 [1,1,0,0,0,0|2,0,0]=4 2254 B7R1.2 CN1C=CC(=O)N1 Amb22233839 [1,1,0,0,0,0|2,0,0]=4 2255 B7R1.2 C[C@@H]1C=CC(=O)O1 Amb25114434 [1,1,0,0,0,0|0,0,1]=3 2256 B7R1.2 C[C@H]1C=CC(=O)O1 Amb13887292 [1,1,0,0,0,0|0,0,1]=3 2257 B7R1.2 Cc1[n]c(Br)co1 Amb25727162 [1,1,0,0,0,0|1,0,1]=4 2258 B7R1.2 Cc1[n]c(N)co1 Amb22011557 [1,1,0,0,0,0|1,0,1]=4 2259 B7R1.2 Cc1[n]c(N)co1 Amb22899203 [1,1,0,0,0,0|1,0,1]=4 2260 B7R1.2 Cc1[n]cc(C)o1 Amb23399817 [1,1,0,0,0,0|1,0,1]=4 2261 B7R1.2 Cc1[n]cc(N)o1 Amb18061806 [1,1,0,0,0,0|1,0,1]=4 2262 B7R1.2 Cc1c[n]c(Br)o1 Amb24113164 [1,1,0,0,0,0|1,0,1]=4 2263 B7R1.2 Cc1c[n]c(Cl)o1 Amb19516434 [1,1,0,0,0,0|1,0,1]=4 2264 B7R1.2 Cc1c[n]c(Cl)o1 Amb24117495 [1,1,0,0,0,0|1,0,1]=4 2265 B7R1.2 Cc1c[n]c(N)o1 Amb18277977 [1,1,0,0,0,0|1,0,1]=4 2266 B7R1.2 Cc1c[s]c(N)c1 Amb22498092 [1,1,0,0,0,0|1,1,0]=4 2267 B7R1.2 Cc1cc(Br)c[nH]1 Amb18199424 [1,1,0,0,0,0|1,0,1]=4 2268 B7R1.2 Cc1cc(Br)co1 Amb18828030 [1,1,0,0,0,0|0,0,1]=3 2269 B7R1.2 Cc1cc(Br)o[n]1 Amb18190948 [1,1,0,0,0,0|2,0,0]=4 2270 B7R1.2 Cc1cc(C)on1 Amb17685548 [1,1,0,0,0,0|1,0,1]=4 2271 B7R1.2 Cc1cc(Cl)[n]o1 Amb24524072 [1,1,0,0,0,0|1,0,1]=4 2272 B7R1.2 Cc1cc(Cl)co1 Amb25180623 [1,1,0,0,0,0|0,0,1]=3 2273 B7R1.2 Cc1cc(F)[s]c1 Amb25054484 [1,1,0,0,0,0|1,1,0]=4 2274 B7R1.2 Cc1cc(I)[s]c1 Amb22496053 [1,1,0,0,0,0|1,1,0]=4 2275 B7R1.2 Cc1cc(I)o[n]1 Amb22754616 [1,1,0,0,0,0|2,0,0]=4 2276 B7R1.2 Cc1cc(N)[nH]c1 Amb18203096 [1,1,0,0,0,0|2,0,0]=4 2277 B7R1.2 Cc1cc(N)[s]c1 Amb19958131 [1,1,0,0,0,0|1,1,0]=4 2278 B7R1.2 Cc1cc(N)c[nH]1 Amb18199372 [1,1,0,0,0,0|1,0,1]=4 2279 B7R1.2 Cc1cc(N)c[s]1 Amb18833057 [1,1,0,0,0,0|0,1,1]=4 2280 B7R1.2 Cc1cc(N)c[s]1 Amb22276155 [1,1,0,0,0,0|0,1,1]=4 2281 B7R1.2 Cc1cc(O)[s]c1 Amb20617904 [1,1,0,0,0,0|0,1,1]=4 2282 B7R1.2 Cc1cc(O)c[s]1 Amb24523671 [1,1,0,0,0,0|0,1,1]=4 2283 B7R1.2 Cc1cc(O)co1 Amb24708163 [1,1,0,0,0,0|0,0,1]=3 2284 B7R1.2 Cc1cc(O)o[n]1 Amb22337742 [1,1,0,0,0,0|1,0,1]=4 2285 B7R1.2 Cc1cc([O-])o[n]1 Amb22264776 [1,1,0,0,0,0|1,0,1]=4 2286 B7R1.2 Cc1ccc(Br)[nH]1 Amb18199425 [1,1,0,0,0,0|1,0,1]=4 2287 B7R1.2 Cc1ccc(Cl)o1 Amb25242029 [1,1,0,0,0,0|0,0,1]=3 2288 B7R1.2 Cc1ccc(F)[s]1 Amb24479469 [1,1,0,0,0,0|0,1,1]=4 2289 B7R1.2 Cc1ccc(I)o1 Amb25723970 [1,1,0,0,0,0|0,0,1]=3 2290 B7R1.2 Cc1ccc(N)[nH]1 Amb24122413 [1,1,0,0,0,0|1,0,1]=4 2291 B7R1.2 Cc1ccc(N)[s]1 Amb19890911 [1,1,0,0,0,0|0,1,1]=4 2292 B7R1.2 Cc1ccc(N)[s]1 Amb22498572 [1,1,0,0,0,0|0,1,1]=4 2293 B7R1.2 Cc1ccc(S)[s]1 Amb20623930 [1,1,0,0,0,0|0,1,1]=4 2294 B7R1.2 Cc1ccc([SiH3])[s]1 Amb24569460 [1,1,0,0,0,0|0,1,1]=4 2295 B7R1.2 Cc1ccc(o1)Br Amb10600628 [1,1,0,0,0,0|0,0,1]=3 2296 B7R1.2 Cc1ccc(o1)C Amb2447078 [1,1,0,0,0,0|0,0,1]=3 2297 B7R1.2 Cc1ccc(o1)N Amb10600629 [1,1,0,0,0,0|0,0,1]=3 2298 B7R1.2 Cc1ccc(s1)C Amb2447067 [1,1,0,0,0,0|0,1,1]=4 2299 B7R1.2 Cc1ccc(s1)Cl Amb16230980 [1,1,0,0,0,0|0,1,1]=4 2300 B7R1.2 Cc1ccc(s1)O Amb17593190 [1,1,0,0,0,0|0,1,1]=4 2301 B7R1.2 Cc1coc(Br)[n]1 Amb19958804 [1,1,0,0,0,0|2,0,0]=4 2302 B7R1.2 Cc1coc(C)c1 Amb22049832 [1,1,0,0,0,0|0,0,1]=3 2303 B7R1.2 Cc1coc(Cl)[n]1 Amb22728834 [1,1,0,0,0,0|2,0,0]=4 2304 B7R1.2 Cc1coc(S)[n]1 Amb24121247 [1,1,0,0,0,0|1,1,0]=4 2305 B7R1.2 Cc1coc(c1)Br Amb10600631 [1,1,0,0,0,0|1,0,0]=3 2306 B7R1.2 Cc1coc(c1)N Amb10600632 [1,1,0,0,0,0|1,0,0]=3 2307 B7R1.2 Cc1coc(n1)N Amb2455669 [1,1,0,0,0,0|2,0,0]=4 2308 B7R1.2 Cc1csc(c1)Br Amb10600630 [1,1,0,0,0,0|1,1,0]=4 2309 B7R1.2 Cc1noc(c1)N Amb1156064 [1,1,0,0,0,0|2,0,0]=4 2310 B7R1.2 Cc1occ(n1)C Amb15692404 [1,1,0,0,0,0|1,0,1]=4 2311 B7R1.2 Cc1onc(c1)C Amb1150307 [1,1,0,0,0,0|1,0,1]=4 2312 B7R1.2 Cc1scc(c1)C Amb2447068 [1,1,0,0,0,0|0,1,1]=4 2313 B7R1.2 Clc1[n]c(Cl)co1 Amb25377934 [1,1,0,0,0,0|2,0,0]=4 2314 B7R1.2 Clc1c[nH]c(Cl)c1 Amb24511808 [1,1,0,0,0,0|2,0,0]=4 2315 B7R1.2 Clc1c[s]c(Cl)c1 Amb24056457 [1,1,0,0,0,0|1,1,0]=4 2316 B7R1.2 Clc1ccc(Cl)o1 Amb24061017 [1,1,0,0,0,0|1,0,0]=3 2317 B7R1.2 Clc1ccc(I)[s]1 Amb20620732 [1,1,0,0,0,0|1,1,0]=4 2318 B7R1.2 Clc1ccc(I)o1 Amb24752684 [1,1,0,0,0,0|1,0,0]=3 2319 B7R1.2 Clc1ccc(s1)Cl Amb2447120 [1,1,0,0,0,0|1,1,0]=4 2320 B7R1.2 Fc1c[s]c(F)c1 Amb24411512 [1,1,0,0,0,0|1,1,0]=4 2321 B7R1.2 Fc1cc(Br)[nH]c1 Amb18199781 [1,1,0,0,0,0|2,0,0]=4 2322 B7R1.2 Fc1cc(Br)[s]c1 Amb18193378 [1,1,0,0,0,0|1,1,0]=4 2323 B7R1.2 Fc1cc(Br)oc1 Amb18199638 [1,1,0,0,0,0|1,0,0]=3 2324 B7R1.2 Fc1cc(Cl)c[s]1 Amb25744927 [1,1,0,0,0,0|1,1,0]=4 2325 B7R1.2 Fc1cc(I)[s]c1 Amb25351938 [1,1,0,0,0,0|1,1,0]=4 2326 B7R1.2 Fc1cc(I)c[s]1 Amb25301648 [1,1,0,0,0,0|1,1,0]=4 2327 B7R1.2 Fc1ccc(Br)[nH]1 Amb18828838 [1,1,0,0,0,0|2,0,0]=4 2328 B7R1.2 Fc1ccc(Br)[s]1 Amb18193111 [1,1,0,0,0,0|1,1,0]=4 2329 B7R1.2 Fc1ccc(Br)o1 Amb18199668 [1,1,0,0,0,0|1,0,0]=3 2330 B7R1.2 Fc1ccc(I)[s]1 Amb24269146 [1,1,0,0,0,0|1,1,0]=4 2331 B7R1.2 Fc1coc(F)c1 Amb25746010 [1,1,0,0,0,0|1,0,0]=3 2332 B7R1.2 IC1=CC(=O)OC1 Amb2455617 [1,1,0,0,0,0|0,0,1]=3 2333 B7R1.2 Ic1[n]c(I)co1 Amb25700929 [1,1,0,0,0,0|2,0,0]=4 2334 B7R1.2 Ic1[n]cc(I)o1 Amb24733906 [1,1,0,0,0,0|2,0,0]=4 2335 B7R1.2 N=C1C=CC(=N)N1 Amb25663065 [1,1,0,0,0,0|2,0,0]=4 2336 B7R1.2 NC1=CC(=O)CN1 Amb25268710 [1,1,0,0,0,0|2,0,0]=4 2337 B7R1.2 NC1=CC(=O)CO1 Amb24516411 [1,1,0,0,0,0|1,0,1]=4 2338 B7R1.2 NC1=CC(=O)CS1 Amb22229937 [1,1,0,0,0,0|2,0,0]=4 2339 B7R1.2 NC1=CC(=O)NN1 Amb18941269 [1,1,0,0,0,0|2,0,0]=4 2340 B7R1.2 NC1=CC(=O)NO1 Amb20103209 [1,1,0,0,0,0|2,0,0]=4 2341 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [1,1,0,0,0,0|1,0,1]=4 2342 B7R1.2 NC1=NC(=O)C=N1 Amb22015342 [1,1,0,0,0,0|2,0,0]=4 2343 B7R1.2 NC1=NCC(=O)O1 Amb24061087 [1,1,0,0,0,0|1,0,1]=4 2344 B7R1.2 NC1C=CC(=O)O1 Amb24349779 [1,1,0,0,0,0|0,0,1]=3 2345 B7R1.2 NC=1COC(=O)N1 Amb24576517 [1,1,0,0,0,0|1,0,1]=4 2346 B7R1.2 NC=1NOC(=O)N1 Amb24060381 [1,1,0,0,0,0|2,0,0]=4 2347 B7R1.2 N[C@@H]1CC(=O)C=C1 Amb24579377 [1,1,0,0,0,0|1,0,1]=4 2348 B7R1.2 N[C@H]1CC(=O)C=C1 Amb24605966 [1,1,0,0,0,0|1,0,1]=4 2349 B7R1.2 Nc1[n]c(I)co1 Amb25335651 [1,1,0,0,0,0|2,0,0]=4 2350 B7R1.2 Nc1[n]c(N)co1 Amb25267769 [1,1,0,0,0,0|2,0,0]=4 2351 B7R1.2 Nc1[n]cc(Cl)o1 Amb25075968 [1,1,0,0,0,0|2,0,0]=4 2352 B7R1.2 Nc1c[nH]c(N)c1 Amb18200110 [1,1,0,0,0,0|2,0,0]=4 2353 B7R1.2 Nc1c[s]c(N)c1 Amb18203357 [1,1,0,0,0,0|1,1,0]=4 2354 B7R1.2 Nc1cc(Br)[nH]c1 Amb18199640 [1,1,0,0,0,0|2,0,0]=4 2355 B7R1.2 Nc1cc(Br)[s]c1 Amb18648086 [1,1,0,0,0,0|1,1,0]=4 2356 B7R1.2 Nc1cc(Br)[s]c1 Amb19929503 [1,1,0,0,0,0|1,1,0]=4 2357 B7R1.2 Nc1cc(Br)c[nH]1 Amb18199649 [1,1,0,0,0,0|2,0,0]=4 2358 B7R1.2 Nc1cc(Br)c[s]1 Amb18564069 [1,1,0,0,0,0|1,1,0]=4 2359 B7R1.2 Nc1cc(Br)co1 Amb18819119 [1,1,0,0,0,0|1,0,0]=3 2360 B7R1.2 Nc1cc(Br)oc1 Amb18190961 [1,1,0,0,0,0|1,0,0]=3 2361 B7R1.2 Nc1cc(Cl)[s]c1 Amb22492848 [1,1,0,0,0,0|1,1,0]=4 2362 B7R1.2 Nc1cc(Cl)[s]c1 Amb22757511 [1,1,0,0,0,0|1,1,0]=4 2363 B7R1.2 Nc1cc(Cl)c[s]1 Amb23400218 [1,1,0,0,0,0|1,1,0]=4 2364 B7R1.2 Nc1cc(Cl)c[s]1 Amb23401708 [1,1,0,0,0,0|1,1,0]=4 2365 B7R1.2 Nc1cc(I)[s]c1 Amb25788262 [1,1,0,0,0,0|1,1,0]=4 2366 B7R1.2 Nc1cc(O)[n]o1 Amb18941358 [1,1,0,0,0,0|2,0,0]=4 2367 B7R1.2 Nc1ccc(Br)[nH]1 Amb18199648 [1,1,0,0,0,0|2,0,0]=4 2368 B7R1.2 Nc1ccc(Br)[s]1 Amb20241251 [1,1,0,0,0,0|1,1,0]=4 2369 B7R1.2 Nc1ccc(Br)[s]1 Amb22491952 [1,1,0,0,0,0|1,1,0]=4 2370 B7R1.2 Nc1ccc(Cl)[s]1 Amb18055064 [1,1,0,0,0,0|1,1,0]=4 2371 B7R1.2 Nc1ccc(Cl)[s]1 Amb19958824 [1,1,0,0,0,0|1,1,0]=4 2372 B7R1.2 Nc1ccc(Cl)[s]1 Amb23401704 [1,1,0,0,0,0|1,1,0]=4 2373 B7R1.2 Nc1ccc(Cl)o1 Amb25360216 [1,1,0,0,0,0|1,0,0]=3 2374 B7R1.2 Nc1ccc(F)[s]1 Amb18202738 [1,1,0,0,0,0|1,1,0]=4 2375 B7R1.2 Nc1ccc(F)o1 Amb18202898 [1,1,0,0,0,0|1,0,0]=3 2376 B7R1.2 Nc1ccc(N)[nH]1 Amb18200126 [1,1,0,0,0,0|2,0,0]=4 2377 B7R1.2 Nc1ccc(N)[s]1 Amb18203358 [1,1,0,0,0,0|1,1,0]=4 2378 B7R1.2 Nc1ccc(N)o1 Amb18203063 [1,1,0,0,0,0|1,0,0]=3 2379 B7R1.2 Nc1ccc(O)o1 Amb24526005 [1,1,0,0,0,0|0,0,1]=3 2380 B7R1.2 Nc1ccc(o1)Br Amb13884560 [1,1,0,0,0,0|1,0,0]=3 2381 B7R1.2 Nc1ccc(o1)[2H] Amb10597230 [1,1,0,0,0,0|1,0,0]=3 2382 B7R1.2 Nc1ccc(s1)Br Amb13884559 [1,1,0,0,0,0|1,1,0]=4 2383 B7R1.2 Nc1ccc(s1)[2H] Amb10597229 [1,1,0,0,0,0|1,1,0]=4 2384 B7R1.2 Nc1coc(N)c1 Amb18199155 [1,1,0,0,0,0|1,0,0]=3 2385 B7R1.2 Nc1onc(c1)N Amb13951830 [1,1,0,0,0,0|2,0,0]=4 2386 B7R1.2 Nc1onc(c1)N Amb17622003 [1,1,0,0,0,0|2,0,0]=4 2387 B7R1.2 O=C1C=C(Br)CN1 Amb23400584 [1,1,0,0,0,0|1,0,1]=4 2388 B7R1.2 O=C1C=C(Br)CN1 Amb23402184 [1,1,0,0,0,0|1,0,1]=4 2389 B7R1.2 O=C1C=C(Br)CS1 Amb25026198 [1,1,0,0,0,0|0,1,1]=4 2390 B7R1.2 O=C1C=C(Cl)CO1 Amb25241116 [1,1,0,0,0,0|0,0,1]=3 2391 B7R1.2 O=C1C=CC(=O)N1 Amb1235242 [1,1,0,0,0,0|1,0,0]=3 2392 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [1,1,0,0,0,0|0,0,0]=2 2393 B7R1.2 O=C1C=CC(=O)O1 Amb22369065 [1,1,0,0,0,0|0,0,0]=2 2394 B7R1.2 O=C1C=CC(=O)S1 Amb24603022 [1,1,0,0,0,0|0,1,0]=3 2395 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [1,1,0,0,0,0|0,0,1]=3 2396 B7R1.2 O=C1C=CC(I)O1 Amb25325287 [1,1,0,0,0,0|0,0,1]=3 2397 B7R1.2 O=C1C=C[13C](=O)O1 Amb22367487 [1,1,0,0,0,0|0,0,0]=2 2398 B7R1.2 O=C1CC(=O)C=C1 Amb22338203 [1,1,0,0,0,0|1,0,0]=3 2399 B7R1.2 O=C1CC(Cl)C=C1 Amb25240609 [1,1,0,0,0,0|1,0,1]=4 2400 B7R1.2 O=C1CC(I)C=C1 Amb24666810 [1,1,0,0,0,0|1,0,1]=4 2401 B7R1.2 O=C1CCC(Br)=C1 Amb23399816 [1,1,0,0,0,0|1,0,1]=4 2402 B7R1.2 O=C1CCC(I)=C1 Amb25811714 [1,1,0,0,0,0|1,0,1]=4 2403 B7R1.2 O=C1C[C@@H](Br)C=C1 Amb25724437 [1,1,0,0,0,0|1,0,1]=4 2404 B7R1.2 O=C1C[C@H](Cl)C=C1 Amb25088364 [1,1,0,0,0,0|1,0,1]=4 2405 B7R1.2 O=C1NC(=O)C=S1 Amb25780722 [1,1,0,0,0,0|1,1,0]=4 2406 B7R1.2 O=C1NC=C(I)S1 Amb24623936 [1,1,0,0,0,0|1,1,0]=4 2407 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [1,1,0,0,0,0|2,0,0]=4 2408 B7R1.2 O=C1OC=C(C1)O Amb17621628 [1,1,0,0,0,0|0,0,1]=3 2409 B7R1.2 O=C1OCC(=O)N1 Amb1625991 [1,1,0,0,0,0|1,0,1]=4 2410 B7R1.2 O=C1[13CH]=[13CH]C(=O)O1 Amb22353372 [1,1,0,0,0,0|0,0,0]=2 2411 B7R1.2 O=C1[14CH2][14CH2]C(=O)O1 Amb22729170 [1,1,0,0,0,0|0,0,2]=4 2412 B7R1.2 O=[13C]1C=C[13C](=O)O1 Amb22367373 [1,1,0,0,0,0|0,0,0]=2 2413 B7R1.2 O=[13C]1CC[13C](=O)O1 Amb20243426 [1,1,0,0,0,0|0,0,2]=4 2414 B7R1.2 O=[13C]1[13CH2][13CH2][13C](=O)O1 Amb22056174 [1,1,0,0,0,0|0,0,2]=4 2415 B7R1.2 O=[13C]1[13CH]=[13CH][13C](=O)O1 Amb22055653 [1,1,0,0,0,0|0,0,0]=2 2416 B7R1.2 OC1C=CC(=O)O1 Amb24544763 [1,1,0,0,0,0|0,0,1]=3 2417 B7R1.2 OC=1C=CC(=O)N1 Amb22552540 [1,1,0,0,0,0|1,0,0]=3 2418 B7R1.2 OC=1CNC(=O)C1 Amb20623530 [1,1,0,0,0,0|1,0,1]=4 2419 B7R1.2 ON1CC(=O)C=C1 Amb25286099 [1,1,0,0,0,0|2,0,0]=4 2420 B7R1.2 O[C@@H]1C=CC(=O)N1 Amb25844488 [1,1,0,0,0,0|1,0,1]=4 2421 B7R1.2 O[C@@H]1C=CC(=O)O1 Amb25064237 [1,1,0,0,0,0|0,0,1]=3 2422 B7R1.2 O[C@H]1C=CC(=O)O1 Amb24479542 [1,1,0,0,0,0|0,0,1]=3 2423 B7R1.2 Oc1cc(Br)c[s]1 Amb18819059 [1,1,0,0,0,0|0,1,1]=4 2424 B7R1.2 Oc1ccc(Br)[nH]1 Amb18819121 [1,1,0,0,0,0|1,0,1]=4 2425 B7R1.2 Oc1ccc(Br)[s]1 Amb18055072 [1,1,0,0,0,0|0,1,1]=4 2426 B7R1.2 Oc1ccc(Br)o1 Amb18199811 [1,1,0,0,0,0|0,0,1]=3 2427 B7R1.2 Oc1ccc(Cl)[s]1 Amb18055065 [1,1,0,0,0,0|0,1,1]=4 2428 B7R1.2 Oc1ccc(Cl)o1 Amb25723971 [1,1,0,0,0,0|0,0,1]=3 2429 B7R1.2 Oc1noc(c1)C Amb2370655 [1,1,0,0,0,0|1,0,1]=4 2430 B7R1.2 Sc1[n]cc(Cl)o1 Amb25822211 [1,1,0,0,0,0|1,1,0]=4 2431 B7R1.2 Sc1[n]cc(I)o1 Amb24675167 [1,1,0,0,0,0|1,1,0]=4 2432 B7R1.2 Sc1ccc(Br)[s]1 Amb24524248 [1,1,0,0,0,0|0,2,0]=4 2433 B7R1.2 Sc1ccc(Cl)[s]1 Amb24479766 [1,1,0,0,0,0|0,2,0]=4 2434 B7R1.2 [*]c1ccc([*])[s]1 Amb17933771 [1,1,0,0,0,0|1,1,0]=4 2435 B7R1.2 [13CH3]c1ccc([13CH3])o1 Amb22338842 [1,1,0,0,0,0|0,0,1]=3 2436 B7R1.2 [O-][S+]1C=CC(=O)N1 Amb1837430 [1,1,0,0,0,0|2,0,0]=4 2437 B7R1.2 [SiH3]c1ccc(Cl)[s]1 Amb24638420 [1,1,0,0,0,0|0,2,0]=4 2438 B7R1.4 Brc1[s]ccc1I Amb20620493 [1,1,0,0,0,0|1,1,0]=4 2439 B7R1.4 Brc1cc[s]c1I Amb20620492 [1,1,0,0,0,0|1,1,0]=4 2440 B7R1.4 Brc1oc[n]c1Br Amb25270455 [1,1,0,0,0,0|2,0,0]=4 2441 B7R1.4 Brc1sccc1Br Amb2237068 [1,1,0,0,0,0|1,1,0]=4 2442 B7R1.4 C=C1CC=CC1O Amb25682078 [1,1,0,0,0,0|1,0,1]=4 2443 B7R1.4 CC1=CC=CC1=O Amb24408382 [1,1,0,0,0,0|1,0,0]=3 2444 B7R1.4 CC1=CNOC1=O Amb25843682 [1,1,0,0,0,0|1,0,0]=3 2445 B7R1.4 CC1=CSNC1=O Amb24480941 [1,1,0,0,0,0|2,0,0]=4 2446 B7R1.4 CC1C=CCC1=O Amb25233761 [1,1,0,0,0,0|1,0,1]=4 2447 B7R1.4 CC1CC=CC1=O Amb25143468 [1,1,0,0,0,0|1,0,1]=4 2448 B7R1.4 CC1N=COC1=O Amb24518855 [1,1,0,0,0,0|1,0,1]=4 2449 B7R1.4 CN1C=CCC1=O Amb25806222 [1,1,0,0,0,0|1,0,1]=4 2450 B7R1.4 CN1C=CNC1=O Amb20622459 [1,1,0,0,0,0|2,0,0]=4 2451 B7R1.4 CN1CC=CC1=O Amb22372248 [1,1,0,0,0,0|1,0,1]=4 2452 B7R1.4 CN1NC=CC1=O Amb22002214 [1,1,0,0,0,0|2,0,0]=4 2453 B7R1.4 CN1OC=CC1=O Amb25845405 [1,1,0,0,0,0|1,0,1]=4 2454 B7R1.4 CN1SC=CC1=O Amb19133167 [1,1,0,0,0,0|2,0,0]=4 2455 B7R1.4 CN1SC=CC1=O Amb20239425 [1,1,0,0,0,0|2,0,0]=4 2456 B7R1.4 C[C@H]1CC=CC1=O Amb24364068 [1,1,0,0,0,0|1,0,1]=4 2457 B7R1.4 C[n]1cccc1Br Amb18199426 [1,1,0,0,0,0|2,0,0]=4 2458 B7R1.4 C[n]1cccc1Cl Amb25212184 [1,1,0,0,0,0|2,0,0]=4 2459 B7R1.4 C[n]1cccc1I Amb24756601 [1,1,0,0,0,0|2,0,0]=4 2460 B7R1.4 C[n]1cccc1N Amb24480442 [1,1,0,0,0,0|2,0,0]=4 2461 B7R1.4 Cc1[nH]ccc1Br Amb18199851 [1,1,0,0,0,0|1,0,1]=4 2462 B7R1.4 Cc1[nH]ccc1N Amb18198050 [1,1,0,0,0,0|1,0,1]=4 2463 B7R1.4 Cc1[nH]ccc1O Amb25214639 [1,1,0,0,0,0|1,0,1]=4 2464 B7R1.4 Cc1[n]coc1N Amb22234804 [1,1,0,0,0,0|2,0,0]=4 2465 B7R1.4 Cc1[n]coc1O Amb24536045 [1,1,0,0,0,0|1,0,1]=4 2466 B7R1.4 Cc1[s]ccc1N Amb18833056 [1,1,0,0,0,0|0,1,1]=4 2467 B7R1.4 Cc1[s]ccc1N Amb22276099 [1,1,0,0,0,0|0,1,1]=4 2468 B7R1.4 Cc1c[n]oc1N Amb18943767 [1,1,0,0,0,0|2,0,0]=4 2469 B7R1.4 Cc1c[n]oc1O Amb25064746 [1,1,0,0,0,0|1,0,1]=4 2470 B7R1.4 Cc1cc[nH]c1C Amb17938702 [1,1,0,0,0,0|1,0,1]=4 2471 B7R1.4 Cc1cc[s]c1I Amb22898804 [1,1,0,0,0,0|1,1,0]=4 2472 B7R1.4 Cc1cc[s]c1N Amb18679496 [1,1,0,0,0,0|1,1,0]=4 2473 B7R1.4 Cc1cc[s]c1N Amb22496058 [1,1,0,0,0,0|1,1,0]=4 2474 B7R1.4 Cc1cc[s]c1N Amb22498571 [1,1,0,0,0,0|1,1,0]=4 2475 B7R1.4 Cc1cc[s]c1O Amb24639732 [1,1,0,0,0,0|0,1,1]=4 2476 B7R1.4 Cc1cc[s]c1S Amb25747282 [1,1,0,0,0,0|0,2,0]=4 2477 B7R1.4 Cc1ccc[n]1N Amb25774373 [1,1,0,0,0,0|1,0,1]=4 2478 B7R1.4 Cc1ccoc1Br Amb22276939 [1,1,0,0,0,0|1,0,0]=3 2479 B7R1.4 Cc1ccsc1Br Amb2236394 [1,1,0,0,0,0|1,1,0]=4 2480 B7R1.4 Cc1o[n]cc1Br Amb18199818 [1,1,0,0,0,0|1,0,1]=4 2481 B7R1.4 Cc1o[n]cc1N Amb18119789 [1,1,0,0,0,0|1,0,1]=4 2482 B7R1.4 Cc1o[n]cc1N Amb20668399 [1,1,0,0,0,0|1,0,1]=4 2483 B7R1.4 Cc1oc[n]c1Br Amb24357642 [1,1,0,0,0,0|1,0,1]=4 2484 B7R1.4 Cc1oc[n]c1C Amb22396059 [1,1,0,0,0,0|1,0,1]=4 2485 B7R1.4 Cc1occc1N Amb18203072 [1,1,0,0,0,0|0,0,1]=3 2486 B7R1.4 Cc1occc1O Amb25178728 [1,1,0,0,0,0|0,0,1]=3 2487 B7R1.4 Cc1sccc1C Amb2447413 [1,1,0,0,0,0|0,1,1]=4 2488 B7R1.4 Clc1cc[nH]c1Br Amb25315179 [1,1,0,0,0,0|2,0,0]=4 2489 B7R1.4 Clc1cc[nH]c1Cl Amb24359419 [1,1,0,0,0,0|2,0,0]=4 2490 B7R1.4 Clc1cc[s]c1I Amb25169530 [1,1,0,0,0,0|1,1,0]=4 2491 B7R1.4 Clc1ccoc1Cl Amb25208816 [1,1,0,0,0,0|1,0,0]=3 2492 B7R1.4 Clc1occc1Br Amb24443259 [1,1,0,0,0,0|1,0,0]=3 2493 B7R1.4 Cn1cccc1C Amb2447020 [1,1,0,0,0,0|1,0,1]=4 2494 B7R1.4 Fc1[s]ccc1Br Amb25802858 [1,1,0,0,0,0|1,1,0]=4 2495 B7R1.4 Fc1cc[nH]c1Br Amb18199773 [1,1,0,0,0,0|2,0,0]=4 2496 B7R1.4 Fc1cc[s]c1Br Amb18522293 [1,1,0,0,0,0|1,1,0]=4 2497 B7R1.4 Fc1cc[s]c1Cl Amb25662800 [1,1,0,0,0,0|1,1,0]=4 2498 B7R1.4 Fc1cc[s]c1F Amb24562839 [1,1,0,0,0,0|1,1,0]=4 2499 B7R1.4 Fc1ccoc1Br Amb18199675 [1,1,0,0,0,0|1,0,0]=3 2500 B7R1.4 Fc1occc1Br Amb24638170 [1,1,0,0,0,0|1,0,0]=3 2501 B7R1.4 Ic1cc[s]c1I Amb25270694 [1,1,0,0,0,0|1,1,0]=4 2502 B7R1.4 NC1=CCOC1=O Amb22234102 [1,1,0,0,0,0|0,0,1]=3 2503 B7R1.4 NC1=CNNC1=O Amb24120355 [1,1,0,0,0,0|2,0,0]=4 2504 B7R1.4 NC1=CONC1=O Amb18203033 [1,1,0,0,0,0|2,0,0]=4 2505 B7R1.4 NC1=CSSC1=O Amb25303597 [1,1,0,0,0,0|1,1,0]=4 2506 B7R1.4 NN1C=CNC1=O Amb25084441 [1,1,0,0,0,0|2,0,0]=4 2507 B7R1.4 NN1C=COC1=O Amb24626105 [1,1,0,0,0,0|1,0,0]=3 2508 B7R1.4 N[C@H]1C=COC1=O Amb25259750 [1,1,0,0,0,0|0,0,1]=3 2509 B7R1.4 Nc1[nH]ccc1Br Amb18199832 [1,1,0,0,0,0|2,0,0]=4 2510 B7R1.4 Nc1[nH]ccc1S Amb25364973 [1,1,0,0,0,0|2,0,0]=4 2511 B7R1.4 Nc1[n]coc1O Amb24594151 [1,1,0,0,0,0|1,0,1]=4 2512 B7R1.4 Nc1[s]ccc1Br Amb18190889 [1,1,0,0,0,0|1,1,0]=4 2513 B7R1.4 Nc1[s]ccc1Cl Amb23400220 [1,1,0,0,0,0|1,1,0]=4 2514 B7R1.4 Nc1[s]ccc1Cl Amb23401705 [1,1,0,0,0,0|1,1,0]=4 2515 B7R1.4 Nc1[s]ccc1F Amb24679180 [1,1,0,0,0,0|1,1,0]=4 2516 B7R1.4 Nc1[s]ccc1I Amb25822246 [1,1,0,0,0,0|1,1,0]=4 2517 B7R1.4 Nc1c[n]oc1Cl Amb25025558 [1,1,0,0,0,0|2,0,0]=4 2518 B7R1.4 Nc1cc[nH]c1Br Amb18199645 [1,1,0,0,0,0|2,0,0]=4 2519 B7R1.4 Nc1cc[nH]c1N Amb18200118 [1,1,0,0,0,0|2,0,0]=4 2520 B7R1.4 Nc1cc[s]c1Br Amb22757373 [1,1,0,0,0,0|1,1,0]=4 2521 B7R1.4 Nc1cc[s]c1Cl Amb24054287 [1,1,0,0,0,0|1,1,0]=4 2522 B7R1.4 Nc1cc[s]c1Cl Amb25077005 [1,1,0,0,0,0|1,1,0]=4 2523 B7R1.4 Nc1cc[s]c1N Amb18203359 [1,1,0,0,0,0|1,1,0]=4 2524 B7R1.4 Nc1ccoc1Br Amb13884558 [1,1,0,0,0,0|1,0,0]=3 2525 B7R1.4 Nc1ccoc1N Amb18832360 [1,1,0,0,0,0|1,0,0]=3 2526 B7R1.4 Nc1ccsc1Br Amb13884557 [1,1,0,0,0,0|1,1,0]=4 2527 B7R1.4 Nc1o[n]cc1Cl Amb24385964 [1,1,0,0,0,0|2,0,0]=4 2528 B7R1.4 Nc1occc1O Amb25327034 [1,1,0,0,0,0|1,0,0]=3 2529 B7R1.4 O=C1C=CCC1Br Amb24739668 [1,1,0,0,0,0|1,0,1]=4 2530 B7R1.4 O=C1C=COC1=O Amb24706925 [1,1,0,0,0,0|0,0,0]=2 2531 B7R1.4 O=C1C=COC1Br Amb24061538 [1,1,0,0,0,0|1,0,1]=4 2532 B7R1.4 O=C1CCC=C1Br Amb10067494 [1,1,0,0,0,0|1,0,1]=4 2533 B7R1.4 O=C1CCC=C1Cl Amb24749092 [1,1,0,0,0,0|1,0,1]=4 2534 B7R1.4 O=C1CCC=C1O Amb17593067 [1,1,0,0,0,0|1,0,1]=4 2535 B7R1.4 O=C1N=CNC1=O Amb25066061 [1,1,0,0,0,0|2,0,0]=4 2536 B7R1.4 O=C1N=NC=C1Cl Amb25836875 [1,1,0,0,0,0|2,0,0]=4 2537 B7R1.4 O=C1NOC=C1Br Amb24641631 [1,1,0,0,0,0|2,0,0]=4 2538 B7R1.4 O=C1OC=CC1Br Amb22015332 [1,1,0,0,0,0|0,0,1]=3 2539 B7R1.4 O=C1OC=CC1I Amb24679050 [1,1,0,0,0,0|0,0,1]=3 2540 B7R1.4 O=C1OCC=C1Br Amb10067498 [1,1,0,0,0,0|0,0,1]=3 2541 B7R1.4 O=C1OCC=C1C Amb16231256 [1,1,0,0,0,0|0,0,1]=3 2542 B7R1.4 O=C1OCC=C1Cl Amb23571857 [1,1,0,0,0,0|0,0,1]=3 2543 B7R1.4 O=C1OCC=C1I Amb24679080 [1,1,0,0,0,0|0,0,1]=3 2544 B7R1.4 O=C1ON=CC1=O Amb25319011 [1,1,0,0,0,0|1,0,0]=3 2545 B7R1.4 O=C1O[Ca]OC1=O Amb20671286 [1,1,0,0,0,0|2,0,0]=4 2546 B7R1.4 O=C1O[Fe]OC1=O Amb22167955 [1,1,0,0,0,0|2,0,0]=4 2547 B7R1.4 O=C1O[Sn]OC1=O Amb19894343 [1,1,0,0,0,0|2,0,0]=4 2548 B7R1.4 O=C1O[Sr]OC1=O Amb22338392 [1,1,0,0,0,0|2,0,0]=4 2549 B7R1.4 OC1=CCOC1=O Amb25147525 [1,1,0,0,0,0|0,0,1]=3 2550 B7R1.4 OC1C=CCC1=O Amb24734405 [1,1,0,0,0,0|1,0,1]=4 2551 B7R1.4 OC1C=COC1=O Amb25296159 [1,1,0,0,0,0|0,0,1]=3 2552 B7R1.4 O[C@@H]1CC=CC1=O Amb24571805 [1,1,0,0,0,0|1,0,1]=4 2553 B7R1.4 O[C@H]1CC=CC1=O Amb25745808 [1,1,0,0,0,0|1,0,1]=4 2554 B7R1.4 Oc1[nH]ccc1Br Amb18819118 [1,1,0,0,0,0|1,0,1]=4 2555 B7R1.4 Oc1[s]ccc1Br Amb22492529 [1,1,0,0,0,0|0,1,1]=4 2556 B7R1.4 Oc1[s]ccc1Cl Amb25296805 [1,1,0,0,0,0|0,1,1]=4 2557 B7R1.4 Oc1[s]ccc1F Amb25177194 [1,1,0,0,0,0|0,1,1]=4 2558 B7R1.4 Oc1cc[nH]c1S Amb25025393 [1,1,0,0,0,0|1,1,0]=4 2559 B7R1.4 Oc1ccoc1Br Amb24078809 [1,1,0,0,0,0|1,0,0]=3 2560 B7R1.4 Oc1ccoc1O Amb24060949 [1,1,0,0,0,0|0,0,1]=3 2561 B7R1.4 Oc1occc1Br Amb18199810 [1,1,0,0,0,0|0,0,1]=3 2562 B7R1.4 Sc1ccoc1C Amb16232454 [1,1,0,0,0,0|0,0,1]=3 2563 B7R1.4 Sc1ccsc1C Amb16232447 [1,1,0,0,0,0|0,1,1]=4 2564 B7R1.14 CP1(=O)C=CCO1 Amb25345454 [1,1,0,0,0,0|1,0,1]=4 2565 B7R1.14 O=S1(=O)C=CC=C1 Amb24106983 [1,1,0,0,0,0|2,0,0]=4 2566 B7R1.14 O=S1(=O)C=CCO1 Amb19957378 [1,1,0,0,0,0|1,0,1]=4 2567 B7R1.6 C=C\C=C\1/CC=C1 Amb24570990 [0,1,0,0,1,0|1,0,1]=4 2568 B7R1.18 CC(=O)C1CC=C1 Amb25807635 [0,1,0,0,1,0|0,0,2]=4 2569 B7R1.18 CC(=O)C=1CCC1 Amb23453500 [0,1,0,0,1,0|0,0,2]=4 2570 B7R1.18 CC(=O)N1CC=C1 Amb22001815 [0,1,0,0,1,0|1,0,1]=4 2571 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [0,1,0,0,1,0|0,0,2]=4 2572 B9R1.1 Brc1ccc(cc1)N=O Amb17779258 [0,1,0,0,0,1|2,0,0]=4 2573 B9R1.1 C=C1C=CC(C=C1)=CO Amb25344008 [0,1,0,0,0,1|1,0,1]=4 2574 B9R1.1 C=Cc1[n]cc(Br)c[n]1 Amb25303775 [0,1,0,0,0,1|2,0,0]=4 2575 B9R1.1 C=Cc1[n]cc(F)c[n]1 Amb25207602 [0,1,0,0,0,1|2,0,0]=4 2576 B9R1.1 C=Cc1[n]cc(N)c[n]1 Amb24378050 [0,1,0,0,0,1|2,0,0]=4 2577 B9R1.1 C=Cc1c[n]c(N)c[n]1 Amb24714754 [0,1,0,0,0,1|2,0,0]=4 2578 B9R1.1 C=Cc1cc[n+]([O-])cc1 Amb25724448 [0,1,0,0,0,1|2,0,0]=4 2579 B9R1.1 C=Cc1ccc(Br)[n]c1 Amb23446259 [0,1,0,0,0,1|2,0,0]=4 2580 B9R1.1 C=Cc1ccc(Br)c[n]1 Amb21857299 [0,1,0,0,0,1|2,0,0]=4 2581 B9R1.1 C=Cc1ccc(Cl)[n][n]1 Amb22748864 [0,1,0,0,0,1|2,0,0]=4 2582 B9R1.1 C=Cc1ccc(Cl)[n]c1 Amb19516435 [0,1,0,0,0,1|2,0,0]=4 2583 B9R1.1 C=Cc1ccc(Cl)c[n]1 Amb24071183 [0,1,0,0,0,1|2,0,0]=4 2584 B9R1.1 C=Cc1ccc(I)[n]c1 Amb23446985 [0,1,0,0,0,1|2,0,0]=4 2585 B9R1.1 C=Cc1ccc(I)cc1 Amb22736012 [0,1,0,0,0,1|2,0,0]=4 2586 B9R1.1 C=Cc1ccc(N)[n]c1 Amb23446330 [0,1,0,0,0,1|2,0,0]=4 2587 B9R1.1 C=Cc1ccc(N)c[n]1 Amb24091913 [0,1,0,0,0,1|2,0,0]=4 2588 B9R1.1 C=Cc1ccc(N)cc1 Amb21857763 [0,1,0,0,0,1|2,0,0]=4 2589 B9R1.1 C=Cc1ccc(O)[n]c1 Amb23446716 [0,1,0,0,0,1|2,0,0]=4 2590 B9R1.1 C=Cc1ccc(O)cc1 Amb22367052 [0,1,0,0,0,1|2,0,0]=4 2591 B9R1.1 C=Cc1ccc(S)[n]c1 Amb23446729 [0,1,0,0,0,1|2,0,0]=4 2592 B9R1.1 C=Cc1ccc(cc1)O Amb10603802 [0,1,0,0,0,1|2,0,0]=4 2593 B9R1.1 CC=C1C=CN(C)C=C1 Amb24091559 [0,1,0,0,0,1|2,0,0]=4 2594 B9R1.1 Cc1c[n]c(cc1)N=O Amb24071566 [0,1,0,0,0,1|2,0,0]=4 2595 B9R1.1 Cc1ccc(C=N)cc1 Amb24063680 [0,1,0,0,0,1|2,0,0]=4 2596 B9R1.1 Cc1ccc(C=S)cc1 Amb22233234 [0,1,0,0,0,1|1,1,0]=4 2597 B9R1.1 Cc1ccc(cc1)C=C Amb22338256 [0,1,0,0,0,1|2,0,0]=4 2598 B9R1.1 Cc1ccc(cc1)C=C Amb22338285 [0,1,0,0,0,1|2,0,0]=4 2599 B9R1.1 Cc1ccc(cc1)N=O Amb22167394 [0,1,0,0,0,1|2,0,0]=4 2600 B9R1.1 Cc1cnc(cn1)C=C Amb15691848 [0,1,0,0,0,1|2,0,0]=4 2601 B9R1.1 Clc1ccc(cc1)N=O Amb17940420 [0,1,0,0,0,1|2,0,0]=4 2602 B9R1.1 Clc1ccc(nn1)C=O Amb10070846 [0,1,0,0,0,1|1,0,0]=3 2603 B9R1.1 N#CC=1C=CC(=O)OC1 Amb22304830 [0,1,0,0,0,1|1,0,1]=4 2604 B9R1.1 N=Cc1ccc(cc1)O Amb17593236 [0,1,0,0,0,1|2,0,0]=4 2605 B9R1.1 Nc1[n]cc(C=O)[n][n]1 Amb24621544 [0,1,0,0,0,1|2,0,0]=4 2606 B9R1.1 Nc1[n]cc(C=O)c[n]1 Amb22234750 [0,1,0,0,0,1|2,0,0]=4 2607 B9R1.1 Nc1c[n]c(C=O)[n]c1 Amb25226484 [0,1,0,0,0,1|1,0,0]=3 2608 B9R1.1 Nc1c[n]c(C=O)c[n]1 Amb25147118 [0,1,0,0,0,1|1,0,0]=3 2609 B9R1.1 Nc1ccc(C=O)[n]c1 Amb23403602 [0,1,0,0,0,1|1,0,0]=3 2610 B9R1.1 Nc1ccc(C=O)c[n]1 Amb20247831 [0,1,0,0,0,1|1,0,0]=3 2611 B9R1.1 Nc1ccc(C=O)c[n]1 Amb22436785 [0,1,0,0,0,1|1,0,0]=3 2612 B9R1.1 Nc1ccc(C=O)cc1 Amb17842945 [0,1,0,0,0,1|1,0,0]=3 2613 B9R1.1 O=C1C=CC(=CN1)C=O Amb18642085 [0,1,0,0,0,1|1,0,0]=3 2614 B9R1.1 O=C1C=CC(=CO1)C=O Amb18124299 [0,1,0,0,0,1|0,0,0]=2 2615 B9R1.1 O=C1C=CC(C=O)=NN1 Amb18848569 [0,1,0,0,0,1|1,0,0]=3 2616 B9R1.1 O=C1C=CC(C=O)=NN1 Amb22497662 [0,1,0,0,0,1|1,0,0]=3 2617 B9R1.1 O=C1C=NC(=CN1)C=O Amb25195744 [0,1,0,0,0,1|1,0,0]=3 2618 B9R1.1 O=C1CCC(=CC1)C=O Amb18642167 [0,1,0,0,0,1|1,0,1]=4 2619 B9R1.1 O=C1NC=C(C=N1)C=O Amb24063042 [0,1,0,0,0,1|2,0,0]=4 2620 B9R1.1 O=Cc1[n]cc(Br)c[n]1 Amb21857013 [0,1,0,0,0,1|1,0,0]=3 2621 B9R1.1 O=Cc1[n]cc(Cl)c[n]1 Amb22276742 [0,1,0,0,0,1|1,0,0]=3 2622 B9R1.1 O=Cc1[n]cc(F)c[n]1 Amb23439727 [0,1,0,0,0,1|1,0,0]=3 2623 B9R1.1 O=Cc1c[n]c(Br)[n]c1 Amb25346680 [0,1,0,0,0,1|2,0,0]=4 2624 B9R1.1 O=Cc1c[n]c(Cl)c[n]1 Amb21962170 [0,1,0,0,0,1|1,0,0]=3 2625 B9R1.1 O=Cc1c[n]c(I)[n]c1 Amb24481675 [0,1,0,0,0,1|2,0,0]=4 2626 B9R1.1 O=Cc1cc[n+](cc1)C Amb10552785 [0,1,0,0,0,1|1,0,0]=3 2627 B9R1.1 O=Cc1ccc(I)[n]c1 Amb22445889 [0,1,0,0,0,1|1,0,0]=3 2628 B9R1.1 O=Cc1ccc(S)[n]c1 Amb23446588 [0,1,0,0,0,1|1,0,0]=3 2629 B9R1.1 O=Cc1ccc(S)cc1 Amb18643289 [0,1,0,0,0,1|1,0,0]=3 2630 B9R1.1 O=Cc1ccc(cc1)Br Amb1880872 [0,1,0,0,0,1|1,0,0]=3 2631 B9R1.1 O=Cc1ccc(cc1)C Amb2447582 [0,1,0,0,0,1|1,0,0]=3 2632 B9R1.1 O=Cc1ccc(cc1)Cl Amb1881691 [0,1,0,0,0,1|1,0,0]=3 2633 B9R1.1 O=Cc1ccc(cc1)O Amb1873769 [0,1,0,0,0,1|1,0,0]=3 2634 B9R1.1 O=Cc1ccc(cn1)Br Amb2447415 [0,1,0,0,0,1|1,0,0]=3 2635 B9R1.1 O=Cc1ccc(cn1)Cl Amb10975428 [0,1,0,0,0,1|1,0,0]=3 2636 B9R1.1 O=Cc1ccc(cn1)F Amb2447570 [0,1,0,0,0,1|1,0,0]=3 2637 B9R1.1 O=Cc1ccc(nc1)Br Amb2447414 [0,1,0,0,0,1|1,0,0]=3 2638 B9R1.1 O=Cc1ccc(nc1)C Amb10603697 [0,1,0,0,0,1|1,0,0]=3 2639 B9R1.1 O=Cc1ccc(nc1)F Amb2447589 [0,1,0,0,0,1|1,0,0]=3 2640 B9R1.1 O=Cc1cnc(nc1)Cl Amb13890624 [0,1,0,0,0,1|2,0,0]=4 2641 B9R1.1 O=Nc1c[n]c(Cl)cc1 Amb24679258 [0,1,0,0,0,1|2,0,0]=4 2642 B9R1.1 O=Nc1ccc(Br)c[n]1 Amb24471213 [0,1,0,0,0,1|2,0,0]=4 2643 B9R1.1 O=Nc1ccc(Cl)c[n]1 Amb24071179 [0,1,0,0,0,1|2,0,0]=4 2644 B9R1.1 O=Nc1ccc(I)c[n]1 Amb24743090 [0,1,0,0,0,1|2,0,0]=4 2645 B9R1.1 O=Nc1ccc(cc1)N Amb17593244 [0,1,0,0,0,1|2,0,0]=4 2646 B9R1.1 O=Nc1ccc(cc1)O Amb10071749 [0,1,0,0,0,1|2,0,0]=4 2647 B9R1.1 O=[13CH]c1ccc(Cl)cc1 Amb22366894 [0,1,0,0,0,1|1,0,0]=3 2648 B9R1.1 O=[13CH]c1ccc(cc1)O Amb17615151 [0,1,0,0,0,1|1,0,0]=3 2649 B9R1.1 O=[As]c1ccc(cc1)N Amb17608246 [0,1,0,0,0,1|2,0,0]=4 2650 B9R1.1 OC=C1C=CC(=O)C=N1 Amb19316321 [0,1,0,0,0,1|1,0,1]=4 2651 B9R1.1 OCC=1C=CC(=O)OC1 Amb25835811 [0,1,0,0,0,1|0,0,2]=4 2652 B9R1.1 O\C=C/1\C=CC(=O)C=N1 Amb24647679 [0,1,0,0,0,1|1,0,1]=4 2653 B9R1.1 Oc1ccc(nn1)C=O Amb10067589 [0,1,0,0,0,1|1,0,0]=3 2654 B9R1.1 [O-][n+]1ccc(C=O)cc1 Amb22338213 [0,1,0,0,0,1|1,0,0]=3 2655 B9R1.2 Brc1cc(C=O)cnc1 Amb2447305 [0,1,0,0,0,1|1,0,0]=3 2656 B9R1.2 Brc1cc(C=O)ncc1 Amb10602645 [0,1,0,0,0,1|1,0,0]=3 2657 B9R1.2 C=CC1=CC=CC(=O)N1 Amb24740217 [0,1,0,0,0,1|2,0,0]=4 2658 B9R1.2 C=CC1CC(=O)C=CO1 Amb22748833 [0,1,0,0,0,1|1,0,1]=4 2659 B9R1.2 C=Cc1[n]c(Cl)cc[n]1 Amb25335481 [0,1,0,0,0,1|2,0,0]=4 2660 B9R1.2 C=Cc1c[n+]([O-])ccc1 Amb25077954 [0,1,0,0,0,1|2,0,0]=4 2661 B9R1.2 C=Cc1c[n]cc(Br)c1 Amb21964484 [0,1,0,0,0,1|2,0,0]=4 2662 B9R1.2 C=Cc1c[n]cc(N)c1 Amb25713325 [0,1,0,0,0,1|2,0,0]=4 2663 B9R1.2 C=Cc1cc(Cl)cc[n]1 Amb20248254 [0,1,0,0,0,1|2,0,0]=4 2664 B9R1.2 C=Cc1cc(N)[n]c[n]1 Amb25293819 [0,1,0,0,0,1|2,0,0]=4 2665 B9R1.2 C=Cc1cc(N)cc[n]1 Amb21857212 [0,1,0,0,0,1|2,0,0]=4 2666 B9R1.2 C=Cc1cc[n]c(Br)c1 Amb21857300 [0,1,0,0,0,1|2,0,0]=4 2667 B9R1.2 C=Cc1cc[n]c(Cl)[n]1 Amb24104269 [0,1,0,0,0,1|2,0,0]=4 2668 B9R1.2 C=Cc1cc[n]c(Cl)c1 Amb25085912 [0,1,0,0,0,1|2,0,0]=4 2669 B9R1.2 C=Cc1cc[n]c(F)c1 Amb22001524 [0,1,0,0,0,1|2,0,0]=4 2670 B9R1.2 C=Cc1cc[n]c(N)[n]1 Amb25108040 [0,1,0,0,0,1|2,0,0]=4 2671 B9R1.2 C=Cc1cc[n]c(N)c1 Amb24070684 [0,1,0,0,0,1|2,0,0]=4 2672 B9R1.2 C=Cc1cc[n]c(O)c1 Amb24711724 [0,1,0,0,0,1|2,0,0]=4 2673 B9R1.2 C=Cc1ccc[n+](c1)C Amb10553005 [0,1,0,0,0,1|2,0,0]=4 2674 B9R1.2 C=Cc1cccc(Br)[n]1 Amb21857281 [0,1,0,0,0,1|2,0,0]=4 2675 B9R1.2 C=Cc1cccc(Cl)[n]1 Amb22276062 [0,1,0,0,0,1|2,0,0]=4 2676 B9R1.2 C=Cc1cccc(F)[n]1 Amb22276063 [0,1,0,0,0,1|2,0,0]=4 2677 B9R1.2 C=Cc1cccc(I)c1 Amb22295906 [0,1,0,0,0,1|2,0,0]=4 2678 B9R1.2 C=Cc1cccc(N)[n]1 Amb25727477 [0,1,0,0,0,1|2,0,0]=4 2679 B9R1.2 C=Cc1cccc(N)c1 Amb21857034 [0,1,0,0,0,1|2,0,0]=4 2680 B9R1.2 C=Cc1cccc(N)c1 Amb21857762 [0,1,0,0,0,1|2,0,0]=4 2681 B9R1.2 C=Cc1cccc(S)c1 Amb25265216 [0,1,0,0,0,1|2,0,0]=4 2682 B9R1.2 C=Cc1cccc(c1)O Amb17593228 [0,1,0,0,0,1|2,0,0]=4 2683 B9R1.2 CC1C=CCC(C=O)=N1 Amb25311680 [0,1,0,0,0,1|1,0,1]=4 2684 B9R1.2 CC=1CC(C=O)OCC1 Amb25717883 [0,1,0,0,0,1|0,0,2]=4 2685 B9R1.2 CN1C=CCC(C=O)=C1 Amb24062329 [0,1,0,0,0,1|1,0,0]=3 2686 B9R1.2 CN1CC=CC(C=O)=C1 Amb25338110 [0,1,0,0,0,1|1,0,1]=4 2687 B9R1.2 C[n+]1cc(C=O)ccc1 Amb25103663 [0,1,0,0,0,1|1,0,0]=3 2688 B9R1.2 Cc1[n]c(C=C)cc[n]1 Amb24670141 [0,1,0,0,0,1|2,0,0]=4 2689 B9R1.2 Cc1[n]c(C=O)c[n][n]1 Amb18124292 [0,1,0,0,0,1|2,0,0]=4 2690 B9R1.2 Cc1c[n]cc(C=C)[n]1 Amb24366704 [0,1,0,0,0,1|2,0,0]=4 2691 B9R1.2 Cc1cc(C=C)[n]c[n]1 Amb24070544 [0,1,0,0,0,1|2,0,0]=4 2692 B9R1.2 Cc1cc(C=C)cc[n]1 Amb24340158 [0,1,0,0,0,1|2,0,0]=4 2693 B9R1.2 Cc1cc(cc[n]1)N=O Amb25832029 [0,1,0,0,0,1|2,0,0]=4 2694 B9R1.2 Cc1cc(ccc1)I=O Amb25312202 [0,1,0,0,0,1|2,0,0]=4 2695 B9R1.2 Cc1cc(ccc1)N=O Amb25843313 [0,1,0,0,0,1|2,0,0]=4 2696 B9R1.2 Cc1cccc(N=O)[n]1 Amb24084835 [0,1,0,0,0,1|2,0,0]=4 2697 B9R1.2 Clc1ccnc(n1)C=O Amb16185712 [0,1,0,0,0,1|1,0,0]=3 2698 B9R1.2 Fc1cc(C=O)cnc1 Amb2447593 [0,1,0,0,0,1|1,0,0]=3 2699 B9R1.2 N=Cc1cccc(O)c1 Amb25273098 [0,1,0,0,0,1|2,0,0]=4 2700 B9R1.2 Nc1[n]c(C=O)c[n][n]1 Amb18832923 [0,1,0,0,0,1|2,0,0]=4 2701 B9R1.2 Nc1c[n]cc(C=O)[n]1 Amb24459794 [0,1,0,0,0,1|1,0,0]=3 2702 B9R1.2 Nc1cc(C=O)[n]c[n]1 Amb25147217 [0,1,0,0,0,1|1,0,0]=3 2703 B9R1.2 Nc1cc(C=O)[n]cc1 Amb25072810 [0,1,0,0,0,1|1,0,0]=3 2704 B9R1.2 Nc1cc(C=O)cc[n]1 Amb24179191 [0,1,0,0,0,1|1,0,0]=3 2705 B9R1.2 O=C1C=C(C=CO1)C=O Amb18642160 [0,1,0,0,0,1|1,0,0]=3 2706 B9R1.2 O=C1C=C(C=NN1)C=O Amb23400498 [0,1,0,0,0,1|2,0,0]=4 2707 B9R1.2 O=C1C=C(C=O)NC=N1 Amb22396538 [0,1,0,0,0,1|1,0,0]=3 2708 B9R1.2 O=C1C=CC=C(C=O)N1 Amb19882313 [0,1,0,0,0,1|1,0,0]=3 2709 B9R1.2 O=C1C=COC(=C1)C=O Amb24636661 [0,1,0,0,0,1|0,0,0]=2 2710 B9R1.2 O=C1CCCC(=C1)C=O Amb18642169 [0,1,0,0,0,1|1,0,1]=4 2711 B9R1.2 O=C1NC(C=CN1)=C=O Amb24468524 [0,1,0,0,0,1|1,0,1]=4 2712 B9R1.2 O=C1NC=CC(=N1)N=O Amb24651408 [0,1,0,0,0,1|2,0,0]=4 2713 B9R1.2 O=C1NC=CC(C=O)=N1 Amb22499756 [0,1,0,0,0,1|1,0,0]=3 2714 B9R1.2 O=C1NC=CC(C=S)=N1 Amb24674179 [0,1,0,0,0,1|1,1,0]=4 2715 B9R1.2 O=CC1CC=CC(=O)O1 Amb18642367 [0,1,0,0,0,1|0,0,1]=3 2716 B9R1.2 O=C[C@H]1CC=CC(=O)C1 Amb25733544 [0,1,0,0,0,1|1,0,1]=4 2717 B9R1.2 O=C[C@H]1CC=CC(=O)O1 Amb25309566 [0,1,0,0,0,1|0,0,1]=3 2718 B9R1.2 O=Cc1[n]c(F)cc[n]1 Amb25746889 [0,1,0,0,0,1|1,0,0]=3 2719 B9R1.2 O=Cc1[n]c[n]c(Cl)[n]1 Amb24756748 [0,1,0,0,0,1|2,0,0]=4 2720 B9R1.2 O=Cc1c[n][n]c(Br)[n]1 Amb18188918 [0,1,0,0,0,1|2,0,0]=4 2721 B9R1.2 O=Cc1c[n][n]c(Cl)[n]1 Amb18202418 [0,1,0,0,0,1|2,0,0]=4 2722 B9R1.2 O=Cc1c[n]cc(Cl)[n]1 Amb21857014 [0,1,0,0,0,1|1,0,0]=3 2723 B9R1.2 O=Cc1c[n]cc(F)[n]1 Amb22388248 [0,1,0,0,0,1|1,0,0]=3 2724 B9R1.2 O=Cc1cc(Cl)[n]c[n]1 Amb20670858 [0,1,0,0,0,1|1,0,0]=3 2725 B9R1.2 O=Cc1cc(F)cc[n]1 Amb21963126 [0,1,0,0,0,1|1,0,0]=3 2726 B9R1.2 O=Cc1cc[n]c(Br)[n]1 Amb24733587 [0,1,0,0,0,1|1,0,0]=3 2727 B9R1.2 O=Cc1cc[n]c(Cl)c1 Amb22831477 [0,1,0,0,0,1|1,0,0]=3 2728 B9R1.2 O=Cc1cc[n]c(F)[n]1 Amb25287821 [0,1,0,0,0,1|1,0,0]=3 2729 B9R1.2 O=Cc1cc[n]c(I)c1 Amb25377215 [0,1,0,0,0,1|1,0,0]=3 2730 B9R1.2 O=Cc1cc[n]c(S)[n]1 Amb18202872 [0,1,0,0,0,1|1,0,0]=3 2731 B9R1.2 O=Cc1cccc(I)[n]1 Amb24611045 [0,1,0,0,0,1|1,0,0]=3 2732 B9R1.2 O=Cc1cccc(c1)Br Amb1232086 [0,1,0,0,0,1|1,0,0]=3 2733 B9R1.2 O=Cc1cccc(c1)I Amb1033003 [0,1,0,0,0,1|1,0,0]=3 2734 B9R1.2 O=Cc1cccc(c1)O Amb1880871 [0,1,0,0,0,1|1,0,0]=3 2735 B9R1.2 O=Cc1cccc(c1)S Amb13952077 [0,1,0,0,0,1|1,0,0]=3 2736 B9R1.2 O=Cc1cccc(n1)N Amb16231443 [0,1,0,0,0,1|1,0,0]=3 2737 B9R1.2 O=Cc1ccnc(c1)Br Amb2455911 [0,1,0,0,0,1|1,0,0]=3 2738 B9R1.2 O=Cc1ccnc(c1)C Amb16231936 [0,1,0,0,0,1|1,0,0]=3 2739 B9R1.2 O=Cc1ccnc(c1)Cl Amb2447585 [0,1,0,0,0,1|1,0,0]=3 2740 B9R1.2 O=Cc1ccnc(c1)N Amb16231973 [0,1,0,0,0,1|1,0,0]=3 2741 B9R1.2 O=Nc1cc(Cl)[n]c[n]1 Amb24091399 [0,1,0,0,0,1|2,0,0]=4 2742 B9R1.2 Oc1cc(C=O)c[n]c1 Amb19895145 [0,1,0,0,0,1|1,0,0]=3 2743 B9R1.2 Oc1cccc(C=O)[n]1 Amb20247934 [0,1,0,0,0,1|1,0,0]=3 2744 B9R1.2 [O-][n+]1cc(C=O)ccc1 Amb22263067 [0,1,0,0,0,1|1,0,0]=3 2745 B9R1.6 BrC(=C)c1ccccn1 Amb2447497 [0,1,0,0,0,1|2,0,0]=4 2746 B9R1.6 C=C(Br)c1cc[n]cc1 Amb24710590 [0,1,0,0,0,1|2,0,0]=4 2747 B9R1.6 C=C(Cl)c1cc[n]cc1 Amb24102656 [0,1,0,0,0,1|2,0,0]=4 2748 B9R1.6 C=C(Cl)c1ccc[n]c1 Amb24085113 [0,1,0,0,0,1|2,0,0]=4 2749 B9R1.6 C=C(Cl)c1cccc[n]1 Amb24069950 [0,1,0,0,0,1|2,0,0]=4 2750 B9R1.6 C=C(F)c1cc[n]cc1 Amb20248442 [0,1,0,0,0,1|2,0,0]=4 2751 B9R1.6 C=C(F)c1ccc[n]c1 Amb20248553 [0,1,0,0,0,1|2,0,0]=4 2752 B9R1.6 C=C(F)c1cccc[n]1 Amb20248373 [0,1,0,0,0,1|2,0,0]=4 2753 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [0,1,0,0,0,1|2,0,0]=4 2754 B9R1.6 C=C([Zn+])c1ccccc1 Amb22228006 [0,1,0,0,0,1|2,0,0]=4 2755 B9R1.6 CC(=C)c1[n]ccc[n]1 Amb24084451 [0,1,0,0,0,1|2,0,0]=4 2756 B9R1.6 CC(=C)c1cc[n]cc1 Amb25126374 [0,1,0,0,0,1|2,0,0]=4 2757 B9R1.6 CC(=C)c1cccc[n]1 Amb25077592 [0,1,0,0,0,1|2,0,0]=4 2758 B9R1.6 CC(=C)c1ccccc1 Amb22338342 [0,1,0,0,0,1|2,0,0]=4 2759 B9R1.6 CC(=C)c1ccccc1 Amb22338444 [0,1,0,0,0,1|2,0,0]=4 2760 B9R1.6 CC(=N)c1cc[n]cc1 Amb24478617 [0,1,0,0,0,1|2,0,0]=4 2761 B9R1.6 CC(=N)c1ccc[n]c1 Amb22170296 [0,1,0,0,0,1|2,0,0]=4 2762 B9R1.6 CC(=O)C1=CC=CCS1 Amb24582465 [0,1,0,0,0,1|0,1,0]=3 2763 B9R1.6 CC(=O)C1=COCCO1 Amb20669275 [0,1,0,0,0,1|0,0,2]=4 2764 B9R1.6 CC(=O)C1C=CNC=C1 Amb24707722 [0,1,0,0,0,1|1,0,1]=4 2765 B9R1.6 CC(=O)C1CCC=CO1 Amb24650635 [0,1,0,0,0,1|0,0,2]=4 2766 B9R1.6 CC(=O)C=1CCC=CC1 Amb22232236 [0,1,0,0,0,1|1,0,0]=3 2767 B9R1.6 CC(=O)C=1CNC=CC1 Amb25700322 [0,1,0,0,0,1|1,0,0]=3 2768 B9R1.6 CC(=O)[C@H]1CCC=CO1 Amb25349063 [0,1,0,0,0,1|0,0,2]=4 2769 B9R1.6 CC(=O)[n+]1ccccc1 Amb24692607 [0,1,0,0,0,1|2,0,0]=4 2770 B9R1.6 CC(=O)c1c[n][n]c[n]1 Amb18203342 [0,1,0,0,0,1|2,0,0]=4 2771 B9R1.6 CC(=O)c1c[n]c[n][n]1 Amb18832971 [0,1,0,0,0,1|2,0,0]=4 2772 B9R1.6 CC(=O)c1cc[n][n]c1 Amb19958070 [0,1,0,0,0,1|2,0,0]=4 2773 B9R1.6 CC(=O)c1cc[n]c[n]1 Amb19959228 [0,1,0,0,0,1|1,0,0]=3 2774 B9R1.6 CC(=O)c1ccc[nH+]c1 Amb10552777 [0,1,0,0,0,1|1,0,0]=3 2775 B9R1.6 CC(=O)c1ccc[n][n]1 Amb20242017 [0,1,0,0,0,1|1,0,0]=3 2776 B9R1.6 CC(=O)c1cccc[nH+]1 Amb10552776 [0,1,0,0,0,1|1,0,0]=3 2777 B9R1.6 CC(=S)c1c[n]cc[n]1 Amb24354640 [0,1,0,0,0,1|1,1,0]=4 2778 B9R1.6 CP(=O)c1ccccc1 Amb21858071 [0,1,0,0,0,1|2,0,0]=4 2779 B9R1.6 CS(=O)c1c[n]ccc1 Amb24102456 [0,1,0,0,0,1|2,0,0]=4 2780 B9R1.6 CS(=O)c1cc[n]c[n]1 Amb24103017 [0,1,0,0,0,1|2,0,0]=4 2781 B9R1.6 CS(=O)c1cc[n]cc1 Amb24103016 [0,1,0,0,0,1|2,0,0]=4 2782 B9R1.6 CS(=O)c1cccc[n]1 Amb24562247 [0,1,0,0,0,1|2,0,0]=4 2783 B9R1.6 C[13C](=O)c1ccccc1 Amb22337854 [0,1,0,0,0,1|1,0,0]=3 2784 B9R1.6 C[S@@](=O)c1ccccc1 Amb22747474 [0,1,0,0,0,1|2,0,0]=4 2785 B9R1.6 C[Si](=O)c1ccccc1 Amb22053625 [0,1,0,0,0,1|1,1,0]=4 2786 B9R1.6 ClC(=O)C1=COCCO1 Amb10879700 [0,1,0,0,0,1|0,0,2]=4 2787 B9R1.6 ClC(=O)c1cnccn1 Amb2455965 [0,1,0,0,0,1|1,0,0]=3 2788 B9R1.6 ClS(=O)c1ccccc1 Amb13881360 [0,1,0,0,0,1|2,0,0]=4 2789 B9R1.6 FC(=O)c1ccccc1 Amb10607152 [0,1,0,0,0,1|1,0,0]=3 2790 B9R1.6 N=C(/N)\c1cc[n]cc1 Amb20243353 [0,1,0,0,0,1|2,0,0]=4 2791 B9R1.6 N=C(Cl)c1cccc[n]1 Amb24061333 [0,1,0,0,0,1|2,0,0]=4 2792 B9R1.6 N=C(O)c1c[n]cc[n]1 Amb22166847 [0,1,0,0,0,1|1,0,1]=4 2793 B9R1.6 NC(=N)c1[n]ccc[n]1 Amb22899134 [0,1,0,0,0,1|2,0,0]=4 2794 B9R1.6 NC(=N)c1c[n]cc[n]1 Amb22489518 [0,1,0,0,0,1|2,0,0]=4 2795 B9R1.6 NC(=N)c1cc[nH+]cc1 Amb22734887 [0,1,0,0,0,1|2,0,0]=4 2796 B9R1.6 NC(=N)c1cc[n]c[n]1 Amb22292200 [0,1,0,0,0,1|2,0,0]=4 2797 B9R1.6 NC(=N)c1cc[n]c[n]1 Amb24099639 [0,1,0,0,0,1|2,0,0]=4 2798 B9R1.6 NC(=N)c1cc[n]cc1 Amb24180789 [0,1,0,0,0,1|2,0,0]=4 2799 B9R1.6 NC(=N)c1ccc[nH+]c1 Amb22166890 [0,1,0,0,0,1|2,0,0]=4 2800 B9R1.6 NC(=N)c1ccc[n]c1 Amb21955334 [0,1,0,0,0,1|2,0,0]=4 2801 B9R1.6 NC(=N)c1cccc[n]1 Amb22343442 [0,1,0,0,0,1|2,0,0]=4 2802 B9R1.6 NC(=N)c1ccccc1 Amb10068704 [0,1,0,0,0,1|2,0,0]=4 2803 B9R1.6 NC(=N)c1ccccc1 Amb2371546 [0,1,0,0,0,1|2,0,0]=4 2804 B9R1.6 NC(=N)c1ncccn1 Amb13951992 [0,1,0,0,0,1|2,0,0]=4 2805 B9R1.6 NC(=O)C1=CCCCO1 Amb23585657 [0,1,0,0,0,1|0,0,2]=4 2806 B9R1.6 NC(=O)C1=COCCO1 Amb24560922 [0,1,0,0,0,1|0,0,2]=4 2807 B9R1.6 NC(=O)C1CC=CC=N1 Amb25032101 [0,1,0,0,0,1|1,0,1]=4 2808 B9R1.6 NC(=O)C1CC=CCO1 Amb25378814 [0,1,0,0,0,1|0,0,2]=4 2809 B9R1.6 NC(=O)C1CCC=CO1 Amb24061614 [0,1,0,0,0,1|0,0,2]=4 2810 B9R1.6 NC(=O)C=1C=COCC1 Amb25662817 [0,1,0,0,0,1|1,0,1]=4 2811 B9R1.6 NC(=O)C=1CC=CNC1 Amb24574438 [0,1,0,0,0,1|1,0,0]=3 2812 B9R1.6 NC(=O)N1CC=CCO1 Amb24655392 [0,1,0,0,0,1|1,0,1]=4 2813 B9R1.6 NC(=O)[C@H]1CCC=CO1 Amb25229284 [0,1,0,0,0,1|0,0,2]=4 2814 B9R1.6 NC(=O)c1c[n][n]c[n]1 Amb24349739 [0,1,0,0,0,1|2,0,0]=4 2815 B9R1.6 NC(=O)c1cc[n][n]c1 Amb22235791 [0,1,0,0,0,1|2,0,0]=4 2816 B9R1.6 NC(=O)c1cc[n]c[n]1 Amb24074283 [0,1,0,0,0,1|1,0,0]=3 2817 B9R1.6 NC(=O)c1cc[n]cc1 Amb24066211 [0,1,0,0,0,1|1,0,0]=3 2818 B9R1.6 NC(=O)c1ccc[n][n]1 Amb22499430 [0,1,0,0,0,1|1,0,0]=3 2819 B9R1.6 NC(=O)c1cccc[p]1 Amb25353307 [0,1,0,0,0,1|1,0,0]=3 2820 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [0,1,0,0,0,1|1,0,0]=3 2821 B9R1.6 NC(=O)c1cccnc1 Amb16231206 [0,1,0,0,0,1|1,0,0]=3 2822 B9R1.6 NC(=S)c1cc[n]c[n]1 Amb21933379 [0,1,0,0,0,1|1,1,0]=4 2823 B9R1.6 NC(=S)c1cccnc1 Amb1152408 [0,1,0,0,0,1|1,1,0]=4 2824 B9R1.6 NC(=S)c1cccnn1 Amb10070425 [0,1,0,0,0,1|1,1,0]=4 2825 B9R1.6 NC(=S)c1ccncc1 Amb1397718 [0,1,0,0,0,1|1,1,0]=4 2826 B9R1.6 NC(=[NH2+])c1ccccn1 Amb16233715 [0,1,0,0,0,1|2,0,0]=4 2827 B9R1.6 N[13C](=O)c1ccccc1 Amb22351604 [0,1,0,0,0,1|1,0,0]=3 2828 B9R1.6 O=C(Br)c1cc[n]cc1 Amb24536581 [0,1,0,0,0,1|1,0,0]=3 2829 B9R1.6 O=C(Cl)C1CC=COC1 Amb25189711 [0,1,0,0,0,1|0,0,2]=4 2830 B9R1.6 O=C(Cl)C1CCC=CO1 Amb24636010 [0,1,0,0,0,1|0,0,2]=4 2831 B9R1.6 O=C(Cl)c1[n]ccc[n]1 Amb24056588 [0,1,0,0,0,1|1,0,0]=3 2832 B9R1.6 O=C(Cl)c1c[n]cc[n]1 Amb21954009 [0,1,0,0,0,1|1,0,0]=3 2833 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [0,1,0,0,0,1|1,0,0]=3 2834 B9R1.6 O=C(Cl)c1cc[n]c[n]1 Amb19895573 [0,1,0,0,0,1|1,0,0]=3 2835 B9R1.6 O=C(Cl)c1ccc[n][n]1 Amb24062270 [0,1,0,0,0,1|1,0,0]=3 2836 B9R1.6 O=C(Cl)c1cccc[n]1 Amb22492448 [0,1,0,0,0,1|1,0,0]=3 2837 B9R1.6 O=C(F)c1ccc[n]c1 Amb25146722 [0,1,0,0,0,1|1,0,0]=3 2838 B9R1.6 O=N(=O)c1cc[n]cc1 Amb20621911 [0,1,0,0,0,1|2,0,0]=4 2839 B9R1.6 O=S(Cl)c1c[n]ccc1 Amb25347198 [0,1,0,0,0,1|2,0,0]=4 2840 B9R1.6 O=[13C](Cl)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054407 [0,1,0,0,0,1|1,0,0]=3 2841 B9R1.6 O=[13C](Cl)c1ccccc1 Amb22167795 [0,1,0,0,0,1|1,0,0]=3 2842 B9R1.6 OC(=O)C1=CC=CCS1 Amb22831443 [0,1,0,0,0,1|0,1,0]=3 2843 B9R1.6 OC(=O)C1=COC=CO1 Amb25305603 [0,1,0,0,0,1|0,0,0]=2 2844 B9R1.6 OC(=O)C1=COCCO1 Amb1106470 [0,1,0,0,0,1|0,0,2]=4 2845 B9R1.6 OC(=O)C1=CSCCO1 Amb20455323 [0,1,0,0,0,1|0,0,2]=4 2846 B9R1.6 OC(=O)C1C=CC=CN1 Amb24746571 [0,1,0,0,0,1|1,0,1]=4 2847 B9R1.6 OC(=O)C1C=CC=CO1 Amb18642363 [0,1,0,0,0,1|0,0,1]=3 2848 B9R1.6 OC(=O)C1C=CCC=C1 Amb17593268 [0,1,0,0,0,1|1,0,1]=4 2849 B9R1.6 OC(=O)C1C=CNC=C1 Amb24099560 [0,1,0,0,0,1|1,0,1]=4 2850 B9R1.6 OC(=O)C1CC=CC=N1 Amb25246673 [0,1,0,0,0,1|1,0,1]=4 2851 B9R1.6 OC(=O)C1CC=CCO1 Amb18642584 [0,1,0,0,0,1|0,0,2]=4 2852 B9R1.6 OC(=O)C1CCC=CO1 Amb10071565 [0,1,0,0,0,1|0,0,2]=4 2853 B9R1.6 OC(=O)C=1CC=CNC1 Amb25293556 [0,1,0,0,0,1|1,0,0]=3 2854 B9R1.6 OC(=O)C=1CNC=CC1 Amb25823057 [0,1,0,0,0,1|1,0,0]=3 2855 B9R1.6 OC(=O)C=1COCCC1 Amb19958529 [0,1,0,0,0,1|0,0,2]=4 2856 B9R1.6 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054405 [0,1,0,0,0,1|1,0,0]=3 2857 B9R1.6 OC(=O)[13c]1ccccc1 Amb22353371 [0,1,0,0,0,1|1,0,0]=3 2858 B9R1.6 OC(=O)[C@@H]1C=CCNO1 Amb24541147 [0,1,0,0,0,1|0,0,2]=4 2859 B9R1.6 OC(=O)[C@H]1CC=CCO1 Amb24455780 [0,1,0,0,0,1|0,0,2]=4 2860 B9R1.6 OC(=O)c1[n]ccc[n]1 Amb19330380 [0,1,0,0,0,1|1,0,0]=3 2861 B9R1.6 OC(=O)c1c[n]c[n][n]1 Amb18832864 [0,1,0,0,0,1|2,0,0]=4 2862 B9R1.6 OC(=O)c1c[n]c[n]c1 Amb24099331 [0,1,0,0,0,1|2,0,0]=4 2863 B9R1.6 OC(=O)c1cc[13cH]cc1 Amb22367544 [0,1,0,0,0,1|1,0,0]=3 2864 B9R1.6 OC(=O)c1ccccc1 Amb16232256 [0,1,0,0,0,1|1,0,0]=3 2865 B9R1.6 OC(=O)c1ccccc1 Amb1935196 [0,1,0,0,0,1|1,0,0]=3 2866 B9R1.6 OC(=O)c1ccccc1 Amb22002523 [0,1,0,0,0,1|1,0,0]=3 2867 B9R1.6 OC(=O)c1ccccc1 Amb22279605 [0,1,0,0,0,1|1,0,0]=3 2868 B9R1.6 OC(=O)c1ccccc1 Amb22336602 [0,1,0,0,0,1|1,0,0]=3 2869 B9R1.6 OC(=O)c1ccccc1 Amb22338105 [0,1,0,0,0,1|1,0,0]=3 2870 B9R1.6 OC(=O)c1ccccc1 Amb22351742 [0,1,0,0,0,1|1,0,0]=3 2871 B9R1.6 OC(=O)c1ccccc1 Amb22472602 [0,1,0,0,0,1|1,0,0]=3 2872 B9R1.6 OC(=O)c1ccccc1 Amb22491636 [0,1,0,0,0,1|1,0,0]=3 2873 B9R1.6 OC(=O)c1ccccn1 Amb1227737 [0,1,0,0,0,1|1,0,0]=3 2874 B9R1.6 OC(=O)c1cccnc1 Amb1195995 [0,1,0,0,0,1|1,0,0]=3 2875 B9R1.6 OC(=O)c1ccncn1 Amb1102414 [0,1,0,0,0,1|1,0,0]=3 2876 B9R1.6 OC(=O)c1cnccn1 Amb2455963 [0,1,0,0,0,1|1,0,0]=3 2877 B9R1.6 OC(=O)c1cncnc1 Amb2455830 [0,1,0,0,0,1|2,0,0]=4 2878 B9R1.6 OC(=S)c1ccc[n]c1 Amb22731908 [0,1,0,0,0,1|1,0,1]=4 2879 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [0,1,0,0,0,1|1,0,1]=4 2880 B9R1.6 OP(=O)c1ccccc1 Amb10571098 [0,1,0,0,0,1|2,0,0]=4 2881 B9R1.6 OS(=O)c1[n]ccc[n]1 Amb24061346 [0,1,0,0,0,1|2,0,0]=4 2882 B9R1.6 OS(=O)c1c[n]ccc1 Amb24062548 [0,1,0,0,0,1|2,0,0]=4 2883 B9R1.6 OS(=O)c1cc[n]cc1 Amb24099594 [0,1,0,0,0,1|2,0,0]=4 2884 B9R1.6 OS(=O)c1ccccc1 Amb17939345 [0,1,0,0,0,1|2,0,0]=4 2885 B9R1.6 O[12C](=O)[12c]1[12cH][12cH][12cH][12cH][12cH]1 Amb22338193 [0,1,0,0,0,1|1,0,0]=3 2886 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367547 [0,1,0,0,0,1|1,0,0]=3 2887 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1 Amb17618353 [0,1,0,0,0,1|1,0,0]=3 2888 B9R1.6 O[13C](=O)c1ccccc1 Amb22338753 [0,1,0,0,0,1|1,0,0]=3 2889 B9R1.6 O[14C](=O)c1ccccc1 Amb22352700 [0,1,0,0,0,1|1,0,0]=3 2890 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [0,1,0,0,0,1|1,1,0]=4 2891 B9R1.6 SC(=S)c1ccccc1 Amb22051683 [0,1,0,0,0,1|1,1,0]=4 2892 B9R1.6 [13CH3]C(=O)c1ccccc1 Amb22353264 [0,1,0,0,0,1|1,0,0]=3 2893 B9R1.6 [13CH3][13C](=O)c1ccccc1 Amb22366852 [0,1,0,0,0,1|1,0,0]=3 2894 B9R1.6 [15NH2]C(=O)c1ccc[n]c1 Amb22367445 [0,1,0,0,0,1|1,0,0]=3 2895 B9R1.6 [15NH2]C(=O)c1ccccc1 Amb22366901 [0,1,0,0,0,1|1,0,0]=3 2896 B9R1.6 [2H]C(=C)c1ccccc1 Amb22337758 [0,1,0,0,0,1|2,0,0]=4 2897 B9R1.6 [2H]C(=O)c1ccccc1 Amb22043987 [0,1,0,0,0,1|1,0,0]=3 2898 B9R1.6 [2H][13C](=O)c1ccccc1 Amb22369001 [0,1,0,0,0,1|1,0,0]=3 2899 B9R1.6 [CH2-]C(=O)c1c[n]cc[n]1 Amb25692527 [0,1,0,0,0,1|1,0,0]=3 2900 B9R1.6 [CH2-]C(=O)c1cc[n]c[n]1 Amb25373169 [0,1,0,0,0,1|1,0,0]=3 2901 B9R1.6 [CH2-]C(=O)c1ccc[n][n]1 Amb24631590 [0,1,0,0,0,1|1,0,0]=3 2902 B9R1.6 [CH2-]C(=O)c1ccc[n]c1 Amb25692916 [0,1,0,0,0,1|1,0,0]=3 2903 B9R1.6 [O-]C(=O)C1CCC=CO1 Amb22002689 [0,1,0,0,0,1|0,0,2]=4 2904 B9R1.6 [O-]C(=O)c1[n][n]cc[n]1 Amb24056387 [0,1,0,0,0,1|2,0,0]=4 2905 B9R1.6 [O-]C(=O)c1[n]ccc[n]1 Amb22643200 [0,1,0,0,0,1|1,0,0]=3 2906 B9R1.6 [O-]C(=O)c1c[n]cc[n]1 Amb21928015 [0,1,0,0,0,1|1,0,0]=3 2907 B9R1.6 [O-]C(=O)c1cc[n]c[n]1 Amb22057356 [0,1,0,0,0,1|1,0,0]=3 2908 B9R1.6 [O-]C(=O)c1cc[n]cc1 Amb22730239 [0,1,0,0,0,1|1,0,0]=3 2909 B9R1.6 [O-]C(=O)c1ccc[n]c1 Amb22043320 [0,1,0,0,0,1|1,0,0]=3 2910 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22058087 [0,1,0,0,0,1|1,0,0]=3 2911 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22411648 [0,1,0,0,0,1|1,0,0]=3 2912 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22734923 [0,1,0,0,0,1|1,0,0]=3 2913 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053472 [0,1,0,0,0,1|1,0,0]=3 2914 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053705 [0,1,0,0,0,1|1,0,0]=3 2915 B9R1.6 [O-]C(=O)c1ccccc1 Amb22167689 [0,1,0,0,0,1|1,0,0]=3 2916 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168438 [0,1,0,0,0,1|1,0,0]=3 2917 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168439 [0,1,0,0,0,1|1,0,0]=3 2918 B9R1.6 [O-]C(=O)c1ccccc1 Amb22351958 [0,1,0,0,0,1|1,0,0]=3 2919 B9R1.6 [O-]C(=O)c1ccccc1 Amb22353183 [0,1,0,0,0,1|1,0,0]=3 2920 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732264 [0,1,0,0,0,1|1,0,0]=3 2921 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732273 [0,1,0,0,0,1|1,0,0]=3 2922 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732500 [0,1,0,0,0,1|1,0,0]=3 2923 B9R1.6 [O-]C(=O)c1ccccc1 Amb22734002 [0,1,0,0,0,1|1,0,0]=3 2924 B9R1.6 [O-]P(=O)c1ccccc1 Amb21618955 [0,1,0,0,0,1|2,0,0]=4 2925 B9R1.6 [O-]S(=O)c1cccc[n]1 Amb22751253 [0,1,0,0,0,1|2,0,0]=4 2926 B9R1.6 [O-]S(=O)c1ccccc1 Amb10790483 [0,1,0,0,0,1|2,0,0]=4 2927 B9R1.6 [O-]S(=O)c1ccccc1 Amb22043426 [0,1,0,0,0,1|2,0,0]=4 2928 B9R1.6 [O-]S(=O)c1ccccc1 Amb22053867 [0,1,0,0,0,1|2,0,0]=4 2929 B9R1.6 [O-]S(=O)c1ccccc1 Amb22352998 [0,1,0,0,0,1|2,0,0]=4 2930 B9R1.6 [O-][15N+](=O)c1ccccc1 Amb22351461 [0,1,0,0,0,1|2,0,0]=4 2931 B9R1.6 [O-][N+](=O)C1=CC=CCN1 Amb24753159 [0,1,0,0,0,1|2,0,0]=4 2932 B9R1.6 [O-][N+](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351475 [0,1,0,0,0,1|2,0,0]=4 2933 B9R1.6 [O-][N+](=O)c1[n]ccc[n]1 Amb24084906 [0,1,0,0,0,1|2,0,0]=4 2934 B9R1.6 [O-][N+](=O)c1c[n]cc[n]1 Amb25129450 [0,1,0,0,0,1|2,0,0]=4 2935 B9R1.6 [O-][N+](=O)c1cc[n]c[n]1 Amb24070596 [0,1,0,0,0,1|2,0,0]=4 2936 B9R1.6 [O-][N+](=O)c1ccc[n][n]1 Amb20669697 [0,1,0,0,0,1|2,0,0]=4 2937 B9R1.6 [O-][N+](=O)c1ccccc1 Amb24061309 [0,1,0,0,0,1|2,0,0]=4 2938 B9R1.6 [O-][P](=O)c1ccccc1 Amb22731674 [0,1,0,0,0,1|2,0,0]=4 2939 B9R1.6 [S-]C(=O)c1ccccc1 Amb10555187 [0,1,0,0,0,1|1,0,0]=3 2940 B9R1.8 Br\C=C/c1c[n]ccc1 Amb24085678 [0,1,0,0,0,1|2,0,0]=4 2941 B9R1.8 Br\C=C/c1cc[n]cc1 Amb25074029 [0,1,0,0,0,1|2,0,0]=4 2942 B9R1.8 Br\C=C/c1cccc[n]1 Amb25200984 [0,1,0,0,0,1|2,0,0]=4 2943 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [0,1,0,0,0,1|2,0,0]=4 2944 B9R1.8 Br\C=C\c1c[n]ccc1 Amb24085662 [0,1,0,0,0,1|2,0,0]=4 2945 B9R1.8 Br\C=C\c1cccc[n]1 Amb24546348 [0,1,0,0,0,1|2,0,0]=4 2946 B9R1.8 C=C=Cc1c[n]ccc1 Amb24102495 [0,1,0,0,0,1|2,0,0]=4 2947 B9R1.8 C=CCc1c[n]cc[n]1 Amb24365743 [0,1,0,0,0,1|2,0,0]=4 2948 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [0,1,0,0,0,1|2,0,0]=4 2949 B9R1.8 C=CCc1cc[n]c[n]1 Amb24091172 [0,1,0,0,0,1|2,0,0]=4 2950 B9R1.8 C=CNc1ccccc1 Amb24476658 [0,1,0,0,0,1|2,0,0]=4 2951 B9R1.8 C=COc1c[n]ccc1 Amb24085952 [0,1,0,0,0,1|2,0,0]=4 2952 B9R1.8 C=COc1cc[n]cc1 Amb24091446 [0,1,0,0,0,1|2,0,0]=4 2953 B9R1.8 C=COc1ccccc1 Amb10564213 [0,1,0,0,0,1|2,0,0]=4 2954 B9R1.8 C=CSc1[n]ccc[n]1 Amb22896416 [0,1,0,0,0,1|2,0,0]=4 2955 B9R1.8 C=CSc1c[n]ccc1 Amb24102618 [0,1,0,0,0,1|2,0,0]=4 2956 B9R1.8 C=CSc1cc[n]cc1 Amb24070689 [0,1,0,0,0,1|2,0,0]=4 2957 B9R1.8 C=C\C=C\1/C=CC=CN1 Amb24691445 [0,1,0,0,0,1|2,0,0]=4 2958 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [0,1,0,0,0,1|2,0,0]=4 2959 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [0,1,0,0,0,1|2,0,0]=4 2960 B9R1.8 C\C=C\c1[n]ccc[n]1 Amb24101878 [0,1,0,0,0,1|2,0,0]=4 2961 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [0,1,0,0,0,1|2,0,0]=4 2962 B9R1.8 C\C=N\c1cccc[n]1 Amb24533295 [0,1,0,0,0,1|2,0,0]=4 2963 B9R1.8 C\N=C/c1cccc[n]1 Amb25337459 [0,1,0,0,0,1|2,0,0]=4 2964 B9R1.8 C\N=C\c1c[n]ccc1 Amb21962079 [0,1,0,0,0,1|2,0,0]=4 2965 B9R1.8 C\N=C\c1cc[n]cc1 Amb22330508 [0,1,0,0,0,1|2,0,0]=4 2966 B9R1.8 C\N=C\c1cccc[n]1 Amb24553183 [0,1,0,0,0,1|2,0,0]=4 2967 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [0,1,0,0,0,1|2,0,0]=4 2968 B9R1.8 Cl\C=C/c1c[n]ccc1 Amb24085684 [0,1,0,0,0,1|2,0,0]=4 2969 B9R1.8 Cl\C=C/c1cc[n]cc1 Amb24103276 [0,1,0,0,0,1|2,0,0]=4 2970 B9R1.8 Cl\C=C/c1cccc[n]1 Amb24106765 [0,1,0,0,0,1|2,0,0]=4 2971 B9R1.8 Cl\C=C\c1cccc[n]1 Amb24106741 [0,1,0,0,0,1|2,0,0]=4 2972 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [0,1,0,0,0,1|2,0,0]=4 2973 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [0,1,0,0,0,1|2,0,0]=4 2974 B9R1.8 Cl\N=C\c1c[n]ccc1 Amb24096978 [0,1,0,0,0,1|2,0,0]=4 2975 B9R1.8 Cl\N=C\c1cc[n]cc1 Amb24096987 [0,1,0,0,0,1|2,0,0]=4 2976 B9R1.8 Cl\N=C\c1cccc[n]1 Amb24096969 [0,1,0,0,0,1|2,0,0]=4 2977 B9R1.8 F\C=C/c1cccc[n]1 Amb24106770 [0,1,0,0,0,1|2,0,0]=4 2978 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [0,1,0,0,0,1|2,0,0]=4 2979 B9R1.8 I\C=C\c1c[n]ccc1 Amb24628558 [0,1,0,0,0,1|2,0,0]=4 2980 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [0,1,0,0,0,1|2,0,0]=4 2981 B9R1.8 N=CNc1[n]ccc[n]1 Amb24073528 [0,1,0,0,0,1|2,0,0]=4 2982 B9R1.8 N=CNc1cccc[n]1 Amb24073535 [0,1,0,0,0,1|2,0,0]=4 2983 B9R1.8 NN=Cc1c[n]ccc1 Amb24082007 [0,1,0,0,0,1|2,0,0]=4 2984 B9R1.8 N\C=C/c1cc[n]cc1 Amb24068867 [0,1,0,0,0,1|2,0,0]=4 2985 B9R1.8 N\C=C\c1cc[n]cc1 Amb24749618 [0,1,0,0,0,1|2,0,0]=4 2986 B9R1.8 N\C=C\c1cccc[n]1 Amb24518526 [0,1,0,0,0,1|2,0,0]=4 2987 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [0,1,0,0,0,1|2,0,0]=4 2988 B9R1.8 N\N=C/c1cc[n]cc1 Amb25146897 [0,1,0,0,0,1|2,0,0]=4 2989 B9R1.8 N\N=C\c1cc[n]c[n]1 Amb24571961 [0,1,0,0,0,1|2,0,0]=4 2990 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [0,1,0,0,0,1|2,0,0]=4 2991 B9R1.8 O=C=Cc1cc[n]cc1 Amb24100723 [0,1,0,0,0,1|1,0,0]=3 2992 B9R1.8 O=C=Cc1cccc[n]1 Amb24070207 [0,1,0,0,0,1|1,0,0]=3 2993 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [0,1,0,0,0,1|1,0,0]=3 2994 B9R1.8 O=C=Nc1c[n]cc[n]1 Amb25102566 [0,1,0,0,0,1|1,0,1]=4 2995 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [0,1,0,0,0,1|1,0,1]=4 2996 B9R1.8 O=C=Nc1ncccn1 Amb10601979 [0,1,0,0,0,1|1,0,1]=4 2997 B9R1.8 O=CCc1[n]ccc[n]1 Amb24061341 [0,1,0,0,0,1|1,0,0]=3 2998 B9R1.8 O=CCc1c[n]c[n]c1 Amb24634482 [0,1,0,0,0,1|2,0,0]=4 2999 B9R1.8 O=CCc1c[n]cc[n]1 Amb25124492 [0,1,0,0,0,1|1,0,0]=3 3000 B9R1.8 O=CCc1cc[n]c[n]1 Amb24099612 [0,1,0,0,0,1|1,0,0]=3 3001 B9R1.8 O=CCc1ccc[n][n]1 Amb24682971 [0,1,0,0,0,1|1,0,0]=3 3002 B9R1.8 O=CCc1ccccn1 Amb17089528 [0,1,0,0,0,1|1,0,0]=3 3003 B9R1.8 O=CCc1ccncc1 Amb17089529 [0,1,0,0,0,1|1,0,0]=3 3004 B9R1.8 O=CNc1[n]c[n]c[n]1 Amb24476859 [0,1,0,0,0,1|2,0,0]=4 3005 B9R1.8 O=CNc1c[n]c[n]c1 Amb24095248 [0,1,0,0,0,1|2,0,0]=4 3006 B9R1.8 O=CNc1c[n]cc[n]1 Amb24698276 [0,1,0,0,0,1|1,0,0]=3 3007 B9R1.8 O=COc1c[n]ccc1 Amb25299157 [0,1,0,0,0,1|1,0,0]=3 3008 B9R1.8 O=COc1ccccc1 Amb22002710 [0,1,0,0,0,1|1,0,0]=3 3009 B9R1.8 O=C\C=C/1\C=CC=CN1 Amb24068319 [0,1,0,0,0,1|1,0,0]=3 3010 B9R1.8 O=C\C=C/1\C=CNC=N1 Amb24068339 [0,1,0,0,0,1|1,0,0]=3 3011 B9R1.8 O=C\C=C/1\CC=CCC1 Amb18642056 [0,1,0,0,0,1|1,0,1]=4 3012 B9R1.8 O=C\C=C/1\CCCC=C1 Amb24654989 [0,1,0,0,0,1|1,0,1]=4 3013 B9R1.8 O=C\C=C\1/C=CC=NN1 Amb24596682 [0,1,0,0,0,1|1,0,0]=3 3014 B9R1.8 O=C\C=C\1/CC=CCC1 Amb24513021 [0,1,0,0,0,1|1,0,1]=4 3015 B9R1.8 O=C\C=C\1/CCCC=C1 Amb18642057 [0,1,0,0,0,1|1,0,1]=4 3016 B9R1.8 O=C\C=C\1/NC=CC=N1 Amb24100373 [0,1,0,0,0,1|1,0,0]=3 3017 B9R1.8 O=NNc1[n]ccc[n]1 Amb24678165 [0,1,0,0,0,1|2,0,0]=4 3018 B9R1.8 O=S=Nc1cc[n]cc1 Amb25147155 [0,1,0,0,0,1|2,0,0]=4 3019 B9R1.8 ON=Cc1cc[n]c[n]1 Amb20668794 [0,1,0,0,0,1|1,0,1]=4 3020 B9R1.8 ON=Cc1ccccn1 Amb10573542 [0,1,0,0,0,1|1,0,1]=4 3021 B9R1.8 ON=Cc1ccncc1 Amb10075320 [0,1,0,0,0,1|1,0,1]=4 3022 B9R1.8 O\N=C/c1c[n]ccc1 Amb24611619 [0,1,0,0,0,1|1,0,1]=4 3023 B9R1.8 O\N=C/c1ccccn1 Amb10069892 [0,1,0,0,0,1|1,0,1]=4 3024 B9R1.8 O\N=C\C=1CC=CNC1 Amb24668003 [0,1,0,0,0,1|1,0,1]=4 3025 B9R1.8 O\N=C\c1cc[n]c[n]1 Amb22292199 [0,1,0,0,0,1|1,0,1]=4 3026 B9R1.8 O\N=C\c1ccc[n][n]1 Amb23539035 [0,1,0,0,0,1|1,0,1]=4 3027 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [0,1,0,0,0,1|1,0,1]=4 3028 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [0,1,0,0,0,1|1,0,1]=4 3029 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [0,1,0,0,0,1|1,1,0]=4 3030 B9R1.8 S=CNc1[n]ccc[n]1 Amb24073532 [0,1,0,0,0,1|1,1,0]=4 3031 B9R1.8 S=CNc1cccc[n]1 Amb25785094 [0,1,0,0,0,1|1,1,0]=4 3032 B9R1.8 S=CNc1ccccc1 Amb25788857 [0,1,0,0,0,1|1,1,0]=4 3033 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [0,1,0,0,0,1|2,0,0]=4 3034 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [0,1,0,0,0,1|2,0,0]=4 3035 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [0,1,0,0,0,1|2,0,0]=4 3036 B9R1.8 [N-]=[N+]=Cc1[n]ccc[n]1 Amb25745647 [0,1,0,0,0,1|2,0,0]=4 3037 B9R1.8 [N-]=[N+]=Cc1cc[n]cc1 Amb25320767 [0,1,0,0,0,1|2,0,0]=4 3038 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [0,1,0,0,0,1|2,0,0]=4 3039 B9R1.15 C=C/1C=CC=C\C1=C\O Amb25052188 [0,1,0,0,0,1|1,0,1]=4 3040 B9R1.15 C=C1C=CCCN1C=O Amb24060012 [0,1,0,0,0,1|2,0,0]=4 3041 B9R1.15 C=CC1=CC=CNC1=O Amb22001879 [0,1,0,0,0,1|2,0,0]=4 3042 B9R1.15 C=Cc1[n]c[n]cc1Br Amb22276728 [0,1,0,0,0,1|2,0,0]=4 3043 B9R1.15 C=Cc1[n]cccc1Br Amb21857298 [0,1,0,0,0,1|2,0,0]=4 3044 B9R1.15 C=Cc1[n]cccc1Cl Amb24085906 [0,1,0,0,0,1|2,0,0]=4 3045 B9R1.15 C=Cc1[n]cccc1N Amb24062299 [0,1,0,0,0,1|2,0,0]=4 3046 B9R1.15 C=Cc1[n]cccc1O Amb24062589 [0,1,0,0,0,1|2,0,0]=4 3047 B9R1.15 C=Cc1c[n]ccc1Cl Amb24091389 [0,1,0,0,0,1|2,0,0]=4 3048 B9R1.15 C=Cc1c[n]ccc1N Amb24102614 [0,1,0,0,0,1|2,0,0]=4 3049 B9R1.15 C=Cc1cc[n]cc1Cl Amb25776658 [0,1,0,0,0,1|2,0,0]=4 3050 B9R1.15 C=Cc1cc[n]cc1F Amb24481861 [0,1,0,0,0,1|2,0,0]=4 3051 B9R1.15 C=Cc1cc[n]cc1O Amb25358569 [0,1,0,0,0,1|2,0,0]=4 3052 B9R1.15 C=Cc1cc[n]cc1S Amb24727490 [0,1,0,0,0,1|2,0,0]=4 3053 B9R1.15 C=Cc1ccc[n]c1Br Amb24709309 [0,1,0,0,0,1|2,0,0]=4 3054 B9R1.15 C=Cc1ccc[n]c1F Amb25355017 [0,1,0,0,0,1|2,0,0]=4 3055 B9R1.15 C=Cc1ccc[n]c1N Amb25831150 [0,1,0,0,0,1|2,0,0]=4 3056 B9R1.15 C=Cc1ccc[n]c1S Amb24410147 [0,1,0,0,0,1|2,0,0]=4 3057 B9R1.15 C=Cc1cccc[n+]1C Amb10553004 [0,1,0,0,0,1|2,0,0]=4 3058 B9R1.15 C=Cc1cccc[n+]1[O-] Amb25852532 [0,1,0,0,0,1|2,0,0]=4 3059 B9R1.15 C=Cc1ccccc1N Amb17593221 [0,1,0,0,0,1|2,0,0]=4 3060 B9R1.15 C=Cc1ccccc1N Amb21857764 [0,1,0,0,0,1|2,0,0]=4 3061 B9R1.15 C=Cc1ccccc1O Amb17593227 [0,1,0,0,0,1|2,0,0]=4 3062 B9R1.15 COC1=CC=COC1=O Amb25174071 [0,1,0,0,0,1|2,0,0]=4 3063 B9R1.15 COC1=COC=CC1=O Amb25735758 [0,1,0,0,0,1|2,0,0]=4 3064 B9R1.15 C[C@@H]1C=CNC=C1C=O Amb24678380 [0,1,0,0,0,1|1,0,0]=3 3065 B9R1.15 C\C=C/1\C=CC=CN1C Amb24068341 [0,1,0,0,0,1|2,0,0]=4 3066 B9R1.15 C\C=C\1/CCC=CC1=O Amb25718019 [0,1,0,0,0,1|2,0,0]=4 3067 B9R1.15 Cc1[n]cccc1C=C Amb24432711 [0,1,0,0,0,1|2,0,0]=4 3068 B9R1.15 Cc1ccc[n]c1N=O Amb24102379 [0,1,0,0,0,1|2,0,0]=4 3069 B9R1.15 Cc1ccccc1I=O Amb25055325 [0,1,0,0,0,1|2,0,0]=4 3070 B9R1.15 Cc1ccccc1N=O Amb22233124 [0,1,0,0,0,1|2,0,0]=4 3071 B9R1.15 N=C/1C=CC=C\C1=C\Cl Amb24710326 [0,1,0,0,0,1|2,0,0]=4 3072 B9R1.15 N=CC1=CC=CNC1=O Amb24626538 [0,1,0,0,0,1|2,0,0]=4 3073 B9R1.15 N=Cc1cc[n]cc1O Amb24691548 [0,1,0,0,0,1|2,0,0]=4 3074 B9R1.15 N=Cc1ccccc1O Amb1790126 [0,1,0,0,0,1|2,0,0]=4 3075 B9R1.15 N=Cc1ccccc1O Amb1797150 [0,1,0,0,0,1|2,0,0]=4 3076 B9R1.15 N=Cc1ccccc1O Amb1801896 [0,1,0,0,0,1|2,0,0]=4 3077 B9R1.15 N\C=C/1\C=CC=CC1=O Amb25347543 [0,1,0,0,0,1|2,0,0]=4 3078 B9R1.15 N\C=C/1\C=CC=NC1=O Amb24710475 [0,1,0,0,0,1|2,0,0]=4 3079 B9R1.15 Nc1[n]cc[n]c1C=O Amb19957741 [0,1,0,0,0,1|1,0,0]=3 3080 B9R1.15 Nc1[n]cccc1C=O Amb22831433 [0,1,0,0,0,1|1,0,0]=3 3081 B9R1.15 Nc1c[n]c[n]c1C=O Amb24613857 [0,1,0,0,0,1|1,0,0]=3 3082 B9R1.15 Nc1c[n]ccc1C=O Amb21963531 [0,1,0,0,0,1|1,0,0]=3 3083 B9R1.15 Nc1c[n]ccc1C=O Amb22490574 [0,1,0,0,0,1|1,0,0]=3 3084 B9R1.15 Nc1cc[n]cc1C=O Amb19929570 [0,1,0,0,0,1|1,0,0]=3 3085 B9R1.15 Nc1ccccc1C=N Amb25178096 [0,1,0,0,0,1|2,0,0]=4 3086 B9R1.15 O=C1C=CNC=C1C=O Amb18642082 [0,1,0,0,0,1|1,0,0]=3 3087 B9R1.15 O=C1NC=CC=C1C=O Amb18832973 [0,1,0,0,0,1|1,0,0]=3 3088 B9R1.15 O=C1NC=CC=C1N=O Amb24501067 [0,1,0,0,0,1|2,0,0]=4 3089 B9R1.15 O=C1NN=CC=C1C=O Amb23455763 [0,1,0,0,0,1|2,0,0]=4 3090 B9R1.15 O=C1OC=CC=C1CCl Amb24460780 [0,1,0,0,0,1|1,0,1]=4 3091 B9R1.15 O=CC1=CC=CCC1=S Amb24565736 [0,1,0,0,0,1|1,0,0]=3 3092 B9R1.15 O=CC1CCC=CC1=O Amb25835701 [0,1,0,0,0,1|1,0,1]=4 3093 B9R1.15 O=CC1COCC=C1Cl Amb24634392 [0,1,0,0,0,1|0,0,2]=4 3094 B9R1.15 O=CC=1COC=CC1Cl Amb24357235 [0,1,0,0,0,1|0,0,0]=2 3095 B9R1.15 O=CC=1CSC=CC1Cl Amb24375149 [0,1,0,0,0,1|0,1,0]=3 3096 B9R1.15 O=Cc1[n]c[n][n]c1Cl Amb24478602 [0,1,0,0,0,1|2,0,0]=4 3097 B9R1.15 O=Cc1[n]c[n]cc1Cl Amb18831609 [0,1,0,0,0,1|1,0,0]=3 3098 B9R1.15 O=Cc1[n]c[n]cc1I Amb22497945 [0,1,0,0,0,1|1,0,0]=3 3099 B9R1.15 O=Cc1[n]cc[n]c1Br Amb22388478 [0,1,0,0,0,1|1,0,0]=3 3100 B9R1.15 O=Cc1[n]cc[n]c1F Amb22388295 [0,1,0,0,0,1|1,0,0]=3 3101 B9R1.15 O=Cc1[n]cc[n]c1I Amb23400029 [0,1,0,0,0,1|1,0,0]=3 3102 B9R1.15 O=Cc1[n]cccc1I Amb24756661 [0,1,0,0,0,1|1,0,0]=3 3103 B9R1.15 O=Cc1c[n]c[n]c1Cl Amb18202502 [0,1,0,0,0,1|2,0,0]=4 3104 B9R1.15 O=Cc1c[n]c[n]c1F Amb25196009 [0,1,0,0,0,1|2,0,0]=4 3105 B9R1.15 O=Cc1c[n]ccc1Br Amb22491437 [0,1,0,0,0,1|1,0,0]=3 3106 B9R1.15 O=Cc1c[n]ccc1Cl Amb22491113 [0,1,0,0,0,1|1,0,0]=3 3107 B9R1.15 O=Cc1c[n]ccc1F Amb20247834 [0,1,0,0,0,1|1,0,0]=3 3108 B9R1.15 O=Cc1c[n]ccc1I Amb24578847 [0,1,0,0,0,1|1,0,0]=3 3109 B9R1.15 O=Cc1cc[n][n]c1Br Amb22284820 [0,1,0,0,0,1|2,0,0]=4 3110 B9R1.15 O=Cc1cc[n][n]c1Cl Amb22284821 [0,1,0,0,0,1|2,0,0]=4 3111 B9R1.15 O=Cc1cc[n]cc1Cl Amb22728978 [0,1,0,0,0,1|1,0,0]=3 3112 B9R1.15 O=Cc1cc[n]cc1S Amb24407601 [0,1,0,0,0,1|1,0,0]=3 3113 B9R1.15 O=Cc1cccc[n+]1C Amb10552784 [0,1,0,0,0,1|1,0,0]=3 3114 B9R1.15 O=Cc1ccccc1Cl Amb2387351 [0,1,0,0,0,1|1,0,0]=3 3115 B9R1.15 O=Cc1ccccc1I Amb1207354 [0,1,0,0,0,1|1,0,0]=3 3116 B9R1.15 O=Cc1ccccc1S Amb18643290 [0,1,0,0,0,1|1,0,0]=3 3117 B9R1.15 O=Cc1cccnc1Br Amb2234596 [0,1,0,0,0,1|1,0,0]=3 3118 B9R1.15 O=Cc1cccnc1C Amb10602118 [0,1,0,0,0,1|1,0,0]=3 3119 B9R1.15 O=Cc1cccnc1Cl Amb2418601 [0,1,0,0,0,1|1,0,0]=3 3120 B9R1.15 O=Cc1cccnc1F Amb2447351 [0,1,0,0,0,1|1,0,0]=3 3121 B9R1.15 O=Cc1cccnc1N Amb1090876 [0,1,0,0,0,1|1,0,0]=3 3122 B9R1.15 O=Cc1ccncc1Br Amb2447417 [0,1,0,0,0,1|1,0,0]=3 3123 B9R1.15 O=Cc1ccncc1F Amb2447437 [0,1,0,0,0,1|1,0,0]=3 3124 B9R1.15 O=Cc1cnccc1Br Amb13890400 [0,1,0,0,0,1|1,0,0]=3 3125 B9R1.15 O=Cc1cnccc1Br Amb2447416 [0,1,0,0,0,1|1,0,0]=3 3126 B9R1.15 O=Cc1cnccc1C Amb2447575 [0,1,0,0,0,1|1,0,0]=3 3127 B9R1.15 O=Cc1cnccc1Cl Amb10067841 [0,1,0,0,0,1|1,0,0]=3 3128 B9R1.15 O=Cc1cnccc1N Amb1094063 [0,1,0,0,0,1|1,0,0]=3 3129 B9R1.15 O=Cc1ncccc1Br Amb2447550 [0,1,0,0,0,1|1,0,0]=3 3130 B9R1.15 O=Cc1ncccc1C Amb2447573 [0,1,0,0,0,1|1,0,0]=3 3131 B9R1.15 O=Cc1ncccc1Cl Amb10602299 [0,1,0,0,0,1|1,0,0]=3 3132 B9R1.15 O=Cc1ncccc1F Amb2447518 [0,1,0,0,0,1|1,0,0]=3 3133 B9R1.15 O=Cc1ncncc1Br Amb10602877 [0,1,0,0,0,1|1,0,0]=3 3134 B9R1.15 O=Nc1[n]cc[n]c1Cl Amb25351921 [0,1,0,0,0,1|2,0,0]=4 3135 B9R1.15 O=Nc1[n]cccc1S Amb24062559 [0,1,0,0,0,1|2,0,0]=4 3136 B9R1.15 O=Nc1ccccc1Br Amb24439402 [0,1,0,0,0,1|2,0,0]=4 3137 B9R1.15 O=Nc1ccccc1F Amb24424177 [0,1,0,0,0,1|2,0,0]=4 3138 B9R1.15 O=Nc1ccccc1O Amb17593255 [0,1,0,0,0,1|2,0,0]=4 3139 B9R1.15 OC=1C=COCC1C=O Amb24440922 [0,1,0,0,0,1|0,0,0]=2 3140 B9R1.15 O\C=C/1\C=CN=CC1=O Amb25132276 [0,1,0,0,0,1|1,0,1]=4 3141 B9R1.15 O\C=C/1\CCC=CC1=O Amb24562020 [0,1,0,0,0,1|1,0,1]=4 3142 B9R1.15 O\C=C/1\N=CC=CC1=O Amb25265487 [0,1,0,0,0,1|1,0,1]=4 3143 B9R1.15 Oc1[n]c[n]cc1C=O Amb24063066 [0,1,0,0,0,1|2,0,0]=4 3144 B9R1.15 Oc1[n]cccc1C=O Amb18642078 [0,1,0,0,0,1|1,0,0]=3 3145 B9R1.15 Oc1cc[n]cc1C=O Amb20247827 [0,1,0,0,0,1|1,0,0]=3 3146 B9R1.15 Oc1cc[n]cc1N=O Amb24099605 [0,1,0,0,0,1|2,0,0]=4 3147 B9R1.15 Oc1ccc[n]c1C=O Amb22495285 [0,1,0,0,0,1|1,0,0]=3 3148 B9R1.15 Oc1ccccc1C=S Amb25273126 [0,1,0,0,0,1|1,1,0]=4 3149 B9R1.15 [O-][n+]1c[n]ccc1C=O Amb25192428 [0,1,0,0,0,1|1,0,0]=3 3150 B9R1.15 [O-]c1ccccc1C=O Amb22345675 [0,1,0,0,0,1|1,0,0]=3 3151 B9R1.118 CC1(C=O)C=CCC=C1 Amb25785575 [0,1,0,0,0,1|1,0,1]=4 3152 B9R1.118 CC1(CCC=CO1)C=O Amb18642403 [0,1,0,0,0,1|0,0,2]=4 3153 B9R1.7 Brc1cc(sc1)\C=C\I Amb10067487 [0,2,0,0,0,0|1,1,0]=4 3154 B9R1.7 Brc1ccc(s1)\C=C\I Amb10067486 [0,2,0,0,0,0|1,1,0]=4 3155 B9R1.7 C=CCC1=CCC(=O)O1 Amb24583267 [0,2,0,0,0,0|1,0,1]=4 3156 B9R1.7 CC=1CCC(C1)=CC=O Amb24612084 [0,2,0,0,0,0|1,0,1]=4 3157 B9R1.7 CC=1CC\C(\C1)=C\C=O Amb25747179 [0,2,0,0,0,0|1,0,1]=4 3158 B9R1.7 CCCc1ccc(Br)o1 Amb24318772 [0,2,0,0,0,0|1,0,1]=4 3159 B9R1.7 CCCc1ccc(S)o1 Amb24541239 [0,2,0,0,0,0|1,0,1]=4 3160 B9R1.7 CCSc1cc(Br)co1 Amb25351967 [0,2,0,0,0,0|1,0,1]=4 3161 B9R1.7 CCSc1ccc(O)o1 Amb25234153 [0,2,0,0,0,0|1,0,1]=4 3162 B9R1.7 CC\C=C/1\C=CC(=O)O1 Amb25359381 [0,2,0,0,0,0|1,0,0]=3 3163 B9R1.7 CC\N=C\1/C=CC(=O)O1 Amb25274141 [0,2,0,0,0,0|1,0,1]=4 3164 B9R1.7 CNCc1cc(Cl)co1 Amb23537708 [0,2,0,0,0,0|1,0,1]=4 3165 B9R1.7 CNCc1ccc(Br)o1 Amb25280004 [0,2,0,0,0,0|1,0,1]=4 3166 B9R1.7 CNCc1ccc(Cl)o1 Amb18523734 [0,2,0,0,0,0|1,0,1]=4 3167 B9R1.7 CNCc1ccc(N)o1 Amb18101397 [0,2,0,0,0,0|1,0,1]=4 3168 B9R1.7 CNCc1ccc(o1)Br Amb1131647 [0,2,0,0,0,0|1,0,1]=4 3169 B9R1.7 CNCc1ccc(o1)C Amb1105046 [0,2,0,0,0,0|1,0,1]=4 3170 B9R1.7 COCc1cc(Br)co1 Amb25178576 [0,2,0,0,0,0|0,0,2]=4 3171 B9R1.7 COCc1ccc(Br)o1 Amb25837821 [0,2,0,0,0,0|0,0,2]=4 3172 B9R1.7 COCc1ccc(I)o1 Amb23538044 [0,2,0,0,0,0|0,0,2]=4 3173 B9R1.7 CSCc1ccc(S)o1 Amb24476599 [0,2,0,0,0,0|0,1,1]=4 3174 B9R1.7 C[n]1cc(CC=O)cc1 Amb24361738 [0,2,0,0,0,0|2,0,0]=4 3175 B9R1.7 C[n]1ccc(NC=O)[n]1 Amb25335297 [0,2,0,0,0,0|2,0,0]=4 3176 B9R1.7 C\C=C\C1C=CC(=O)O1 Amb25238033 [0,2,0,0,0,0|1,0,1]=4 3177 B9R1.7 C\C=C\[C@H]1C=CC(=O)O1 Amb24415319 [0,2,0,0,0,0|1,0,1]=4 3178 B9R1.7 C\N=C\c1ccc(Cl)o1 Amb24679384 [0,2,0,0,0,0|1,0,0]=3 3179 B9R1.7 Cc1[n]c(CC=O)c[s]1 Amb24099724 [0,2,0,0,0,0|2,0,0]=4 3180 B9R1.7 Cc1[n]cc(N=C=O)o1 Amb24651287 [0,2,0,0,0,0|1,0,1]=4 3181 B9R1.7 Cc1c[n]c(CC=O)[s]1 Amb25144878 [0,2,0,0,0,0|1,1,0]=4 3182 B9R1.7 Cc1c[n]c(NC=O)[s]1 Amb24524172 [0,2,0,0,0,0|1,1,0]=4 3183 B9R1.7 Cc1c[s]c(CC=O)[n]1 Amb25283474 [0,2,0,0,0,0|1,1,0]=4 3184 B9R1.7 Cc1cc(C=NO)[nH]c1 Amb25268477 [0,2,0,0,0,0|1,0,1]=4 3185 B9R1.7 Cc1cc(C=NO)oc1 Amb25211029 [0,2,0,0,0,0|0,0,1]=3 3186 B9R1.7 Cc1cc(CC=C)o[n]1 Amb24557641 [0,2,0,0,0,0|2,0,0]=4 3187 B9R1.7 Cc1cc(CC=O)[s][n]1 Amb25026958 [0,2,0,0,0,0|1,1,0]=4 3188 B9R1.7 Cc1cc(CC=O)c[s]1 Amb24385702 [0,2,0,0,0,0|2,0,0]=4 3189 B9R1.7 Cc1cc(CCN)oc1 Amb18832812 [0,2,0,0,0,0|1,0,1]=4 3190 B9R1.7 Cc1cc(N=C=O)oc1 Amb24665949 [0,2,0,0,0,0|0,0,1]=3 3191 B9R1.7 Cc1cc(NC=O)[nH][n]1 Amb25111687 [0,2,0,0,0,0|2,0,0]=4 3192 B9R1.7 Cc1cc(\C=N\N)o[n]1 Amb25108812 [0,2,0,0,0,0|2,0,0]=4 3193 B9R1.7 Cc1cc[n](CC=O)[n]1 Amb25147172 [0,2,0,0,0,0|2,0,0]=4 3194 B9R1.7 Cc1ccc(C=[N+]=[N-])o1 Amb24638381 [0,2,0,0,0,0|1,0,0]=3 3195 B9R1.7 Cc1ccc(CC=O)[s]1 Amb24679545 [0,2,0,0,0,0|0,1,0]=3 3196 B9R1.7 Cc1ccc(CCC)o1 Amb22339463 [0,2,0,0,0,0|1,0,1]=4 3197 B9R1.7 Cc1ccc(CCO)o1 Amb24496246 [0,2,0,0,0,0|0,0,2]=4 3198 B9R1.7 Cc1ccc(CON)o1 Amb24679622 [0,2,0,0,0,0|0,0,2]=4 3199 B9R1.7 Cc1ccc(CSC)o1 Amb24696980 [0,2,0,0,0,0|0,1,1]=4 3200 B9R1.7 Cc1ccc(\C=N/O)o1 Amb25147225 [0,2,0,0,0,0|0,0,1]=3 3201 B9R1.7 Cc1ccc(\C=N\N)[s]1 Amb25297019 [0,2,0,0,0,0|1,1,0]=4 3202 B9R1.7 Cc1ccc(\C=N\N)o1 Amb25788831 [0,2,0,0,0,0|1,0,0]=3 3203 B9R1.7 Cc1ccc(o1)OCC Amb25238828 [0,2,0,0,0,0|1,0,1]=4 3204 B9R1.7 Cc1ccc(o1)SCC Amb25174134 [0,2,0,0,0,0|1,0,1]=4 3205 B9R1.7 Cc1coc(N=C=O)[n]1 Amb24679208 [0,2,0,0,0,0|1,0,1]=4 3206 B9R1.7 Cc1csc(n1)NC=O Amb10562492 [0,2,0,0,0,0|1,1,0]=4 3207 B9R1.7 ClCCc1ccc(Br)o1 Amb25147196 [0,2,0,0,0,0|1,0,1]=4 3208 B9R1.7 Clc1ccc(\C=C\Cl)[s]1 Amb24636929 [0,2,0,0,0,0|1,1,0]=4 3209 B9R1.7 N#CCc1cc(Br)co1 Amb18129572 [0,2,0,0,0,0|1,0,1]=4 3210 B9R1.7 NCCc1cc(Cl)co1 Amb18831465 [0,2,0,0,0,0|1,0,1]=4 3211 B9R1.7 NCCc1ccc(Br)o1 Amb20626078 [0,2,0,0,0,0|1,0,1]=4 3212 B9R1.7 NCCc1ccc(Cl)o1 Amb18963970 [0,2,0,0,0,0|1,0,1]=4 3213 B9R1.7 NN=Cc1cc(Br)c[s]1 Amb25854902 [0,2,0,0,0,0|1,1,0]=4 3214 B9R1.7 NN=Cc1cc(Br)co1 Amb25180611 [0,2,0,0,0,0|1,0,0]=3 3215 B9R1.7 NN=Cc1cc(Cl)c[s]1 Amb25265696 [0,2,0,0,0,0|1,1,0]=4 3216 B9R1.7 NOCc1ccc(Br)o1 Amb25032146 [0,2,0,0,0,0|0,0,2]=4 3217 B9R1.7 N\C=C\c1cc(Cl)[n]o1 Amb24562459 [0,2,0,0,0,0|2,0,0]=4 3218 B9R1.7 N\N=C\c1ccc(Br)o1 Amb24415450 [0,2,0,0,0,0|1,0,0]=3 3219 B9R1.7 N\N=C\c1ccc(Cl)o1 Amb25296773 [0,2,0,0,0,0|1,0,0]=3 3220 B9R1.7 O=C1C=C\C(=C/C=O)\O1 Amb24334582 [0,2,0,0,0,0|0,0,0]=2 3221 B9R1.7 O=C1C=C\C(=C/CBr)\O1 Amb25211667 [0,2,0,0,0,0|1,0,0]=3 3222 B9R1.7 O=C1C=C\C(=C\C=O)\O1 Amb24668983 [0,2,0,0,0,0|0,0,0]=2 3223 B9R1.7 O=C1C\C(\C=C1)=C\C=S Amb24577808 [0,2,0,0,0,0|1,1,0]=4 3224 B9R1.7 O=C=Nc1cc(Br)c[s]1 Amb18566857 [0,2,0,0,0,0|0,1,1]=4 3225 B9R1.7 O=C=Nc1cc(Cl)c[s]1 Amb24374591 [0,2,0,0,0,0|0,1,1]=4 3226 B9R1.7 O=C=Nc1ccc(Cl)[s]1 Amb18279846 [0,2,0,0,0,0|0,1,1]=4 3227 B9R1.7 O=C=Nc1ccc(Cl)o1 Amb25780963 [0,2,0,0,0,0|0,0,1]=3 3228 B9R1.7 O=CCc1[n]c(Br)c[s]1 Amb25763121 [0,2,0,0,0,0|1,1,0]=4 3229 B9R1.7 O=CCc1[n]cc(I)[s]1 Amb24481969 [0,2,0,0,0,0|1,1,0]=4 3230 B9R1.7 O=CCc1c[n]c(Br)[s]1 Amb24363351 [0,2,0,0,0,0|1,1,0]=4 3231 B9R1.7 O=CCc1c[n]c(Cl)[s]1 Amb22043734 [0,2,0,0,0,0|1,1,0]=4 3232 B9R1.7 O=CCc1c[s]c(Br)[n]1 Amb25032295 [0,2,0,0,0,0|2,0,0]=4 3233 B9R1.7 O=CCc1c[s]c(Br)c1 Amb24596953 [0,2,0,0,0,0|2,0,0]=4 3234 B9R1.7 O=CCc1c[s]c(Cl)c1 Amb25759440 [0,2,0,0,0,0|2,0,0]=4 3235 B9R1.7 O=CCc1cc(Br)co1 Amb25249614 [0,2,0,0,0,0|0,0,0]=2 3236 B9R1.7 O=CCc1ccc(Br)[s]1 Amb24433759 [0,2,0,0,0,0|0,1,0]=3 3237 B9R1.7 O=CCc1ccc(Cl)o1 Amb25174639 [0,2,0,0,0,0|0,0,0]=2 3238 B9R1.7 O=CCc1ccc(F)[s]1 Amb24648364 [0,2,0,0,0,0|0,1,0]=3 3239 B9R1.7 O=CNc1[n]cc(Br)[s]1 Amb24474404 [0,2,0,0,0,0|1,1,0]=4 3240 B9R1.7 O=CNc1c[s]c(Cl)[n]1 Amb25784715 [0,2,0,0,0,0|2,0,0]=4 3241 B9R1.7 O=COC1C=CC(=O)O1 Amb25201503 [0,2,0,0,0,0|0,0,1]=3 3242 B9R1.7 OCCc1ccc(F)o1 Amb24527495 [0,2,0,0,0,0|0,0,2]=4 3243 B9R1.7 OC\C=C\1/C=CC(=O)O1 Amb25801971 [0,2,0,0,0,0|0,0,1]=3 3244 B9R1.7 ONCc1ccc(Cl)o1 Amb24449836 [0,2,0,0,0,0|0,0,2]=4 3245 B9R1.7 O\N=C/c1ccc(Br)[s]1 Amb21811533 [0,2,0,0,0,0|0,1,1]=4 3246 B9R1.7 O\N=C\c1cc(Cl)co1 Amb24192789 [0,2,0,0,0,0|0,0,1]=3 3247 B9R1.7 O\N=C\c1ccc(F)[s]1 Amb19892823 [0,2,0,0,0,0|0,1,1]=4 3248 B9R1.7 O\N=C\c1ccc(I)[s]1 Amb24335180 [0,2,0,0,0,0|0,1,1]=4 3249 B9R1.7 O\N=C\c1ccc(o1)Br Amb2387512 [0,2,0,0,0,0|0,0,1]=3 3250 B9R1.7 O\N=C\c1ccc(o1)I Amb16239327 [0,2,0,0,0,0|0,0,1]=3 3251 B9R1.7 Oc1c[n][n](CC=O)c1 Amb18832767 [0,2,0,0,0,0|2,0,0]=4 3252 B9R1.7 [C-]#[N+]Cc1ccc(o1)C Amb1981057 [0,2,0,0,0,0|1,0,1]=4 3253 B9R1.7 [N-]=[N+]=Cc1ccc(Cl)o1 Amb25325284 [0,2,0,0,0,0|1,0,0]=3 3254 B9R1.7 [O-][N+]#Cc1ccc(Cl)o1 Amb25257856 [0,2,0,0,0,0|0,0,2]=4 3255 B9R1.21 C#Cc1c[n]c(C=O)[s]1 Amb25303631 [0,2,0,0,0,0|1,1,0]=4 3256 B9R1.21 C#Cc1ccc(CO)o1 Amb25306139 [0,2,0,0,0,0|0,0,2]=4 3257 B9R1.21 C=Cc1[nH]cc(C=O)[n]1 Amb24433352 [0,2,0,0,0,0|2,0,0]=4 3258 B9R1.21 C=Cc1[n]c(C=O)co1 Amb24708203 [0,2,0,0,0,0|2,0,0]=4 3259 B9R1.21 C=Cc1cc(C=O)c[s]1 Amb25830217 [0,2,0,0,0,0|1,1,0]=4 3260 B9R1.21 C=Cc1cc(C=O)oc1 Amb24395954 [0,2,0,0,0,0|0,0,0]=2 3261 B9R1.21 C=Cc1cc(CN)c[s]1 Amb24587832 [0,2,0,0,0,0|1,1,0]=4 3262 B9R1.21 C=Cc1cc(CN)co1 Amb25042025 [0,2,0,0,0,0|1,0,0]=3 3263 B9R1.21 C=Cc1ccc(C=C)[s]1 Amb25364578 [0,2,0,0,0,0|1,1,0]=4 3264 B9R1.21 C=Cc1ccc(C=O)[s]1 Amb18643293 [0,2,0,0,0,0|0,1,0]=3 3265 B9R1.21 C=Cc1ccc(C=O)o1 Amb18124289 [0,2,0,0,0,0|0,0,0]=2 3266 B9R1.21 CC[n]1c[n]c(C=O)c1 Amb18642190 [0,2,0,0,0,0|2,0,0]=4 3267 B9R1.21 CC[n]1cc(C=O)cc1 Amb24417132 [0,2,0,0,0,0|2,0,0]=4 3268 B9R1.21 CCc1[n][n]c(C=O)o1 Amb25842963 [0,2,0,0,0,0|2,0,0]=4 3269 B9R1.21 CCc1[n]c(C=O)co1 Amb25679095 [0,2,0,0,0,0|2,0,0]=4 3270 B9R1.21 CCc1[n]cc(C=O)[s]1 Amb19514527 [0,2,0,0,0,0|1,1,0]=4 3271 B9R1.21 CCc1c[nH]c(C=O)[n]1 Amb18673000 [0,2,0,0,0,0|2,0,0]=4 3272 B9R1.21 CCc1cc(C=O)[nH]c1 Amb21971277 [0,2,0,0,0,0|1,0,0]=3 3273 B9R1.21 CCc1cc(C=O)[n][s]1 Amb24514339 [0,2,0,0,0,0|2,0,0]=4 3274 B9R1.21 CCc1cc(C=O)[n]o1 Amb18832855 [0,2,0,0,0,0|2,0,0]=4 3275 B9R1.21 CCc1cc(C=O)[s]c1 Amb24694630 [0,2,0,0,0,0|0,1,0]=3 3276 B9R1.21 CCc1cc(C=O)c[nH]1 Amb18142592 [0,2,0,0,0,0|2,0,0]=4 3277 B9R1.21 CCc1cc(C=O)c[s]1 Amb18643619 [0,2,0,0,0,0|2,0,0]=4 3278 B9R1.21 CCc1cc(C=O)co1 Amb18678528 [0,2,0,0,0,0|1,0,1]=4 3279 B9R1.21 CCc1cc(C=O)oc1 Amb18673932 [0,2,0,0,0,0|0,0,0]=2 3280 B9R1.21 CCc1ccc(C=C)[s]1 Amb24478629 [0,2,0,0,0,0|1,1,0]=4 3281 B9R1.21 CCc1ccc(CCl)o1 Amb25140995 [0,2,0,0,0,0|1,0,1]=4 3282 B9R1.21 CCc1ccc(CN)o1 Amb18960153 [0,2,0,0,0,0|1,0,1]=4 3283 B9R1.21 CCc1ccc(CO)o1 Amb23512583 [0,2,0,0,0,0|0,0,2]=4 3284 B9R1.21 CCc1ccc(CS)o1 Amb24367663 [0,2,0,0,0,0|0,1,1]=4 3285 B9R1.21 CCc1ccc([nH]1)C=O Amb17593257 [0,2,0,0,0,0|1,0,0]=3 3286 B9R1.21 CCc1ccc(o1)C#N Amb10574576 [0,2,0,0,0,0|1,0,1]=4 3287 B9R1.21 CCc1ccc(o1)SC Amb25178741 [0,2,0,0,0,0|1,0,1]=4 3288 B9R1.21 CCc1coc(C=O)[n]1 Amb25059302 [0,2,0,0,0,0|1,0,0]=3 3289 B9R1.21 CCc1csc(n1)C=O Amb10602725 [0,2,0,0,0,0|1,1,0]=4 3290 B9R1.21 CCc1n[nH]c(c1)C=O Amb15701600 [0,2,0,0,0,0|2,0,0]=4 3291 B9R1.21 CCc1ncc(o1)C=O Amb17399800 [0,2,0,0,0,0|1,0,0]=3 3292 B9R1.21 CCc1noc(c1)C=O Amb10608410 [0,2,0,0,0,0|1,0,0]=3 3293 B9R1.21 CNc1[n][n]c(C=O)o1 Amb25309666 [0,2,0,0,0,0|2,0,0]=4 3294 B9R1.21 COC1C=C\C(=C\Cl)\O1 Amb24480027 [0,2,0,0,0,0|1,0,1]=4 3295 B9R1.21 COc1[nH]cc(C=O)[n]1 Amb25075970 [0,2,0,0,0,0|2,0,0]=4 3296 B9R1.21 COc1[n]c(C=O)c[s]1 Amb24099740 [0,2,0,0,0,0|2,0,0]=4 3297 B9R1.21 COc1c[s]c(C=O)c1 Amb18202589 [0,2,0,0,0,0|0,1,0]=3 3298 B9R1.21 COc1cc(C=O)c[nH]1 Amb18832857 [0,2,0,0,0,0|2,0,0]=4 3299 B9R1.21 COc1cc(C=O)c[s]1 Amb18643873 [0,2,0,0,0,0|2,0,0]=4 3300 B9R1.21 COc1cc(C=O)o[n]1 Amb24331446 [0,2,0,0,0,0|1,0,0]=3 3301 B9R1.21 COc1ccc(C=O)[nH]1 Amb18832853 [0,2,0,0,0,0|1,0,0]=3 3302 B9R1.21 COc1ccc(C=O)o1 Amb18832781 [0,2,0,0,0,0|0,0,0]=2 3303 B9R1.21 COc1ccc(CC)o1 Amb25229999 [0,2,0,0,0,0|1,0,1]=4 3304 B9R1.21 COc1ccc(N=O)[s]1 Amb24759285 [0,2,0,0,0,0|1,1,0]=4 3305 B9R1.21 COc1ccc(o1)OC Amb22295890 [0,2,0,0,0,0|2,0,0]=4 3306 B9R1.21 COc1ccc(s1)C=O Amb17593592 [0,2,0,0,0,0|0,1,0]=3 3307 B9R1.21 COc1coc(CS)c1 Amb24402337 [0,2,0,0,0,0|0,1,1]=4 3308 B9R1.21 COc1coc(c1)C=O Amb18832782 [0,2,0,0,0,0|0,0,0]=2 3309 B9R1.21 CSc1[nH]cc(C=O)[n]1 Amb18643876 [0,2,0,0,0,0|2,0,0]=4 3310 B9R1.21 CSc1[n][n]c(C=O)o1 Amb24566750 [0,2,0,0,0,0|2,0,0]=4 3311 B9R1.21 CSc1[n]c(c[s]1)C=O Amb24099738 [0,2,0,0,0,0|2,0,0]=4 3312 B9R1.21 CSc1[n]cc(C=O)[s]1 Amb18830321 [0,2,0,0,0,0|1,1,0]=4 3313 B9R1.21 CSc1[n]cc(C=O)o1 Amb25224818 [0,2,0,0,0,0|1,0,0]=3 3314 B9R1.21 CSc1cc(C=O)[n][nH]1 Amb21864910 [0,2,0,0,0,0|2,0,0]=4 3315 B9R1.21 CSc1cc(CO)co1 Amb24696963 [0,2,0,0,0,0|2,0,0]=4 3316 B9R1.21 CSc1cc(c[s]1)C=O Amb18680675 [0,2,0,0,0,0|2,0,0]=4 3317 B9R1.21 CSc1ccc(C#N)o1 Amb18643423 [0,2,0,0,0,0|1,0,1]=4 3318 B9R1.21 CSc1ccc(C=O)[nH]1 Amb18124598 [0,2,0,0,0,0|1,0,0]=3 3319 B9R1.21 CSc1ccc(C=O)o1 Amb18643872 [0,2,0,0,0,0|0,0,0]=2 3320 B9R1.21 CSc1ccc(CBr)o1 Amb25758931 [0,2,0,0,0,0|1,0,1]=4 3321 B9R1.21 CSc1ccc(CCl)o1 Amb25830387 [0,2,0,0,0,0|1,0,1]=4 3322 B9R1.21 CSc1ccc(CN)o1 Amb18908342 [0,2,0,0,0,0|1,0,1]=4 3323 B9R1.21 CSc1ccc(CO)o1 Amb24087433 [0,2,0,0,0,0|0,0,2]=4 3324 B9R1.21 CSc1coc(C=O)c1 Amb25072714 [0,2,0,0,0,0|0,0,0]=2 3325 B9R1.21 CSc1coc(CO)c1 Amb24616081 [0,2,0,0,0,0|0,0,2]=4 3326 B9R1.21 ClCc1cc(CCl)co1 Amb24421085 [0,2,0,0,0,0|1,0,1]=4 3327 B9R1.21 ClCc1csc(c1)C=O Amb1102126 [0,2,0,0,0,0|0,1,0]=3 3328 B9R1.21 Cl[Hg]c1ccc([Hg]Cl)o1 Amb17672749 [0,2,0,0,0,0|2,0,0]=4 3329 B9R1.21 N#Cc1[n]c(C=O)co1 Amb24481862 [0,2,0,0,0,0|2,0,0]=4 3330 B9R1.21 N#Cc1c[nH]c(C=O)[n]1 Amb25147096 [0,2,0,0,0,0|2,0,0]=4 3331 B9R1.21 N#Cc1c[nH]c(C=O)c1 Amb18641986 [0,2,0,0,0,0|1,0,0]=3 3332 B9R1.21 N#Cc1c[n]c(C=O)[s]1 Amb25225444 [0,2,0,0,0,0|1,1,0]=4 3333 B9R1.21 N#Cc1c[s]c(C=O)[n]1 Amb24099733 [0,2,0,0,0,0|1,1,0]=4 3334 B9R1.21 N#Cc1c[s]c(C=O)c1 Amb18124480 [0,2,0,0,0,0|0,1,0]=3 3335 B9R1.21 N#Cc1cc(C=O)c[nH]1 Amb18641982 [0,2,0,0,0,0|2,0,0]=4 3336 B9R1.21 N#Cc1cc(C=O)c[s]1 Amb18124490 [0,2,0,0,0,0|2,0,0]=4 3337 B9R1.21 N#Cc1cc(C=O)co1 Amb18833001 [0,2,0,0,0,0|1,0,1]=4 3338 B9R1.21 N#Cc1cc(C=O)o[n]1 Amb25668172 [0,2,0,0,0,0|1,0,0]=3 3339 B9R1.21 N#Cc1cc(CBr)co1 Amb25116122 [0,2,0,0,0,0|1,0,1]=4 3340 B9R1.21 N#Cc1cc(co1)C#N Amb25180704 [0,2,0,0,0,0|1,0,1]=4 3341 B9R1.21 N#Cc1ccc(C#N)o1 Amb22734014 [0,2,0,0,0,0|1,0,1]=4 3342 B9R1.21 N#Cc1ccc(C=O)[nH]1 Amb18641983 [0,2,0,0,0,0|1,0,0]=3 3343 B9R1.21 N#Cc1ccc(C=O)o1 Amb18124285 [0,2,0,0,0,0|0,0,0]=2 3344 B9R1.21 N#Cc1ccc(CCl)o1 Amb18643781 [0,2,0,0,0,0|1,0,1]=4 3345 B9R1.21 N#Cc1ccc(CO)o1 Amb18642081 [0,2,0,0,0,0|0,0,2]=4 3346 B9R1.21 N#Cc1coc(C=O)[n]1 Amb25358957 [0,2,0,0,0,0|1,0,0]=3 3347 B9R1.21 N#Cc1coc(C=O)c1 Amb18833002 [0,2,0,0,0,0|0,0,0]=2 3348 B9R1.21 N#Cc1coc(CBr)c1 Amb25141016 [0,2,0,0,0,0|1,0,1]=4 3349 B9R1.21 N#Cc1coc(CCl)c1 Amb18124601 [0,2,0,0,0,0|1,0,1]=4 3350 B9R1.21 N#Cc1coc(CO)c1 Amb18642087 [0,2,0,0,0,0|0,0,2]=4 3351 B9R1.21 N#[N+]c1[n]cc(C=O)[s]1 Amb25370010 [0,2,0,0,0,0|1,1,0]=4 3352 B9R1.21 NCc1cc(CO)co1 Amb24065086 [0,2,0,0,0,0|1,0,1]=4 3353 B9R1.21 NCc1cc(co1)C#N Amb20241076 [0,2,0,0,0,0|1,0,1]=4 3354 B9R1.21 NCc1cc(co1)C#N Amb20241197 [0,2,0,0,0,0|1,0,1]=4 3355 B9R1.21 NCc1ccc(C#N)o1 Amb18251086 [0,2,0,0,0,0|1,0,1]=4 3356 B9R1.21 NCc1ccc(C#N)o1 Amb20241075 [0,2,0,0,0,0|1,0,1]=4 3357 B9R1.21 NCc1ccc(C=O)o1 Amb24581084 [0,2,0,0,0,0|0,0,0]=2 3358 B9R1.21 NCc1ccc(CCl)o1 Amb24511708 [0,2,0,0,0,0|1,0,1]=4 3359 B9R1.21 NCc1ccc(CO)o1 Amb18251107 [0,2,0,0,0,0|0,0,2]=4 3360 B9R1.21 NCc1ccc(o1)CN Amb17609504 [0,2,0,0,0,0|1,0,1]=4 3361 B9R1.21 O=C[n]1cc(cc1)C=O Amb25134086 [0,2,0,0,0,0|2,0,0]=4 3362 B9R1.21 O=Cc1[n]c(CCl)c[s]1 Amb25307007 [0,2,0,0,0,0|1,1,0]=4 3363 B9R1.21 O=Cc1[n]c(CCl)co1 Amb25244031 [0,2,0,0,0,0|1,0,0]=3 3364 B9R1.21 O=Cc1[n]cc(CBr)o1 Amb24689353 [0,2,0,0,0,0|1,0,0]=3 3365 B9R1.21 O=Cc1[n]cc(CF)[s]1 Amb24653057 [0,2,0,0,0,0|1,1,0]=4 3366 B9R1.21 O=Cc1c[n]c(CCl)[s]1 Amb24624018 [0,2,0,0,0,0|1,1,0]=4 3367 B9R1.21 O=Cc1c[s]c(CF)[n]1 Amb25194956 [0,2,0,0,0,0|2,0,0]=4 3368 B9R1.21 O=Cc1cc(C=O)[n][nH]1 Amb25063819 [0,2,0,0,0,0|2,0,0]=4 3369 B9R1.21 O=Cc1cc(CCl)co1 Amb25714786 [0,2,0,0,0,0|0,0,0]=2 3370 B9R1.21 O=Cc1cc(c[nH]1)C=O Amb18642080 [0,2,0,0,0,0|1,0,0]=3 3371 B9R1.21 O=Cc1cc(co1)C=O Amb22170483 [0,2,0,0,0,0|0,0,0]=2 3372 B9R1.21 O=Cc1ccc(CBr)[s]1 Amb24426974 [0,2,0,0,0,0|0,1,0]=3 3373 B9R1.21 O=Cc1ccc(CBr)o1 Amb18129279 [0,2,0,0,0,0|0,0,0]=2 3374 B9R1.21 O=Cc1ccc(CCl)[s]1 Amb24532845 [0,2,0,0,0,0|0,1,0]=3 3375 B9R1.21 O=Cc1ccc(CI)o1 Amb24094652 [0,2,0,0,0,0|0,0,0]=2 3376 B9R1.21 O=Cc1ccc(CS)o1 Amb24519070 [0,2,0,0,0,0|0,0,0]=2 3377 B9R1.21 O=Cc1ccc([nH]1)C=O Amb10576392 [0,2,0,0,0,0|1,0,0]=3 3378 B9R1.21 O=Cc1ccc(o1)C#C Amb16192466 [0,2,0,0,0,0|0,0,0]=2 3379 B9R1.21 O=Cc1ccc(s1)C#C Amb16192464 [0,2,0,0,0,0|0,1,0]=3 3380 B9R1.21 O=Cc1ccc(s1)C#N Amb10982493 [0,2,0,0,0,0|0,1,0]=3 3381 B9R1.21 O=Cc1ccn(n1)CC Amb1945724 [0,2,0,0,0,0|2,0,0]=4 3382 B9R1.21 O=Cc1scc(c1)C#C Amb16192469 [0,2,0,0,0,0|0,1,0]=3 3383 B9R1.21 O=Cc1scc(c1)C=O Amb1102128 [0,2,0,0,0,0|0,1,0]=3 3384 B9R1.21 OCC1CC=C(C=O)O1 Amb24418450 [0,2,0,0,0,0|0,0,2]=4 3385 B9R1.21 OC[n]1ccc(C=O)[n]1 Amb25162833 [0,2,0,0,0,0|2,0,0]=4 3386 B9R1.21 OCc1[n]cc(C=O)[s]1 Amb24502349 [0,2,0,0,0,0|1,1,0]=4 3387 B9R1.21 OCc1c[s]c(C=O)[n]1 Amb25684695 [0,2,0,0,0,0|1,1,0]=4 3388 B9R1.21 OCc1cc(C=O)co1 Amb25045602 [0,2,0,0,0,0|0,0,2]=4 3389 B9R1.21 OCc1cc(C=O)oc1 Amb20248337 [0,2,0,0,0,0|0,0,0]=2 3390 B9R1.21 OCc1cc(CO)co1 Amb20248338 [0,2,0,0,0,0|0,0,2]=4 3391 B9R1.21 OCc1ccc(C=O)[nH]1 Amb18642272 [0,2,0,0,0,0|1,0,0]=3 3392 B9R1.21 OCc1ccc(C=O)[s]1 Amb18643874 [0,2,0,0,0,0|0,1,0]=3 3393 B9R1.21 OCc1ccc(CBr)o1 Amb25082040 [0,2,0,0,0,0|0,0,2]=4 3394 B9R1.21 O[13CH2][13c]1[13cH][13cH][13c](o1)[13CH]=O Amb17615531 [0,2,0,0,0,0|0,0,0]=2 3395 B9R1.22 CC1=CC(=O)OC1=CBr Amb25259288 [0,2,0,0,0,0|1,0,0]=3 3396 B9R1.22 CC=1CC(=O)OC1C=C Amb25147142 [0,2,0,0,0,0|1,0,1]=4 3397 B9R1.22 CC=1C\C(=C\C)\C(=O)C1 Amb24714919 [0,2,0,0,0,0|2,0,0]=4 3398 B9R1.22 CC=1NC(=S)NC1C=O Amb24392146 [0,2,0,0,0,0|2,0,0]=4 3399 B9R1.22 C[n]1[n]c(Br)cc1C=O Amb18190512 [0,2,0,0,0,0|2,0,0]=4 3400 B9R1.22 C[n]1[n]c(Cl)cc1C=O Amb25206773 [0,2,0,0,0,0|2,0,0]=4 3401 B9R1.22 C[n]1[n]c(F)cc1C=O Amb25180765 [0,2,0,0,0,0|2,0,0]=4 3402 B9R1.22 C[n]1[n]c(O)cc1C=O Amb25687342 [0,2,0,0,0,0|2,0,0]=4 3403 B9R1.22 C[n]1cc(Br)[n]c1C=O Amb18129386 [0,2,0,0,0,0|2,0,0]=4 3404 B9R1.22 C[n]1cc(Br)cc1C=O Amb22408738 [0,2,0,0,0,0|1,0,0]=3 3405 B9R1.22 C[n]1cc(C=O)c(Cl)c1 Amb18202416 [0,2,0,0,0,0|2,0,0]=4 3406 B9R1.22 C[n]1cc(I)c(C=O)[n]1 Amb20242329 [0,2,0,0,0,0|2,0,0]=4 3407 B9R1.22 C[n]1cc(N)cc1C=O Amb18679741 [0,2,0,0,0,0|1,0,0]=3 3408 B9R1.22 C[n]1cc(O)c(C=O)[n]1 Amb18832774 [0,2,0,0,0,0|2,0,0]=4 3409 B9R1.22 C\C=C\1/OC(=O)C=C1N Amb24426967 [0,2,0,0,0,0|1,0,0]=3 3410 B9R1.22 C\C=C\1/OC(=O)CC1=O Amb25348554 [0,2,0,0,0,0|1,0,1]=4 3411 B9R1.22 Cc1[nH]c(Br)c(C=O)[n]1 Amb18129372 [0,2,0,0,0,0|2,0,0]=4 3412 B9R1.22 Cc1[nH]c(C=O)c(Cl)[n]1 Amb18831477 [0,2,0,0,0,0|2,0,0]=4 3413 B9R1.22 Cc1[n]c(Br)[s]c1C=O Amb18176304 [0,2,0,0,0,0|1,1,0]=4 3414 B9R1.22 Cc1[n]c(Br)oc1C=O Amb25267784 [0,2,0,0,0,0|1,0,0]=3 3415 B9R1.22 Cc1[n]c(C)oc1C=O Amb18832860 [0,2,0,0,0,0|1,0,0]=3 3416 B9R1.22 Cc1[n]c(C=O)c(Br)o1 Amb24481840 [0,2,0,0,0,0|2,0,0]=4 3417 B9R1.22 Cc1[n]c(Cl)[s]c1C=O Amb19648751 [0,2,0,0,0,0|1,1,0]=4 3418 B9R1.22 Cc1[n]c(Cl)c(C=O)[s]1 Amb25756226 [0,2,0,0,0,0|1,1,0]=4 3419 B9R1.22 Cc1[n]c(N)[s]c1C=O Amb24053082 [0,2,0,0,0,0|1,1,0]=4 3420 B9R1.22 Cc1[n]c(N)c(C=O)o1 Amb24118068 [0,2,0,0,0,0|1,0,0]=3 3421 B9R1.22 Cc1[n]c(O)[s]c1C=O Amb18831592 [0,2,0,0,0,0|1,1,0]=4 3422 B9R1.22 Cc1[s]c(Br)[n]c1C=O Amb22500770 [0,2,0,0,0,0|2,0,0]=4 3423 B9R1.22 Cc1[s]c(Br)cc1C=O Amb18783661 [0,2,0,0,0,0|2,0,0]=4 3424 B9R1.22 Cc1[s]c(Cl)[n]c1C=O Amb22500741 [0,2,0,0,0,0|2,0,0]=4 3425 B9R1.22 Cc1[s]c(F)[n]c1C=O Amb25301612 [0,2,0,0,0,0|2,0,0]=4 3426 B9R1.22 Cc1[s]c(F)cc1C=O Amb18202410 [0,2,0,0,0,0|2,0,0]=4 3427 B9R1.22 Cc1[s]c(I)[n]c1C=O Amb25760941 [0,2,0,0,0,0|2,0,0]=4 3428 B9R1.22 Cc1[s]c(N)[n]c1C=O Amb22500859 [0,2,0,0,0,0|2,0,0]=4 3429 B9R1.22 Cc1[s]c(N)cc1C=O Amb18831710 [0,2,0,0,0,0|2,0,0]=4 3430 B9R1.22 Cc1cc(Br)[s]c1C=O Amb18176568 [0,2,0,0,0,0|0,1,0]=3 3431 B9R1.22 Cc1cc(Br)c(C=O)o1 Amb18190707 [0,2,0,0,0,0|0,0,0]=2 3432 B9R1.22 Cc1cc(C)[nH]c1C=S Amb24741780 [0,2,0,0,0,0|1,1,0]=4 3433 B9R1.22 Cc1cc(C)oc1C=O Amb18642172 [0,2,0,0,0,0|0,0,0]=2 3434 B9R1.22 Cc1cc(C)oc1CN Amb18642317 [0,2,0,0,0,0|1,0,1]=4 3435 B9R1.22 Cc1cc(C=O)c(Br)o1 Amb25309596 [0,2,0,0,0,0|2,0,0]=4 3436 B9R1.22 Cc1cc(C=O)c(F)[s]1 Amb18831510 [0,2,0,0,0,0|2,0,0]=4 3437 B9R1.22 Cc1cc(C=O)c(F)o1 Amb18832649 [0,2,0,0,0,0|2,0,0]=4 3438 B9R1.22 Cc1cc(C=O)c(N)[s]1 Amb18831709 [0,2,0,0,0,0|2,0,0]=4 3439 B9R1.22 Cc1cc(C=O)c(N)o1 Amb18832838 [0,2,0,0,0,0|2,0,0]=4 3440 B9R1.22 Cc1cc(Cl)c(C=O)[s]1 Amb18199727 [0,2,0,0,0,0|0,1,0]=3 3441 B9R1.22 Cc1cc(Cl)c(C=O)o1 Amb18202379 [0,2,0,0,0,0|0,0,0]=2 3442 B9R1.22 Cc1cc(F)c(C=O)[s]1 Amb18831511 [0,2,0,0,0,0|0,1,0]=3 3443 B9R1.22 Cc1cc(N)[s]c1C=O Amb18831714 [0,2,0,0,0,0|0,1,0]=3 3444 B9R1.22 Cc1cc(N)c(C=O)[s]1 Amb18831708 [0,2,0,0,0,0|0,1,0]=3 3445 B9R1.22 Cc1cc(N)c(C=O)o1 Amb18832843 [0,2,0,0,0,0|0,0,0]=2 3446 B9R1.22 Cc1cc(N)oc1CC Amb18832815 [0,2,0,0,0,0|1,0,1]=4 3447 B9R1.22 Cc1cc(O)c(C=O)[s]1 Amb24340076 [0,2,0,0,0,0|0,1,0]=3 3448 B9R1.22 Cc1cc(S)c(C=O)[s]1 Amb24444845 [0,2,0,0,0,0|0,1,0]=3 3449 B9R1.22 Cc1oc(Br)[n]c1C=O Amb22754712 [0,2,0,0,0,0|2,0,0]=4 3450 B9R1.22 Cc1oc(Br)cc1C=O Amb18187311 [0,2,0,0,0,0|2,0,0]=4 3451 B9R1.22 Cc1oc(N)cc1C=O Amb18832842 [0,2,0,0,0,0|2,0,0]=4 3452 B9R1.22 Cn1nc(cc1C=O)C Amb1945989 [0,2,0,0,0,0|2,0,0]=4 3453 B9R1.22 Nc1[n]c(C=O)c(Br)[s]1 Amb24352312 [0,2,0,0,0,0|2,0,0]=4 3454 B9R1.22 Nc1[n]c(C=O)c(Cl)[s]1 Amb24113535 [0,2,0,0,0,0|2,0,0]=4 3455 B9R1.22 Nc1[n]c(C=O)c(I)[s]1 Amb25058544 [0,2,0,0,0,0|2,0,0]=4 3456 B9R1.22 Nc1[n]c(Cl)c(C=O)o1 Amb24574246 [0,2,0,0,0,0|1,0,0]=3 3457 B9R1.22 Nc1cc(Br)[s]c1C=O Amb25699279 [0,2,0,0,0,0|0,1,0]=3 3458 B9R1.22 Nc1cc(Cl)oc1C#N Amb24518925 [0,2,0,0,0,0|1,0,1]=4 3459 B9R1.22 Nc1cc(I)[s]c1C=O Amb25716966 [0,2,0,0,0,0|0,1,0]=3 3460 B9R1.22 O=C1C=C(Br)\C(=C/Br)\O1 Amb24478650 [0,2,0,0,0,0|1,0,0]=3 3461 B9R1.22 O=C1C=C(Cl)\C(=C/Cl)\O1 Amb25210550 [0,2,0,0,0,0|1,0,0]=3 3462 B9R1.22 O=C1N=C(C=O)C(Cl)=N1 Amb25790579 [0,2,0,0,0,0|2,0,0]=4 3463 B9R1.22 O=C1NC(Br)=C(C=O)S1 Amb25790582 [0,2,0,0,0,0|1,1,0]=4 3464 B9R1.22 O=C1NC(Cl)=C(C=O)S1 Amb19148103 [0,2,0,0,0,0|1,1,0]=4 3465 B9R1.22 O=Cc1[nH]c(cc1C)C Amb1031562 [0,2,0,0,0,0|1,0,0]=3 3466 B9R1.22 O=Cc1[nH]c(nc1C)C Amb17593273 [0,2,0,0,0,0|2,0,0]=4 3467 B9R1.22 O=Cc1[n]c(Cl)[s]c1Cl Amb22495270 [0,2,0,0,0,0|2,0,0]=4 3468 B9R1.22 O=Cc1[sH]c(Cl)[nH]c1Cl Amb24476594 [0,2,0,0,0,0|1,1,0]=4 3469 B9R1.22 O=Cc1cc(Br)[s]c1Br Amb21520284 [0,2,0,0,0,0|2,0,0]=4 3470 B9R1.22 O=Cc1cc(Br)[s]c1Cl Amb18134784 [0,2,0,0,0,0|2,0,0]=4 3471 B9R1.22 O=Cc1cc(Cl)[s]c1Br Amb19929813 [0,2,0,0,0,0|2,0,0]=4 3472 B9R1.22 O=Cc1cc([nH]c1C)C Amb1153775 [0,2,0,0,0,0|2,0,0]=4 3473 B9R1.22 O=Cc1oc(Cl)cc1Cl Amb25072805 [0,2,0,0,0,0|0,0,0]=2 3474 B9R1.22 O=Cc1sc(cc1C)C Amb2447440 [0,2,0,0,0,0|0,1,0]=3 3475 B9R1.22 O=Cc1sc(nc1Br)Br Amb10603505 [0,2,0,0,0,0|1,1,0]=4 3476 B9R1.22 O=Cc1sc(nc1Cl)Cl Amb1105526 [0,2,0,0,0,0|1,1,0]=4 3477 B9R1.22 OC1CC(=O)C=C1C=O Amb18642370 [0,2,0,0,0,0|1,0,1]=4 3478 B9R1.22 O[C@@H]1CC(=O)C=C1C=O Amb25277229 [0,2,0,0,0,0|1,0,1]=4 3479 B9R1.22 Oc1[n]c(Cl)c(C=O)[s]1 Amb22058751 [0,2,0,0,0,0|1,1,0]=4 3480 B9R1.22 Oc1cc(C=O)c(Cl)[nH]1 Amb18198136 [0,2,0,0,0,0|2,0,0]=4 3481 B9R1.23 C#Cc1cc(Br)c(Br)o1 Amb25104410 [0,2,0,0,0,0|1,0,1]=4 3482 B9R1.23 C=Cc1cc(Br)c(Br)o1 Amb25340894 [0,2,0,0,0,0|1,0,0]=3 3483 B9R1.23 CC1=CC(CC1=O)=CCl Amb24587086 [0,2,0,0,0,0|2,0,0]=4 3484 B9R1.23 CC1=C\C(=C\Br)\OC1=O Amb25800206 [0,2,0,0,0,0|1,0,0]=3 3485 B9R1.23 CC1=C\C(\CC1=O)=C/C Amb24364089 [0,2,0,0,0,0|2,0,0]=4 3486 B9R1.23 CC1=C\C(\CC1=O)=C/Cl Amb24390340 [0,2,0,0,0,0|2,0,0]=4 3487 B9R1.23 CC1=C\C(\CC1=O)=C\Br Amb24390871 [0,2,0,0,0,0|2,0,0]=4 3488 B9R1.23 CC1=C\C(\CC1=O)=C\C Amb25053114 [0,2,0,0,0,0|2,0,0]=4 3489 B9R1.23 CC1=C\C(\CC1=O)=C\Cl Amb24339422 [0,2,0,0,0,0|2,0,0]=4 3490 B9R1.23 CC1=N\C(=C/C)\OC1=O Amb24558024 [0,2,0,0,0,0|2,0,0]=4 3491 B9R1.23 CN1C=C(C=O)SC1=O Amb19649786 [0,2,0,0,0,0|1,1,0]=4 3492 B9R1.23 C[n]1cc(C=O)[n]c1N Amb24751976 [0,2,0,0,0,0|2,0,0]=4 3493 B9R1.23 C[n]1cc(C=O)[s]c1=S Amb24102390 [0,2,0,0,0,0|1,1,0]=4 3494 B9R1.23 Cc1[nH]c(C=O)[n]c1Cl Amb25310229 [0,2,0,0,0,0|2,0,0]=4 3495 B9R1.23 Cc1[nH]c(C=O)cc1Br Amb21970295 [0,2,0,0,0,0|1,0,0]=3 3496 B9R1.23 Cc1[n]c(C=O)[nH]c1C Amb18832919 [0,2,0,0,0,0|2,0,0]=4 3497 B9R1.23 Cc1[n]c(C=O)[s]c1Br Amb20670840 [0,2,0,0,0,0|1,1,0]=4 3498 B9R1.23 Cc1[n]c(C=O)[s]c1Cl Amb25340839 [0,2,0,0,0,0|1,1,0]=4 3499 B9R1.23 Cc1[n]c(C=O)c[n]1C Amb18832918 [0,2,0,0,0,0|2,0,0]=4 3500 B9R1.23 Cc1[s]c(C=C)cc1Br Amb24524004 [0,2,0,0,0,0|1,1,0]=4 3501 B9R1.23 Cc1[s]c(C=O)[n]c1Br Amb24481846 [0,2,0,0,0,0|1,1,0]=4 3502 B9R1.23 Cc1[s]c(C=O)cc1F Amb18831512 [0,2,0,0,0,0|0,1,0]=3 3503 B9R1.23 Cc1[s]c(C=O)cc1N Amb18831711 [0,2,0,0,0,0|0,1,0]=3 3504 B9R1.23 Cc1[s]c(C=O)cc1S Amb24456716 [0,2,0,0,0,0|0,1,0]=3 3505 B9R1.23 Cc1cc(C=O)[s]c1N Amb18831705 [0,2,0,0,0,0|0,1,0]=3 3506 B9R1.23 Cc1cc(C=O)c[n]1C Amb18832958 [0,2,0,0,0,0|2,0,0]=4 3507 B9R1.23 Cc1cc(C=O)oc1Br Amb18187323 [0,2,0,0,0,0|0,0,0]=2 3508 B9R1.23 Cc1cc(C=O)oc1N Amb18832858 [0,2,0,0,0,0|0,0,0]=2 3509 B9R1.23 Cc1oc(C=O)[n]c1C Amb18832861 [0,2,0,0,0,0|1,0,0]=3 3510 B9R1.23 Cc1oc(C=O)cc1Br Amb18129294 [0,2,0,0,0,0|0,0,0]=2 3511 B9R1.23 Cc1oc(C=O)cc1F Amb18832650 [0,2,0,0,0,0|0,0,0]=2 3512 B9R1.23 Cc1oc(C=O)cc1N Amb18832845 [0,2,0,0,0,0|0,0,0]=2 3513 B9R1.23 Cc1oc(CN)cc1Br Amb23537726 [0,2,0,0,0,0|1,0,1]=4 3514 B9R1.23 Cc1oc(CN)cc1C Amb18642316 [0,2,0,0,0,0|1,0,1]=4 3515 B9R1.23 Cc1oc(CN)cc1N Amb18832726 [0,2,0,0,0,0|1,0,1]=4 3516 B9R1.23 Cc1oc(CO)cc1Br Amb23537832 [0,2,0,0,0,0|0,0,2]=4 3517 B9R1.23 Cc1oc(cc1Br)C#N Amb23537727 [0,2,0,0,0,0|1,0,1]=4 3518 B9R1.23 ClCc1cc(Br)c(Br)o1 Amb25082917 [0,2,0,0,0,0|1,0,1]=4 3519 B9R1.23 Cl[Hg]c1cc(Br)c(Br)o1 Amb22366199 [0,2,0,0,0,0|2,0,0]=4 3520 B9R1.23 N#Cc1cc(Br)c(Br)o1 Amb23537581 [0,2,0,0,0,0|1,0,1]=4 3521 B9R1.23 N#Cc1cc(Br)c(Cl)o1 Amb23539105 [0,2,0,0,0,0|1,0,1]=4 3522 B9R1.23 N#Cc1cc(Cl)c(Cl)o1 Amb23538069 [0,2,0,0,0,0|1,0,1]=4 3523 B9R1.23 NCc1cc(Br)c(Br)o1 Amb23535608 [0,2,0,0,0,0|1,0,1]=4 3524 B9R1.23 Nc1[s]c(C=O)cc1Br Amb25301911 [0,2,0,0,0,0|0,1,0]=3 3525 B9R1.23 Nc1cc(C=O)oc1Br Amb18189507 [0,2,0,0,0,0|0,0,0]=2 3526 B9R1.23 O=C=C1C=C(Cl)C(Cl)=C1 Amb24627991 [0,2,0,0,0,0|1,0,1]=4 3527 B9R1.23 O=Cc1[nH]c(Br)c(Br)[n]1 Amb24678873 [0,2,0,0,0,0|2,0,0]=4 3528 B9R1.23 O=Cc1[nH]c(Cl)c(Cl)[n]1 Amb18646192 [0,2,0,0,0,0|2,0,0]=4 3529 B9R1.23 O=Cc1[nH]c(c(c1)Br)Br Amb10071311 [0,2,0,0,0,0|1,0,0]=3 3530 B9R1.23 O=Cc1[nH]c(c(c1)C)C Amb1031554 [0,2,0,0,0,0|1,0,0]=3 3531 B9R1.23 O=Cc1cc(Br)c(Cl)o1 Amb18131113 [0,2,0,0,0,0|0,0,0]=2 3532 B9R1.23 O=Cc1cc(Cl)c(Cl)[nH]1 Amb22497619 [0,2,0,0,0,0|1,0,0]=3 3533 B9R1.23 O=Cc1cc(Cl)c(Cl)[s]1 Amb18128273 [0,2,0,0,0,0|0,1,0]=3 3534 B9R1.23 O=Cc1cc(Cl)c(Cl)o1 Amb25366256 [0,2,0,0,0,0|0,0,0]=2 3535 B9R1.23 O=Cc1cc(I)c(I)[nH]1 Amb24478751 [0,2,0,0,0,0|1,0,0]=3 3536 B9R1.23 O=Cc1cc(c(s1)Br)C Amb2447432 [0,2,0,0,0,0|0,1,0]=3 3537 B9R1.23 O=Cc1nn(c(c1)C)C Amb1946178 [0,2,0,0,0,0|2,0,0]=4 3538 B9R1.23 O=Cc1oc(c(c1)Br)Br Amb1799053 [0,2,0,0,0,0|0,0,0]=2 3539 B9R1.23 O=Cc1sc(c(c1)Br)Br Amb1935055 [0,2,0,0,0,0|0,1,0]=3 3540 B9R1.23 O=Cc1sc(c(n1)C)C Amb17399870 [0,2,0,0,0,0|1,1,0]=4 3541 B9R1.23 OCc1cc(Br)c(Cl)o1 Amb23539104 [0,2,0,0,0,0|0,0,2]=4 3542 B9R1.35 BrC(=O)c1ccc(Br)o1 Amb17939056 [0,2,0,0,0,0|0,0,0]=2 3543 B9R1.35 Brc1occ(c1)C(=O)O Amb1111481 [0,2,0,0,0,0|2,0,0]=4 3544 B9R1.35 Brc1scc(c1)C(=O)C Amb10603337 [0,2,0,0,0,0|2,0,0]=4 3545 B9R1.35 Brc1scc(c1)C(=O)O Amb2372549 [0,2,0,0,0,0|2,0,0]=4 3546 B9R1.35 C=C1CC(=CC1)C(O)=O Amb25093101 [0,2,0,0,0,0|1,0,1]=4 3547 B9R1.35 CC(=C)c1cc(Br)co1 Amb24596524 [0,2,0,0,0,0|1,0,0]=3 3548 B9R1.35 CC(=C)c1ccc(Cl)[s]1 Amb25255902 [0,2,0,0,0,0|1,1,0]=4 3549 B9R1.35 CC(=O)C1=CC(=O)ON1 Amb24666901 [0,2,0,0,0,0|2,0,0]=4 3550 B9R1.35 CC(=O)C1=CC(=O)SS1 Amb25767902 [0,2,0,0,0,0|1,1,0]=4 3551 B9R1.35 CC(=O)C1=CC(=S)SS1 Amb25112552 [0,2,0,0,0,0|1,1,0]=4 3552 B9R1.35 CC(=O)C1=CCC(=N)S1 Amb25728918 [0,2,0,0,0,0|0,1,1]=4 3553 B9R1.35 CC(=O)C1=CCC(O)O1 Amb25092439 [0,2,0,0,0,0|0,0,2]=4 3554 B9R1.35 CC(=O)C1=CSC(=S)N1 Amb25227392 [0,2,0,0,0,0|2,0,0]=4 3555 B9R1.35 CC(=O)C1CC(=O)C=C1 Amb25851582 [0,2,0,0,0,0|1,0,1]=4 3556 B9R1.35 CC(=O)C=1CC(=O)NC1 Amb24669843 [0,2,0,0,0,0|2,0,0]=4 3557 B9R1.35 CC(=O)N1C=CC(=O)N1 Amb24481715 [0,2,0,0,0,0|2,0,0]=4 3558 B9R1.35 CC(=O)N1CC(=O)C=C1 Amb24062029 [0,2,0,0,0,0|2,0,0]=4 3559 B9R1.35 CC(=O)[n]1cc(F)c[n]1 Amb23400558 [0,2,0,0,0,0|2,0,0]=4 3560 B9R1.35 CC(=O)[n]1cc(N)cc1 Amb24482008 [0,2,0,0,0,0|2,0,0]=4 3561 B9R1.35 CC(=O)c1[nH]c(Br)c[n]1 Amb24536108 [0,2,0,0,0,0|2,0,0]=4 3562 B9R1.35 CC(=O)c1[nH]cc(Cl)[n]1 Amb24756826 [0,2,0,0,0,0|2,0,0]=4 3563 B9R1.35 CC(=O)c1[n][n]c(Br)o1 Amb18819022 [0,2,0,0,0,0|2,0,0]=4 3564 B9R1.35 CC(=O)c1[n][n]c(N)o1 Amb18124317 [0,2,0,0,0,0|2,0,0]=4 3565 B9R1.35 CC(=O)c1[n]c(Br)[n]o1 Amb18819017 [0,2,0,0,0,0|2,0,0]=4 3566 B9R1.35 CC(=O)c1[n]c(Br)c[s]1 Amb24321383 [0,2,0,0,0,0|1,1,0]=4 3567 B9R1.35 CC(=O)c1[n]c(N)[n]o1 Amb18203288 [0,2,0,0,0,0|2,0,0]=4 3568 B9R1.35 CC(=O)c1[n]cc(I)[s]1 Amb24532854 [0,2,0,0,0,0|1,1,0]=4 3569 B9R1.35 CC(=O)c1c[nH]c(N)[n]1 Amb18642280 [0,2,0,0,0,0|2,0,0]=4 3570 B9R1.35 CC(=O)c1c[n](C)c[n]1 Amb23399836 [0,2,0,0,0,0|2,0,0]=4 3571 B9R1.35 CC(=O)c1c[n]c(Br)[s]1 Amb18176255 [0,2,0,0,0,0|1,1,0]=4 3572 B9R1.35 CC(=O)c1c[n]c(Cl)[nH]1 Amb25042017 [0,2,0,0,0,0|2,0,0]=4 3573 B9R1.35 CC(=O)c1c[n]c(Cl)[s]1 Amb25202568 [0,2,0,0,0,0|1,1,0]=4 3574 B9R1.35 CC(=O)c1c[n]c(F)[s]1 Amb25247555 [0,2,0,0,0,0|1,1,0]=4 3575 B9R1.35 CC(=O)c1c[n]c(N)[s]1 Amb19515342 [0,2,0,0,0,0|1,1,0]=4 3576 B9R1.35 CC(=O)c1c[n]c(S)[s]1 Amb19882270 [0,2,0,0,0,0|1,1,0]=4 3577 B9R1.35 CC(=O)c1c[s]c(Br)[n]1 Amb25103826 [0,2,0,0,0,0|2,0,0]=4 3578 B9R1.35 CC(=O)c1c[s]c(Cl)[n]1 Amb19944607 [0,2,0,0,0,0|2,0,0]=4 3579 B9R1.35 CC(=O)c1c[s]c(F)c1 Amb18202409 [0,2,0,0,0,0|2,0,0]=4 3580 B9R1.35 CC(=O)c1c[s]c(I)c1 Amb25785696 [0,2,0,0,0,0|2,0,0]=4 3581 B9R1.35 CC(=O)c1c[s]c(N)[n]1 Amb19888625 [0,2,0,0,0,0|2,0,0]=4 3582 B9R1.35 CC(=O)c1c[s]c(N)[n]1 Amb21954270 [0,2,0,0,0,0|2,0,0]=4 3583 B9R1.35 CC(=O)c1c[s]c(O)[n]1 Amb25243684 [0,2,0,0,0,0|2,0,0]=4 3584 B9R1.35 CC(=O)c1cc(Br)[n]o1 Amb18190978 [0,2,0,0,0,0|1,0,0]=3 3585 B9R1.35 CC(=O)c1cc(Br)co1 Amb25780956 [0,2,0,0,0,0|0,0,0]=2 3586 B9R1.35 CC(=O)c1cc(Cl)[nH][n]1 Amb25217261 [0,2,0,0,0,0|2,0,0]=4 3587 B9R1.35 CC(=O)c1cc(F)c[s]1 Amb18831508 [0,2,0,0,0,0|0,1,0]=3 3588 B9R1.35 CC(=O)c1cc(I)c[nH]1 Amb22498099 [0,2,0,0,0,0|1,0,0]=3 3589 B9R1.35 CC(=O)c1cc(I)c[s]1 Amb22751276 [0,2,0,0,0,0|0,1,0]=3 3590 B9R1.35 CC(=O)c1cc(N)[n][nH]1 Amb18832823 [0,2,0,0,0,0|2,0,0]=4 3591 B9R1.35 CC(=O)c1cc(N)[n][nH]1 Amb23439101 [0,2,0,0,0,0|2,0,0]=4 3592 B9R1.35 CC(=O)c1cc(N)[n]o1 Amb18832777 [0,2,0,0,0,0|1,0,0]=3 3593 B9R1.35 CC(=O)c1cc(N)c[nH]1 Amb18142624 [0,2,0,0,0,0|1,0,0]=3 3594 B9R1.35 CC(=O)c1cc(N)c[s]1 Amb18678229 [0,2,0,0,0,0|0,1,0]=3 3595 B9R1.35 CC(=O)c1cc(O)o[n]1 Amb25174380 [0,2,0,0,0,0|2,0,0]=4 3596 B9R1.35 CC(=O)c1cc(c[nH]1)Cl Amb10601713 [0,2,0,0,0,0|1,0,0]=3 3597 B9R1.35 CC(=O)c1cc(cs1)Br Amb1946493 [0,2,0,0,0,0|0,1,0]=3 3598 B9R1.35 CC(=O)c1ccc(Br)o1 Amb18678443 [0,2,0,0,0,0|0,0,0]=2 3599 B9R1.35 CC(=O)c1ccc(Cl)[nH]1 Amb24383198 [0,2,0,0,0,0|1,0,0]=3 3600 B9R1.35 CC(=O)c1ccc(Cl)o1 Amb24476595 [0,2,0,0,0,0|0,0,0]=2 3601 B9R1.35 CC(=O)c1ccc(F)[s]1 Amb18831509 [0,2,0,0,0,0|0,1,0]=3 3602 B9R1.35 CC(=O)c1ccc(F)o1 Amb24569531 [0,2,0,0,0,0|0,0,0]=2 3603 B9R1.35 CC(=O)c1ccc(I)[s]1 Amb19886673 [0,2,0,0,0,0|0,1,0]=3 3604 B9R1.35 CC(=O)c1ccc(I)o1 Amb24678169 [0,2,0,0,0,0|0,0,0]=2 3605 B9R1.35 CC(=O)c1ccc(N)o1 Amb18642262 [0,2,0,0,0,0|0,0,0]=2 3606 B9R1.35 CC(=O)c1ccc(S)[s]1 Amb25706073 [0,2,0,0,0,0|0,1,0]=3 3607 B9R1.35 CC(=O)c1ccc(S)o1 Amb25376412 [0,2,0,0,0,0|0,0,0]=2 3608 B9R1.35 CC(=O)c1ccc([nH]1)Br Amb10601714 [0,2,0,0,0,0|1,0,0]=3 3609 B9R1.35 CC(=O)c1ccc([nH]1)C Amb17593258 [0,2,0,0,0,0|1,0,0]=3 3610 B9R1.35 CC(=O)c1ccc([nH]1)I Amb10601715 [0,2,0,0,0,0|1,0,0]=3 3611 B9R1.35 CC(=O)c1ccc(s1)Br Amb1151096 [0,2,0,0,0,0|0,1,0]=3 3612 B9R1.35 CC(=O)c1ccc(s1)Cl Amb1148733 [0,2,0,0,0,0|0,1,0]=3 3613 B9R1.35 CC(=O)c1ccc(s1)N Amb17477841 [0,2,0,0,0,0|0,1,0]=3 3614 B9R1.35 CC(=O)c1cnc([nH]1)C Amb17593272 [0,2,0,0,0,0|2,0,0]=4 3615 B9R1.35 CC(=O)c1cnc(o1)N Amb17231842 [0,2,0,0,0,0|1,0,0]=3 3616 B9R1.35 CC(=O)c1cnc(s1)N Amb10605732 [0,2,0,0,0,0|1,1,0]=4 3617 B9R1.35 CC(=O)c1coc(Cl)[n]1 Amb25070464 [0,2,0,0,0,0|2,0,0]=4 3618 B9R1.35 CC(=O)c1csc([nH+]1)C Amb2410562 [0,2,0,0,0,0|2,0,0]=4 3619 B9R1.35 CC(=O)n1cc(cn1)I Amb15693384 [0,2,0,0,0,0|2,0,0]=4 3620 B9R1.35 CC(Br)c1ccc(Br)o1 Amb24444085 [0,2,0,0,0,0|1,0,1]=4 3621 B9R1.35 CC(C)=C1C=C(C)C=C1 Amb24399879 [0,2,0,0,0,0|2,0,0]=4 3622 B9R1.35 CC(C)=C1C=CC(=O)N1 Amb25119174 [0,2,0,0,0,0|2,0,0]=4 3623 B9R1.35 CC(C)=C1C=CC(=O)O1 Amb25663354 [0,2,0,0,0,0|1,0,0]=3 3624 B9R1.35 CC(C)=C1C=CC(=O)S1 Amb24756741 [0,2,0,0,0,0|1,1,0]=4 3625 B9R1.35 CC(N)c1cc(Br)co1 Amb24746809 [0,2,0,0,0,0|1,0,1]=4 3626 B9R1.35 CC(N)c1cc(F)co1 Amb24480319 [0,2,0,0,0,0|1,0,1]=4 3627 B9R1.35 CC(O)c1ccc(Cl)o1 Amb24554790 [0,2,0,0,0,0|0,0,2]=4 3628 B9R1.35 CC(c1ccc(o1)Br)C Amb10600622 [0,2,0,0,0,0|1,0,1]=4 3629 B9R1.35 CC(c1ccc(o1)N)C Amb10600623 [0,2,0,0,0,0|1,0,1]=4 3630 B9R1.35 CC1C=CC(O1)C(O)=O Amb18642586 [0,2,0,0,0,0|0,0,2]=4 3631 B9R1.35 CN(C)c1ccc(Br)o1 Amb24317621 [0,2,0,0,0,0|2,0,0]=4 3632 B9R1.35 CN(C)c1ccc(O)o1 Amb25830511 [0,2,0,0,0,0|2,0,0]=4 3633 B9R1.35 C[C@@H](N)c1cc(Cl)co1 Amb24611768 [0,2,0,0,0,0|1,0,1]=4 3634 B9R1.35 C[C@@H](N)c1cc(O)co1 Amb24605618 [0,2,0,0,0,0|1,0,1]=4 3635 B9R1.35 C[C@@H](N)c1ccc(F)o1 Amb24572823 [0,2,0,0,0,0|1,0,1]=4 3636 B9R1.35 C[C@@H](N)c1ccc(N)o1 Amb25121513 [0,2,0,0,0,0|1,0,1]=4 3637 B9R1.35 C[C@H](N)c1cc(N)co1 Amb25300413 [0,2,0,0,0,0|1,0,1]=4 3638 B9R1.35 C[C@H](N)c1cc(O)co1 Amb25327387 [0,2,0,0,0,0|1,0,1]=4 3639 B9R1.35 C[C@H](N)c1ccc(N)o1 Amb25185372 [0,2,0,0,0,0|1,0,1]=4 3640 B9R1.35 C[n]1cc(cc1)C(=O)Cl Amb25222626 [0,2,0,0,0,0|2,0,0]=4 3641 B9R1.35 C[n]1cc(cc1)C(N)=O Amb18243390 [0,2,0,0,0,0|2,0,0]=4 3642 B9R1.35 Cc1[nH]c(c[n]1)C(N)=O Amb24340093 [0,2,0,0,0,0|2,0,0]=4 3643 B9R1.35 Cc1[nH]cc([n]1)C(O)=O Amb22587025 [0,2,0,0,0,0|2,0,0]=4 3644 B9R1.35 Cc1[n][n]c(o1)C(=O)Cl Amb22169651 [0,2,0,0,0,0|2,0,0]=4 3645 B9R1.35 Cc1[n][n]c(o1)C(C)=O Amb22898820 [0,2,0,0,0,0|2,0,0]=4 3646 B9R1.35 Cc1[n][n]c(o1)C([O-])=O Amb21937025 [0,2,0,0,0,0|2,0,0]=4 3647 B9R1.35 Cc1[n][n]c(o1)C([O-])=O Amb22499708 [0,2,0,0,0,0|2,0,0]=4 3648 B9R1.35 Cc1[n]c(c[s]1)C(C)=O Amb20622917 [0,2,0,0,0,0|2,0,0]=4 3649 B9R1.35 Cc1[n]c(c[s]1)C(O)=O Amb22587710 [0,2,0,0,0,0|2,0,0]=4 3650 B9R1.35 Cc1[n]c(co1)C(=O)Cl Amb22736505 [0,2,0,0,0,0|2,0,0]=4 3651 B9R1.35 Cc1[n]c(co1)C(C)=O Amb18832850 [0,2,0,0,0,0|2,0,0]=4 3652 B9R1.35 Cc1[n]c(o[n]1)C(O)=O Amb18687563 [0,2,0,0,0,0|2,0,0]=4 3653 B9R1.35 Cc1[n]c(o[n]1)C([O-])=O Amb21963031 [0,2,0,0,0,0|2,0,0]=4 3654 B9R1.35 Cc1[n]cc([s]1)C(=O)Cl Amb24084612 [0,2,0,0,0,0|1,1,0]=4 3655 B9R1.35 Cc1[n]cc([s]1)C(C)=O Amb19882144 [0,2,0,0,0,0|1,1,0]=4 3656 B9R1.35 Cc1[n]cc(o1)C(C)=O Amb23437343 [0,2,0,0,0,0|1,0,0]=3 3657 B9R1.35 Cc1[n]cc(o1)C(N)=O Amb22276048 [0,2,0,0,0,0|1,0,0]=3 3658 B9R1.35 Cc1[n]cc(o1)[N+]([O-])=O Amb24511571 [0,2,0,0,0,0|2,0,0]=4 3659 B9R1.35 Cc1[n]oc([n]1)C(C)=O Amb18138552 [0,2,0,0,0,0|2,0,0]=4 3660 B9R1.35 Cc1c[nH]c([n]1)C(O)=O Amb22587724 [0,2,0,0,0,0|2,0,0]=4 3661 B9R1.35 Cc1c[nH]c(n1)C(=O)C Amb15701563 [0,2,0,0,0,0|2,0,0]=4 3662 B9R1.35 Cc1c[n]([n]c1)C(N)=O Amb24713542 [0,2,0,0,0,0|2,0,0]=4 3663 B9R1.35 Cc1c[n]c([nH]1)C(=O)Cl Amb24636865 [0,2,0,0,0,0|2,0,0]=4 3664 B9R1.35 Cc1c[n]c([nH]1)C(N)=O Amb24520095 [0,2,0,0,0,0|2,0,0]=4 3665 B9R1.35 Cc1c[n]c([s]1)C(C)=O Amb18831720 [0,2,0,0,0,0|1,1,0]=4 3666 B9R1.35 Cc1c[n]c([s]1)C([O-])=O Amb19958312 [0,2,0,0,0,0|1,1,0]=4 3667 B9R1.35 Cc1c[n]c(o1)C(C)=O Amb18832862 [0,2,0,0,0,0|1,0,0]=3 3668 B9R1.35 Cc1c[n]c(o1)C(O)=O Amb18832708 [0,2,0,0,0,0|1,0,0]=3 3669 B9R1.35 Cc1c[n]c(o1)C([O-])=O Amb24183598 [0,2,0,0,0,0|1,0,0]=3 3670 B9R1.35 Cc1c[s]c([n]1)C(C)=O Amb22347859 [0,2,0,0,0,0|1,1,0]=4 3671 B9R1.35 Cc1c[s]c([n]1)C([O-])=O Amb21955319 [0,2,0,0,0,0|1,1,0]=4 3672 B9R1.35 Cc1cc([nH][n]1)C(=O)Cl Amb24477859 [0,2,0,0,0,0|2,0,0]=4 3673 B9R1.35 Cc1cc([nH][n]1)C(C)=O Amb18832906 [0,2,0,0,0,0|2,0,0]=4 3674 B9R1.35 Cc1cc([nH][n]1)C(O)=O Amb19958136 [0,2,0,0,0,0|2,0,0]=4 3675 B9R1.35 Cc1cc([nH]c1)C(N)=O Amb24476641 [0,2,0,0,0,0|1,0,0]=3 3676 B9R1.35 Cc1cc([n][s]1)C(C)=O Amb18831706 [0,2,0,0,0,0|2,0,0]=4 3677 B9R1.35 Cc1cc([n][s]1)C(N)=O Amb24722380 [0,2,0,0,0,0|2,0,0]=4 3678 B9R1.35 Cc1cc([n][s]1)C(O)=O Amb18202486 [0,2,0,0,0,0|2,0,0]=4 3679 B9R1.35 Cc1cc([n]o1)C(C)=O Amb21964495 [0,2,0,0,0,0|2,0,0]=4 3680 B9R1.35 Cc1cc([s][n]1)C(C)=O Amb18831719 [0,2,0,0,0,0|1,1,0]=4 3681 B9R1.35 Cc1cc([s]c1)[N+]([O-])=O Amb24524204 [0,2,0,0,0,0|1,1,0]=4 3682 B9R1.35 Cc1cc(c[s]1)C(C)=O Amb22494674 [0,2,0,0,0,0|2,0,0]=4 3683 B9R1.35 Cc1cc(c[s]1)C(N)=O Amb25700357 [0,2,0,0,0,0|2,0,0]=4 3684 B9R1.35 Cc1cc(c[s]1)C(O)=O Amb17659438 [0,2,0,0,0,0|2,0,0]=4 3685 B9R1.35 Cc1cc(co1)C(=O)Cl Amb25742363 [0,2,0,0,0,0|2,0,0]=4 3686 B9R1.35 Cc1cc(co1)C(N)=O Amb23589835 [0,2,0,0,0,0|2,0,0]=4 3687 B9R1.35 Cc1cc(n[nH]1)C(=O)O Amb1136645 [0,2,0,0,0,0|2,0,0]=4 3688 B9R1.35 Cc1cc(o[n]1)C(C)=O Amb18672024 [0,2,0,0,0,0|1,0,0]=3 3689 B9R1.35 Cc1cc(o[n]1)C(N)=O Amb22295917 [0,2,0,0,0,0|1,0,0]=3 3690 B9R1.35 Cc1cc(oc1)C(O)=O Amb18642368 [0,2,0,0,0,0|0,0,0]=2 3691 B9R1.35 Cc1cc(sn1)C(=O)O Amb17593610 [0,2,0,0,0,0|1,1,0]=4 3692 B9R1.35 Cc1ccc([nH]1)C(N)=O Amb25277435 [0,2,0,0,0,0|1,0,0]=3 3693 B9R1.35 Cc1ccc([s]1)C(C)=C Amb24478627 [0,2,0,0,0,0|1,1,0]=4 3694 B9R1.35 Cc1ccc([s]1)S(=O)Cl Amb25179362 [0,2,0,0,0,0|1,1,0]=4 3695 B9R1.35 Cc1ccc([s]1)S([O-])=O Amb24753008 [0,2,0,0,0,0|1,1,0]=4 3696 B9R1.35 Cc1ccc(o1)B(C)C Amb25239116 [0,2,0,0,0,0|2,0,0]=4 3697 B9R1.35 Cc1ccc(o1)B(O)O Amb22586674 [0,2,0,0,0,0|1,0,1]=4 3698 B9R1.35 Cc1ccc(o1)C(=O)C Amb1154368 [0,2,0,0,0,0|0,0,0]=2 3699 B9R1.35 Cc1ccc(o1)C(C)=C Amb24716757 [0,2,0,0,0,0|1,0,0]=3 3700 B9R1.35 Cc1ccc(o1)C(C)C Amb22749543 [0,2,0,0,0,0|1,0,1]=4 3701 B9R1.35 Cc1ccc(o1)C(N)=N Amb21959999 [0,2,0,0,0,0|1,0,0]=3 3702 B9R1.35 Cc1ccc(o1)C(O)O Amb24679355 [0,2,0,0,0,0|0,0,2]=4 3703 B9R1.35 Cc1ccc(o1)[C@@H](N)C Amb13952995 [0,2,0,0,0,0|1,0,1]=4 3704 B9R1.35 Cc1ccc(o1)[C@@H](O)C Amb13952992 [0,2,0,0,0,0|0,0,2]=4 3705 B9R1.35 Cc1ccc(o1)[C@H](N)C Amb13952993 [0,2,0,0,0,0|1,0,1]=4 3706 B9R1.35 Cc1ccc(o1)[C@H](O)C Amb13952991 [0,2,0,0,0,0|0,0,2]=4 3707 B9R1.35 Cc1ccc(s1)C(=N)N Amb17601556 [0,2,0,0,0,0|1,1,0]=4 3708 B9R1.35 Cc1ccc(s1)C(=O)C Amb1153736 [0,2,0,0,0,0|0,1,0]=3 3709 B9R1.35 Cc1ccc(s1)C(=O)O Amb1157149 [0,2,0,0,0,0|0,1,0]=3 3710 B9R1.35 Cc1coc([n]1)C(C)=O Amb21963773 [0,2,0,0,0,0|1,0,0]=3 3711 B9R1.35 Cc1coc([n]1)C(N)=N Amb24545783 [0,2,0,0,0,0|2,0,0]=4 3712 B9R1.35 Cc1coc([n]1)C(O)=O Amb18832706 [0,2,0,0,0,0|1,0,0]=3 3713 B9R1.35 Cc1coc(c1)C(C)C Amb25223545 [0,2,0,0,0,0|1,0,1]=4 3714 B9R1.35 Cc1coc(c1)C(C)N Amb18203314 [0,2,0,0,0,0|1,0,1]=4 3715 B9R1.35 Cc1ncc([nH]1)C(=O)O Amb17617498 [0,2,0,0,0,0|2,0,0]=4 3716 B9R1.35 Cc1ncc(o1)C(=O)O Amb17399815 [0,2,0,0,0,0|1,0,0]=3 3717 B9R1.35 Cc1ncc(s1)C(=O)N Amb13952295 [0,2,0,0,0,0|1,1,0]=4 3718 B9R1.35 Cc1occ(c1)C(=O)O Amb16231454 [0,2,0,0,0,0|2,0,0]=4 3719 B9R1.35 Cc1scc(c1)C(=O)Cl Amb16230125 [0,2,0,0,0,0|2,0,0]=4 3720 B9R1.35 Clc1ccc(s1)S(=O)=O Amb17953409 [0,2,0,0,0,0|1,1,0]=4 3721 B9R1.35 Clc1ccc(s1)S(=O)=O Amb17953410 [0,2,0,0,0,0|1,1,0]=4 3722 B9R1.35 Cn1cc(nc1)C(=O)Cl Amb16185771 [0,2,0,0,0,0|2,0,0]=4 3723 B9R1.35 Cn1cc(nc1)C(=O)O Amb1092551 [0,2,0,0,0,0|2,0,0]=4 3724 B9R1.35 Cn1ccc(c1)C(=O)O Amb10603441 [0,2,0,0,0,0|2,0,0]=4 3725 B9R1.35 Cn1ccc(n1)C(=O)C Amb1946513 [0,2,0,0,0,0|2,0,0]=4 3726 B9R1.35 Cn1ccc(n1)C(=O)O Amb1101992 [0,2,0,0,0,0|2,0,0]=4 3727 B9R1.35 FC(F)c1ccc(I)o1 Amb22008359 [0,2,0,0,0,0|1,0,1]=4 3728 B9R1.35 Ic1occ(c1)C(=O)O Amb13952880 [0,2,0,0,0,0|2,0,0]=4 3729 B9R1.35 Ic1scc(c1)C(=O)O Amb13952879 [0,2,0,0,0,0|2,0,0]=4 3730 B9R1.35 NC(=N)c1cc(Cl)c[s]1 Amb23447090 [0,2,0,0,0,0|1,1,0]=4 3731 B9R1.35 NC(=N)c1ccc(F)[s]1 Amb24476663 [0,2,0,0,0,0|1,1,0]=4 3732 B9R1.35 NC(=N)c1ccc(o1)I Amb16240317 [0,2,0,0,0,0|1,0,0]=3 3733 B9R1.35 NC(=N)c1ccc(o1)I Amb17601640 [0,2,0,0,0,0|1,0,0]=3 3734 B9R1.35 NC(=N)c1ccc(s1)Br Amb17601641 [0,2,0,0,0,0|1,1,0]=4 3735 B9R1.35 NC(=N)c1ccc(s1)Cl Amb10609838 [0,2,0,0,0,0|1,1,0]=4 3736 B9R1.35 NC(=O)C1=CC(=O)NN1 Amb25339416 [0,2,0,0,0,0|2,0,0]=4 3737 B9R1.35 NC(=O)C1=CC(=O)SS1 Amb25349084 [0,2,0,0,0,0|1,1,0]=4 3738 B9R1.35 NC(=O)C1=CSC(=S)N1 Amb24099747 [0,2,0,0,0,0|2,0,0]=4 3739 B9R1.35 NC(=O)[n]1cc(Br)c[n]1 Amb24053200 [0,2,0,0,0,0|2,0,0]=4 3740 B9R1.35 NC(=O)c1[nH]cc(Br)[n]1 Amb22495066 [0,2,0,0,0,0|2,0,0]=4 3741 B9R1.35 NC(=O)c1[n][n]c(S)o1 Amb25340487 [0,2,0,0,0,0|2,0,0]=4 3742 B9R1.35 NC(=O)c1[n]cc(Br)[s]1 Amb22233825 [0,2,0,0,0,0|1,1,0]=4 3743 B9R1.35 NC(=O)c1[n]cc(Cl)[s]1 Amb22753105 [0,2,0,0,0,0|1,1,0]=4 3744 B9R1.35 NC(=O)c1[n]cc(I)[s]1 Amb22753109 [0,2,0,0,0,0|1,1,0]=4 3745 B9R1.35 NC(=O)c1c[nH]c(Br)c1 Amb24473487 [0,2,0,0,0,0|2,0,0]=4 3746 B9R1.35 NC(=O)c1c[nH]c(F)[n]1 Amb24614006 [0,2,0,0,0,0|2,0,0]=4 3747 B9R1.35 NC(=O)c1c[n]c(Br)[s]1 Amb19958304 [0,2,0,0,0,0|1,1,0]=4 3748 B9R1.35 NC(=O)c1c[n]c(Cl)[s]1 Amb24093636 [0,2,0,0,0,0|1,1,0]=4 3749 B9R1.35 NC(=O)c1c[s]c(I)[n]1 Amb25237542 [0,2,0,0,0,0|2,0,0]=4 3750 B9R1.35 NC(=O)c1c[s]c(I)c1 Amb20643996 [0,2,0,0,0,0|2,0,0]=4 3751 B9R1.35 NC(=O)c1c[s]c(O)[n]1 Amb25075863 [0,2,0,0,0,0|2,0,0]=4 3752 B9R1.35 NC(=O)c1cc(Br)[nH][n]1 Amb23402762 [0,2,0,0,0,0|2,0,0]=4 3753 B9R1.35 NC(=O)c1cc(Br)[n]o1 Amb22276047 [0,2,0,0,0,0|1,0,0]=3 3754 B9R1.35 NC(=O)c1cc(Br)co1 Amb22044254 [0,2,0,0,0,0|0,0,0]=2 3755 B9R1.35 NC(=O)c1cc(Cl)[n][s]1 Amb24684396 [0,2,0,0,0,0|1,1,0]=4 3756 B9R1.35 NC(=O)c1cc(Cl)c[nH]1 Amb24639906 [0,2,0,0,0,0|1,0,0]=3 3757 B9R1.35 NC(=O)c1cc(Cl)c[s]1 Amb24480032 [0,2,0,0,0,0|0,1,0]=3 3758 B9R1.35 NC(=O)c1cc(F)c[nH]1 Amb23412353 [0,2,0,0,0,0|1,0,0]=3 3759 B9R1.35 NC(=O)c1cc(I)c[nH]1 Amb22498454 [0,2,0,0,0,0|1,0,0]=3 3760 B9R1.35 NC(=O)c1cc(O)[n]o1 Amb22495931 [0,2,0,0,0,0|1,0,0]=3 3761 B9R1.35 NC(=O)c1cc(O)o[n]1 Amb24657236 [0,2,0,0,0,0|2,0,0]=4 3762 B9R1.35 NC(=O)c1cc(S)c[s]1 Amb24524226 [0,2,0,0,0,0|0,1,0]=3 3763 B9R1.35 NC(=O)c1cc(ns1)O Amb17615451 [0,2,0,0,0,0|1,1,0]=4 3764 B9R1.35 NC(=O)c1ccc(Br)[nH]1 Amb21857251 [0,2,0,0,0,0|1,0,0]=3 3765 B9R1.35 NC(=O)c1ccc(F)[s]1 Amb23449713 [0,2,0,0,0,0|0,1,0]=3 3766 B9R1.35 NC(=O)c1ccc(I)[nH]1 Amb22498374 [0,2,0,0,0,0|1,0,0]=3 3767 B9R1.35 NC(=O)c1ccc(S)o1 Amb24093660 [0,2,0,0,0,0|0,0,0]=2 3768 B9R1.35 NC(=O)c1ccc(s1)Cl Amb1948780 [0,2,0,0,0,0|0,1,0]=3 3769 B9R1.35 NC(=O)c1coc(Br)[n]1 Amb22490827 [0,2,0,0,0,0|2,0,0]=4 3770 B9R1.35 NC(=O)c1coc(Br)c1 Amb20626410 [0,2,0,0,0,0|2,0,0]=4 3771 B9R1.35 NC(=O)c1coc(Cl)[n]1 Amb22496227 [0,2,0,0,0,0|2,0,0]=4 3772 B9R1.35 NC(=O)c1coc(Cl)c1 Amb25301661 [0,2,0,0,0,0|2,0,0]=4 3773 B9R1.35 NC(=O)c1csc(n1)Br Amb10602040 [0,2,0,0,0,0|2,0,0]=4 3774 B9R1.35 NC(=O)c1csc(n1)Cl Amb10608523 [0,2,0,0,0,0|2,0,0]=4 3775 B9R1.35 NC(=O)c1n[nH]c(c1)N Amb15701310 [0,2,0,0,0,0|2,0,0]=4 3776 B9R1.35 NC(=S)c1ccc(o1)Br Amb1117160 [0,2,0,0,0,0|0,1,0]=3 3777 B9R1.35 NC1COC(=C1)C(O)=O Amb18642690 [0,2,0,0,0,0|0,0,2]=4 3778 B9R1.35 NS(=O)c1ccc(Cl)[s]1 Amb24077125 [0,2,0,0,0,0|1,1,0]=4 3779 B9R1.35 N[C@H]1COC(=C1)C(O)=O Amb24640906 [0,2,0,0,0,0|0,0,2]=4 3780 B9R1.35 N[n]1cc(cc1)C(O)=O Amb23447035 [0,2,0,0,0,0|2,0,0]=4 3781 B9R1.35 N[n]1ccc([n]1)C(O)=O Amb18642484 [0,2,0,0,0,0|2,0,0]=4 3782 B9R1.35 Nc1[nH]c(c[n]1)C(N)=O Amb24623709 [0,2,0,0,0,0|2,0,0]=4 3783 B9R1.35 Nc1[nH]cc([n]1)C(O)=O Amb21864810 [0,2,0,0,0,0|2,0,0]=4 3784 B9R1.35 Nc1[n][n]c(o1)C(O)=O Amb18832581 [0,2,0,0,0,0|2,0,0]=4 3785 B9R1.35 Nc1[n]c(c[s]1)C(=O)Cl Amb24099734 [0,2,0,0,0,0|2,0,0]=4 3786 B9R1.35 Nc1[n]c(c[s]1)C(O)=O Amb21927716 [0,2,0,0,0,0|2,0,0]=4 3787 B9R1.35 Nc1[n]c(co1)C(N)=O Amb24383446 [0,2,0,0,0,0|2,0,0]=4 3788 B9R1.35 Nc1[n]cc(o1)C(N)=O Amb23400984 [0,2,0,0,0,0|1,0,0]=3 3789 B9R1.35 Nc1[n]cc(o1)C(O)=O Amb19959202 [0,2,0,0,0,0|1,0,0]=3 3790 B9R1.35 Nc1c[nH]c([n]1)C(O)=O Amb21962133 [0,2,0,0,0,0|2,0,0]=4 3791 B9R1.35 Nc1c[n][n](c1)C(N)=O Amb24636856 [0,2,0,0,0,0|2,0,0]=4 3792 B9R1.35 Nc1c[n]c([s]1)C(N)=O Amb22489884 [0,2,0,0,0,0|1,1,0]=4 3793 B9R1.35 Nc1c[n]c([s]1)C(O)=O Amb22235290 [0,2,0,0,0,0|1,1,0]=4 3794 B9R1.35 Nc1c[n]c([s]1)C(O)=O Amb22899439 [0,2,0,0,0,0|1,1,0]=4 3795 B9R1.35 Nc1cc([nH]c1)C(O)=O Amb18945036 [0,2,0,0,0,0|1,0,0]=3 3796 B9R1.35 Nc1cc([n][nH]1)C(N)=O Amb22587265 [0,2,0,0,0,0|2,0,0]=4 3797 B9R1.35 Nc1cc([n]o1)C(N)=O Amb25858665 [0,2,0,0,0,0|2,0,0]=4 3798 B9R1.35 Nc1cc([n]o1)C(O)=O Amb18832652 [0,2,0,0,0,0|2,0,0]=4 3799 B9R1.35 Nc1cc([s]c1)C(O)=O Amb18124637 [0,2,0,0,0,0|0,1,0]=3 3800 B9R1.35 Nc1cc(c[s]1)C(N)=O Amb24744487 [0,2,0,0,0,0|2,0,0]=4 3801 B9R1.35 Nc1cc(c[s]1)C(O)=O Amb18280928 [0,2,0,0,0,0|2,0,0]=4 3802 B9R1.35 Nc1cc(n[nH]1)C(=O)O Amb1995261 [0,2,0,0,0,0|2,0,0]=4 3803 B9R1.35 Nc1cc(o[n]1)C(O)=O Amb18832657 [0,2,0,0,0,0|1,0,0]=3 3804 B9R1.35 Nc1cc(oc1)C(O)=O Amb24428249 [0,2,0,0,0,0|0,0,0]=2 3805 B9R1.35 Nc1cc(sc1)C(=O)O Amb10602581 [0,2,0,0,0,0|0,1,0]=3 3806 B9R1.35 Nc1ccc([nH]1)C(O)=O Amb21963287 [0,2,0,0,0,0|1,0,0]=3 3807 B9R1.35 Nc1ccc([nH]1)C(O)=O Amb22899764 [0,2,0,0,0,0|1,0,0]=3 3808 B9R1.35 Nc1ccc([nH]1)[N+]([O-])=O Amb18832702 [0,2,0,0,0,0|2,0,0]=4 3809 B9R1.35 Nc1ccc([s]1)C(N)=O Amb18831646 [0,2,0,0,0,0|0,1,0]=3 3810 B9R1.35 Nc1ccc([s]1)C(O)=O Amb18831593 [0,2,0,0,0,0|0,1,0]=3 3811 B9R1.35 Nc1ccc([s]1)[N+]([O-])=O Amb18202412 [0,2,0,0,0,0|1,1,0]=4 3812 B9R1.35 Nc1ccc(o1)C(N)=O Amb18107255 [0,2,0,0,0,0|0,0,0]=2 3813 B9R1.35 Nc1ccc(o1)C(O)=O Amb18946756 [0,2,0,0,0,0|0,0,0]=2 3814 B9R1.35 Nc1ccc(o1)[N+]([O-])=O Amb18832656 [0,2,0,0,0,0|1,0,0]=3 3815 B9R1.35 Nc1nc(co1)C(=O)O Amb10879778 [0,2,0,0,0,0|2,0,0]=4 3816 B9R1.35 Nc1nc(cs1)C(=O)O Amb10067797 [0,2,0,0,0,0|2,0,0]=4 3817 B9R1.35 Nc1nc(cs1)C(=O)O Amb1982045 [0,2,0,0,0,0|2,0,0]=4 3818 B9R1.35 Nc1nnc(o1)C(=O)N Amb1063100 [0,2,0,0,0,0|2,0,0]=4 3819 B9R1.35 O=C(Br)C1=CSC(=S)N1 Amb24518857 [0,2,0,0,0,0|2,0,0]=4 3820 B9R1.35 O=C(Cl)c1[n]c(Br)c[s]1 Amb24639219 [0,2,0,0,0,0|1,1,0]=4 3821 B9R1.35 O=C(Cl)c1c[nH]c(=S)[s]1 Amb24085071 [0,2,0,0,0,0|1,1,0]=4 3822 B9R1.35 O=C(Cl)c1c[n]c(Br)[s]1 Amb25208694 [0,2,0,0,0,0|1,1,0]=4 3823 B9R1.35 O=C(Cl)c1c[s]c(Br)[n]1 Amb24478753 [0,2,0,0,0,0|2,0,0]=4 3824 B9R1.35 O=C(Cl)c1c[s]c(Cl)[n]1 Amb22551861 [0,2,0,0,0,0|2,0,0]=4 3825 B9R1.35 O=C(Cl)c1c[s]c(S)[n]1 Amb25772498 [0,2,0,0,0,0|2,0,0]=4 3826 B9R1.35 O=C(Cl)c1cc(Cl)[s]c1 Amb24589654 [0,2,0,0,0,0|2,0,0]=4 3827 B9R1.35 O=C(Cl)c1ccc(F)[s]1 Amb23449712 [0,2,0,0,0,0|0,1,0]=3 3828 B9R1.35 O=C(F)c1cc(Br)c[s]1 Amb24479911 [0,2,0,0,0,0|0,1,0]=3 3829 B9R1.35 O=C(F)c1ccc(Br)[s]1 Amb25732924 [0,2,0,0,0,0|0,1,0]=3 3830 B9R1.35 O=C(I)c1ccc(Br)o1 Amb25180066 [0,2,0,0,0,0|0,0,0]=2 3831 B9R1.35 O=C(I)c1ccc(Cl)[s]1 Amb25239113 [0,2,0,0,0,0|0,1,0]=3 3832 B9R1.35 O=C1C=C(CO1)C(=O)Cl Amb25147108 [0,2,0,0,0,0|2,0,0]=4 3833 B9R1.35 O=C1CCC(=C1)C(=O)O Amb13883804 [0,2,0,0,0,0|1,0,1]=4 3834 B9R1.35 O=C1NC(=CS1)C(=O)Cl Amb25242433 [0,2,0,0,0,0|2,0,0]=4 3835 B9R1.35 O=C1NC=C(O1)C(=O)Cl Amb24400990 [0,2,0,0,0,0|1,0,0]=3 3836 B9R1.35 O=S(Cl)c1ccc(Br)[s]1 Amb18577477 [0,2,0,0,0,0|1,1,0]=4 3837 B9R1.35 O=S(Cl)c1ccc(Cl)[s]1 Amb18066388 [0,2,0,0,0,0|1,1,0]=4 3838 B9R1.35 OB(O)c1cc(Br)co1 Amb24312747 [0,2,0,0,0,0|1,0,1]=4 3839 B9R1.35 OB(O)c1cc(Cl)co1 Amb24433254 [0,2,0,0,0,0|1,0,1]=4 3840 B9R1.35 OB(O)c1cc(F)co1 Amb25066867 [0,2,0,0,0,0|1,0,1]=4 3841 B9R1.35 OB(O)c1ccc(Br)o1 Amb24312807 [0,2,0,0,0,0|1,0,1]=4 3842 B9R1.35 OB(O)c1ccc(Cl)o1 Amb25072410 [0,2,0,0,0,0|1,0,1]=4 3843 B9R1.35 OB(c1occ(c1)C)O Amb10597554 [0,2,0,0,0,0|1,0,1]=4 3844 B9R1.35 OC(=O)C1=CC(=O)NN1 Amb18944048 [0,2,0,0,0,0|2,0,0]=4 3845 B9R1.35 OC(=O)C1=CC(=O)NO1 Amb19889163 [0,2,0,0,0,0|1,0,0]=3 3846 B9R1.35 OC(=O)C1=CC(=S)SS1 Amb25059344 [0,2,0,0,0,0|1,1,0]=4 3847 B9R1.35 OC(=O)C1=CNC(=O)N1 Amb18278248 [0,2,0,0,0,0|2,0,0]=4 3848 B9R1.35 OC(=O)C1=CNC(=S)N1 Amb22586764 [0,2,0,0,0,0|2,0,0]=4 3849 B9R1.35 OC(=O)C1CC=C(Br)O1 Amb25251659 [0,2,0,0,0,0|0,0,2]=4 3850 B9R1.35 OC(=O)C=1CC(=O)NC1 Amb18832707 [0,2,0,0,0,0|2,0,0]=4 3851 B9R1.35 OC(=O)C=1COC(=O)C1 Amb18642559 [0,2,0,0,0,0|2,0,0]=4 3852 B9R1.35 OC(=O)[C@@H]1C=CC(=O)N1 Amb25140391 [0,2,0,0,0,0|1,0,1]=4 3853 B9R1.35 OC(=O)c1[nH]cc(Br)[n]1 Amb22494766 [0,2,0,0,0,0|2,0,0]=4 3854 B9R1.35 OC(=O)c1[nH]cc(Cl)[n]1 Amb22493985 [0,2,0,0,0,0|2,0,0]=4 3855 B9R1.35 OC(=O)c1[nH]cc(I)[n]1 Amb22497620 [0,2,0,0,0,0|2,0,0]=4 3856 B9R1.35 OC(=O)c1[n][n]c(Br)o1 Amb18190404 [0,2,0,0,0,0|2,0,0]=4 3857 B9R1.35 OC(=O)c1[n]c(Br)[n]o1 Amb25760224 [0,2,0,0,0,0|2,0,0]=4 3858 B9R1.35 OC(=O)c1[n]c(Br)co1 Amb22754333 [0,2,0,0,0,0|1,0,0]=3 3859 B9R1.35 OC(=O)c1[n]cc(Cl)[s]1 Amb22002189 [0,2,0,0,0,0|1,1,0]=4 3860 B9R1.35 OC(=O)c1[n]cc(Cl)o1 Amb25208596 [0,2,0,0,0,0|1,0,0]=3 3861 B9R1.35 OC(=O)c1c[nH]c(=O)[nH]1 Amb1208380 [0,2,0,0,0,0|2,0,0]=4 3862 B9R1.35 OC(=O)c1c[nH]c(=O)[s]1 Amb24084921 [0,2,0,0,0,0|1,1,0]=4 3863 B9R1.35 OC(=O)c1c[nH]c(Br)c1 Amb19374049 [0,2,0,0,0,0|2,0,0]=4 3864 B9R1.35 OC(=O)c1c[nH]c(Cl)[n]1 Amb24359911 [0,2,0,0,0,0|2,0,0]=4 3865 B9R1.35 OC(=O)c1c[nH]c(Cl)c1 Amb18202356 [0,2,0,0,0,0|2,0,0]=4 3866 B9R1.35 OC(=O)c1c[nH]c(n1)S Amb2583031 [0,2,0,0,0,0|2,0,0]=4 3867 B9R1.35 OC(=O)c1c[n]c(Br)[nH]1 Amb23439053 [0,2,0,0,0,0|2,0,0]=4 3868 B9R1.35 OC(=O)c1c[n]c(Br)o1 Amb19958445 [0,2,0,0,0,0|1,0,0]=3 3869 B9R1.35 OC(=O)c1c[n]c(Br)o1 Amb22432570 [0,2,0,0,0,0|1,0,0]=3 3870 B9R1.35 OC(=O)c1c[n]c(F)[s]1 Amb24329329 [0,2,0,0,0,0|1,1,0]=4 3871 B9R1.35 OC(=O)c1c[n]c(I)[s]1 Amb24331890 [0,2,0,0,0,0|1,1,0]=4 3872 B9R1.35 OC(=O)c1c[s]c(F)[n]1 Amb25147077 [0,2,0,0,0,0|2,0,0]=4 3873 B9R1.35 OC(=O)c1c[s]c(S)[n]1 Amb24480164 [0,2,0,0,0,0|2,0,0]=4 3874 B9R1.35 OC(=O)c1cc(Br)[nH][n]1 Amb22233805 [0,2,0,0,0,0|2,0,0]=4 3875 B9R1.35 OC(=O)c1cc(Br)[s][n]1 Amb25857412 [0,2,0,0,0,0|2,0,0]=4 3876 B9R1.35 OC(=O)c1cc(Br)co1 Amb18129829 [0,2,0,0,0,0|0,0,0]=2 3877 B9R1.35 OC(=O)c1cc(Cl)[nH][n]1 Amb20241280 [0,2,0,0,0,0|2,0,0]=4 3878 B9R1.35 OC(=O)c1cc(Cl)[n][s]1 Amb18189241 [0,2,0,0,0,0|1,1,0]=4 3879 B9R1.35 OC(=O)c1cc(Cl)co1 Amb18644297 [0,2,0,0,0,0|0,0,0]=2 3880 B9R1.35 OC(=O)c1cc(F)c[nH]1 Amb22887025 [0,2,0,0,0,0|1,0,0]=3 3881 B9R1.35 OC(=O)c1cc(I)o[n]1 Amb24578190 [0,2,0,0,0,0|2,0,0]=4 3882 B9R1.35 OC(=O)c1cc(S)c[s]1 Amb24478659 [0,2,0,0,0,0|0,1,0]=3 3883 B9R1.35 OC(=O)c1cc(c[nH]1)Br Amb1154606 [0,2,0,0,0,0|1,0,0]=3 3884 B9R1.35 OC(=O)c1cc(c[nH]1)Cl Amb1106125 [0,2,0,0,0,0|1,0,0]=3 3885 B9R1.35 OC(=O)c1cc(cs1)Br Amb1935172 [0,2,0,0,0,0|0,1,0]=3 3886 B9R1.35 OC(=O)c1cc(cs1)Cl Amb16185757 [0,2,0,0,0,0|0,1,0]=3 3887 B9R1.35 OC(=O)c1cc(cs1)F Amb10602731 [0,2,0,0,0,0|0,1,0]=3 3888 B9R1.35 OC(=O)c1cc(no1)Br Amb10603676 [0,2,0,0,0,0|1,0,0]=3 3889 B9R1.35 OC(=O)c1cc(no1)Cl Amb15701317 [0,2,0,0,0,0|1,0,0]=3 3890 B9R1.35 OC(=O)c1ccc(Br)[nH]1 Amb21857063 [0,2,0,0,0,0|1,0,0]=3 3891 B9R1.35 OC(=O)c1ccc(F)o1 Amb23538033 [0,2,0,0,0,0|0,0,0]=2 3892 B9R1.35 OC(=O)c1ccc(I)[nH]1 Amb22498191 [0,2,0,0,0,0|1,0,0]=3 3893 B9R1.35 OC(=O)c1ccc(I)[s]1 Amb22002319 [0,2,0,0,0,0|0,1,0]=3 3894 B9R1.35 OC(=O)c1ccc(S)o1 Amb18279728 [0,2,0,0,0,0|0,0,0]=2 3895 B9R1.35 OC(=O)c1ccc(o1)Cl Amb1107530 [0,2,0,0,0,0|0,0,0]=2 3896 B9R1.35 OC(=O)c1ccc(o1)I Amb2459665 [0,2,0,0,0,0|0,0,0]=2 3897 B9R1.35 OC(=O)c1ccc(s1)Cl Amb1152956 [0,2,0,0,0,0|0,1,0]=3 3898 B9R1.35 OC(=O)c1cnc(s1)Cl Amb2432444 [0,2,0,0,0,0|1,1,0]=4 3899 B9R1.35 OC(=O)c1coc(Br)[n]1 Amb21857043 [0,2,0,0,0,0|2,0,0]=4 3900 B9R1.35 OC(=O)c1coc(Cl)c1 Amb22284566 [0,2,0,0,0,0|2,0,0]=4 3901 B9R1.35 OC(=O)c1coc(F)[n]1 Amb22756381 [0,2,0,0,0,0|2,0,0]=4 3902 B9R1.35 OC(=O)c1coc(I)[n]1 Amb22000930 [0,2,0,0,0,0|2,0,0]=4 3903 B9R1.35 OC(=O)c1coc(n1)Cl Amb16232458 [0,2,0,0,0,0|2,0,0]=4 3904 B9R1.35 OC(=O)c1csc(n1)Br Amb2455706 [0,2,0,0,0,0|2,0,0]=4 3905 B9R1.35 OC(=O)c1nc(cs1)Br Amb13883510 [0,2,0,0,0,0|1,1,0]=4 3906 B9R1.35 OC(=O)c1ncc(s1)Br Amb10606388 [0,2,0,0,0,0|1,1,0]=4 3907 B9R1.35 OS(=O)c1cc(Br)c[s]1 Amb18867802 [0,2,0,0,0,0|1,1,0]=4 3908 B9R1.35 OS(=O)c1ccc(Br)[s]1 Amb18571234 [0,2,0,0,0,0|1,1,0]=4 3909 B9R1.35 OS(=O)c1ccc(Cl)[s]1 Amb18560136 [0,2,0,0,0,0|1,1,0]=4 3910 B9R1.35 Oc1[n]c(co1)C(O)=O Amb24481698 [0,2,0,0,0,0|2,0,0]=4 3911 B9R1.35 Oc1[n]cc(o1)C(O)=O Amb25178101 [0,2,0,0,0,0|1,0,0]=3 3912 B9R1.35 Oc1[n]oc([n]1)C(O)=O Amb24742050 [0,2,0,0,0,0|2,0,0]=4 3913 B9R1.35 Oc1c[nH]c(c1)C(O)=O Amb24649356 [0,2,0,0,0,0|1,0,0]=3 3914 B9R1.35 Oc1c[n]c(o1)C(O)=O Amb25145621 [0,2,0,0,0,0|1,0,0]=3 3915 B9R1.35 Oc1cc([n][nH]1)C(O)=O Amb19893064 [0,2,0,0,0,0|2,0,0]=4 3916 B9R1.35 Oc1cc([n]o1)C(O)=O Amb22495932 [0,2,0,0,0,0|2,0,0]=4 3917 B9R1.35 Oc1cc([s][n]1)C(O)=O Amb24579600 [0,2,0,0,0,0|1,1,0]=4 3918 B9R1.35 Oc1ccc(o1)C(O)=O Amb18946939 [0,2,0,0,0,0|0,0,0]=2 3919 B9R1.35 Oc1coc([n]1)C(O)=O Amb25243276 [0,2,0,0,0,0|1,0,0]=3 3920 B9R1.35 [O-]C(=O)c1ccc(o1)I Amb2459790 [0,2,0,0,0,0|0,0,0]=2 3921 B9R1.35 [O-]C(=O)c1ncc(s1)C Amb16187163 [0,2,0,0,0,0|1,1,0]=4 3922 B9R1.35 [O-]C(=O)c1nnc(o1)C Amb17617582 [0,2,0,0,0,0|2,0,0]=4 3923 B9R1.35 [O-]S(=O)c1ccc(Br)[s]1 Amb19929132 [0,2,0,0,0,0|1,1,0]=4 3924 B9R1.35 [O-]S(=O)c1ccc(Cl)[s]1 Amb24654148 [0,2,0,0,0,0|1,1,0]=4 3925 B9R1.35 [O-][N+](=O)c1cc(Br)c[nH]1 Amb24427522 [0,2,0,0,0,0|2,0,0]=4 3926 B9R1.35 [O-][N+](=O)c1cc(cs1)Br Amb10574144 [0,2,0,0,0,0|1,1,0]=4 3927 B9R1.35 [O-][N+](=O)c1ccc(F)[s]1 Amb19892814 [0,2,0,0,0,0|1,1,0]=4 3928 B9R1.35 [O-][N+](=O)c1ccc(O)[s]1 Amb21964257 [0,2,0,0,0,0|1,1,0]=4 3929 B9R1.35 [O-][N+](=O)c1ccc(O)o1 Amb25025913 [0,2,0,0,0,0|1,0,0]=3 3930 B9R1.35 [O-][N+](=O)c1ccc(s1)C Amb10574813 [0,2,0,0,0,0|1,1,0]=4 3931 B9R1.35 [O-][N+](=O)c1ccc(s1)Cl Amb10609919 [0,2,0,0,0,0|1,1,0]=4 3932 B9R1.35 [O-][N+](=O)c1cnc(o1)N Amb17098063 [0,2,0,0,0,0|2,0,0]=4 3933 B9R1.35 [O-]c1cc(on1)C(=O)N Amb17608357 [0,2,0,0,0,0|1,0,0]=3 3934 B9R1.132 CC1=CC\C(=C\C)\C1=O Amb25273066 [0,2,0,0,0,0|2,0,0]=4 3935 B9R1.132 CC1=CSN(C=O)C1=O Amb24741198 [0,2,0,0,0,0|1,1,0]=4 3936 B9R1.132 C[n]1c(Br)ccc1C=O Amb18813036 [0,2,0,0,0,0|1,0,0]=3 3937 B9R1.132 C[n]1c(C=O)c[n]c1Br Amb18129389 [0,2,0,0,0,0|2,0,0]=4 3938 B9R1.132 C[n]1c(C=O)c[n]c1Cl Amb25835855 [0,2,0,0,0,0|2,0,0]=4 3939 B9R1.132 C[n]1c(Cl)c[n]c1C=O Amb18644174 [0,2,0,0,0,0|2,0,0]=4 3940 B9R1.132 C[n]1c(Cl)ccc1C=O Amb18124666 [0,2,0,0,0,0|1,0,0]=3 3941 B9R1.132 C[n]1c(N)c[n]c1C=O Amb18832828 [0,2,0,0,0,0|2,0,0]=4 3942 B9R1.132 C[n]1c(O)[n]cc1C=O Amb18832772 [0,2,0,0,0,0|2,0,0]=4 3943 B9R1.132 C[n]1c[n]c(C=O)c1Br Amb18129385 [0,2,0,0,0,0|2,0,0]=4 3944 B9R1.132 C[n]1ccc(C=O)c1Cl Amb18831521 [0,2,0,0,0,0|2,0,0]=4 3945 B9R1.132 Cc1[s]cc(C=O)c1F Amb18831513 [0,2,0,0,0,0|2,0,0]=4 3946 B9R1.132 Cc1c(Br)c[nH]c1C=O Amb24635896 [0,2,0,0,0,0|1,0,0]=3 3947 B9R1.132 Cc1c(C=O)[nH][n]c1C Amb18832917 [0,2,0,0,0,0|2,0,0]=4 3948 B9R1.132 Cc1c(C=O)[n][s]c1C Amb18202719 [0,2,0,0,0,0|2,0,0]=4 3949 B9R1.132 Cc1c(C=O)[n]oc1C Amb18832863 [0,2,0,0,0,0|2,0,0]=4 3950 B9R1.132 Cc1c(C=O)[s]cc1C Amb18643622 [0,2,0,0,0,0|0,1,0]=3 3951 B9R1.132 Cc1c(C=O)c[nH]c1C Amb18642116 [0,2,0,0,0,0|2,0,0]=4 3952 B9R1.132 Cc1c(C=O)c[s]c1C Amb18643621 [0,2,0,0,0,0|2,0,0]=4 3953 B9R1.132 Cc1c(C=O)cc[n]1C Amb23100946 [0,2,0,0,0,0|2,0,0]=4 3954 B9R1.132 Cc1c(C=O)coc1Br Amb18681280 [0,2,0,0,0,0|2,0,0]=4 3955 B9R1.132 Cc1c(C=O)o[n]c1C Amb25095506 [0,2,0,0,0,0|1,0,0]=3 3956 B9R1.132 Cc1c(N)[s]cc1C=O Amb18146232 [0,2,0,0,0,0|2,0,0]=4 3957 B9R1.132 Cc1c(N)c[s]c1C=O Amb18831713 [0,2,0,0,0,0|0,1,0]=3 3958 B9R1.132 Cc1c(N)coc1C=O Amb18832844 [0,2,0,0,0,0|0,0,0]=2 3959 B9R1.132 Cc1c[s]c(C=O)c1Br Amb18129700 [0,2,0,0,0,0|0,1,0]=3 3960 B9R1.132 Cc1c[s]c(C=O)c1Cl Amb22886669 [0,2,0,0,0,0|0,1,0]=3 3961 B9R1.132 Cc1cc[n](C=O)c1C Amb24648826 [0,2,0,0,0,0|2,0,0]=4 3962 B9R1.132 Cc1coc(C=O)c1Br Amb18187328 [0,2,0,0,0,0|0,0,0]=2 3963 B9R1.132 Cc1occ(C=O)c1F Amb18832651 [0,2,0,0,0,0|2,0,0]=4 3964 B9R1.132 N#Cc1occ(Cl)c1Cl Amb23538002 [0,2,0,0,0,0|1,0,1]=4 3965 B9R1.132 Nc1c(Br)coc1C#N Amb25825107 [0,2,0,0,0,0|1,0,1]=4 3966 B9R1.132 Nc1c(Cl)[nH][n]c1C=O Amb25680106 [0,2,0,0,0,0|2,0,0]=4 3967 B9R1.132 O=CC=1CC=C(Cl)C1Cl Amb24678121 [0,2,0,0,0,0|1,0,0]=3 3968 B9R1.132 O=Cc1[nH][n]c(Cl)c1Br Amb24557442 [0,2,0,0,0,0|2,0,0]=4 3969 B9R1.132 O=Cc1[nH]cc(Cl)c1Cl Amb24478727 [0,2,0,0,0,0|1,0,0]=3 3970 B9R1.132 O=Cc1[nH]cc(F)c1F Amb24394159 [0,2,0,0,0,0|1,0,0]=3 3971 B9R1.132 O=Cc1[nH]cc(c1C)C Amb1031555 [0,2,0,0,0,0|1,0,0]=3 3972 B9R1.132 O=Cc1[nH]nc(c1Br)C Amb15701545 [0,2,0,0,0,0|2,0,0]=4 3973 B9R1.132 O=Cc1[nH]nc(c1Cl)C Amb15701597 [0,2,0,0,0,0|2,0,0]=4 3974 B9R1.132 O=Cc1[n][nH]c(Br)c1Br Amb23402739 [0,2,0,0,0,0|2,0,0]=4 3975 B9R1.132 O=Cc1[s]cc(Cl)c1Cl Amb25258774 [0,2,0,0,0,0|0,1,0]=3 3976 B9R1.132 O=Cc1c[nH]c(Br)c1Br Amb24467976 [0,2,0,0,0,0|2,0,0]=4 3977 B9R1.132 O=Cc1c[s]c(Br)c1Br Amb22498205 [0,2,0,0,0,0|2,0,0]=4 3978 B9R1.132 O=Cc1c[s]c(Br)c1F Amb24727683 [0,2,0,0,0,0|2,0,0]=4 3979 B9R1.132 O=Cc1coc(Br)c1F Amb24574220 [0,2,0,0,0,0|2,0,0]=4 3980 B9R1.132 O=Cc1scc(c1Br)Br Amb2433174 [0,2,0,0,0,0|0,1,0]=3 3981 B9R1.132 O=Cc1scc(c1C)Br Amb10607132 [0,2,0,0,0,0|0,1,0]=3 3982 B9R1.132 OCc1occ(Cl)c1Cl Amb25760097 [0,2,0,0,0,0|0,0,2]=4 3983 B9R1.132 Oc1o[n]c(C=O)c1Br Amb25196131 [0,2,0,0,0,0|2,0,0]=4 3984 B9R1.11 C#CC(=O)c1c[n]c[s]1 Amb25125555 [0,2,0,0,0,0|1,1,0]=4 3985 B9R1.11 C#CC(=O)c1c[s]c[n]1 Amb24411872 [0,2,0,0,0,0|2,0,0]=4 3986 B9R1.11 C#CC(=O)c1ccc[s]1 Amb24495280 [0,2,0,0,0,0|0,1,0]=3 3987 B9R1.11 C#CC(N)c1ccco1 Amb23448719 [0,2,0,0,0,0|1,0,1]=4 3988 B9R1.11 C#CC(O)c1ccco1 Amb25188923 [0,2,0,0,0,0|0,0,2]=4 3989 B9R1.11 C#C[C@@H](O)c1ccco1 Amb25842614 [0,2,0,0,0,0|0,0,2]=4 3990 B9R1.11 C=C(C#N)c1ccco1 Amb24645340 [0,2,0,0,0,0|1,0,0]=3 3991 B9R1.11 C=C(C=O)c1ccoc1 Amb24708336 [0,2,0,0,0,0|2,0,0]=4 3992 B9R1.11 C=C(CCl)c1ccc[s]1 Amb25349350 [0,2,0,0,0,0|1,1,0]=4 3993 B9R1.11 C=C(CN)c1ccc[s]1 Amb18908327 [0,2,0,0,0,0|1,1,0]=4 3994 B9R1.11 C=CC(=O)C1=CCCO1 Amb25760187 [0,2,0,0,0,0|0,0,2]=4 3995 B9R1.11 C=CC(=O)c1[nH]cc[n]1 Amb24543423 [0,2,0,0,0,0|2,0,0]=4 3996 B9R1.11 C=CC(=O)c1cc[nH]c1 Amb18062477 [0,2,0,0,0,0|2,0,0]=4 3997 B9R1.11 C=CC(=O)c1cc[s]c1 Amb24478667 [0,2,0,0,0,0|2,0,0]=4 3998 B9R1.11 C=CC(=O)c1ccc[nH]1 Amb24477792 [0,2,0,0,0,0|1,0,0]=3 3999 B9R1.11 C=CC(=O)c1ccc[s]1 Amb18562033 [0,2,0,0,0,0|0,1,0]=3 4000 B9R1.11 C=CC(=O)c1ccco1 Amb16232452 [0,2,0,0,0,0|0,0,0]=2 4001 B9R1.11 C=CC(N)c1ccc[nH]1 Amb24477837 [0,2,0,0,0,0|2,0,0]=4 4002 B9R1.11 C=CC(O)c1ccc[s]1 Amb25123773 [0,2,0,0,0,0|1,1,0]=4 4003 B9R1.11 C=CC(O)c1ccco1 Amb24332569 [0,2,0,0,0,0|1,0,0]=3 4004 B9R1.11 C=C[C@@H](O)c1ccco1 Amb25074343 [0,2,0,0,0,0|1,0,0]=3 4005 B9R1.11 C=C[C@H](N)c1ccc[s]1 Amb24693080 [0,2,0,0,0,0|1,1,0]=4 4006 B9R1.11 C=C[C@H](O)c1ccc[s]1 Amb25084312 [0,2,0,0,0,0|1,1,0]=4 4007 B9R1.11 C=C[C@H](O)c1ccco1 Amb25056767 [0,2,0,0,0,0|1,0,0]=3 4008 B9R1.11 CC(=NO)c1ccc[nH]1 Amb24059875 [0,2,0,0,0,0|1,0,1]=4 4009 B9R1.11 CC(=NO)c1ccc[s]1 Amb24060087 [0,2,0,0,0,0|0,1,1]=4 4010 B9R1.11 CC(C=O)[n]1cccc1 Amb18642117 [0,2,0,0,0,0|2,0,0]=4 4011 B9R1.11 CC(C=O)c1c[nH]cc1 Amb24477753 [0,2,0,0,0,0|2,0,0]=4 4012 B9R1.11 CC(C=O)c1ccc[nH]1 Amb24349735 [0,2,0,0,0,0|1,0,0]=3 4013 B9R1.11 CC(C=O)c1ccco1 Amb18642174 [0,2,0,0,0,0|0,0,0]=2 4014 B9R1.11 CC(CCl)=C1C=CC=C1 Amb25705321 [0,2,0,0,0,0|2,0,0]=4 4015 B9R1.11 CCC(=O)c1c[nH]c[n]1 Amb23402204 [0,2,0,0,0,0|2,0,0]=4 4016 B9R1.11 CCC(=O)c1c[n]c[s]1 Amb25308975 [0,2,0,0,0,0|1,1,0]=4 4017 B9R1.11 CCC(=O)c1c[s]c[n]1 Amb24384180 [0,2,0,0,0,0|2,0,0]=4 4018 B9R1.11 CCC(=O)c1cc[nH][n]1 Amb25842047 [0,2,0,0,0,0|2,0,0]=4 4019 B9R1.11 CCC(=O)c1cc[nH]c1 Amb18062764 [0,2,0,0,0,0|2,0,0]=4 4020 B9R1.11 CCC(=O)c1cc[s][n]1 Amb24593642 [0,2,0,0,0,0|2,0,0]=4 4021 B9R1.11 CCC(=O)n1cccc1 Amb17938694 [0,2,0,0,0,0|2,0,0]=4 4022 B9R1.11 CCC(c1ccco1)Cl Amb17138399 [0,2,0,0,0,0|1,0,1]=4 4023 B9R1.11 CCC(c1ccco1)N Amb17061211 [0,2,0,0,0,0|1,0,1]=4 4024 B9R1.11 CCC(c1ccco1)O Amb17138369 [0,2,0,0,0,0|0,0,2]=4 4025 B9R1.11 CCS(=O)c1[n]cco1 Amb24679306 [0,2,0,0,0,0|2,0,0]=4 4026 B9R1.11 CC[C@@H](N)c1ccco1 Amb25246133 [0,2,0,0,0,0|1,0,1]=4 4027 B9R1.11 CN(C=O)c1[n]cc[s]1 Amb24096785 [0,2,0,0,0,0|1,1,0]=4 4028 B9R1.11 CN(C=O)c1c[s]cc1 Amb24666083 [0,2,0,0,0,0|2,0,0]=4 4029 B9R1.11 CNC(=N)c1ccc[s]1 Amb25698724 [0,2,0,0,0,0|1,1,0]=4 4030 B9R1.11 CNC(=N)c1ccco1 Amb24539020 [0,2,0,0,0,0|1,0,0]=3 4031 B9R1.11 CNC(=O)C1=CCCO1 Amb24476706 [0,2,0,0,0,0|0,0,2]=4 4032 B9R1.11 CNC(=O)c1[n]cc[s]1 Amb24719418 [0,2,0,0,0,0|1,1,0]=4 4033 B9R1.11 CNC(=O)c1c[nH]c[n]1 Amb21811792 [0,2,0,0,0,0|2,0,0]=4 4034 B9R1.11 CNC(=O)c1c[nH]cc1 Amb24612395 [0,2,0,0,0,0|2,0,0]=4 4035 B9R1.11 CNC(=O)c1c[n]co1 Amb22963679 [0,2,0,0,0,0|1,0,0]=3 4036 B9R1.11 CNC(=O)c1c[s]c[n]1 Amb24623696 [0,2,0,0,0,0|2,0,0]=4 4037 B9R1.11 CNC(=O)c1cc[nH][n]1 Amb20619706 [0,2,0,0,0,0|2,0,0]=4 4038 B9R1.11 CNC(=O)c1ccc[nH]1 Amb21859009 [0,2,0,0,0,0|1,0,0]=3 4039 B9R1.11 CNC(=O)c1ccoc1 Amb24531887 [0,2,0,0,0,0|2,0,0]=4 4040 B9R1.11 CNC(=S)c1ccc[s]1 Amb25185356 [0,2,0,0,0,0|0,2,0]=4 4041 B9R1.11 CNC(=S)c1ccco1 Amb25146108 [0,2,0,0,0,0|0,1,0]=3 4042 B9R1.11 CNC(C)c1ccco1 Amb19888104 [0,2,0,0,0,0|1,0,1]=4 4043 B9R1.11 CNC(c1ccco1)C Amb1127360 [0,2,0,0,0,0|1,0,1]=4 4044 B9R1.11 CN[C@H](C)c1ccco1 Amb24434234 [0,2,0,0,0,0|1,0,1]=4 4045 B9R1.11 COC(=N)c1ccc[nH]1 Amb24669587 [0,2,0,0,0,0|1,0,1]=4 4046 B9R1.11 COC(=N)c1ccco1 Amb22263727 [0,2,0,0,0,0|0,0,1]=3 4047 B9R1.11 COC(=N)c1cccs1 Amb17621680 [0,2,0,0,0,0|0,1,1]=4 4048 B9R1.11 COC(=O)C=1C=CCC1 Amb25145939 [0,2,0,0,0,0|1,0,1]=4 4049 B9R1.11 COC(=O)c1[n][n]co1 Amb24425959 [0,2,0,0,0,0|2,0,0]=4 4050 B9R1.11 COC(=O)c1[n]cco1 Amb22001762 [0,2,0,0,0,0|1,0,0]=3 4051 B9R1.11 COC(=O)c1c[nH]c[n]1 Amb20621624 [0,2,0,0,0,0|2,0,0]=4 4052 B9R1.11 COC(=O)c1c[n]co1 Amb21520455 [0,2,0,0,0,0|1,0,0]=3 4053 B9R1.11 COC(=O)c1cc[nH]n1 Amb1000875 [0,2,0,0,0,0|2,0,0]=4 4054 B9R1.11 COC(=O)c1cc[s][n]1 Amb22896459 [0,2,0,0,0,0|2,0,0]=4 4055 B9R1.11 COC(=O)c1ccc[nH]1 Amb1088973 [0,2,0,0,0,0|1,0,0]=3 4056 B9R1.11 COC(=O)c1cccs1 Amb1911537 [0,2,0,0,0,0|0,1,0]=3 4057 B9R1.11 COC(=O)c1ccns1 Amb13883507 [0,2,0,0,0,0|1,1,0]=4 4058 B9R1.11 COC(=O)c1cco[n]1 Amb23412333 [0,2,0,0,0,0|2,0,0]=4 4059 B9R1.11 COC(=O)c1cncs1 Amb2455728 [0,2,0,0,0,0|1,1,0]=4 4060 B9R1.11 COC(=O)c1coc[n]1 Amb21857674 [0,2,0,0,0,0|2,0,0]=4 4061 B9R1.11 COC(=O)c1cscn1 Amb10067320 [0,2,0,0,0,0|2,0,0]=4 4062 B9R1.11 COC(=O)c1nccs1 Amb10807389 [0,2,0,0,0,0|1,1,0]=4 4063 B9R1.11 COC(=S)c1ccco1 Amb22232675 [0,2,0,0,0,0|0,0,1]=3 4064 B9R1.11 COC(C)c1ccco1 Amb25220078 [0,2,0,0,0,0|0,0,2]=4 4065 B9R1.11 COS(=O)c1ccc[s]1 Amb25254375 [0,2,0,0,0,0|1,1,0]=4 4066 B9R1.11 CSC(=N)c1ccc[s]1 Amb25856152 [0,2,0,0,0,0|0,2,0]=4 4067 B9R1.11 CSC(=O)c1ccc[s]1 Amb24520558 [0,2,0,0,0,0|0,1,0]=3 4068 B9R1.11 CSC(=O)c1cscn1 Amb10070320 [0,2,0,0,0,0|2,0,0]=4 4069 B9R1.11 C[C@@H](C=O)[n]1cccc1 Amb25032110 [0,2,0,0,0,0|2,0,0]=4 4070 B9R1.11 C[C@@H](C=O)c1ccc[s]1 Amb24602792 [0,2,0,0,0,0|0,1,0]=3 4071 B9R1.11 C[C@@H](C=O)c1ccco1 Amb25830685 [0,2,0,0,0,0|0,0,0]=2 4072 B9R1.11 C[C@@H](CO)c1ccco1 Amb24340224 [0,2,0,0,0,0|0,0,2]=4 4073 B9R1.11 C[C@H](C=O)c1c[s]cc1 Amb24722851 [0,2,0,0,0,0|2,0,0]=4 4074 B9R1.11 C[C@H](C=O)c1ccco1 Amb25735791 [0,2,0,0,0,0|0,0,0]=2 4075 B9R1.11 C[C@H](NO)c1ccco1 Amb25354707 [0,2,0,0,0,0|0,0,2]=4 4076 B9R1.11 C\C(=C\Cl)\c1ccc[s]1 Amb24470059 [0,2,0,0,0,0|1,1,0]=4 4077 B9R1.11 C\C(=N/N)\c1ccco1 Amb24407173 [0,2,0,0,0,0|1,0,0]=3 4078 B9R1.11 C\C(=N\C)\c1ccc[nH]1 Amb25146083 [0,2,0,0,0,0|2,0,0]=4 4079 B9R1.11 C\C(=N\N)\c1ccc[s]1 Amb25677118 [0,2,0,0,0,0|1,1,0]=4 4080 B9R1.11 C\C(=N\N)\c1ccco1 Amb25272224 [0,2,0,0,0,0|1,0,0]=3 4081 B9R1.11 C\C(=N\O)\c1ccc[nH]1 Amb19894730 [0,2,0,0,0,0|1,0,1]=4 4082 B9R1.11 C\N=C(/c1ccco1)\Cl Amb2371268 [0,2,0,0,0,0|1,0,0]=3 4083 B9R1.11 C\N=C(/c1cccs1)\Cl Amb2371267 [0,2,0,0,0,0|1,1,0]=4 4084 B9R1.11 ClCC(=O)c1ccco1 Amb17138398 [0,2,0,0,0,0|0,0,0]=2 4085 B9R1.11 ClCC(=O)c1cscn1 Amb17506261 [0,2,0,0,0,0|2,0,0]=4 4086 B9R1.11 Cl\C(=C/Cl)\c1ccc[s]1 Amb24332765 [0,2,0,0,0,0|1,1,0]=4 4087 B9R1.11 N#CC(=C)c1cccs1 Amb17231891 [0,2,0,0,0,0|1,1,0]=4 4088 B9R1.11 N#CC(=O)c1ccc[nH]1 Amb25146154 [0,2,0,0,0,0|1,0,0]=3 4089 B9R1.11 N#CC(=O)c1ccco1 Amb17231835 [0,2,0,0,0,0|0,0,0]=2 4090 B9R1.11 N#CC(Cl)c1ccco1 Amb24726526 [0,2,0,0,0,0|1,0,1]=4 4091 B9R1.11 N#CC(c1ccco1)N Amb1108460 [0,2,0,0,0,0|1,0,1]=4 4092 B9R1.11 N#C[C@H](O)c1ccco1 Amb24502187 [0,2,0,0,0,0|0,0,2]=4 4093 B9R1.11 N=NC(=O)c1[n]cc[s]1 Amb25258622 [0,2,0,0,0,0|1,1,0]=4 4094 B9R1.11 NC(=S=O)c1c[n]c[s]1 Amb24390967 [0,2,0,0,0,0|1,1,0]=4 4095 B9R1.11 NCC(=O)c1[n]cc[s]1 Amb18831642 [0,2,0,0,0,0|1,1,0]=4 4096 B9R1.11 NCC(=O)c1c[nH]c[n]1 Amb18642287 [0,2,0,0,0,0|2,0,0]=4 4097 B9R1.11 NCC(=O)c1c[n]c[s]1 Amb18831640 [0,2,0,0,0,0|1,1,0]=4 4098 B9R1.11 NCC(=O)c1c[s]c[n]1 Amb18831641 [0,2,0,0,0,0|2,0,0]=4 4099 B9R1.11 NCC(=O)c1cc[nH]c1 Amb18560375 [0,2,0,0,0,0|2,0,0]=4 4100 B9R1.11 NCC(=O)c1cc[s][n]1 Amb24471992 [0,2,0,0,0,0|2,0,0]=4 4101 B9R1.11 NCC(=O)c1cc[s]c1 Amb18643742 [0,2,0,0,0,0|2,0,0]=4 4102 B9R1.11 NCC(=O)c1ccc[nH]1 Amb17593270 [0,2,0,0,0,0|1,0,0]=3 4103 B9R1.11 NCC(=O)c1ccco1 Amb18642269 [0,2,0,0,0,0|0,0,0]=2 4104 B9R1.11 NCC(=O)c1ccco1 Amb19373982 [0,2,0,0,0,0|0,0,0]=2 4105 B9R1.11 NCC(=O)c1cccs1 Amb1286169 [0,2,0,0,0,0|0,1,0]=3 4106 B9R1.11 NCC(=O)c1ccoc1 Amb18642270 [0,2,0,0,0,0|2,0,0]=4 4107 B9R1.11 NCC(=O)c1coc[n]1 Amb24393351 [0,2,0,0,0,0|2,0,0]=4 4108 B9R1.11 NCC(F)c1ccco1 Amb24573586 [0,2,0,0,0,0|1,0,1]=4 4109 B9R1.11 NCC(c1ccco1)O Amb1108638 [0,2,0,0,0,0|0,0,2]=4 4110 B9R1.11 NC[C@@H](O)c1ccco1 Amb22747769 [0,2,0,0,0,0|0,0,2]=4 4111 B9R1.11 NC[C@H](N)c1ccco1 Amb24467396 [0,2,0,0,0,0|1,0,1]=4 4112 B9R1.11 NNC(=O)c1[n]cc[s]1 Amb22490247 [0,2,0,0,0,0|1,1,0]=4 4113 B9R1.11 NNC(=O)c1[n]cco1 Amb22754368 [0,2,0,0,0,0|1,0,0]=3 4114 B9R1.11 NNC(=O)c1c[n]c[nH]1 Amb20667960 [0,2,0,0,0,0|2,0,0]=4 4115 B9R1.11 NNC(=O)c1c[n]co1 Amb19516901 [0,2,0,0,0,0|1,0,0]=3 4116 B9R1.11 NNC(=O)c1cc[s]c1 Amb22341783 [0,2,0,0,0,0|2,0,0]=4 4117 B9R1.11 NNC(=O)c1ccc[nH]1 Amb1154497 [0,2,0,0,0,0|1,0,0]=3 4118 B9R1.11 NNC(=O)c1ccn[nH]1 Amb1923694 [0,2,0,0,0,0|2,0,0]=4 4119 B9R1.11 NNC(=O)c1cco[n]1 Amb20622665 [0,2,0,0,0,0|2,0,0]=4 4120 B9R1.11 NNC(=O)c1coc[n]1 Amb25370232 [0,2,0,0,0,0|2,0,0]=4 4121 B9R1.11 NNC(=O)c1cocc1 Amb1137431 [0,2,0,0,0,0|2,0,0]=4 4122 B9R1.11 NNC(=O)c1cocn1 Amb13890531 [0,2,0,0,0,0|2,0,0]=4 4123 B9R1.11 NNC(=O)c1cscc1 Amb1127945 [0,2,0,0,0,0|2,0,0]=4 4124 B9R1.11 NNC(=O)c1cscn1 Amb1786304 [0,2,0,0,0,0|2,0,0]=4 4125 B9R1.11 NNC(=O)c1ncc[nH]1 Amb16679405 [0,2,0,0,0,0|2,0,0]=4 4126 B9R1.11 NNC(=S)c1ccc[s]1 Amb25807998 [0,2,0,0,0,0|0,2,0]=4 4127 B9R1.11 NNC(=S)c1ccco1 Amb25042393 [0,2,0,0,0,0|0,1,0]=3 4128 B9R1.11 NOC(=O)c1ccc[s]1 Amb25268305 [0,2,0,0,0,0|0,1,0]=3 4129 B9R1.11 N[C@@H](C#N)c1ccco1 Amb25078710 [0,2,0,0,0,0|1,0,1]=4 4130 B9R1.11 N[C@@H](CF)c1ccco1 Amb25133807 [0,2,0,0,0,0|1,0,1]=4 4131 B9R1.11 N[C@H](C=O)c1c[n]c[nH]1 Amb25084959 [0,2,0,0,0,0|2,0,0]=4 4132 B9R1.11 N\C(=C\O)\c1ccc[s]1 Amb25305790 [0,2,0,0,0,0|0,1,1]=4 4133 B9R1.11 N\C(=N/O)\c1ccc[nH]1 Amb19869356 [0,2,0,0,0,0|1,0,1]=4 4134 B9R1.11 N\C(=N/O)\c1ccco1 Amb22587188 [0,2,0,0,0,0|0,0,1]=3 4135 B9R1.11 N\C(=N\Cl)\c1ccc[s]1 Amb24339392 [0,2,0,0,0,0|1,1,0]=4 4136 B9R1.11 N\C(=N\N)\c1ccc[nH]1 Amb24351294 [0,2,0,0,0,0|2,0,0]=4 4137 B9R1.11 N\C(=N\N)\c1ccc[s]1 Amb25250535 [0,2,0,0,0,0|1,1,0]=4 4138 B9R1.11 N\C(=N\N)\c1ccco1 Amb25330067 [0,2,0,0,0,0|1,0,0]=3 4139 B9R1.11 N\C(=N\O)\c1cc[n]o1 Amb22292334 [0,2,0,0,0,0|1,0,1]=4 4140 B9R1.11 N\N=C(\c1cccs1)/C Amb1152010 [0,2,0,0,0,0|1,1,0]=4 4141 B9R1.11 O([2H])C(=O)c1cccs1 Amb10573503 [0,2,0,0,0,0|0,1,0]=3 4142 B9R1.11 O=C(C=O)c1[n]cc[s]1 Amb25188962 [0,2,0,0,0,0|1,1,0]=4 4143 B9R1.11 O=C(C=O)c1c[s]cc1 Amb18124566 [0,2,0,0,0,0|2,0,0]=4 4144 B9R1.11 O=C(C=O)c1ccc[nH]1 Amb25146153 [0,2,0,0,0,0|1,0,0]=3 4145 B9R1.11 O=C(CBr)c1c[n]c[s]1 Amb22755956 [0,2,0,0,0,0|1,1,0]=4 4146 B9R1.11 O=C(CBr)c1c[s]c[n]1 Amb22755902 [0,2,0,0,0,0|2,0,0]=4 4147 B9R1.11 O=C(CBr)c1c[s]c[n]1 Amb22899135 [0,2,0,0,0,0|2,0,0]=4 4148 B9R1.11 O=C(CBr)c1cc[nH]c1 Amb18224795 [0,2,0,0,0,0|2,0,0]=4 4149 B9R1.11 O=C(CBr)c1cc[n]o1 Amb24106246 [0,2,0,0,0,0|1,0,0]=3 4150 B9R1.11 O=C(CBr)c1ccc[s]1 Amb22491221 [0,2,0,0,0,0|0,1,0]=3 4151 B9R1.11 O=C(CBr)c1cco[n]1 Amb23412312 [0,2,0,0,0,0|2,0,0]=4 4152 B9R1.11 O=C(CBr)c1ccoc1 Amb25772759 [0,2,0,0,0,0|2,0,0]=4 4153 B9R1.11 O=C(CCl)c1[n]cc[s]1 Amb24104111 [0,2,0,0,0,0|1,1,0]=4 4154 B9R1.11 O=C(CCl)c1[n]cco1 Amb22904306 [0,2,0,0,0,0|1,0,0]=3 4155 B9R1.11 O=C(CCl)c1c[n]c[s]1 Amb24104081 [0,2,0,0,0,0|1,1,0]=4 4156 B9R1.11 O=C(CCl)c1cc[nH][n]1 Amb25308297 [0,2,0,0,0,0|2,0,0]=4 4157 B9R1.11 O=C(CCl)c1cc[nH]c1 Amb18063662 [0,2,0,0,0,0|2,0,0]=4 4158 B9R1.11 O=C(CCl)c1cc[s]c1 Amb25727715 [0,2,0,0,0,0|2,0,0]=4 4159 B9R1.11 O=C(CCl)c1cco[n]1 Amb24104110 [0,2,0,0,0,0|2,0,0]=4 4160 B9R1.11 O=C(CCl)c1ccoc1 Amb22395346 [0,2,0,0,0,0|2,0,0]=4 4161 B9R1.11 O=C(CCl)c1coc[n]1 Amb22011648 [0,2,0,0,0,0|2,0,0]=4 4162 B9R1.11 O=C(CF)c1cc[s]c1 Amb24084132 [0,2,0,0,0,0|2,0,0]=4 4163 B9R1.11 O=C(CF)c1ccc[s]1 Amb21964939 [0,2,0,0,0,0|0,1,0]=3 4164 B9R1.11 O=C(CI)c1ccco1 Amb25365425 [0,2,0,0,0,0|0,0,0]=2 4165 B9R1.11 O=C(OCl)c1ccc[nH]1 Amb24518091 [0,2,0,0,0,0|1,0,0]=3 4166 B9R1.11 O=CC(=O)c1ccco1 Amb17593264 [0,2,0,0,0,0|0,0,0]=2 4167 B9R1.11 O=CC(=O)c1cccs1 Amb10067937 [0,2,0,0,0,0|0,1,0]=3 4168 B9R1.11 O=CC(=O)c1cccs1 Amb10607111 [0,2,0,0,0,0|0,1,0]=3 4169 B9R1.11 O=CC(F)c1c[nH]c[n]1 Amb24714535 [0,2,0,0,0,0|2,0,0]=4 4170 B9R1.11 O=CC(c1cccs1)C Amb17138391 [0,2,0,0,0,0|0,1,0]=3 4171 B9R1.11 OC(C=O)c1c[s]cc1 Amb24466343 [0,2,0,0,0,0|2,0,0]=4 4172 B9R1.11 OC(C=O)c1ccco1 Amb25769824 [0,2,0,0,0,0|0,0,0]=2 4173 B9R1.11 OC(C=O)c1cocc1 Amb25334420 [0,2,0,0,0,0|2,0,0]=4 4174 B9R1.11 OCC(=O)[n]1cccc1 Amb25107623 [0,2,0,0,0,0|2,0,0]=4 4175 B9R1.11 OCC(=O)c1cc[nH]c1 Amb18560595 [0,2,0,0,0,0|2,0,0]=4 4176 B9R1.11 OCC(=O)c1cc[s]c1 Amb25348480 [0,2,0,0,0,0|2,0,0]=4 4177 B9R1.11 OCC(=O)c1ccc[s]1 Amb25742219 [0,2,0,0,0,0|0,1,0]=3 4178 B9R1.11 OCC(=O)c1ccco1 Amb17689139 [0,2,0,0,0,0|0,0,0]=2 4179 B9R1.11 OCC(F)c1ccco1 Amb25365029 [0,2,0,0,0,0|0,0,2]=4 4180 B9R1.11 OCC(c1ccco1)N Amb17231846 [0,2,0,0,0,0|0,0,2]=4 4181 B9R1.11 OC[C@@H](O)c1ccco1 Amb24183799 [0,2,0,0,0,0|0,0,2]=4 4182 B9R1.11 ONC(=N)c1ccco1 Amb17231841 [0,2,0,0,0,0|0,0,1]=3 4183 B9R1.11 ONC(=N)c1cccs1 Amb17231942 [0,2,0,0,0,0|0,1,1]=4 4184 B9R1.11 ONC(=O)[n]1cccc1 Amb25114377 [0,2,0,0,0,0|2,0,0]=4 4185 B9R1.11 ONC(=O)c1c[nH]c[n]1 Amb24712489 [0,2,0,0,0,0|2,0,0]=4 4186 B9R1.11 ONC(=O)c1c[n]co1 Amb24734821 [0,2,0,0,0,0|1,0,0]=3 4187 B9R1.11 ONC(=O)c1c[s]c[n]1 Amb25201230 [0,2,0,0,0,0|2,0,0]=4 4188 B9R1.11 ONC(=O)c1ccc[nH]1 Amb24451516 [0,2,0,0,0,0|1,0,0]=3 4189 B9R1.11 ONC(=O)c1cccs1 Amb1151586 [0,2,0,0,0,0|0,1,0]=3 4190 B9R1.11 ONC(c1ccco1)C Amb10605011 [0,2,0,0,0,0|0,0,2]=4 4191 B9R1.11 O[C@H](CBr)c1ccco1 Amb24480070 [0,2,0,0,0,0|0,0,2]=4 4192 B9R1.11 O\N=C(/c1cccs1)\N Amb1106021 [0,2,0,0,0,0|0,1,1]=4 4193 B9R1.11 O\N=C(\Cl)/c1ccco1 Amb24398879 [0,2,0,0,0,0|0,0,1]=3 4194 B9R1.11 SCC(=O)c1cccs1 Amb17400035 [0,2,0,0,0,0|0,1,0]=3 4195 B9R1.11 [Cu]OC(=O)c1cccs1 Amb13890298 [0,2,0,0,0,0|0,1,0]=3 4196 B9R1.11 [Li]OC(=O)n1cccc1 Amb10552456 [0,2,0,0,0,0|2,0,0]=4 4197 B9R1.11 [NH3+]CC(=O)c1cccs1 Amb17848802 [0,2,0,0,0,0|0,1,0]=3 4198 B9R1.11 [O-]NC(=O)c1cccs1 Amb1104818 [0,2,0,0,0,0|0,1,0]=3 4199 B9R1.19 C([2H])(c1ccco1)(O)[2H] Amb17614665 [0,2,0,0,0,0|0,0,2]=4 4200 B9R1.19 C([2H])(c1ccco1)(S)[2H] Amb17614666 [0,2,0,0,0,0|0,1,1]=4 4201 B9R1.19 C([2H])(c1ccco1)([2H])[2H] Amb17617446 [0,2,0,0,0,0|1,0,1]=4 4202 B9R1.19 CC(C)(C)c1ccco1 Amb22360626 [0,2,0,0,0,0|1,0,1]=4 4203 B9R1.19 CC(C)(O)c1ccco1 Amb22749603 [0,2,0,0,0,0|0,0,2]=4 4204 B9R1.19 CC(c1ccco1)(N)C Amb17078788 [0,2,0,0,0,0|1,0,1]=4 4205 B9R1.19 CS(=O)(=O)c1ccc[nH]1 Amb25145999 [0,2,0,0,0,0|2,0,0]=4 4206 B9R1.19 C[Si](C)(C)c1ccco1 Amb20671355 [0,2,0,0,0,0|1,1,0]=4 4207 B9R1.19 C[Si](C)(O)c1ccco1 Amb22167043 [0,2,0,0,0,0|0,1,1]=4 4208 B9R1.19 C[Si](C)([O-])c1ccco1 Amb22047449 [0,2,0,0,0,0|0,1,1]=4 4209 B9R1.19 ClS(=O)(=O)c1cccs1 Amb1216878 [0,2,0,0,0,0|1,1,0]=4 4210 B9R1.19 FC(F)(Cl)c1ccco1 Amb24743557 [0,2,0,0,0,0|1,0,1]=4 4211 B9R1.19 F[B-](c1ccco1)(F)F Amb13890469 [0,2,0,0,0,0|2,0,0]=4 4212 B9R1.19 NS(=O)(=O)c1ccc[nH]1 Amb18202344 [0,2,0,0,0,0|2,0,0]=4 4213 B9R1.19 NS(=O)(=O)c1ccco1 Amb24093662 [0,2,0,0,0,0|1,0,0]=3 4214 B9R1.19 NS(=O)(=O)c1cccs1 Amb1103388 [0,2,0,0,0,0|1,1,0]=4 4215 B9R1.19 O=S(=O)(Cl)c1[n]cco1 Amb24117208 [0,2,0,0,0,0|2,0,0]=4 4216 B9R1.19 O=S(=O)(Cl)c1ccc[nH]1 Amb25840010 [0,2,0,0,0,0|2,0,0]=4 4217 B9R1.19 O=S(=O)(F)c1ccc[nH]1 Amb24681061 [0,2,0,0,0,0|2,0,0]=4 4218 B9R1.19 O=S(=O)(F)c1ccc[s]1 Amb18520967 [0,2,0,0,0,0|1,1,0]=4 4219 B9R1.19 OB(O)(O)c1ccco1 Amb24615100 [0,2,0,0,0,0|1,0,1]=4 4220 B9R1.19 OP(=O)(c1cccs1)O Amb10558199 [0,2,0,0,0,0|1,1,0]=4 4221 B9R1.19 OP(O)(=O)c1ccc[s]1 Amb24678119 [0,2,0,0,0,0|1,1,0]=4 4222 B9R1.19 OP(O)(=O)c1ccco1 Amb24649753 [0,2,0,0,0,0|1,0,0]=3 4223 B9R1.19 OS(=O)(=O)c1ccc[nH]1 Amb24567340 [0,2,0,0,0,0|2,0,0]=4 4224 B9R1.19 OS(=O)(=O)c1cccs1 Amb17672954 [0,2,0,0,0,0|1,1,0]=4 4225 B9R1.19 [O-]S(=O)(=O)c1ccc[s]1 Amb22346181 [0,2,0,0,0,0|1,1,0]=4 4226 B9R1.41 CC(=O)N1CC=CC1=O Amb22494822 [0,2,0,0,0,0|2,0,0]=4 4227 B9R1.41 CC(=O)[n]1cccc1N Amb25032085 [0,2,0,0,0,0|2,0,0]=4 4228 B9R1.41 CC(=O)c1[nH][n]cc1N Amb22495431 [0,2,0,0,0,0|2,0,0]=4 4229 B9R1.41 CC(=O)c1[nH]c[n]c1C Amb22463133 [0,2,0,0,0,0|2,0,0]=4 4230 B9R1.41 CC(=O)c1[nH]c[n]c1N Amb18642279 [0,2,0,0,0,0|2,0,0]=4 4231 B9R1.41 CC(=O)c1[nH]ccc1C Amb17593259 [0,2,0,0,0,0|1,0,0]=3 4232 B9R1.41 CC(=O)c1[nH]ccc1N Amb18832901 [0,2,0,0,0,0|1,0,0]=3 4233 B9R1.41 CC(=O)c1[nH]ccc1O Amb25837329 [0,2,0,0,0,0|1,0,0]=3 4234 B9R1.41 CC(=O)c1[n]cc[n]1O Amb25716983 [0,2,0,0,0,0|2,0,0]=4 4235 B9R1.41 CC(=O)c1[s][n]cc1N Amb18202585 [0,2,0,0,0,0|1,1,0]=4 4236 B9R1.41 CC(=O)c1[s]c[n]c1Br Amb18176253 [0,2,0,0,0,0|1,1,0]=4 4237 B9R1.41 CC(=O)c1[s]c[n]c1Cl Amb24686719 [0,2,0,0,0,0|1,1,0]=4 4238 B9R1.41 CC(=O)c1[s]c[n]c1N Amb18831647 [0,2,0,0,0,0|1,1,0]=4 4239 B9R1.41 CC(=O)c1[s]ccc1F Amb18831514 [0,2,0,0,0,0|0,1,0]=3 4240 B9R1.41 CC(=O)c1[s]ccc1O Amb18202590 [0,2,0,0,0,0|0,1,0]=3 4241 B9R1.41 CC(=O)c1c[nH]cc1C Amb1031557 [0,2,0,0,0,0|2,0,0]=4 4242 B9R1.41 CC(=O)c1c[n]c[n]1C Amb18145080 [0,2,0,0,0,0|2,0,0]=4 4243 B9R1.41 CC(=O)c1c[s]cc1Br Amb22500733 [0,2,0,0,0,0|2,0,0]=4 4244 B9R1.41 CC(=O)c1c[s]cc1Cl Amb22899017 [0,2,0,0,0,0|2,0,0]=4 4245 B9R1.41 CC(=O)c1c[s]cc1F Amb18202408 [0,2,0,0,0,0|2,0,0]=4 4246 B9R1.41 CC(=O)c1c[s]cc1N Amb23455111 [0,2,0,0,0,0|2,0,0]=4 4247 B9R1.41 CC(=O)c1c[s]cc1O Amb24662074 [0,2,0,0,0,0|2,0,0]=4 4248 B9R1.41 CC(=O)c1cc[s]c1Br Amb22498154 [0,2,0,0,0,0|2,0,0]=4 4249 B9R1.41 CC(=O)c1cc[s]c1Cl Amb25147022 [0,2,0,0,0,0|2,0,0]=4 4250 B9R1.41 CC(=O)c1cc[s]c1S Amb25185349 [0,2,0,0,0,0|2,0,0]=4 4251 B9R1.41 CC(=O)c1ccc[n]1N Amb25188906 [0,2,0,0,0,0|1,0,0]=3 4252 B9R1.41 CC(=O)c1ccnn1C Amb1995284 [0,2,0,0,0,0|2,0,0]=4 4253 B9R1.41 CC(=O)c1ccsc1N Amb16231458 [0,2,0,0,0,0|2,0,0]=4 4254 B9R1.41 CC(=O)c1nccn1C Amb16230260 [0,2,0,0,0,0|2,0,0]=4 4255 B9R1.41 CC(=O)c1occc1Br Amb19374756 [0,2,0,0,0,0|0,0,0]=2 4256 B9R1.41 CC(=O)c1occc1N Amb18832859 [0,2,0,0,0,0|0,0,0]=2 4257 B9R1.41 CC(=O)c1occc1S Amb24518707 [0,2,0,0,0,0|0,0,0]=2 4258 B9R1.41 CC(=O)c1sccc1Br Amb2440289 [0,2,0,0,0,0|0,1,0]=3 4259 B9R1.41 CC(=O)c1sccc1Cl Amb2415188 [0,2,0,0,0,0|0,1,0]=3 4260 B9R1.41 CC(=S)c1ccc[n]1C Amb25257219 [0,2,0,0,0,0|1,1,0]=4 4261 B9R1.41 CC(C)c1occc1Br Amb18820654 [0,2,0,0,0,0|1,0,1]=4 4262 B9R1.41 CC(Cl)c1occc1Br Amb25769784 [0,2,0,0,0,0|1,0,1]=4 4263 B9R1.41 CC(N)c1occc1N Amb24358118 [0,2,0,0,0,0|1,0,1]=4 4264 B9R1.41 CC(N)c1occc1O Amb24480336 [0,2,0,0,0,0|1,0,1]=4 4265 B9R1.41 CC(O)c1occc1Cl Amb25136263 [0,2,0,0,0,0|0,0,2]=4 4266 B9R1.41 CC=1C=CCC1C(O)=O Amb24358734 [0,2,0,0,0,0|1,0,0]=3 4267 B9R1.41 CC=1CC=CC1C(O)=O Amb25145525 [0,2,0,0,0,0|1,0,1]=4 4268 B9R1.41 CN1C=CC=[N]1C(C)=O Amb17873694 [0,2,0,0,0,0|2,0,0]=4 4269 B9R1.41 C[C@@H](N)c1occc1F Amb24760248 [0,2,0,0,0,0|1,0,1]=4 4270 B9R1.41 C[C@@H](N)c1occc1N Amb25108222 [0,2,0,0,0,0|1,0,1]=4 4271 B9R1.41 C[C@H](N)c1occc1Cl Amb25067336 [0,2,0,0,0,0|1,0,1]=4 4272 B9R1.41 C[n]1cccc1C(=O)F Amb24696861 [0,2,0,0,0,0|1,0,0]=3 4273 B9R1.41 C[n]1cccc1C(N)=S Amb25032223 [0,2,0,0,0,0|1,1,0]=4 4274 B9R1.41 C[n]1cccc1S(O)=O Amb25335328 [0,2,0,0,0,0|2,0,0]=4 4275 B9R1.41 C\C(\O)=C/1\OC=CC1=O Amb25686104 [0,2,0,0,0,0|0,0,1]=3 4276 B9R1.41 C\C(\O)=C/1\SC=CC1=O Amb24340198 [0,2,0,0,0,0|0,1,1]=4 4277 B9R1.41 Cc1[nH]c[n]c1C(O)=O Amb23385331 [0,2,0,0,0,0|2,0,0]=4 4278 B9R1.41 Cc1[nH]ccc1C(N)=O Amb25145979 [0,2,0,0,0,0|2,0,0]=4 4279 B9R1.41 Cc1[n][n]oc1C(O)=O Amb25348753 [0,2,0,0,0,0|2,0,0]=4 4280 B9R1.41 Cc1[n]c[nH]c1C(N)=O Amb24714752 [0,2,0,0,0,0|2,0,0]=4 4281 B9R1.41 Cc1[n]c[s]c1C(O)=O Amb21953746 [0,2,0,0,0,0|1,1,0]=4 4282 B9R1.41 Cc1[n]coc1C(C)=O Amb20621539 [0,2,0,0,0,0|1,0,0]=3 4283 B9R1.41 Cc1[s]c[n]c1C(=O)Cl Amb21961749 [0,2,0,0,0,0|2,0,0]=4 4284 B9R1.41 Cc1[s]c[n]c1C(C)=O Amb18831707 [0,2,0,0,0,0|2,0,0]=4 4285 B9R1.41 Cc1[s]c[n]c1C(N)=O Amb22498462 [0,2,0,0,0,0|2,0,0]=4 4286 B9R1.41 Cc1[s]ccc1C(=O)Cl Amb25320759 [0,2,0,0,0,0|2,0,0]=4 4287 B9R1.41 Cc1[s]ccc1C(C)=O Amb25102874 [0,2,0,0,0,0|2,0,0]=4 4288 B9R1.41 Cc1c(nc[nH]1)C(=O)O Amb10608578 [0,2,0,0,0,0|2,0,0]=4 4289 B9R1.41 Cc1c[n][nH]c1C(C)=O Amb18832920 [0,2,0,0,0,0|2,0,0]=4 4290 B9R1.41 Cc1c[n]oc1C(C)=O Amb18832846 [0,2,0,0,0,0|1,0,0]=3 4291 B9R1.41 Cc1c[n]oc1C(N)=O Amb24332206 [0,2,0,0,0,0|1,0,0]=3 4292 B9R1.41 Cc1c[s][n]c1C(O)=O Amb24706313 [0,2,0,0,0,0|2,0,0]=4 4293 B9R1.41 Cc1c[s]cc1C(C)=O Amb24333731 [0,2,0,0,0,0|2,0,0]=4 4294 B9R1.41 Cc1c[s]cc1C(N)=O Amb24699178 [0,2,0,0,0,0|2,0,0]=4 4295 B9R1.41 Cc1c[s]cc1C(O)=O Amb20240802 [0,2,0,0,0,0|2,0,0]=4 4296 B9R1.41 Cc1cc[nH]c1C(N)=O Amb22500475 [0,2,0,0,0,0|1,0,0]=3 4297 B9R1.41 Cc1cc[nH]c1C(N)=S Amb24579039 [0,2,0,0,0,0|1,1,0]=4 4298 B9R1.41 Cc1cc[nH]c1C(O)=O Amb22491226 [0,2,0,0,0,0|1,0,0]=3 4299 B9R1.41 Cc1cc[s]c1C(C)=S Amb25073701 [0,2,0,0,0,0|0,2,0]=4 4300 B9R1.41 Cc1ccnn1C(N)=O Amb17778918 [0,2,0,0,0,0|2,0,0]=4 4301 B9R1.41 Cc1ccoc1B(O)O Amb25106923 [0,2,0,0,0,0|1,0,1]=4 4302 B9R1.41 Cc1ccoc1C(C)=O Amb20668258 [0,2,0,0,0,0|0,0,0]=2 4303 B9R1.41 Cc1ccoc1C(C)N Amb18203315 [0,2,0,0,0,0|1,0,1]=4 4304 B9R1.41 Cc1ccoc1C(C)O Amb25121301 [0,2,0,0,0,0|0,0,2]=4 4305 B9R1.41 Cc1ccoc1C(F)F Amb23589862 [0,2,0,0,0,0|1,0,1]=4 4306 B9R1.41 Cc1ccoc1C(N)=N Amb24368716 [0,2,0,0,0,0|1,0,0]=3 4307 B9R1.41 Cc1ccoc1C(N)=S Amb25775196 [0,2,0,0,0,0|0,1,0]=3 4308 B9R1.41 Cc1ccoc1[C@@H](C)N Amb25707081 [0,2,0,0,0,0|1,0,1]=4 4309 B9R1.41 Cc1ccoc1[N+]([O-])=O Amb24062153 [0,2,0,0,0,0|1,0,0]=3 4310 B9R1.41 Cc1cnoc1C(=O)O Amb10071410 [0,2,0,0,0,0|1,0,0]=3 4311 B9R1.41 Cc1co[n]c1C(=O)Cl Amb24453247 [0,2,0,0,0,0|2,0,0]=4 4312 B9R1.41 Cc1co[n]c1C(N)=O Amb25836375 [0,2,0,0,0,0|2,0,0]=4 4313 B9R1.41 Cc1cocc1C(=O)Cl Amb25239178 [0,2,0,0,0,0|2,0,0]=4 4314 B9R1.41 Cc1cocc1C(O)=O Amb22886569 [0,2,0,0,0,0|2,0,0]=4 4315 B9R1.41 Cc1conc1C(=O)O Amb13883731 [0,2,0,0,0,0|2,0,0]=4 4316 B9R1.41 Cc1oc[n]c1C(C)=O Amb25245183 [0,2,0,0,0,0|2,0,0]=4 4317 B9R1.41 Cc1oc[n]c1C(N)=O Amb25141600 [0,2,0,0,0,0|2,0,0]=4 4318 B9R1.41 Cc1occc1C(=O)O Amb1102055 [0,2,0,0,0,0|2,0,0]=4 4319 B9R1.41 Cc1ocnc1C(=O)Cl Amb10071436 [0,2,0,0,0,0|2,0,0]=4 4320 B9R1.41 Cc1ocnc1C(=O)O Amb10067408 [0,2,0,0,0,0|2,0,0]=4 4321 B9R1.41 Cc1sccc1C(=O)O Amb2447618 [0,2,0,0,0,0|2,0,0]=4 4322 B9R1.41 Cc1scnc1C(=O)O Amb10067521 [0,2,0,0,0,0|2,0,0]=4 4323 B9R1.41 ClC(=O)c1nccn1C Amb10844843 [0,2,0,0,0,0|2,0,0]=4 4324 B9R1.41 Cn1cncc1C(=O)Cl Amb10844742 [0,2,0,0,0,0|2,0,0]=4 4325 B9R1.41 Cn1cncc1C(=O)N Amb10070980 [0,2,0,0,0,0|2,0,0]=4 4326 B9R1.41 Cn1nccc1C(=O)N Amb1948450 [0,2,0,0,0,0|2,0,0]=4 4327 B9R1.41 Cn1nccc1C(=O)O Amb1068318 [0,2,0,0,0,0|2,0,0]=4 4328 B9R1.41 NC(=N)c1[s]ccc1Br Amb24478707 [0,2,0,0,0,0|1,1,0]=4 4329 B9R1.41 NC(=N)c1[s]ccc1Cl Amb24532417 [0,2,0,0,0,0|1,1,0]=4 4330 B9R1.41 NC(=N)c1occc1Br Amb25350008 [0,2,0,0,0,0|1,0,0]=3 4331 B9R1.41 NC(=O)[13c]1[15n]c[nH][13c]1N Amb17608114 [0,2,0,0,0,0|2,0,0]=4 4332 B9R1.41 NC(=O)c1[nH]cnc1N Amb2371528 [0,2,0,0,0,0|2,0,0]=4 4333 B9R1.41 NC(=O)c1[nH]ncc1N Amb1040035 [0,2,0,0,0,0|2,0,0]=4 4334 B9R1.41 NC(=O)c1[n][nH]cc1F Amb25340430 [0,2,0,0,0,0|2,0,0]=4 4335 B9R1.41 NC(=O)c1[n][nH]cc1I Amb23449598 [0,2,0,0,0,0|2,0,0]=4 4336 B9R1.41 NC(=O)c1[n][s]cc1Br Amb24757529 [0,2,0,0,0,0|2,0,0]=4 4337 B9R1.41 NC(=O)c1[n]c[nH]c1F Amb24746766 [0,2,0,0,0,0|2,0,0]=4 4338 B9R1.41 NC(=O)c1[n]c[s]c1Br Amb22753107 [0,2,0,0,0,0|2,0,0]=4 4339 B9R1.41 NC(=O)c1[n]c[s]c1Cl Amb23402176 [0,2,0,0,0,0|2,0,0]=4 4340 B9R1.41 NC(=O)c1[s]c[n]c1Br Amb25219914 [0,2,0,0,0,0|1,1,0]=4 4341 B9R1.41 NC(=O)c1[s]c[n]c1Cl Amb25714788 [0,2,0,0,0,0|1,1,0]=4 4342 B9R1.41 NC(=O)c1[s]ccc1F Amb24681772 [0,2,0,0,0,0|0,1,0]=3 4343 B9R1.41 NC(=O)c1[s]ccc1S Amb24594973 [0,2,0,0,0,0|0,1,0]=3 4344 B9R1.41 NC(=O)c1c(Br)cn[nH]1 Amb16186688 [0,2,0,0,0,0|2,0,0]=4 4345 B9R1.41 NC(=O)c1c(Cl)cn[nH]1 Amb16186691 [0,2,0,0,0,0|2,0,0]=4 4346 B9R1.41 NC(=O)c1c[s]cc1Br Amb24610632 [0,2,0,0,0,0|2,0,0]=4 4347 B9R1.41 NC(=O)c1c[s]cc1I Amb24666094 [0,2,0,0,0,0|2,0,0]=4 4348 B9R1.41 NC(=O)c1cc[n][n]1N Amb24717734 [0,2,0,0,0,0|2,0,0]=4 4349 B9R1.41 NC(=O)c1cc[s]c1Br Amb22275928 [0,2,0,0,0,0|2,0,0]=4 4350 B9R1.41 NC(=O)c1ccc[n]1N Amb23440206 [0,2,0,0,0,0|1,0,0]=3 4351 B9R1.41 NC(=O)c1cccn1N Amb10067897 [0,2,0,0,0,0|1,0,0]=3 4352 B9R1.41 NC(=O)c1nc[nH]c1I Amb1982323 [0,2,0,0,0,0|2,0,0]=4 4353 B9R1.41 NC(=O)c1nc[nH]c1O Amb10602934 [0,2,0,0,0,0|2,0,0]=4 4354 B9R1.41 NC(=O)c1nccn1C Amb2415054 [0,2,0,0,0,0|2,0,0]=4 4355 B9R1.41 NC(=O)c1nscc1N Amb1089974 [0,2,0,0,0,0|2,0,0]=4 4356 B9R1.41 NC(=O)c1occc1Br Amb25757923 [0,2,0,0,0,0|0,0,0]=2 4357 B9R1.41 NC(=O)c1sccc1Cl Amb2433270 [0,2,0,0,0,0|0,1,0]=3 4358 B9R1.41 NC(=O)c1sccc1O Amb1398894 [0,2,0,0,0,0|0,1,0]=3 4359 B9R1.41 NC(=S)c1sccc1C Amb1116860 [0,2,0,0,0,0|0,2,0]=4 4360 B9R1.41 N[n]1[n]ccc1C(O)=O Amb18642485 [0,2,0,0,0,0|2,0,0]=4 4361 B9R1.41 N[n]1c[n]cc1C(O)=O Amb24724172 [0,2,0,0,0,0|2,0,0]=4 4362 B9R1.41 N[n]1cc[n]c1C(O)=O Amb24470695 [0,2,0,0,0,0|2,0,0]=4 4363 B9R1.41 Nc1[nH]c[n]c1C(=O)Cl Amb25769983 [0,2,0,0,0,0|2,0,0]=4 4364 B9R1.41 Nc1[nH]ccc1C(N)=O Amb22500910 [0,2,0,0,0,0|2,0,0]=4 4365 B9R1.41 Nc1[n]c[s]c1C(O)=O Amb24481890 [0,2,0,0,0,0|1,1,0]=4 4366 B9R1.41 Nc1[s]c[n]c1C(N)=O Amb18643989 [0,2,0,0,0,0|2,0,0]=4 4367 B9R1.41 Nc1[s]c[n]c1C(O)=O Amb25302896 [0,2,0,0,0,0|2,0,0]=4 4368 B9R1.41 Nc1[s]ccc1C([O-])=O Amb22057350 [0,2,0,0,0,0|2,0,0]=4 4369 B9R1.41 Nc1[s]ccc1C([O-])=O Amb22756870 [0,2,0,0,0,0|2,0,0]=4 4370 B9R1.41 Nc1c[nH][n]c1C(O)=O Amb22279479 [0,2,0,0,0,0|2,0,0]=4 4371 B9R1.41 Nc1c[nH]nc1C(=O)O Amb10669484 [0,2,0,0,0,0|2,0,0]=4 4372 B9R1.41 Nc1c[n][nH]c1C(N)=O Amb19889128 [0,2,0,0,0,0|2,0,0]=4 4373 B9R1.41 Nc1c[n][nH]c1C(N)=O Amb22283595 [0,2,0,0,0,0|2,0,0]=4 4374 B9R1.41 Nc1c[n][nH]c1C(N)=O Amb22492369 [0,2,0,0,0,0|2,0,0]=4 4375 B9R1.41 Nc1c[n][s]c1C(N)=O Amb24691139 [0,2,0,0,0,0|1,1,0]=4 4376 B9R1.41 Nc1c[n][s]c1C(O)=O Amb18831515 [0,2,0,0,0,0|1,1,0]=4 4377 B9R1.41 Nc1c[s][n]c1C(O)=O Amb20669014 [0,2,0,0,0,0|2,0,0]=4 4378 B9R1.41 Nc1cc[nH]c1C(N)=O Amb22750975 [0,2,0,0,0,0|1,0,0]=3 4379 B9R1.41 Nc1cc[nH]c1C([O-])=O Amb22899244 [0,2,0,0,0,0|1,0,0]=3 4380 B9R1.41 Nc1cc[nH]c1C([O-])=O Amb22899245 [0,2,0,0,0,0|1,0,0]=3 4381 B9R1.41 Nc1cc[n][n]1C(N)=O Amb24426478 [0,2,0,0,0,0|2,0,0]=4 4382 B9R1.41 Nc1cc[s]c1C(N)=S Amb25336559 [0,2,0,0,0,0|0,2,0]=4 4383 B9R1.41 Nc1cc[s]c1C(O)=O Amb19888389 [0,2,0,0,0,0|0,1,0]=3 4384 B9R1.41 Nc1cc[s]c1[N+]([O-])=O Amb22263237 [0,2,0,0,0,0|1,1,0]=4 4385 B9R1.41 Nc1ccoc1C(O)=O Amb18832709 [0,2,0,0,0,0|0,0,0]=2 4386 B9R1.41 Nc1cocc1C(O)=O Amb25180110 [0,2,0,0,0,0|2,0,0]=4 4387 B9R1.41 Nc1cscc1C(=O)O Amb10071408 [0,2,0,0,0,0|2,0,0]=4 4388 B9R1.41 Nc1csnc1C(=O)O Amb10068068 [0,2,0,0,0,0|2,0,0]=4 4389 B9R1.41 Nc1csnc1C(=O)O Amb1068363 [0,2,0,0,0,0|2,0,0]=4 4390 B9R1.41 Nc1nc[nH]c1C(=O)O Amb10576594 [0,2,0,0,0,0|2,0,0]=4 4391 B9R1.41 Nc1oc[n]c1C(N)=O Amb20241351 [0,2,0,0,0,0|2,0,0]=4 4392 B9R1.41 Nc1oc[n]c1C(O)=O Amb25217256 [0,2,0,0,0,0|2,0,0]=4 4393 B9R1.41 Nc1occc1C(O)=O Amb24481891 [0,2,0,0,0,0|2,0,0]=4 4394 B9R1.41 O=C(Cl)c1[nH]ccc1Cl Amb25287748 [0,2,0,0,0,0|1,0,0]=3 4395 B9R1.41 O=C(Cl)c1[s]ccc1I Amb25746476 [0,2,0,0,0,0|0,1,0]=3 4396 B9R1.41 O=C(Cl)c1cc[s]c1F Amb24511496 [0,2,0,0,0,0|2,0,0]=4 4397 B9R1.41 O=C(Cl)c1cc[s]c1I Amb24651200 [0,2,0,0,0,0|2,0,0]=4 4398 B9R1.41 O=C(Cl)c1occc1Cl Amb25147033 [0,2,0,0,0,0|0,0,0]=2 4399 B9R1.41 O=N(=O)c1[s]ccc1Br Amb20620585 [0,2,0,0,0,0|1,1,0]=4 4400 B9R1.41 O=S(Cl)c1[s]ccc1Br Amb25211359 [0,2,0,0,0,0|1,1,0]=4 4401 B9R1.41 OC(=O)C1=CC=CS1O Amb25825290 [0,2,0,0,0,0|0,1,0]=3 4402 B9R1.41 OC(=O)c1[nH][n]cc1Br Amb19341714 [0,2,0,0,0,0|2,0,0]=4 4403 B9R1.41 OC(=O)c1[nH][n]cc1Cl Amb17659436 [0,2,0,0,0,0|2,0,0]=4 4404 B9R1.41 OC(=O)c1[nH][n]cc1S Amb24655262 [0,2,0,0,0,0|2,0,0]=4 4405 B9R1.41 OC(=O)c1[nH]c[n]c1Br Amb22499455 [0,2,0,0,0,0|2,0,0]=4 4406 B9R1.41 OC(=O)c1[nH]c[n]c1Cl Amb18644301 [0,2,0,0,0,0|2,0,0]=4 4407 B9R1.41 OC(=O)c1[nH]c[n]c1I Amb24505060 [0,2,0,0,0,0|2,0,0]=4 4408 B9R1.41 OC(=O)c1[nH]c[n]c1S Amb18644065 [0,2,0,0,0,0|2,0,0]=4 4409 B9R1.41 OC(=O)c1[n][nH]cc1F Amb25367576 [0,2,0,0,0,0|2,0,0]=4 4410 B9R1.41 OC(=O)c1[n][s]cc1Br Amb25827572 [0,2,0,0,0,0|2,0,0]=4 4411 B9R1.41 OC(=O)c1[n][s]cc1I Amb25161872 [0,2,0,0,0,0|2,0,0]=4 4412 B9R1.41 OC(=O)c1[n]c[nH]c1F Amb24518973 [0,2,0,0,0,0|2,0,0]=4 4413 B9R1.41 OC(=O)c1[n]c[s]c1Cl Amb23400582 [0,2,0,0,0,0|2,0,0]=4 4414 B9R1.41 OC(=O)c1[n]c[s]c1I Amb24730301 [0,2,0,0,0,0|2,0,0]=4 4415 B9R1.41 OC(=O)c1[n]cc[n]1O Amb25042752 [0,2,0,0,0,0|2,0,0]=4 4416 B9R1.41 OC(=O)c1[n]coc1Br Amb22235323 [0,2,0,0,0,0|2,0,0]=4 4417 B9R1.41 OC(=O)c1[s]c[n]c1Br Amb18778174 [0,2,0,0,0,0|1,1,0]=4 4418 B9R1.41 OC(=O)c1c(Br)cn[nH]1 Amb1995353 [0,2,0,0,0,0|2,0,0]=4 4419 B9R1.41 OC(=O)c1c(I)cn[nH]1 Amb1948448 [0,2,0,0,0,0|2,0,0]=4 4420 B9R1.41 OC(=O)c1c[nH]cc1Cl Amb18202360 [0,2,0,0,0,0|2,0,0]=4 4421 B9R1.41 OC(=O)c1c[s]cc1S Amb18126245 [0,2,0,0,0,0|2,0,0]=4 4422 B9R1.41 OC(=O)c1cc[s]c1I Amb24741705 [0,2,0,0,0,0|2,0,0]=4 4423 B9R1.41 OC(=O)c1cccn1C Amb1151288 [0,2,0,0,0,0|1,0,0]=3 4424 B9R1.41 OC(=O)c1ccoc1Cl Amb25731243 [0,2,0,0,0,0|2,0,0]=4 4425 B9R1.41 OC(=O)c1ccsc1Cl Amb10576176 [0,2,0,0,0,0|2,0,0]=4 4426 B9R1.41 OC(=O)c1cocc1Cl Amb18202241 [0,2,0,0,0,0|2,0,0]=4 4427 B9R1.41 OC(=O)c1cscc1Br Amb2447458 [0,2,0,0,0,0|2,0,0]=4 4428 B9R1.41 OC(=O)c1n[nH]cc1Br Amb1080876 [0,2,0,0,0,0|2,0,0]=4 4429 B9R1.41 OC(=O)c1n[nH]cc1Cl Amb1934810 [0,2,0,0,0,0|2,0,0]=4 4430 B9R1.41 OC(=O)c1nccn1C Amb1107172 [0,2,0,0,0,0|2,0,0]=4 4431 B9R1.41 OC(=O)c1ncsc1Br Amb10067425 [0,2,0,0,0,0|2,0,0]=4 4432 B9R1.41 OC(=O)c1oc[n]c1Br Amb24481767 [0,2,0,0,0,0|1,0,0]=3 4433 B9R1.41 OC(=O)c1occc1C Amb1156943 [0,2,0,0,0,0|0,0,0]=2 4434 B9R1.41 OC(=O)c1occc1Cl Amb18202245 [0,2,0,0,0,0|0,0,0]=2 4435 B9R1.41 OC(=O)c1sccc1O Amb10069920 [0,2,0,0,0,0|0,1,0]=3 4436 B9R1.41 OC(=O)c1sccc1S Amb2405731 [0,2,0,0,0,0|0,1,0]=3 4437 B9R1.41 OC(=O)c1sncc1Br Amb17595558 [0,2,0,0,0,0|1,1,0]=4 4438 B9R1.41 OC(=O)c1sncc1Cl Amb17594060 [0,2,0,0,0,0|1,1,0]=4 4439 B9R1.41 OS(=O)c1[s]ccc1Br Amb24557305 [0,2,0,0,0,0|1,1,0]=4 4440 B9R1.41 Oc1[n]c[nH]c1C(O)=O Amb18203249 [0,2,0,0,0,0|2,0,0]=4 4441 B9R1.41 Oc1c[s][n]c1C(O)=O Amb24062138 [0,2,0,0,0,0|2,0,0]=4 4442 B9R1.41 Oc1c[s]cc1C(O)=O Amb18124673 [0,2,0,0,0,0|2,0,0]=4 4443 B9R1.41 Oc1cc[nH]c1C(O)=O Amb24387128 [0,2,0,0,0,0|1,0,0]=3 4444 B9R1.41 Oc1co[n]c1C(O)=O Amb22055438 [0,2,0,0,0,0|2,0,0]=4 4445 B9R1.41 [O-]C(=O)c1nccn1C Amb13951582 [0,2,0,0,0,0|2,0,0]=4 4446 B9R1.41 [O-]C(=O)c1sccc1N Amb10842119 [0,2,0,0,0,0|0,1,0]=3 4447 B9R1.41 [O-][N+](=O)c1[nH]ccc1Br Amb24694541 [0,2,0,0,0,0|2,0,0]=4 4448 B9R1.163 CC1(C=CC=C1)C(O)=O Amb22011869 [0,2,0,0,0,0|1,0,1]=4 4449 B9R1.163 CC1(C=CCO1)C(O)=O Amb18642581 [0,2,0,0,0,0|0,0,2]=4 4450 B9R1.12 BrCCCc1ccco1 Amb17104550 [0,2,0,0,0,0|1,0,1]=4 4451 B9R1.12 C#C\C=C\c1ccco1 Amb24575226 [0,2,0,0,0,0|1,0,0]=3 4452 B9R1.12 C=C/C=C/c1ccco1 Amb17939509 [0,2,0,0,0,0|1,0,0]=3 4453 B9R1.12 C=CCCc1ccc[nH]1 Amb25858739 [0,2,0,0,0,0|2,0,0]=4 4454 B9R1.12 C=CCNc1[n]cco1 Amb22586361 [0,2,0,0,0,0|2,0,0]=4 4455 B9R1.12 C=CCNc1c[n]co1 Amb25218393 [0,2,0,0,0,0|2,0,0]=4 4456 B9R1.12 C=CCNc1ncco1 Amb2382968 [0,2,0,0,0,0|2,0,0]=4 4457 B9R1.12 C=CCSc1ccc[nH]1 Amb24692500 [0,2,0,0,0,0|2,0,0]=4 4458 B9R1.12 C=CCSc1cccs1 Amb17672857 [0,2,0,0,0,0|1,1,0]=4 4459 B9R1.12 C=COCc1ccc[s]1 Amb25337439 [0,2,0,0,0,0|1,1,0]=4 4460 B9R1.12 C=COCc1ccco1 Amb24631898 [0,2,0,0,0,0|1,0,0]=3 4461 B9R1.12 C=CSCc1ccco1 Amb24757008 [0,2,0,0,0,0|1,0,0]=3 4462 B9R1.12 C=C\C=C\c1ccc[nH]1 Amb24514828 [0,2,0,0,0,0|2,0,0]=4 4463 B9R1.12 CCCCc1ccco1 Amb10070290 [0,2,0,0,0,0|1,0,1]=4 4464 B9R1.12 CCCSc1ccco1 Amb25249856 [0,2,0,0,0,0|1,0,1]=4 4465 B9R1.12 CCNCc1ccco1 Amb1137312 [0,2,0,0,0,0|1,0,1]=4 4466 B9R1.12 CCOCc1ccco1 Amb22234292 [0,2,0,0,0,0|0,0,2]=4 4467 B9R1.12 CC\N=C\c1ccc[s]1 Amb24518706 [0,2,0,0,0,0|1,1,0]=4 4468 B9R1.12 CN/N=C/c1ccc[nH]1 Amb17865990 [0,2,0,0,0,0|2,0,0]=4 4469 B9R1.12 CN/N=C/c1ccco1 Amb17804206 [0,2,0,0,0,0|1,0,0]=3 4470 B9R1.12 CNCCc1ccco1 Amb17399803 [0,2,0,0,0,0|1,0,1]=4 4471 B9R1.12 COCCc1ccco1 Amb25147016 [0,2,0,0,0,0|0,0,2]=4 4472 B9R1.12 COCOc1ccco1 Amb25312610 [0,2,0,0,0,0|0,0,2]=4 4473 B9R1.12 CONCc1ccco1 Amb25760018 [0,2,0,0,0,0|0,0,2]=4 4474 B9R1.12 CO\C=C\c1ccco1 Amb25208464 [0,2,0,0,0,0|0,0,1]=3 4475 B9R1.12 CO\N=C\c1ccc[nH]1 Amb25781615 [0,2,0,0,0,0|1,0,1]=4 4476 B9R1.12 CS\C=C\c1ccc[nH]1 Amb24629837 [0,2,0,0,0,0|1,1,0]=4 4477 B9R1.12 C\C=C\Cc1ccc[nH]1 Amb25243730 [0,2,0,0,0,0|2,0,0]=4 4478 B9R1.12 C\C=C\Sc1ccc[s]1 Amb24639360 [0,2,0,0,0,0|1,1,0]=4 4479 B9R1.12 ClCC#Cc1ccco1 Amb25215455 [0,2,0,0,0,0|1,0,1]=4 4480 B9R1.12 ClCSCc1ccco1 Amb25265779 [0,2,0,0,0,0|0,1,1]=4 4481 B9R1.12 ClC\C=C\c1ccc[s]1 Amb25084944 [0,2,0,0,0,0|1,1,0]=4 4482 B9R1.12 Cl\C=C\C=C1C=CC=C1 Amb25109347 [0,2,0,0,0,0|2,0,0]=4 4483 B9R1.12 N#CCCc1ccco1 Amb20623925 [0,2,0,0,0,0|1,0,1]=4 4484 B9R1.12 N#C\C=C\c1ccc[nH]1 Amb24529117 [0,2,0,0,0,0|2,0,0]=4 4485 B9R1.12 N#C\C=C\c1ccco1 Amb16233571 [0,2,0,0,0,0|1,0,0]=3 4486 B9R1.12 NC\C=C/c1ccco1 Amb25312822 [0,2,0,0,0,0|1,0,0]=3 4487 B9R1.12 NC\C=C\c1ccc[s]1 Amb18563038 [0,2,0,0,0,0|1,1,0]=4 4488 B9R1.12 NC\C=C\c1ccco1 Amb10560864 [0,2,0,0,0,0|1,0,0]=3 4489 B9R1.12 NOCCc1ccco1 Amb25208726 [0,2,0,0,0,0|0,0,2]=4 4490 B9R1.12 O=C=NCc1cc[n]o1 Amb18061876 [0,2,0,0,0,0|1,0,1]=4 4491 B9R1.12 O=CC#Cc1c[s]cc1 Amb24480330 [0,2,0,0,0,0|2,0,0]=4 4492 B9R1.12 O=CC#Cc1ccco1 Amb24546607 [0,2,0,0,0,0|0,0,0]=2 4493 B9R1.12 O=CCC[n]1cccc1 Amb24062842 [0,2,0,0,0,0|2,0,0]=4 4494 B9R1.12 O=CCCc1[nH]cc[n]1 Amb25076704 [0,2,0,0,0,0|2,0,0]=4 4495 B9R1.12 O=CCCc1[n]cco1 Amb24511583 [0,2,0,0,0,0|1,0,0]=3 4496 B9R1.12 O=CCCc1c[nH]c[n]1 Amb18642200 [0,2,0,0,0,0|2,0,0]=4 4497 B9R1.12 O=CCCc1c[n]c[s]1 Amb25705083 [0,2,0,0,0,0|1,1,0]=4 4498 B9R1.12 O=CCCc1c[s]c[n]1 Amb24099812 [0,2,0,0,0,0|2,0,0]=4 4499 B9R1.12 O=CCCc1ccc[nH]1 Amb24760290 [0,2,0,0,0,0|1,0,0]=3 4500 B9R1.12 O=CCCc1ccco1 Amb17081672 [0,2,0,0,0,0|0,0,0]=2 4501 B9R1.12 O=CCCc1cccs1 Amb17081673 [0,2,0,0,0,0|0,1,0]=3 4502 B9R1.12 O=CCCc1coc[n]1 Amb24559446 [0,2,0,0,0,0|2,0,0]=4 4503 B9R1.12 O=CCSc1[n]cc[s]1 Amb18800114 [0,2,0,0,0,0|1,1,0]=4 4504 B9R1.12 O=CCSc1[n]cco1 Amb24599824 [0,2,0,0,0,0|1,0,0]=3 4505 B9R1.12 O=CCSc1cccs1 Amb17082929 [0,2,0,0,0,0|0,1,0]=3 4506 B9R1.12 O=CC[CH]c1c[nH]c[n]1 Amb24073776 [0,2,0,0,0,0|2,0,0]=4 4507 B9R1.12 O=CNCc1[nH]cc[n]1 Amb24643553 [0,2,0,0,0,0|2,0,0]=4 4508 B9R1.12 O=CNCc1[n]cc[s]1 Amb25295210 [0,2,0,0,0,0|1,1,0]=4 4509 B9R1.12 O=CNCc1c[nH]c[n]1 Amb24478692 [0,2,0,0,0,0|2,0,0]=4 4510 B9R1.12 O=CNCc1c[nH]cc1 Amb24643630 [0,2,0,0,0,0|2,0,0]=4 4511 B9R1.12 O=CNCc1c[s]c[n]1 Amb25146324 [0,2,0,0,0,0|2,0,0]=4 4512 B9R1.12 O=C\C=C\[n]1ccc[n]1 Amb18642043 [0,2,0,0,0,0|2,0,0]=4 4513 B9R1.12 O=C\C=C\c1[n]cc[s]1 Amb24481641 [0,2,0,0,0,0|1,1,0]=4 4514 B9R1.12 O=C\C=C\c1c[nH]c[n]1 Amb24558793 [0,2,0,0,0,0|2,0,0]=4 4515 B9R1.12 O=C\C=C\c1c[s]c[n]1 Amb25299918 [0,2,0,0,0,0|2,0,0]=4 4516 B9R1.12 O=C\C=C\c1c[s]cc1 Amb18643292 [0,2,0,0,0,0|2,0,0]=4 4517 B9R1.12 O=C\C=C\c1cc[n]o1 Amb25325051 [0,2,0,0,0,0|1,0,0]=3 4518 B9R1.12 O=C\C=C\c1ccc[nH]1 Amb18641995 [0,2,0,0,0,0|1,0,0]=3 4519 B9R1.12 O=C\C=C\c1cccs1 Amb17334164 [0,2,0,0,0,0|0,1,0]=3 4520 B9R1.12 O=C\C=C\c1coc[n]1 Amb24628925 [0,2,0,0,0,0|2,0,0]=4 4521 B9R1.12 O=C\C=C\c1cocc1 Amb18124288 [0,2,0,0,0,0|2,0,0]=4 4522 B9R1.12 O=NSCc1ccco1 Amb25806081 [0,2,0,0,0,0|0,0,1]=3 4523 B9R1.12 OC\C=C/c1ccc[nH]1 Amb24744418 [0,2,0,0,0,0|1,0,1]=4 4524 B9R1.12 OC\C=C\c1cc[n]o1 Amb25847068 [0,2,0,0,0,0|1,0,1]=4 4525 B9R1.12 OC\C=C\c1ccc[nH]1 Amb25090739 [0,2,0,0,0,0|1,0,1]=4 4526 B9R1.12 OC\C=C\c1ccc[s]1 Amb23555588 [0,2,0,0,0,0|0,1,1]=4 4527 B9R1.12 S=COCc1ccco1 Amb16232453 [0,2,0,0,0,0|0,1,0]=3 4528 B9R1.12 SCCCc1ccco1 Amb17399874 [0,2,0,0,0,0|0,1,1]=4 4529 B9R1.12 [C-]#[N+]CCc1ccco1 Amb24743086 [0,2,0,0,0,0|1,0,1]=4 4530 B9R1.12 [N-]=[N+]=NCc1ccco1 Amb25791515 [0,2,0,0,0,0|1,0,1]=4 4531 B9R1.13 BrC(Br)=Cc1ccc[nH]1 Amb24464181 [0,2,0,0,0,0|2,0,0]=4 4532 B9R1.13 BrC(Br)=Cc1ccco1 Amb22228062 [0,2,0,0,0,0|1,0,0]=3 4533 B9R1.13 C=C(Br)Cc1ccc[s]1 Amb25185096 [0,2,0,0,0,0|1,1,0]=4 4534 B9R1.13 C=C(Br)Cc1ccco1 Amb24411253 [0,2,0,0,0,0|1,0,0]=3 4535 B9R1.13 C=C(Cl)Cc1ccc[s]1 Amb24674094 [0,2,0,0,0,0|1,1,0]=4 4536 B9R1.13 CC(=C)Cc1ccc[nH]1 Amb24477810 [0,2,0,0,0,0|2,0,0]=4 4537 B9R1.13 CC(=C)Cc1ccco1 Amb24673621 [0,2,0,0,0,0|1,0,0]=3 4538 B9R1.13 CC(=O)CC1=CC=C[SiH2]1 Amb25729101 [0,2,0,0,0,0|1,0,0]=3 4539 B9R1.13 CC(=O)CC1=CCCO1 Amb24583510 [0,2,0,0,0,0|0,0,2]=4 4540 B9R1.13 CC(=O)C[n]1ccc[n]1 Amb21988437 [0,2,0,0,0,0|2,0,0]=4 4541 B9R1.13 CC(=O)Cc1c[nH]c[n]1 Amb25832036 [0,2,0,0,0,0|2,0,0]=4 4542 B9R1.13 CC(=O)Cc1cc[nH]c1 Amb18893399 [0,2,0,0,0,0|2,0,0]=4 4543 B9R1.13 CC(=O)Cc1cc[n]o1 Amb24425365 [0,2,0,0,0,0|1,0,0]=3 4544 B9R1.13 CC(=O)Cc1ccoc1 Amb25713513 [0,2,0,0,0,0|2,0,0]=4 4545 B9R1.13 CC(=O)Cn1cccn1 Amb1092543 [0,2,0,0,0,0|2,0,0]=4 4546 B9R1.13 CC(=O)Nc1c[n]c[nH]1 Amb25125301 [0,2,0,0,0,0|2,0,0]=4 4547 B9R1.13 CC(=O)Nc1c[n]c[s]1 Amb24103761 [0,2,0,0,0,0|1,1,0]=4 4548 B9R1.13 CC(=O)Nc1cc[n]o1 Amb25345903 [0,2,0,0,0,0|1,0,0]=3 4549 B9R1.13 CC(=O)Nc1cc[s][n]1 Amb24381433 [0,2,0,0,0,0|2,0,0]=4 4550 B9R1.13 CC(=O)Nc1cccs1 Amb2228309 [0,2,0,0,0,0|0,1,0]=3 4551 B9R1.13 CC(=O)Nc1ncc[nH]1 Amb2182759 [0,2,0,0,0,0|2,0,0]=4 4552 B9R1.13 CC(=O)Oc1c[nH]c[n]1 Amb24708608 [0,2,0,0,0,0|2,0,0]=4 4553 B9R1.13 CC(=O)Oc1cc[nH]c1 Amb24476976 [0,2,0,0,0,0|2,0,0]=4 4554 B9R1.13 CC(=O)Oc1ccc[s]1 Amb24566730 [0,2,0,0,0,0|0,1,0]=3 4555 B9R1.13 CC(=O)Oc1cocc1 Amb24583167 [0,2,0,0,0,0|2,0,0]=4 4556 B9R1.13 CC(=O)Sc1c[s]cc1 Amb24727644 [0,2,0,0,0,0|2,0,0]=4 4557 B9R1.13 CC(=O)Sc1ccc[s]1 Amb25235134 [0,2,0,0,0,0|0,1,0]=3 4558 B9R1.13 CC(=O)Sc1ccco1 Amb24511658 [0,2,0,0,0,0|0,0,0]=2 4559 B9R1.13 CC(Br)Cc1ccco1 Amb25074648 [0,2,0,0,0,0|1,0,1]=4 4560 B9R1.13 CC(O)Cc1ccco1 Amb22748663 [0,2,0,0,0,0|0,0,2]=4 4561 B9R1.13 CC(O)Nc1ccco1 Amb24392212 [0,2,0,0,0,0|0,0,2]=4 4562 B9R1.13 CC(S)Cc1ccco1 Amb25132353 [0,2,0,0,0,0|0,1,1]=4 4563 B9R1.13 CN(C)Cc1ccco1 Amb22730011 [0,2,0,0,0,0|1,0,1]=4 4564 B9R1.13 CN(N)Cc1ccco1 Amb25216114 [0,2,0,0,0,0|1,0,1]=4 4565 B9R1.13 CS(=O)Cc1ccc[s]1 Amb25746950 [0,2,0,0,0,0|0,1,1]=4 4566 B9R1.13 C[C@@H](O)Cc1ccco1 Amb24433279 [0,2,0,0,0,0|0,0,2]=4 4567 B9R1.13 ClC(Cl)=Cc1ccco1 Amb24559898 [0,2,0,0,0,0|1,0,0]=3 4568 B9R1.13 F\C(\Cl)=C\c1ccco1 Amb24665869 [0,2,0,0,0,0|1,0,0]=3 4569 B9R1.13 NC(=O)Cc1[n]cc[s]1 Amb23440630 [0,2,0,0,0,0|1,1,0]=4 4570 B9R1.13 NC(=O)Cc1c[nH]c[n]1 Amb24746799 [0,2,0,0,0,0|2,0,0]=4 4571 B9R1.13 NC(=O)Cc1c[n]c[s]1 Amb22372056 [0,2,0,0,0,0|1,1,0]=4 4572 B9R1.13 NC(=O)Cc1cc[nH]c1 Amb18243493 [0,2,0,0,0,0|2,0,0]=4 4573 B9R1.13 NC(=O)Cc1ccc[nH]1 Amb22886650 [0,2,0,0,0,0|1,0,0]=3 4574 B9R1.13 NC(=O)Cc1ccco1 Amb24534382 [0,2,0,0,0,0|0,0,0]=2 4575 B9R1.13 NC(=O)Cc1cco[n]1 Amb23440839 [0,2,0,0,0,0|2,0,0]=4 4576 B9R1.13 NC(=O)Cn1cccn1 Amb10609663 [0,2,0,0,0,0|2,0,0]=4 4577 B9R1.13 NC(=O)N[n]1ccc[n]1 Amb25727709 [0,2,0,0,0,0|2,0,0]=4 4578 B9R1.13 NC(=O)Nc1c[nH]c[n]1 Amb24646803 [0,2,0,0,0,0|2,0,0]=4 4579 B9R1.13 NC(=O)Nc1cc[nH][n]1 Amb25231119 [0,2,0,0,0,0|2,0,0]=4 4580 B9R1.13 NC(=O)Nc1cc[s]c1 Amb25749521 [0,2,0,0,0,0|2,0,0]=4 4581 B9R1.13 NC(=O)Nc1cco[n]1 Amb25046601 [0,2,0,0,0,0|2,0,0]=4 4582 B9R1.13 NC(=O)Nc1coc[n]1 Amb25072216 [0,2,0,0,0,0|2,0,0]=4 4583 B9R1.13 NC(=O)Nc1nccs1 Amb1125086 [0,2,0,0,0,0|1,1,0]=4 4584 B9R1.13 NC(=O)Oc1ccc[nH]1 Amb24763643 [0,2,0,0,0,0|1,0,0]=3 4585 B9R1.13 NC(=O)Sc1ccc[s]1 Amb24406078 [0,2,0,0,0,0|0,1,0]=3 4586 B9R1.13 NC(=O)\N=C/1\CC=CS1 Amb24462728 [0,2,0,0,0,0|0,1,1]=4 4587 B9R1.13 NC(=S)Cc1ccc[nH]1 Amb19148730 [0,2,0,0,0,0|1,1,0]=4 4588 B9R1.13 NC(=S)Cc1cccs1 Amb1092031 [0,2,0,0,0,0|0,2,0]=4 4589 B9R1.13 O=C(Cl)C[n]1ccc[n]1 Amb24340282 [0,2,0,0,0,0|2,0,0]=4 4590 B9R1.13 O=C(Cl)Cc1c[nH]c[n]1 Amb25146205 [0,2,0,0,0,0|2,0,0]=4 4591 B9R1.13 O=C(Cl)Cc1ccco1 Amb25124003 [0,2,0,0,0,0|0,0,0]=2 4592 B9R1.13 O=C(Cl)Oc1ccco1 Amb25258766 [0,2,0,0,0,0|0,0,0]=2 4593 B9R1.13 O=C(Cl)Sc1ccc[nH]1 Amb25690947 [0,2,0,0,0,0|1,0,0]=3 4594 B9R1.13 O=C(Cl)Sc1ccc[s]1 Amb24696820 [0,2,0,0,0,0|0,1,0]=3 4595 B9R1.13 O=C(Cn1cccn1)[OH2+] Amb10552495 [0,2,0,0,0,0|2,0,0]=4 4596 B9R1.13 O=C(F)Sc1ccc[s]1 Amb25178865 [0,2,0,0,0,0|0,1,0]=3 4597 B9R1.13 OB(Cc1ccco1)O Amb10576612 [0,2,0,0,0,0|0,0,2]=4 4598 B9R1.13 OC(=O)CC1=CCCO1 Amb24639240 [0,2,0,0,0,0|0,0,2]=4 4599 B9R1.13 OC(=O)Cc1[cH-]ccc1 Amb24122585 [0,2,0,0,0,0|1,0,0]=3 4600 B9R1.13 OC(=O)Cc1[nH]cc[n]1 Amb22750530 [0,2,0,0,0,0|2,0,0]=4 4601 B9R1.13 OC(=O)Cc1[n][n]co1 Amb22753920 [0,2,0,0,0,0|2,0,0]=4 4602 B9R1.13 OC(=O)Cc1c[nH]c[n]1 Amb20670251 [0,2,0,0,0,0|2,0,0]=4 4603 B9R1.13 OC(=O)Cc1cc[nH]c1 Amb18062951 [0,2,0,0,0,0|2,0,0]=4 4604 B9R1.13 OC(=O)Cc1cc[n][nH]1 Amb19243677 [0,2,0,0,0,0|2,0,0]=4 4605 B9R1.13 OC(=O)Cc1cc[n][s]1 Amb18831590 [0,2,0,0,0,0|1,1,0]=4 4606 B9R1.13 OC(=O)Cc1cc[s][n]1 Amb18831591 [0,2,0,0,0,0|2,0,0]=4 4607 B9R1.13 OC(=O)Cc1cscc1 Amb1151879 [0,2,0,0,0,0|2,0,0]=4 4608 B9R1.13 OC(=O)Cc1cscn1 Amb17039671 [0,2,0,0,0,0|2,0,0]=4 4609 B9R1.13 OC(=O)Cn1cccc1 Amb1124868 [0,2,0,0,0,0|2,0,0]=4 4610 B9R1.13 OC(=O)Cn1cccn1 Amb1157167 [0,2,0,0,0,0|2,0,0]=4 4611 B9R1.13 OC(=O)Sc1ccco1 Amb24695916 [0,2,0,0,0,0|0,0,0]=2 4612 B9R1.13 [O-]C(=O)Cc1[n][n]co1 Amb20667981 [0,2,0,0,0,0|2,0,0]=4 4613 B9R1.13 [O-]C(=O)Cc1c[nH]cn1 Amb10843901 [0,2,0,0,0,0|2,0,0]=4 4614 B9R1.33 Brc1cc[s]c1\C=C\Br Amb25247582 [0,2,0,0,0,0|1,1,0]=4 4615 B9R1.33 C=CCc1[s]ccc1Cl Amb25709977 [0,2,0,0,0,0|1,1,0]=4 4616 B9R1.33 C=CCc1[s]ccc1S Amb24743677 [0,2,0,0,0,0|1,1,0]=4 4617 B9R1.33 C=CCc1occc1Br Amb24383548 [0,2,0,0,0,0|1,0,0]=3 4618 B9R1.33 CC1=CCCC1=CC=O Amb24696185 [0,2,0,0,0,0|1,0,1]=4 4619 B9R1.33 C[n]1c[n]cc1CC=O Amb25828319 [0,2,0,0,0,0|2,0,0]=4 4620 B9R1.33 C[n]1c[n]cc1NC=O Amb24096340 [0,2,0,0,0,0|2,0,0]=4 4621 B9R1.33 C[n]1cc[n]c1CC=O Amb25201442 [0,2,0,0,0,0|2,0,0]=4 4622 B9R1.33 C[n]1cccc1\C=C\N Amb24690049 [0,2,0,0,0,0|2,0,0]=4 4623 B9R1.33 C\C=C\c1ccc[n]1C Amb25288473 [0,2,0,0,0,0|2,0,0]=4 4624 B9R1.33 C\N=C\C1=CC=C[NH+]1[O-] Amb25352045 [0,2,0,0,0,0|2,0,0]=4 4625 B9R1.33 Cc1[nH]c[n]c1NC=O Amb24579696 [0,2,0,0,0,0|2,0,0]=4 4626 B9R1.33 Cc1c[n][nH]c1NC=O Amb24702354 [0,2,0,0,0,0|2,0,0]=4 4627 B9R1.33 Cc1cc[s]c1\C=N\N Amb22342744 [0,2,0,0,0,0|1,1,0]=4 4628 B9R1.33 Cc1ccoc1CC#N Amb25247026 [0,2,0,0,0,0|1,0,1]=4 4629 B9R1.33 Cc1ccoc1CCN Amb18832814 [0,2,0,0,0,0|1,0,1]=4 4630 B9R1.33 Cc1ccoc1CCO Amb25300068 [0,2,0,0,0,0|0,0,2]=4 4631 B9R1.33 Cc1ccoc1\C=N\N Amb24449093 [0,2,0,0,0,0|1,0,0]=3 4632 B9R1.33 Cc1occc1CC=O Amb25147113 [0,2,0,0,0,0|2,0,0]=4 4633 B9R1.33 Cc1occc1NC=O Amb19148029 [0,2,0,0,0,0|2,0,0]=4 4634 B9R1.33 Cn1nccc1NC=O Amb2389986 [0,2,0,0,0,0|2,0,0]=4 4635 B9R1.33 NCCc1occc1Br Amb18186835 [0,2,0,0,0,0|1,0,1]=4 4636 B9R1.33 NCCc1occc1Cl Amb18202348 [0,2,0,0,0,0|1,0,1]=4 4637 B9R1.33 NNCc1occc1Br Amb25307686 [0,2,0,0,0,0|1,0,1]=4 4638 B9R1.33 N\N=C\c1[s]ccc1Br Amb25852572 [0,2,0,0,0,0|1,1,0]=4 4639 B9R1.33 N\N=C\c1occc1Br Amb25683319 [0,2,0,0,0,0|1,0,0]=3 4640 B9R1.33 Nc1[n]c[nH]c1NC=O Amb24550713 [0,2,0,0,0,0|2,0,0]=4 4641 B9R1.33 O=C=Nc1[s]ccc1Br Amb25325574 [0,2,0,0,0,0|0,1,1]=4 4642 B9R1.33 O=C=Nc1[s]ccc1Cl Amb25076377 [0,2,0,0,0,0|0,1,1]=4 4643 B9R1.33 O=C=Nc1[s]ccc1I Amb25118607 [0,2,0,0,0,0|0,1,1]=4 4644 B9R1.33 O=C=Nc1o[n]cc1Cl Amb24514121 [0,2,0,0,0,0|1,0,1]=4 4645 B9R1.33 O=CCC1CC=CC1=O Amb24567093 [0,2,0,0,0,0|1,0,1]=4 4646 B9R1.33 O=CCc1[s]ccc1Br Amb24534254 [0,2,0,0,0,0|0,1,0]=3 4647 B9R1.33 O=CCc1cc[s]c1Br Amb24589746 [0,2,0,0,0,0|2,0,0]=4 4648 B9R1.33 OC\C=C/1\CC=CC1=O Amb25179367 [0,2,0,0,0,0|1,0,1]=4 4649 B9R1.33 O\N=C\c1[s]ccc1Cl Amb24532403 [0,2,0,0,0,0|0,1,1]=4 4650 B9R1.14 BrCc1occc1CBr Amb24656536 [0,2,0,0,0,0|1,0,1]=4 4651 B9R1.14 C=Cc1[s]ccc1C=O Amb18643291 [0,2,0,0,0,0|1,1,0]=4 4652 B9R1.14 C=Cc1ccoc1C=O Amb24618362 [0,2,0,0,0,0|0,0,0]=2 4653 B9R1.14 C=Cc1ccoc1CN Amb25758246 [0,2,0,0,0,0|1,0,1]=4 4654 B9R1.14 CC[n]1c[n]cc1C=O Amb22000948 [0,2,0,0,0,0|2,0,0]=4 4655 B9R1.14 CCc1[n]c[nH]c1C=O Amb18642191 [0,2,0,0,0,0|2,0,0]=4 4656 B9R1.14 CCc1[n]coc1C=O Amb25239620 [0,2,0,0,0,0|1,0,0]=3 4657 B9R1.14 CCc1c[nH]cc1C=O Amb18832957 [0,2,0,0,0,0|2,0,0]=4 4658 B9R1.14 CCc1c[s]cc1C=O Amb18680899 [0,2,0,0,0,0|2,0,0]=4 4659 B9R1.14 CCc1cc[nH]c1C=O Amb18662698 [0,2,0,0,0,0|1,0,0]=3 4660 B9R1.14 CCc1ccoc1C=O Amb18139773 [0,2,0,0,0,0|0,0,0]=2 4661 B9R1.14 CCc1cocc1C=O Amb18681114 [0,2,0,0,0,0|2,0,0]=4 4662 B9R1.14 CCc1oc[n]c1C=O Amb18832852 [0,2,0,0,0,0|2,0,0]=4 4663 B9R1.14 CCc1occc1C=O Amb18832921 [0,2,0,0,0,0|1,0,1]=4 4664 B9R1.14 CCc1occc1CBr Amb25738291 [0,2,0,0,0,0|1,0,1]=4 4665 B9R1.14 CCc1occc1CCl Amb24748886 [0,2,0,0,0,0|1,0,1]=4 4666 B9R1.14 COc1[s]ccc1C=O Amb18643875 [0,2,0,0,0,0|2,0,0]=4 4667 B9R1.14 COc1c[s]cc1C=O Amb18643871 [0,2,0,0,0,0|2,0,0]=4 4668 B9R1.14 COc1cc[nH]c1C=O Amb18642271 [0,2,0,0,0,0|1,0,0]=3 4669 B9R1.14 COc1cc[s]c1C=C Amb24698779 [0,2,0,0,0,0|1,1,0]=4 4670 B9R1.14 COc1ccoc1C=O Amb18832783 [0,2,0,0,0,0|0,0,0]=2 4671 B9R1.14 COc1ccoc1CS Amb25090900 [0,2,0,0,0,0|0,1,1]=4 4672 B9R1.14 CSc1c[s]cc1C=O Amb25766408 [0,2,0,0,0,0|2,0,0]=4 4673 B9R1.14 CSc1cc[nH]c1C=O Amb18144329 [0,2,0,0,0,0|1,0,0]=3 4674 B9R1.14 CSc1cc[s]c1C=O Amb18126162 [0,2,0,0,0,0|0,1,0]=3 4675 B9R1.14 CSc1ccoc1C=O Amb25129387 [0,2,0,0,0,0|0,0,0]=2 4676 B9R1.14 CSc1occc1CO Amb25052224 [0,2,0,0,0,0|2,0,0]=4 4677 B9R1.14 N#Cc1[n]c[s]c1C=O Amb25063126 [0,2,0,0,0,0|1,1,0]=4 4678 B9R1.14 N#Cc1[s]ccc1C=O Amb18124489 [0,2,0,0,0,0|2,0,0]=4 4679 B9R1.14 N#Cc1c[s]cc1C=O Amb18124488 [0,2,0,0,0,0|2,0,0]=4 4680 B9R1.14 N#Cc1cc[nH]c1C=O Amb18641985 [0,2,0,0,0,0|1,0,0]=3 4681 B9R1.14 N#Cc1cc[s]c1C=O Amb18124487 [0,2,0,0,0,0|0,1,0]=3 4682 B9R1.14 N#Cc1ccoc1C=O Amb18833003 [0,2,0,0,0,0|0,0,0]=2 4683 B9R1.14 N#Cc1cocc1C=O Amb18833000 [0,2,0,0,0,0|2,0,0]=4 4684 B9R1.14 N#Cc1oc[n]c1C=O Amb25141155 [0,2,0,0,0,0|2,0,0]=4 4685 B9R1.14 N#Cc1occc1C=O Amb18833004 [0,2,0,0,0,0|1,0,1]=4 4686 B9R1.14 NCc1occc1C#N Amb25694984 [0,2,0,0,0,0|1,0,1]=4 4687 B9R1.14 N\C=C/1\C=CC=C1C=N Amb25141671 [0,2,0,0,0,0|2,0,0]=4 4688 B9R1.14 N\C=C/1\C=CC=C1C=O Amb25178056 [0,2,0,0,0,0|1,0,0]=3 4689 B9R1.14 O=C[n]1cccc1C=O Amb25712954 [0,2,0,0,0,0|1,0,0]=3 4690 B9R1.14 O=Cc1[nH]ccc1C=O Amb18642079 [0,2,0,0,0,0|1,0,0]=3 4691 B9R1.14 O=Cc1[nH]ncc1C=O Amb17593266 [0,2,0,0,0,0|2,0,0]=4 4692 B9R1.14 O=Cc1[n]occ1CCl Amb18198373 [0,2,0,0,0,0|2,0,0]=4 4693 B9R1.14 O=Cc1c[nH]cc1C=O Amb18642086 [0,2,0,0,0,0|2,0,0]=4 4694 B9R1.14 O=Cc1ccnn1CC Amb1946013 [0,2,0,0,0,0|2,0,0]=4 4695 B9R1.14 O=Cc1cocc1C=O Amb18124298 [0,2,0,0,0,0|2,0,0]=4 4696 B9R1.14 O=Cc1oc[n]c1CBr Amb24481972 [0,2,0,0,0,0|1,0,0]=3 4697 B9R1.14 O=Cc1occc1C=O Amb18642159 [0,2,0,0,0,0|0,0,0]=2 4698 B9R1.14 OC[n]1cccc1C=O Amb25147120 [0,2,0,0,0,0|1,0,0]=3 4699 B9R1.14 OCc1[nH]c[n]c1C=O Amb24505027 [0,2,0,0,0,0|2,0,0]=4 4700 B9R1.14 OCc1[nH]ccc1C=O Amb18642273 [0,2,0,0,0,0|2,0,0]=4 4701 B9R1.14 OCc1[s]ccc1C=O Amb24665662 [0,2,0,0,0,0|2,0,0]=4 4702 B9R1.14 OCc1cc[s]c1C=O Amb24695882 [0,2,0,0,0,0|0,1,0]=3 4703 B9R1.14 OCc1ccoc1C=O Amb25363458 [0,2,0,0,0,0|0,0,0]=2 4704 B9R1.14 OCc1occc1CO Amb25226420 [0,2,0,0,0,0|0,0,2]=4 4705 B9R1.14 O\C=C/1\C=CC=C1C=O Amb25179840 [0,2,0,0,0,0|1,0,0]=3 4706 B9R1.14 O\N=C/1\OC=C\C1=N\O Amb24553064 [0,2,0,0,0,0|1,0,1]=4 4707 B9R1.27 C[n]1[n]cc(I)c1C=O Amb21964134 [0,2,0,0,0,0|2,0,0]=4 4708 B9R1.27 C[n]1[n]cc(O)c1C=O Amb18832773 [0,2,0,0,0,0|2,0,0]=4 4709 B9R1.27 C[n]1c[n]c(Cl)c1C=O Amb18202378 [0,2,0,0,0,0|2,0,0]=4 4710 B9R1.27 C\C=C/1\C(C)C=CC1=O Amb24690538 [0,2,0,0,0,0|2,0,0]=4 4711 B9R1.27 Cc1cc[n](C)c1C=O Amb18832960 [0,2,0,0,0,0|1,0,0]=3 4712 B9R1.27 Cc1ccc(C)n1C=O Amb17938763 [0,2,0,0,0,0|2,0,0]=4 4713 B9R1.27 Cn1cnc(c1C=O)Br Amb2455704 [0,2,0,0,0,0|2,0,0]=4 4714 B9R1.27 Cn1cnc(c1C=O)I Amb2455721 [0,2,0,0,0,0|2,0,0]=4 4715 B9R1.27 Cn1ncc(c1C=O)Br Amb1935223 [0,2,0,0,0,0|2,0,0]=4 4716 B9R1.27 Cn1ncc(c1C=O)Cl Amb1945846 [0,2,0,0,0,0|2,0,0]=4 4717 B9R1.27 O=C[n]1c(F)ccc1F Amb24596049 [0,2,0,0,0,0|2,0,0]=4 4718 B9R1.27 O=Cc1c(Br)c[s]c1Br Amb22752170 [0,2,0,0,0,0|2,0,0]=4 4719 B9R1.27 O=Cc1c(C)c[nH]c1C Amb17593256 [0,2,0,0,0,0|2,0,0]=4 4720 B9R1.27 O=Cc1c(C)coc1C Amb10982463 [0,2,0,0,0,0|2,0,0]=4 4721 B9R1.27 O=Cc1c(F)coc1Br Amb25248968 [0,2,0,0,0,0|2,0,0]=4 4722 B9R1.27 [O-][n+]1cc[n](O)c1C=O Amb23481556 [0,2,0,0,0,0|2,0,0]=4 4723 B7R1.3 Br[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22336381 [0,0,1,1,0,0|2,0,0]=4 4724 B7R1.3 Br[13c]1ccccc1 Amb22367325 [0,0,1,1,0,0|2,0,0]=4 4725 B7R1.3 Brc1cc[13cH]cc1 Amb22367409 [0,0,1,1,0,0|2,0,0]=4 4726 B7R1.3 Brc1ccccc1 Amb19515902 [0,0,1,1,0,0|2,0,0]=4 4727 B7R1.3 C[13c]1ccccc1 Amb22367236 [0,0,1,1,0,0|2,0,0]=4 4728 B7R1.3 Cc1cc[13cH]cc1 Amb22367414 [0,0,1,1,0,0|2,0,0]=4 4729 B7R1.3 Cc1ccccc1 Amb22367017 [0,0,1,1,0,0|2,0,0]=4 4730 B7R1.3 Cc1cccnc1 Amb2447038 [0,0,1,1,0,0|2,0,0]=4 4731 B7R1.3 Cl[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054660 [0,0,1,1,0,0|2,0,0]=4 4732 B7R1.3 Cl[13c]1ccccc1 Amb22367344 [0,0,1,1,0,0|2,0,0]=4 4733 B7R1.3 Clc1cc[13cH]cc1 Amb22367342 [0,0,1,1,0,0|2,0,0]=4 4734 B7R1.3 Clc1ccccc1 Amb2227557 [0,0,1,1,0,0|2,0,0]=4 4735 B7R1.3 Clc1ccccc1 Amb2227630 [0,0,1,1,0,0|2,0,0]=4 4736 B7R1.3 Fc1c[n]ccc1 Amb24094126 [0,0,1,1,0,0|2,0,0]=4 4737 B7R1.3 I[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17616109 [0,0,1,1,0,0|2,0,0]=4 4738 B7R1.3 Ic1ccccc1 Amb10604185 [0,0,1,1,0,0|2,0,0]=4 4739 B7R1.3 Ic1ccccc1 Amb22491511 [0,0,1,1,0,0|2,0,0]=4 4740 B7R1.3 NC1=CCC=CO1 Amb24351196 [0,0,1,1,0,0|2,0,0]=4 4741 B7R1.3 N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351884 [0,0,1,1,0,0|2,0,0]=4 4742 B7R1.3 N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367382 [0,0,1,1,0,0|2,0,0]=4 4743 B7R1.3 N[13c]1ccccc1 Amb22336472 [0,0,1,1,0,0|2,0,0]=4 4744 B7R1.3 Nc1cc[13cH]cc1 Amb22336796 [0,0,1,1,0,0|2,0,0]=4 4745 B7R1.3 Nc1ccccc1 Amb10808131 [0,0,1,1,0,0|2,0,0]=4 4746 B7R1.3 Nc1ccccc1 Amb1935238 [0,0,1,1,0,0|2,0,0]=4 4747 B7R1.3 Nc1ccccc1 Amb22001719 [0,0,1,1,0,0|2,0,0]=4 4748 B7R1.3 Nc1ccccc1 Amb22279608 [0,0,1,1,0,0|2,0,0]=4 4749 B7R1.3 Nc1ccccc1 Amb22504223 [0,0,1,1,0,0|2,0,0]=4 4750 B7R1.3 Nc1ccccc1 Amb22731965 [0,0,1,1,0,0|2,0,0]=4 4751 B7R1.3 Nc1ccccc1 Amb24323804 [0,0,1,1,0,0|2,0,0]=4 4752 B7R1.3 O=C1C=CC=CO1 Amb21951679 [0,0,1,1,0,0|2,0,0]=4 4753 B7R1.3 OC1=CCOC=C1 Amb24100789 [0,0,1,1,0,0|2,0,0]=4 4754 B7R1.3 OC=1CNC=CC1 Amb24744451 [0,0,1,1,0,0|1,0,1]=4 4755 B7R1.3 O[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056043 [0,0,1,1,0,0|1,0,0]=3 4756 B7R1.3 O[13c]1ccccc1 Amb22367569 [0,0,1,1,0,0|1,0,0]=3 4757 B7R1.3 Oc1c[n][n]cc1 Amb22640973 [0,0,1,1,0,0|2,0,0]=4 4758 B7R1.3 Oc1c[n][n]cc1 Amb24053159 [0,0,1,1,0,0|2,0,0]=4 4759 B7R1.3 Oc1c[n]c[n]c1 Amb22284765 [0,0,1,1,0,0|2,0,0]=4 4760 B7R1.3 Oc1c[n]c[n]c1 Amb22500888 [0,0,1,1,0,0|2,0,0]=4 4761 B7R1.3 Oc1cc[13cH]cc1 Amb22367413 [0,0,1,1,0,0|1,0,0]=3 4762 B7R1.3 Oc1cc[nH+]cc1 Amb10552494 [0,0,1,1,0,0|2,0,0]=4 4763 B7R1.3 Oc1cc[n]cc1 Amb22751635 [0,0,1,1,0,0|2,0,0]=4 4764 B7R1.3 Oc1cc[o+]cc1 Amb24444430 [0,0,1,1,0,0|2,0,0]=4 4765 B7R1.3 Oc1cccc[n]1 Amb20622006 [0,0,1,1,0,0|2,0,0]=4 4766 B7R1.3 Oc1cccc[n]1 Amb24082004 [0,0,1,1,0,0|2,0,0]=4 4767 B7R1.3 Oc1ccccc1 Amb22229793 [0,0,1,1,0,0|1,0,0]=3 4768 B7R1.3 Oc1ccccc1 Amb22337931 [0,0,1,1,0,0|1,0,0]=3 4769 B7R1.3 Oc1ccccc1 Amb22367059 [0,0,1,1,0,0|1,0,0]=3 4770 B7R1.3 Oc1ccccc1 Amb24066113 [0,0,1,1,0,0|1,0,0]=3 4771 B7R1.3 Oc1ccnnc1 Amb10602745 [0,0,1,1,0,0|2,0,0]=4 4772 B7R1.3 Pc1ccccc1 Amb19889863 [0,0,1,1,0,0|2,0,0]=4 4773 B7R1.3 Sc1ccccc1 Amb22337858 [0,0,1,1,0,0|1,1,0]=4 4774 B7R1.3 Sc1ccccc1 Amb22353118 [0,0,1,1,0,0|1,1,0]=4 4775 B7R1.3 Sc1cccnc1 Amb13887011 [0,0,1,1,0,0|1,1,0]=4 4776 B7R1.3 [13CH3]c1ccccc1 Amb22366909 [0,0,1,1,0,0|2,0,0]=4 4777 B7R1.3 [15NH2]c1ccccc1 Amb22363322 [0,0,1,1,0,0|2,0,0]=4 4778 B7R1.3 [18OH]c1ccccc1 Amb22367529 [0,0,1,1,0,0|1,0,0]=3 4779 B7R1.3 [CH2]c1ccccc1 Amb22800198 [0,0,1,1,0,0|2,0,0]=4 4780 B7R1.3 [Hg+]c1ccccc1 Amb20246419 [0,0,1,1,0,0|2,0,0]=4 4781 B7R1.3 [Hg+]c1ccccc1 Amb20246502 [0,0,1,1,0,0|2,0,0]=4 4782 B7R1.3 [Hg+]c1ccccc1 Amb22054115 [0,0,1,1,0,0|2,0,0]=4 4783 B7R1.3 [Mg+]c1ccccc1 Amb22045898 [0,0,1,1,0,0|2,0,0]=4 4784 B7R1.3 [Mg+]c1ccccc1 Amb22231387 [0,0,1,1,0,0|2,0,0]=4 4785 B7R1.3 [NH3+]c1ccccc1 Amb22338864 [0,0,1,1,0,0|2,0,0]=4 4786 B7R1.3 [O-]c1c[nH+]ccc1 Amb22492605 [0,0,1,1,0,0|1,0,1]=4 4787 B7R1.3 [O-]c1c[o+]ccc1 Amb25310042 [0,0,1,1,0,0|0,0,2]=4 4788 B7R1.3 [O-]c1ccccc1 Amb20240913 [0,0,1,1,0,0|1,0,1]=4 4789 B7R1.3 [O-]c1ccccc1 Amb22351866 [0,0,1,1,0,0|1,0,1]=4 4790 B7R1.3 [O-]c1ccccc1 Amb22387555 [0,0,1,1,0,0|1,0,1]=4 4791 B7R1.3 [O-]c1ccccc1 Amb22734633 [0,0,1,1,0,0|1,0,1]=4 4792 B7R1.3 [S-]c1ccccc1 Amb22360782 [0,0,1,1,0,0|1,1,0]=4 4793 B7R1.3 [S-]c1ccccc1 Amb22369229 [0,0,1,1,0,0|1,1,0]=4 4794 B7R1.3 [SH2+]c1ccccc1 Amb24524316 [0,0,1,1,0,0|1,1,0]=4 4795 B7R1.3 [SiH3]c1c[n]ccc1 Amb24102608 [0,0,1,1,0,0|2,0,0]=4 4796 B7R1.3 [Sn+3]c1ccccc1 Amb22053683 [0,0,1,1,0,0|2,0,0]=4 4797 B7R1.3 [Zn+]c1ccccc1 Amb22353547 [0,0,1,1,0,0|2,0,0]=4 4798 B7R1.3 c1([2H])ccccc1 Amb16185573 [0,0,1,1,0,0|2,0,0]=4 4799 B7R1.15 CC1=CC(=C)C1=O Amb24456573 [0,0,1,1,0,0|1,0,0]=3 4800 B7R1.15 CC1=CC(=O)C1=O Amb25092478 [0,0,1,1,0,0|0,0,2]=4 4801 B7R1.15 Nc1cc(=O)c1=O Amb17835337 [0,0,1,1,0,0|1,0,1]=4 4802 B7R1.15 O=C1C(Cl)=CC1=O Amb22171299 [0,0,1,1,0,0|1,0,1]=4 4803 B7R1.15 OC1=CC(=O)C1=O Amb20246501 [0,0,1,1,0,0|1,0,0]=3 4804 B7R1.15 OC1=CC(=O)C1=O Amb22171298 [0,0,1,1,0,0|1,0,0]=3 4805 B7R1.15 [O-]C1=CC(=O)C1=O Amb22410185 [0,0,1,1,0,0|1,0,1]=4 4806 B7R1.15 [O-]c1cc(=O)c1=O Amb17770074 [0,0,1,1,0,0|1,0,1]=4 4807 B7R1.22 C=C(C=O)C=1CC1 Amb25207064 [0,0,1,1,0,0|1,0,1]=4 4808 B7R1.7 O=C\C=C/C1CO1 Amb25695433 [0,0,1,1,0,0|0,0,2]=4 4809 B7R1.7 O=C\C=C\C1CO1 Amb25799580 [0,0,1,1,0,0|0,0,2]=4 4810 B7R1.24 C1=CC=CC=CN1 Amb24715380 [0,0,1,1,0,0|2,0,0]=4 4811 B7R1.24 C1=CC=NC=CO1 Amb24616297 [0,0,1,1,0,0|1,0,0]=3 4812 B7R1.24 C1CC=COC=C1 Amb25745349 [0,0,1,1,0,0|1,0,1]=4 4813 B7R1.24 c1ccccc[cH+]1 Amb22338338 [0,0,1,1,0,0|2,0,0]=4 4814 B7R1.24 c1ccccc[cH+]1 Amb22338422 [0,0,1,1,0,0|2,0,0]=4 4815 B7R1.24 c1ccccc[cH+]1 Amb25111537 [0,0,1,1,0,0|2,0,0]=4 4816 B9R2.50 C1=Nc2[n]cccc21 Amb25831654 [0,0,0,1,0,1|2,0,0]=4 4817 B9R2.50 C1=Nc2c[n]ccc21 Amb25272488 [0,0,0,1,0,1|2,0,0]=4 4818 B9R2.50 c1[n]c[n]c2C=Cc21 Amb24060979 [0,0,0,1,0,1|2,0,0]=4 4819 B9R2.50 c1cccc2C=Cc21 Amb19515942 [0,0,0,1,0,1|2,0,0]=4 4820 B9R2.68 C1=Nc2cc1[n]c[n]2 Amb24076628 [0,0,0,1,0,1|2,0,0]=4 4821 B9R2.33 O=C1C=C2C=CC2=C1 Amb24467047 [0,1,0,1,0,0|2,0,0]=4 4822 B9R2.39 O=C1C[C@H]2C=C[C@@H]1O2 Amb24570444 [0,1,0,1,0,0|0,0,2]=4 4823 B9R2.2 C1CC1c2ccco2 Amb24323177 [0,1,0,1,0,0|1,0,1]=4 4824 B9R2.2 C1NC1c2ccco2 Amb18224247 [0,1,0,1,0,0|1,0,1]=4 4825 B9R2.2 c1coc(c1)C2CO2 Amb1135121 [0,1,0,1,0,0|0,0,2]=4 4826 B9R2.3 C1CNc2occc21 Amb18833124 [0,1,0,1,0,0|1,0,1]=4 4827 B9R2.3 C1NCc2occc21 Amb18203409 [0,1,0,1,0,0|1,0,1]=4 4828 B9R2.3 C1OCc2ccoc21 Amb24390804 [0,1,0,1,0,0|0,0,2]=4 4829 B9R2.3 c1[nH]c2[n]coc2[n]1 Amb25311988 [0,1,0,1,0,0|2,0,0]=4 4830 B9R2.3 c1[nH]c2cc[s]c2[n]1 Amb24401032 [0,1,0,1,0,0|1,1,0]=4 4831 B9R2.3 c1[nH]cc2[nH]ccc21 Amb24622492 [0,1,0,1,0,0|2,0,0]=4 4832 B9R2.3 c1[nH]cc2[s]ccc21 Amb25789442 [0,1,0,1,0,0|1,1,0]=4 4833 B9R2.3 c1[nH]cc2o[n]cc21 Amb25289635 [0,1,0,1,0,0|2,0,0]=4 4834 B9R2.3 c1[n][nH]c2cc[s]c21 Amb22499555 [0,1,0,1,0,0|1,1,0]=4 4835 B9R2.3 c1[n]c2[nH]ccc2[s]1 Amb22001806 [0,1,0,1,0,0|1,1,0]=4 4836 B9R2.3 c1[n]c2[n]c[s]c2o1 Amb24066957 [0,1,0,1,0,0|2,0,0]=4 4837 B9R2.3 c1[n]c2[s]c[n]c2o1 Amb24066959 [0,1,0,1,0,0|1,1,0]=4 4838 B9R2.3 c1[n]c2[s]ccc2[s]1 Amb23412515 [0,1,0,1,0,0|0,2,0]=4 4839 B9R2.3 c1[n]c2cc[nH]c2[s]1 Amb23412524 [0,1,0,1,0,0|2,0,0]=4 4840 B9R2.3 c1[n]c2cc[s]c2[s]1 Amb24505343 [0,1,0,1,0,0|1,1,0]=4 4841 B9R2.3 c1[n]c2ccoc2[s]1 Amb24081815 [0,1,0,1,0,0|1,0,0]=3 4842 B9R2.3 c1[n]c2occc2[s]1 Amb23412528 [0,1,0,1,0,0|0,1,0]=3 4843 B9R2.3 c1[n]oc2[nH]ccc21 Amb25699680 [0,1,0,1,0,0|2,0,0]=4 4844 B9R2.3 c1[n]oc2[n]c[s]c21 Amb24066963 [0,1,0,1,0,0|1,1,0]=4 4845 B9R2.3 c1[n]oc2[s]c[n]c21 Amb24066956 [0,1,0,1,0,0|2,0,0]=4 4846 B9R2.3 c1[n]oc2cocc21 Amb25063868 [0,1,0,1,0,0|1,0,1]=4 4847 B9R2.3 c1c[nH]c2cc[nH]c21 Amb24117523 [0,1,0,1,0,0|2,0,0]=4 4848 B9R2.3 c1c[s]c2[nH]ccc21 Amb24525310 [0,1,0,1,0,0|1,1,0]=4 4849 B9R2.3 c1cc2c(s1)scc2 Amb10601670 [0,1,0,1,0,0|1,1,0]=4 4850 B9R2.3 c1cc2occc2[nH]1 Amb24066086 [0,1,0,1,0,0|1,0,0]=3 4851 B9R2.3 c1cc[n]2cc[nH]c21 Amb24525329 [0,1,0,1,0,0|2,0,0]=4 4852 B9R2.3 c1o[n]c2cc[s]c21 Amb24392852 [0,1,0,1,0,0|0,1,1]=4 4853 B9R2.3 c1o[n]c2ccoc21 Amb24081805 [0,1,0,1,0,0|0,0,1]=3 4854 B5R1.2 C=C1CCO1 Amb22736695 [1,0,0,0,1,0|0,0,2]=4 4855 B5R1.2 O=C1CC=C1 Amb24477666 [1,0,0,0,1,0|0,0,1]=3 4856 B5R1.2 O=C1O[Ba]O1 Amb22052524 [1,0,0,0,1,0|2,0,0]=4 4857 B5R1.2 O=C1O[Mg]O1 Amb22052493 [1,0,0,0,1,0|2,0,0]=4 4858 B5R1.2 O=C1O[Ni]O1 Amb22336202 [1,0,0,0,1,0|2,0,0]=4 4859 B5R1.2 O=C1O[Pb]O1 Amb22052516 [1,0,0,0,1,0|2,0,0]=4 4860 B5R1.2 O=[14C]1O[Ba]O1 Amb22730314 [1,0,0,0,1,0|2,0,0]=4 4861 B5R1.2 OC1C=CO1 Amb25810658 [1,0,0,0,1,0|0,0,2]=4 4862 B5R1.3 C1OC1C=O Amb17593007 [0,0,0,0,2,0|0,0,2]=4 4863 B9R1.89 Cl\C=C/1\C=CC=CC#C1 Amb25061405 [0,0,0,0,0,2|2,0,0]=4 4864 B9R1.89 O=CC1=CC=CC=CC1 Amb17593229 [0,0,0,0,0,2|1,0,0]=3 4865 B9R1.89 O=CC1=CNC=CC=N1 Amb25312789 [0,0,0,0,0,2|1,0,0]=3 4866 B9R1.89 O=CC1CC=COC=C1 Amb25139452 [0,0,0,0,0,2|0,0,2]=4 4867 B9R1.89 O=CC=1C=CCCCC1 Amb25827154 [0,0,0,0,0,2|1,0,1]=4 4868 B9R1.89 O=CC=1CC=CSCC1 Amb24099830 [0,0,0,0,0,2|1,0,0]=3 4869 B9R1.89 O=C[C@H]1CC=CCC=C1 Amb25730138 [0,0,0,0,0,2|1,0,1]=4