0 B7R1.1 BrCC1CC=CC1 Amb25216921 [0,0,0,0,0,0|2,0,2]=4 1 B7R1.1 BrCC=1CCCC1 Amb23439168 [0,0,0,0,0,0|2,0,2]=4 2 B7R1.1 BrC[n]1c[n]cc1 Amb25195392 [0,0,0,0,0,0|4,0,0]=4 3 B7R1.1 BrC[n]1ccc[n]1 Amb24557786 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.1 BrCc1[nH]cc[n]1 Amb21858315 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.1 BrCc1[nH]cc[n]1 Amb22284583 [0,0,0,0,0,0|3,0,0]=3 6 B7R1.1 BrCc1[n][n]c[s]1 Amb24065108 [0,0,0,0,0,0|3,1,0]=4 7 B7R1.1 BrCc1[n]cc[s]1 Amb21857626 [0,0,0,0,0,0|2,1,0]=3 8 B7R1.1 BrCc1[n]co[n]1 Amb19517086 [0,0,0,0,0,0|4,0,0]=4 9 B7R1.1 BrCc1c[nH][n][n]1 Amb18182577 [0,0,0,0,0,0|4,0,0]=4 10 B7R1.1 BrCc1c[nH][n]c1 Amb18788025 [0,0,0,0,0,0|4,0,0]=4 11 B7R1.1 BrCc1c[nH]c[n]1 Amb20248272 [0,0,0,0,0,0|3,0,0]=3 12 B7R1.1 BrCc1c[nH]cc1 Amb24709962 [0,0,0,0,0,0|3,0,0]=3 13 B7R1.1 BrCc1c[nH]cn1 Amb2455859 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.1 BrCc1c[n][n][s]1 Amb24442353 [0,0,0,0,0,0|3,1,0]=4 15 B7R1.1 BrCc1c[n]c[s]1 Amb22491257 [0,0,0,0,0,0|2,1,0]=3 16 B7R1.1 BrCc1c[n]o[n]1 Amb24331159 [0,0,0,0,0,0|4,0,0]=4 17 B7R1.1 BrCc1c[s][n][n]1 Amb24478561 [0,0,0,0,0,0|4,0,0]=4 18 B7R1.1 BrCc1c[s]c[n]1 Amb22728093 [0,0,0,0,0,0|3,0,0]=3 19 B7R1.1 BrCc1cc[n][nH]1 Amb18788026 [0,0,0,0,0,0|3,0,0]=3 20 B7R1.1 BrCc1cc[n][s]1 Amb20242134 [0,0,0,0,0,0|2,1,0]=3 21 B7R1.1 BrCc1cc[n]o1 Amb19338117 [0,0,0,0,0,0|2,0,0]=2 22 B7R1.1 BrCc1cc[s][n]1 Amb24715751 [0,0,0,0,0,0|3,0,0]=3 23 B7R1.1 BrCc1ccco1 Amb21862207 [0,0,0,0,0,0|1,0,0]=1 24 B7R1.1 BrCc1cccs1 Amb10602501 [0,0,0,0,0,0|1,1,0]=2 25 B7R1.1 BrCc1cco[n]1 Amb18183486 [0,0,0,0,0,0|3,0,0]=3 26 B7R1.1 BrCc1cnco1 Amb10071196 [0,0,0,0,0,0|2,0,0]=2 27 B7R1.1 BrCc1cncs1 Amb16185415 [0,0,0,0,0,0|2,1,0]=3 28 B7R1.1 BrCc1coc[n]1 Amb24105437 [0,0,0,0,0,0|3,0,0]=3 29 B7R1.1 BrCc1cocc1 Amb21857141 [0,0,0,0,0,0|3,0,0]=3 30 B7R1.1 BrCc1cocn1 Amb10071194 [0,0,0,0,0,0|3,0,0]=3 31 B7R1.1 BrCc1conc1 Amb10609515 [0,0,0,0,0,0|4,0,0]=4 32 B7R1.1 BrCc1ncco1 Amb10071192 [0,0,0,0,0,0|2,0,0]=2 33 B7R1.1 BrCc1nccs1 Amb10602038 [0,0,0,0,0,0|2,1,0]=3 34 B7R1.1 Br[Mg]c1[n]cc[s]1 Amb22897490 [0,0,0,0,0,0|3,1,0]=4 35 B7R1.1 Br[Mg]c1ccc[s]1 Amb22338612 [0,0,0,0,0,0|2,1,0]=3 36 B7R1.1 Br[Zn]c1[n]cc[s]1 Amb22000385 [0,0,0,0,0,0|3,1,0]=4 37 B7R1.1 Br[Zn]c1ccco1 Amb22897621 [0,0,0,0,0,0|2,0,0]=2 38 B7R1.1 Br\C=C/1\CC=CS1 Amb25050461 [0,0,0,0,0,0|1,1,2]=4 39 B7R1.1 C#C[n]1ccc[n]1 Amb25733840 [0,0,0,0,0,0|3,0,1]=4 40 B7R1.1 C#Cc1[nH]cc[n]1 Amb24122958 [0,0,0,0,0,0|3,0,1]=4 41 B7R1.1 C#Cc1[n]cc[s]1 Amb22170067 [0,0,0,0,0,0|2,1,1]=4 42 B7R1.1 C#Cc1[n]cco1 Amb24511804 [0,0,0,0,0,0|2,0,1]=3 43 B7R1.1 C#Cc1c[n]c[s]1 Amb24071349 [0,0,0,0,0,0|2,1,1]=4 44 B7R1.1 C#Cc1c[s]c[n]1 Amb22284777 [0,0,0,0,0,0|3,0,1]=4 45 B7R1.1 C#Cc1cc[n][nH]1 Amb24468960 [0,0,0,0,0,0|3,0,1]=4 46 B7R1.1 C#Cc1cc[n][s]1 Amb25138875 [0,0,0,0,0,0|2,1,1]=4 47 B7R1.1 C#Cc1cc[n]o1 Amb24339440 [0,0,0,0,0,0|2,0,1]=3 48 B7R1.1 C#Cc1ccc[nH]1 Amb24123042 [0,0,0,0,0,0|2,0,1]=3 49 B7R1.1 C#Cc1ccco1 Amb24178904 [0,0,0,0,0,0|1,0,1]=2 50 B7R1.1 C#Cc1cocc1 Amb25283258 [0,0,0,0,0,0|3,0,1]=4 51 B7R1.1 C#Cc1cscc1 Amb10603690 [0,0,0,0,0,0|3,0,1]=4 52 B7R1.1 C=C[n]1ccc[n]1 Amb24583489 [0,0,0,0,0,0|3,0,1]=4 53 B7R1.1 C=C[n]1cccc1 Amb25810319 [0,0,0,0,0,0|3,0,1]=4 54 B7R1.1 C=Cc1[nH]cc[n]1 Amb22002618 [0,0,0,0,0,0|3,0,1]=4 55 B7R1.1 C=Cc1[n]cc[s]1 Amb24056329 [0,0,0,0,0,0|2,1,1]=4 56 B7R1.1 C=Cc1[n]cco1 Amb24650190 [0,0,0,0,0,0|2,0,1]=3 57 B7R1.1 C=Cc1c[n]c[s]1 Amb24395972 [0,0,0,0,0,0|2,1,1]=4 58 B7R1.1 C=Cc1c[s]cc1 Amb22263008 [0,0,0,0,0,0|3,0,1]=4 59 B7R1.1 C=Cc1ccc[nH]1 Amb24480629 [0,0,0,0,0,0|2,0,1]=3 60 B7R1.1 C=Cc1ccco1 Amb22295842 [0,0,0,0,0,0|1,0,1]=2 61 B7R1.1 C=Cc1cocc1 Amb24056798 [0,0,0,0,0,0|3,0,1]=4 62 B7R1.1 C=Nc1c[nH]cc1 Amb24569489 [0,0,0,0,0,0|4,0,0]=4 63 B7R1.1 CCC1C=CC=C1 Amb2227637 [0,0,0,0,0,0|2,0,1]=3 64 B7R1.1 CCC1C=CCN1 Amb22587170 [0,0,0,0,0,0|2,0,2]=4 65 B7R1.1 CCC1NCC=C1 Amb10608188 [0,0,0,0,0,0|2,0,2]=4 66 B7R1.1 CCC=1CC=CC1 Amb24702642 [0,0,0,0,0,0|2,0,0]=2 67 B7R1.1 CC[n+]1c[nH]cc1 Amb25346600 [0,0,0,0,0,0|4,0,0]=4 68 B7R1.1 CC[n]1cc[n][n]1 Amb23441596 [0,0,0,0,0,0|4,0,0]=4 69 B7R1.1 CCc1c[nH][n]c1 Amb19516673 [0,0,0,0,0,0|4,0,0]=4 70 B7R1.1 CCc1c[nH]c[n]1 Amb22295793 [0,0,0,0,0,0|3,0,0]=3 71 B7R1.1 CCc1c[n]c[s]1 Amb25663104 [0,0,0,0,0,0|2,1,0]=3 72 B7R1.1 CCc1c[n]co1 Amb22490969 [0,0,0,0,0,0|2,0,0]=2 73 B7R1.1 CCc1c[n]oc1 Amb24699149 [0,0,0,0,0,0|4,0,0]=4 74 B7R1.1 CCc1cc[nH][n]1 Amb19516891 [0,0,0,0,0,0|3,0,0]=3 75 B7R1.1 CCc1cc[n]o1 Amb22233735 [0,0,0,0,0,0|2,0,0]=2 76 B7R1.1 CCc1coc[n]1 Amb25073231 [0,0,0,0,0,0|3,0,0]=3 77 B7R1.1 CCc1cscn1 Amb13884091 [0,0,0,0,0,0|3,0,0]=3 78 B7R1.1 CCc1n[nH]cn1 Amb10608400 [0,0,0,0,0,0|4,0,0]=4 79 B7R1.1 CCc1ncco1 Amb17399786 [0,0,0,0,0,0|2,0,0]=2 80 B7R1.1 CCc1nccs1 Amb10601013 [0,0,0,0,0,0|2,1,0]=3 81 B7R1.1 CCc1nnco1 Amb2208686 [0,0,0,0,0,0|3,0,0]=3 82 B7R1.1 CCn1cccn1 Amb1934294 [0,0,0,0,0,0|3,0,0]=3 83 B7R1.1 CN[n]1cccc1 Amb25662666 [0,0,0,0,0,0|4,0,0]=4 84 B7R1.1 CNc1[nH]cc[n]1 Amb22749656 [0,0,0,0,0,0|4,0,0]=4 85 B7R1.1 CNc1[n][n]co1 Amb24117942 [0,0,0,0,0,0|4,0,0]=4 86 B7R1.1 CNc1[n]cc[s]1 Amb22490429 [0,0,0,0,0,0|3,1,0]=4 87 B7R1.1 CNc1[n]cco1 Amb21856873 [0,0,0,0,0,0|3,0,0]=3 88 B7R1.1 CNc1c[nH]cc1 Amb18061790 [0,0,0,0,0,0|4,0,0]=4 89 B7R1.1 CNc1c[n]c[s]1 Amb22492450 [0,0,0,0,0,0|3,1,0]=4 90 B7R1.1 CNc1c[n]co1 Amb22490689 [0,0,0,0,0,0|3,0,0]=3 91 B7R1.1 CNc1c[s]cc1 Amb20620164 [0,0,0,0,0,0|4,0,0]=4 92 B7R1.1 CNc1cc[nH][n]1 Amb18281004 [0,0,0,0,0,0|4,0,0]=4 93 B7R1.1 CNc1cc[s][n]1 Amb25063572 [0,0,0,0,0,0|4,0,0]=4 94 B7R1.1 CNc1ccc[s]1 Amb18553885 [0,0,0,0,0,0|2,1,0]=3 95 B7R1.1 CNc1ccc[s]1 Amb20242012 [0,0,0,0,0,0|2,1,0]=3 96 B7R1.1 CNc1ccco1 Amb24645794 [0,0,0,0,0,0|2,0,0]=2 97 B7R1.1 CNc1cco[n]1 Amb18281002 [0,0,0,0,0,0|4,0,0]=4 98 B7R1.1 CNc1cocc1 Amb25024845 [0,0,0,0,0,0|4,0,0]=4 99 B7R1.1 COC=1CC=CN1 Amb25234141 [0,0,0,0,0,0|3,0,1]=4 100 B7R1.1 COC=1CN=CC1 Amb25208584 [0,0,0,0,0,0|4,0,0]=4 101 B7R1.1 COc1[nH]cc[n]1 Amb22011530 [0,0,0,0,0,0|4,0,0]=4 102 B7R1.1 COc1[n]cco1 Amb25810927 [0,0,0,0,0,0|3,0,0]=3 103 B7R1.1 COc1c[nH]cc1 Amb24421224 [0,0,0,0,0,0|4,0,0]=4 104 B7R1.1 COc1c[n]c[nH]1 Amb22295920 [0,0,0,0,0,0|4,0,0]=4 105 B7R1.1 COc1c[n]co1 Amb24680005 [0,0,0,0,0,0|3,0,0]=3 106 B7R1.1 COc1c[s]c[n]1 Amb20621420 [0,0,0,0,0,0|4,0,0]=4 107 B7R1.1 COc1cc[n][nH]1 Amb22899569 [0,0,0,0,0,0|4,0,0]=4 108 B7R1.1 COc1cc[s][n]1 Amb23592267 [0,0,0,0,0,0|4,0,0]=4 109 B7R1.1 COc1ccc[nH]1 Amb24478560 [0,0,0,0,0,0|3,0,0]=3 110 B7R1.1 COc1cocc1 Amb21963231 [0,0,0,0,0,0|4,0,0]=4 111 B7R1.1 COc1nccs1 Amb2447656 [0,0,0,0,0,0|3,1,0]=4 112 B7R1.1 CSc1[nH]cc[n]1 Amb19149025 [0,0,0,0,0,0|4,0,0]=4 113 B7R1.1 CSc1[n]cco1 Amb21961333 [0,0,0,0,0,0|3,0,0]=3 114 B7R1.1 CSc1c[nH]cn1 Amb13883548 [0,0,0,0,0,0|4,0,0]=4 115 B7R1.1 CSc1ccco1 Amb21961438 [0,0,0,0,0,0|2,0,0]=2 116 B7R1.1 CSc1cocc1 Amb25835877 [0,0,0,0,0,0|4,0,0]=4 117 B7R1.1 C[Mn]C=1CC=CC1 Amb19515792 [0,0,0,0,0,0|3,0,0]=3 118 B7R1.1 C[Se]c1ccsc1 Amb17779305 [0,0,0,0,0,0|4,0,0]=4 119 B7R1.1 C[SiH2]c1c[s]cc1 Amb24611076 [0,0,0,0,0,0|3,1,0]=4 120 B7R1.1 ClCC1=CCCO1 Amb24747248 [0,0,0,0,0,0|1,0,2]=3 121 B7R1.1 ClCC1=NCCO1 Amb24599141 [0,0,0,0,0,0|2,0,2]=4 122 B7R1.1 ClCC1CC=CC1 Amb25059951 [0,0,0,0,0,0|2,0,2]=4 123 B7R1.1 ClCC1CCC=C1 Amb24624574 [0,0,0,0,0,0|2,0,2]=4 124 B7R1.1 ClCC=1CC=CC1 Amb25359413 [0,0,0,0,0,0|2,0,0]=2 125 B7R1.1 ClCC=1CCCC1 Amb24479493 [0,0,0,0,0,0|2,0,2]=4 126 B7R1.1 ClC[n]1[n]cc[n]1 Amb25147613 [0,0,0,0,0,0|4,0,0]=4 127 B7R1.1 ClC[n]1ccc[n]1 Amb25084521 [0,0,0,0,0,0|3,0,0]=3 128 B7R1.1 ClC[n]1cccc1 Amb24333990 [0,0,0,0,0,0|3,0,0]=3 129 B7R1.1 ClCc1[n]c[nH][n]1 Amb19515983 [0,0,0,0,0,0|4,0,0]=4 130 B7R1.1 ClCc1[n]cc[s]1 Amb21857625 [0,0,0,0,0,0|2,1,0]=3 131 B7R1.1 ClCc1c[nH][n][n]1 Amb24113168 [0,0,0,0,0,0|4,0,0]=4 132 B7R1.1 ClCc1c[nH][n]c1 Amb22490483 [0,0,0,0,0,0|4,0,0]=4 133 B7R1.1 ClCc1c[nH]cc1 Amb18221809 [0,0,0,0,0,0|3,0,0]=3 134 B7R1.1 ClCc1c[nH]cn1 Amb15701232 [0,0,0,0,0,0|3,0,0]=3 135 B7R1.1 ClCc1c[nH]cn1 Amb2455687 [0,0,0,0,0,0|3,0,0]=3 136 B7R1.1 ClCc1c[nH]nc1 Amb16231442 [0,0,0,0,0,0|4,0,0]=4 137 B7R1.1 ClCc1c[n][n][s]1 Amb22011657 [0,0,0,0,0,0|3,1,0]=4 138 B7R1.1 ClCc1c[n][s]c1 Amb24382498 [0,0,0,0,0,0|4,0,0]=4 139 B7R1.1 ClCc1c[n]c[s]1 Amb18917909 [0,0,0,0,0,0|2,1,0]=3 140 B7R1.1 ClCc1c[n]c[s]1 Amb21857837 [0,0,0,0,0,0|2,1,0]=3 141 B7R1.1 ClCc1c[n]co1 Amb21520456 [0,0,0,0,0,0|2,0,0]=2 142 B7R1.1 ClCc1c[n]co1 Amb22436815 [0,0,0,0,0,0|2,0,0]=2 143 B7R1.1 ClCc1c[n]o[n]1 Amb25842967 [0,0,0,0,0,0|4,0,0]=4 144 B7R1.1 ClCc1c[n]oc1 Amb24097253 [0,0,0,0,0,0|4,0,0]=4 145 B7R1.1 ClCc1cc[nH][n]1 Amb21963521 [0,0,0,0,0,0|3,0,0]=3 146 B7R1.1 ClCc1cc[nH][n]1 Amb22001556 [0,0,0,0,0,0|3,0,0]=3 147 B7R1.1 ClCc1cc[s][n]1 Amb25113916 [0,0,0,0,0,0|3,0,0]=3 148 B7R1.1 ClCc1ccno1 Amb1090466 [0,0,0,0,0,0|2,0,0]=2 149 B7R1.1 ClCc1ccon1 Amb1087842 [0,0,0,0,0,0|3,0,0]=3 150 B7R1.1 ClCc1coc[n]1 Amb21857138 [0,0,0,0,0,0|3,0,0]=3 151 B7R1.1 ClCc1coc[n]1 Amb21857165 [0,0,0,0,0,0|3,0,0]=3 152 B7R1.1 ClCc1cscn1 Amb1154587 [0,0,0,0,0,0|3,0,0]=3 153 B7R1.1 ClCc1cscn1 Amb2371224 [0,0,0,0,0,0|3,0,0]=3 154 B7R1.1 ClCc1n[nH]cn1 Amb1019546 [0,0,0,0,0,0|4,0,0]=4 155 B7R1.1 ClCc1ncc[nH]1 Amb10844832 [0,0,0,0,0,0|3,0,0]=3 156 B7R1.1 ClCc1ncco1 Amb10602092 [0,0,0,0,0,0|2,0,0]=2 157 B7R1.1 ClCc1nccs1 Amb10603583 [0,0,0,0,0,0|2,1,0]=3 158 B7R1.1 ClCc1nocn1 Amb1672620 [0,0,0,0,0,0|4,0,0]=4 159 B7R1.1 ClCn1cccn1 Amb10601542 [0,0,0,0,0,0|3,0,0]=3 160 B7R1.1 ClCn1cncn1 Amb10561428 [0,0,0,0,0,0|4,0,0]=4 161 B7R1.1 Cl[Hg]c1ccc[s]1 Amb22360263 [0,0,0,0,0,0|2,1,0]=3 162 B7R1.1 Cl[Hg]c1cocc1 Amb22360173 [0,0,0,0,0,0|4,0,0]=4 163 B7R1.1 Cl[SiH2]c1ccc[s]1 Amb24637211 [0,0,0,0,0,0|1,2,0]=3 164 B7R1.1 FC[n]1cccc1 Amb24605531 [0,0,0,0,0,0|3,0,0]=3 165 B7R1.1 FCc1c[n]c[nH]1 Amb24520518 [0,0,0,0,0,0|3,0,0]=3 166 B7R1.1 FCc1c[s]cc1 Amb25024865 [0,0,0,0,0,0|3,0,0]=3 167 B7R1.1 FCc1cc[nH][n]1 Amb24423479 [0,0,0,0,0,0|3,0,0]=3 168 B7R1.1 FCc1ccc[nH]1 Amb24721855 [0,0,0,0,0,0|2,0,0]=2 169 B7R1.1 FCc1ccco1 Amb24479569 [0,0,0,0,0,0|1,0,0]=1 170 B7R1.1 FOc1ccco1 Amb25208531 [0,0,0,0,0,0|2,0,0]=2 171 B7R1.1 F[SiH2]c1[n]cc[s]1 Amb25253632 [0,0,0,0,0,0|2,2,0]=4 172 B7R1.1 ICC1CC=CC1 Amb24078965 [0,0,0,0,0,0|2,0,2]=4 173 B7R1.1 ICC1CCC=C1 Amb24358200 [0,0,0,0,0,0|2,0,2]=4 174 B7R1.1 IC[C@@H]1CCC=C1 Amb24366727 [0,0,0,0,0,0|2,0,2]=4 175 B7R1.1 ICc1[n]cc[s]1 Amb24641632 [0,0,0,0,0,0|2,1,0]=3 176 B7R1.1 ICc1[n]co[n]1 Amb25802027 [0,0,0,0,0,0|4,0,0]=4 177 B7R1.1 ICc1c[nH]c[n]1 Amb25759935 [0,0,0,0,0,0|3,0,0]=3 178 B7R1.1 ICc1c[n][s][n]1 Amb24614854 [0,0,0,0,0,0|4,0,0]=4 179 B7R1.1 ICc1c[s]c[n]1 Amb24672501 [0,0,0,0,0,0|3,0,0]=3 180 B7R1.1 ICc1c[s]cc1 Amb25317232 [0,0,0,0,0,0|3,0,0]=3 181 B7R1.1 ICc1ccc[s]1 Amb25280170 [0,0,0,0,0,0|1,1,0]=2 182 B7R1.1 ICc1ccco1 Amb24060883 [0,0,0,0,0,0|1,0,0]=1 183 B7R1.1 ICc1cocc1 Amb25131757 [0,0,0,0,0,0|3,0,0]=3 184 B7R1.1 N#CC1=CCCO1 Amb19149010 [0,0,0,0,0,0|1,0,3]=4 185 B7R1.1 N#CC=1CN=CC1 Amb25278644 [0,0,0,0,0,0|3,0,1]=4 186 B7R1.1 N#Cc1[nH]cc[n]1 Amb22406096 [0,0,0,0,0,0|3,0,1]=4 187 B7R1.1 N#Cc1[n]cc[s]1 Amb19957521 [0,0,0,0,0,0|2,1,1]=4 188 B7R1.1 N#Cc1[n]cco1 Amb19889630 [0,0,0,0,0,0|2,0,1]=3 189 B7R1.1 N#Cc1c[nH]cc1 Amb10067055 [0,0,0,0,0,0|3,0,1]=4 190 B7R1.1 N#Cc1c[n]co1 Amb21520457 [0,0,0,0,0,0|2,0,1]=3 191 B7R1.1 N#Cc1cc[n]o1 Amb22292333 [0,0,0,0,0,0|2,0,1]=3 192 B7R1.1 N#Cc1cc[s][n]1 Amb19894959 [0,0,0,0,0,0|3,0,1]=4 193 B7R1.1 N#Cc1ccco1 Amb1694826 [0,0,0,0,0,0|1,0,1]=2 194 B7R1.1 N#Cc1cccs1 Amb1154392 [0,0,0,0,0,0|1,1,1]=3 195 B7R1.1 N#Cc1ncc[nH]1 Amb10603430 [0,0,0,0,0,0|3,0,1]=4 196 B7R1.1 N=Cc1ccc[nH]1 Amb24549298 [0,0,0,0,0,0|2,0,1]=3 197 B7R1.1 N=Nc1[nH]cc[n]1 Amb24479768 [0,0,0,0,0,0|4,0,0]=4 198 B7R1.1 NC=C1C=CC=C1 Amb24479305 [0,0,0,0,0,0|2,0,1]=3 199 B7R1.1 NCC1C=CCO1 Amb25064815 [0,0,0,0,0,0|1,0,2]=3 200 B7R1.1 NCC1CC=CC1 Amb22301490 [0,0,0,0,0,0|2,0,2]=4 201 B7R1.1 NCC1CCC=C1 Amb18119742 [0,0,0,0,0,0|2,0,2]=4 202 B7R1.1 NCC=1CCCC1 Amb18120760 [0,0,0,0,0,0|2,0,2]=4 203 B7R1.1 NCC=1CNCC1 Amb24714742 [0,0,0,0,0,0|3,0,1]=4 204 B7R1.1 NC[C@@H]1C=CCO1 Amb25831275 [0,0,0,0,0,0|1,0,2]=3 205 B7R1.1 NC[n]1c[n]c[n]1 Amb24585111 [0,0,0,0,0,0|4,0,0]=4 206 B7R1.1 NC[n]1c[n]cc1 Amb25054450 [0,0,0,0,0,0|4,0,0]=4 207 B7R1.1 NC[n]1cc[n][n]1 Amb24652978 [0,0,0,0,0,0|4,0,0]=4 208 B7R1.1 NCc1[nH]cnn1 Amb10609143 [0,0,0,0,0,0|4,0,0]=4 209 B7R1.1 NCc1[n][n]c[s]1 Amb20241052 [0,0,0,0,0,0|3,1,0]=4 210 B7R1.1 NCc1[n][n]c[s]1 Amb23439704 [0,0,0,0,0,0|3,1,0]=4 211 B7R1.1 NCc1[n][n]co1 Amb22756572 [0,0,0,0,0,0|3,0,0]=3 212 B7R1.1 NCc1[n]c[s][n]1 Amb18202816 [0,0,0,0,0,0|4,0,0]=4 213 B7R1.1 NCc1[n]cco1 Amb19929809 [0,0,0,0,0,0|2,0,0]=2 214 B7R1.1 NCc1[n]co[n]1 Amb19275267 [0,0,0,0,0,0|4,0,0]=4 215 B7R1.1 NCc1c[nH][n][n]1 Amb18523723 [0,0,0,0,0,0|4,0,0]=4 216 B7R1.1 NCc1c[nH][n][n]1 Amb21963455 [0,0,0,0,0,0|4,0,0]=4 217 B7R1.1 NCc1c[nH][n]c1 Amb22234749 [0,0,0,0,0,0|4,0,0]=4 218 B7R1.1 NCc1c[nH][n]c1 Amb23439209 [0,0,0,0,0,0|4,0,0]=4 219 B7R1.1 NCc1c[nH]c[n]1 Amb19374683 [0,0,0,0,0,0|3,0,0]=3 220 B7R1.1 NCc1c[nH]cc1 Amb18061787 [0,0,0,0,0,0|3,0,0]=3 221 B7R1.1 NCc1c[nH]cn1 Amb10608889 [0,0,0,0,0,0|3,0,0]=3 222 B7R1.1 NCc1c[n][s][n]1 Amb25858733 [0,0,0,0,0,0|4,0,0]=4 223 B7R1.1 NCc1c[n]c[s]1 Amb21955310 [0,0,0,0,0,0|2,1,0]=3 224 B7R1.1 NCc1c[n]co1 Amb23400902 [0,0,0,0,0,0|2,0,0]=2 225 B7R1.1 NCc1c[n]oc1 Amb21964650 [0,0,0,0,0,0|4,0,0]=4 226 B7R1.1 NCc1c[n]oc1 Amb22000877 [0,0,0,0,0,0|4,0,0]=4 227 B7R1.1 NCc1c[s][n][n]1 Amb19374612 [0,0,0,0,0,0|4,0,0]=4 228 B7R1.1 NCc1c[s]c[n]1 Amb21955307 [0,0,0,0,0,0|3,0,0]=3 229 B7R1.1 NCc1c[s]c[n]1 Amb22586640 [0,0,0,0,0,0|3,0,0]=3 230 B7R1.1 NCc1c[s]c[n]1 Amb22750751 [0,0,0,0,0,0|3,0,0]=3 231 B7R1.1 NCc1cc[nH][n]1 Amb22490711 [0,0,0,0,0,0|3,0,0]=3 232 B7R1.1 NCc1cc[n][nH]1 Amb19516111 [0,0,0,0,0,0|3,0,0]=3 233 B7R1.1 NCc1cc[n][s]1 Amb23441021 [0,0,0,0,0,0|2,1,0]=3 234 B7R1.1 NCc1cc[s][n]1 Amb18203360 [0,0,0,0,0,0|3,0,0]=3 235 B7R1.1 NCc1ccc[nH]1 Amb19957909 [0,0,0,0,0,0|2,0,0]=2 236 B7R1.1 NCc1ccc[s]1 Amb20622043 [0,0,0,0,0,0|1,1,0]=2 237 B7R1.1 NCc1ccn[nH]1 Amb1934827 [0,0,0,0,0,0|3,0,0]=3 238 B7R1.1 NCc1ccno1 Amb10604134 [0,0,0,0,0,0|2,0,0]=2 239 B7R1.1 NCc1cco[n]1 Amb20241091 [0,0,0,0,0,0|3,0,0]=3 240 B7R1.1 NCc1cnco1 Amb10604053 [0,0,0,0,0,0|2,0,0]=2 241 B7R1.1 NCc1cncs1 Amb1087821 [0,0,0,0,0,0|2,1,0]=3 242 B7R1.1 NCc1cncs1 Amb13891841 [0,0,0,0,0,0|2,1,0]=3 243 B7R1.1 NCc1cocn1 Amb10603799 [0,0,0,0,0,0|3,0,0]=3 244 B7R1.1 NCc1cscc1 Amb1140991 [0,0,0,0,0,0|3,0,0]=3 245 B7R1.1 NCc1ncc[nH]1 Amb10071398 [0,0,0,0,0,0|3,0,0]=3 246 B7R1.1 NCc1ncc[nH]1 Amb1068370 [0,0,0,0,0,0|3,0,0]=3 247 B7R1.1 NCc1ncc[nH]1 Amb16233858 [0,0,0,0,0,0|3,0,0]=3 248 B7R1.1 NCc1ncc[nH]1 Amb2154786 [0,0,0,0,0,0|3,0,0]=3 249 B7R1.1 NCc1nccs1 Amb17935776 [0,0,0,0,0,0|2,1,0]=3 250 B7R1.1 NCc1nnc[nH]1 Amb10708860 [0,0,0,0,0,0|4,0,0]=4 251 B7R1.1 NCc1nocn1 Amb16230506 [0,0,0,0,0,0|4,0,0]=4 252 B7R1.1 NCc1scnc1 Amb13883008 [0,0,0,0,0,0|2,1,0]=3 253 B7R1.1 NN=C1NC=CN1 Amb22490478 [0,0,0,0,0,0|4,0,0]=4 254 B7R1.1 NNc1[nH]cc[n]1 Amb18639144 [0,0,0,0,0,0|4,0,0]=4 255 B7R1.1 NNc1[nH]cc[n]1 Amb22336757 [0,0,0,0,0,0|4,0,0]=4 256 B7R1.1 NNc1[nH]cc[n]1 Amb22491294 [0,0,0,0,0,0|4,0,0]=4 257 B7R1.1 NNc1[n]cc[s]1 Amb22757179 [0,0,0,0,0,0|3,1,0]=4 258 B7R1.1 NNc1[n]cc[s]1 Amb22757202 [0,0,0,0,0,0|3,1,0]=4 259 B7R1.1 NNc1[n]cco1 Amb18120860 [0,0,0,0,0,0|3,0,0]=3 260 B7R1.1 NNc1c[n]c[s]1 Amb24097125 [0,0,0,0,0,0|3,1,0]=4 261 B7R1.1 NNc1c[n]co1 Amb25364440 [0,0,0,0,0,0|3,0,0]=3 262 B7R1.1 NNc1c[s]c[n]1 Amb24646183 [0,0,0,0,0,0|4,0,0]=4 263 B7R1.1 NNc1cc[n][nH]1 Amb24745529 [0,0,0,0,0,0|4,0,0]=4 264 B7R1.1 NNc1cc[n][s]1 Amb25291730 [0,0,0,0,0,0|3,1,0]=4 265 B7R1.1 NNc1cc[s][n]1 Amb25849845 [0,0,0,0,0,0|4,0,0]=4 266 B7R1.1 NNc1ccc[s]1 Amb18203361 [0,0,0,0,0,0|2,1,0]=3 267 B7R1.1 NNc1ccco1 Amb18203069 [0,0,0,0,0,0|2,0,0]=2 268 B7R1.1 NNc1nccs1 Amb1120140 [0,0,0,0,0,0|3,1,0]=4 269 B7R1.1 NOc1ccc[nH]1 Amb25194554 [0,0,0,0,0,0|3,0,0]=3 270 B7R1.1 NOc1ccco1 Amb24652732 [0,0,0,0,0,0|2,0,0]=2 271 B7R1.1 O=CC1=CCC=C1 Amb24437176 [0,0,0,0,0,0|1,0,3]=4 272 B7R1.1 O=CC1=CCCO1 Amb18120782 [0,0,0,0,0,0|0,0,4]=4 273 B7R1.1 O=CC1C=CCO1 Amb25347483 [0,0,0,0,0,0|0,0,4]=4 274 B7R1.1 O=CC=1CC=CC1 Amb25799627 [0,0,0,0,0,0|1,0,2]=3 275 B7R1.1 O=C[c-]1cccc1 Amb22168256 [0,0,0,0,0,0|1,0,3]=4 276 B7R1.1 O=Cc1[n][n]co1 Amb21856468 [0,0,0,0,0,0|2,0,2]=4 277 B7R1.1 O=Cc1[n]cc[s]1 Amb22275985 [0,0,0,0,0,0|1,1,2]=4 278 B7R1.1 O=Cc1cc[nH][n]1 Amb22737200 [0,0,0,0,0,0|2,0,2]=4 279 B7R1.1 O=Cc1ccc[nH]1 Amb1952995 [0,0,0,0,0,0|1,0,2]=3 280 B7R1.1 O=Cc1ccc[se]1 Amb22730854 [0,0,0,0,0,0|0,1,2]=3 281 B7R1.1 O=Cc1cncs1 Amb2455730 [0,0,0,0,0,0|1,1,2]=4 282 B7R1.1 O=Cc1cscn1 Amb2455729 [0,0,0,0,0,0|2,0,2]=4 283 B7R1.1 O=Cc1ncc[nH]1 Amb2455714 [0,0,0,0,0,0|2,0,2]=4 284 B7R1.1 O=Nc1c[nH]cc1 Amb25378010 [0,0,0,0,0,0|3,0,1]=4 285 B7R1.1 O=Nc1ccc[nH]1 Amb25739902 [0,0,0,0,0,0|2,0,1]=3 286 B7R1.1 O=Nc1ccc[s]1 Amb25223543 [0,0,0,0,0,0|1,1,1]=3 287 B7R1.1 O=Nc1ccco1 Amb25746897 [0,0,0,0,0,0|1,0,1]=2 288 B7R1.1 O=Nc1cocc1 Amb25364569 [0,0,0,0,0,0|3,0,1]=4 289 B7R1.1 O=S=C1NC=CO1 Amb24539442 [0,0,0,0,0,0|2,0,1]=3 290 B7R1.1 OC=C1C=CC=C1 Amb24644706 [0,0,0,0,0,0|1,0,1]=2 291 B7R1.1 OCC1=CCCO1 Amb25045240 [0,0,0,0,0,0|0,0,2]=2 292 B7R1.1 OCC1=NCCO1 Amb22410786 [0,0,0,0,0,0|1,0,2]=3 293 B7R1.1 OCC1C=CCO1 Amb25222276 [0,0,0,0,0,0|0,0,2]=2 294 B7R1.1 OCC1CCC=C1 Amb23455253 [0,0,0,0,0,0|1,0,2]=3 295 B7R1.1 OCC1CCCO1 Amb22731176 [0,0,0,0,0,0|0,0,4]=4 296 B7R1.1 OCC1CN=CN1 Amb22831209 [0,0,0,0,0,0|2,0,2]=4 297 B7R1.1 OCC1CN=CN1 Amb22831350 [0,0,0,0,0,0|2,0,2]=4 298 B7R1.1 OCC1CNC=N1 Amb22496352 [0,0,0,0,0,0|2,0,2]=4 299 B7R1.1 OCC1COC=C1 Amb24480931 [0,0,0,0,0,0|2,0,1]=3 300 B7R1.1 OCC1NCC=C1 Amb15701263 [0,0,0,0,0,0|1,0,2]=3 301 B7R1.1 OCC1NCCO1 Amb25230305 [0,0,0,0,0,0|1,0,3]=4 302 B7R1.1 OCC=1CCCC1 Amb24479891 [0,0,0,0,0,0|1,0,2]=3 303 B7R1.1 OCC=1CNCC1 Amb25302340 [0,0,0,0,0,0|2,0,1]=3 304 B7R1.1 OCN1NC=CS1 Amb25788152 [0,0,0,0,0,0|2,1,0]=3 305 B7R1.1 OC[C@@H]1C=CCO1 Amb25169572 [0,0,0,0,0,0|0,0,2]=2 306 B7R1.1 OC[C@@H]1CC=CO1 Amb25120125 [0,0,0,0,0,0|0,0,2]=2 307 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [0,0,0,0,0,0|0,0,4]=4 308 B7R1.1 OC[C@@H]1CSC=N1 Amb24333789 [0,0,0,0,0,0|2,0,2]=4 309 B7R1.1 OC[C@@H]1OCCS1 Amb22748777 [0,0,0,0,0,0|1,0,3]=4 310 B7R1.1 OC[C@H]1C=CCO1 Amb25282911 [0,0,0,0,0,0|0,0,2]=2 311 B7R1.1 OC[C@H]1CC=CO1 Amb25058557 [0,0,0,0,0,0|0,0,2]=2 312 B7R1.1 OC[C@H]1CCC=C1 Amb25723081 [0,0,0,0,0,0|1,0,2]=3 313 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [0,0,0,0,0,0|0,0,4]=4 314 B7R1.1 OC[C@H]1OCCS1 Amb25198578 [0,0,0,0,0,0|1,0,3]=4 315 B7R1.1 OC[n]1[n]cc[n]1 Amb24565263 [0,0,0,0,0,0|3,0,0]=3 316 B7R1.1 OC[n]1c[n][n][n]1 Amb24074739 [0,0,0,0,0,0|4,0,0]=4 317 B7R1.1 OC[n]1c[n]cc1 Amb25136761 [0,0,0,0,0,0|3,0,0]=3 318 B7R1.1 OCc1[n][n]c[s]1 Amb23437041 [0,0,0,0,0,0|2,1,0]=3 319 B7R1.1 OCc1[n]c[nH][n]1 Amb20248270 [0,0,0,0,0,0|3,0,0]=3 320 B7R1.1 OCc1[n]cc[s]1 Amb21857481 [0,0,0,0,0,0|1,1,0]=2 321 B7R1.1 OCc1c[nH][n][n]1 Amb24113131 [0,0,0,0,0,0|3,0,0]=3 322 B7R1.1 OCc1c[nH]cc1 Amb18862403 [0,0,0,0,0,0|2,0,0]=2 323 B7R1.1 OCc1c[nH]nc1 Amb10603101 [0,0,0,0,0,0|3,0,0]=3 324 B7R1.1 OCc1c[n][n][s]1 Amb20241951 [0,0,0,0,0,0|2,1,0]=3 325 B7R1.1 OCc1c[n][s]c1 Amb22757389 [0,0,0,0,0,0|3,0,0]=3 326 B7R1.1 OCc1c[n]o[n]1 Amb22490829 [0,0,0,0,0,0|3,0,0]=3 327 B7R1.1 OCc1c[n]oc1 Amb22011478 [0,0,0,0,0,0|3,0,0]=3 328 B7R1.1 OCc1cc[nH]n1 Amb17602658 [0,0,0,0,0,0|2,0,0]=2 329 B7R1.1 OCc1cc[s][n]1 Amb22896461 [0,0,0,0,0,0|2,0,0]=2 330 B7R1.1 OCc1ccn[nH]1 Amb1099131 [0,0,0,0,0,0|2,0,0]=2 331 B7R1.1 OCc1ccns1 Amb16185717 [0,0,0,0,0,0|1,1,0]=2 332 B7R1.1 OCc1cco[n]1 Amb19515377 [0,0,0,0,0,0|2,0,0]=2 333 B7R1.1 OCc1cnco1 Amb10070754 [0,0,0,0,0,0|1,0,0]=1 334 B7R1.1 OCc1cncs1 Amb2455733 [0,0,0,0,0,0|1,1,0]=2 335 B7R1.1 OCc1cnn[nH]1 Amb1085878 [0,0,0,0,0,0|3,0,0]=3 336 B7R1.1 OCc1cocn1 Amb10071193 [0,0,0,0,0,0|2,0,0]=2 337 B7R1.1 OCc1cscn1 Amb2455732 [0,0,0,0,0,0|2,0,0]=2 338 B7R1.1 OCc1ncco1 Amb10071191 [0,0,0,0,0,0|1,0,0]=1 339 B7R1.1 OCn1cccn1 Amb10552412 [0,0,0,0,0,0|2,0,0]=2 340 B7R1.1 OCn1cncn1 Amb1085763 [0,0,0,0,0,0|3,0,0]=3 341 B7R1.1 ONc1[nH]cc[n]1 Amb25739881 [0,0,0,0,0,0|3,0,0]=3 342 B7R1.1 ONc1[n][n]c[s]1 Amb24607711 [0,0,0,0,0,0|3,1,0]=4 343 B7R1.1 ONc1[n]c[n][s]1 Amb24332136 [0,0,0,0,0,0|3,1,0]=4 344 B7R1.1 ONc1[n]cc[s]1 Amb24703503 [0,0,0,0,0,0|2,1,0]=3 345 B7R1.1 O[13CH2][13c]1[13cH]ncs1 Amb17620581 [0,0,0,0,0,0|1,1,0]=2 346 B7R1.1 O\C=C\1/C=CCS1 Amb24480659 [0,0,0,0,0,0|0,1,2]=3 347 B7R1.1 O\N=C\1/C=NC=C1 Amb24579134 [0,0,0,0,0,0|3,0,0]=3 348 B7R1.1 S=Cc1[n]cco1 Amb24541132 [0,0,0,0,0,0|1,1,1]=3 349 B7R1.1 SCC1NC=CN1 Amb25322509 [0,0,0,0,0,0|2,1,1]=4 350 B7R1.1 SCC=1CCCC1 Amb24697613 [0,0,0,0,0,0|1,1,2]=4 351 B7R1.1 SCc1[nH]cc[n]1 Amb25731254 [0,0,0,0,0,0|2,1,0]=3 352 B7R1.1 SCc1[n]cc[s]1 Amb25241320 [0,0,0,0,0,0|1,2,0]=3 353 B7R1.1 SCc1[n]co[n]1 Amb25723940 [0,0,0,0,0,0|3,1,0]=4 354 B7R1.1 SCc1c[nH]c[n]1 Amb25230610 [0,0,0,0,0,0|2,1,0]=3 355 B7R1.1 SCc1cco[n]1 Amb23440702 [0,0,0,0,0,0|2,1,0]=3 356 B7R1.1 SCc1cscn1 Amb17108587 [0,0,0,0,0,0|2,1,0]=3 357 B7R1.1 [C-]#[N+]c1[n]cc[s]1 Amb25352023 [0,0,0,0,0,0|3,1,0]=4 358 B7R1.1 [C-]#[N+]c1ccc[nH]1 Amb24669375 [0,0,0,0,0,0|3,0,0]=3 359 B7R1.1 [N-]=[N+]=C1C=NC=C1 Amb24756939 [0,0,0,0,0,0|4,0,0]=4 360 B7R1.1 [NH3+]Cc1cccs1 Amb10555898 [0,0,0,0,0,0|1,1,0]=2 361 B7R1.1 c1c[nH]nc1C#N Amb10603084 [0,0,0,0,0,0|3,0,1]=4 362 B7R1.1 c1ncsc1C#N Amb10602916 [0,0,0,0,0,0|2,1,1]=4 363 B7R1.1 c1ocnc1C#N Amb10071472 [0,0,0,0,0,0|3,0,1]=4 364 B6R1.2 Bc1c[nH]c[n]1 Amb25308953 [1,0,0,0,0,0|3,0,0]=4 365 B6R1.2 Bc1c[nH]cc1 Amb24366706 [1,0,0,0,0,0|3,0,0]=4 366 B6R1.2 Bc1ccc[nH]1 Amb24529534 [1,0,0,0,0,0|2,0,0]=3 367 B6R1.2 Bc1ccc[s]1 Amb25662874 [1,0,0,0,0,0|1,1,0]=3 368 B6R1.2 Bc1cocc1 Amb24511389 [1,0,0,0,0,0|3,0,0]=4 369 B6R1.2 BrC1=CCC=N1 Amb25195406 [1,0,0,0,0,0|2,0,1]=4 370 B6R1.2 BrC1=CCCO1 Amb24322605 [1,0,0,0,0,0|1,0,2]=4 371 B6R1.2 Brc1[n]c[n]o1 Amb25376458 [1,0,0,0,0,0|3,0,0]=4 372 B6R1.2 Brc1[n]cco1 Amb19514894 [1,0,0,0,0,0|2,0,0]=3 373 B6R1.2 Brc1c[nH]cc1 Amb18243466 [1,0,0,0,0,0|3,0,0]=4 374 B6R1.2 Brc1c[nH]cn1 Amb2455858 [1,0,0,0,0,0|3,0,0]=4 375 B6R1.2 Brc1c[n]co1 Amb24058248 [1,0,0,0,0,0|2,0,0]=3 376 B6R1.2 Brc1cc[n]o1 Amb20242149 [1,0,0,0,0,0|2,0,0]=3 377 B6R1.2 Brc1cc[s][n]1 Amb18828880 [1,0,0,0,0,0|3,0,0]=4 378 B6R1.2 Brc1ccc[nH]1 Amb24065418 [1,0,0,0,0,0|2,0,0]=3 379 B6R1.2 Brc1ccc[se]1 Amb21964756 [1,0,0,0,0,0|1,1,0]=3 380 B6R1.2 Brc1ccon1 Amb13890359 [1,0,0,0,0,0|3,0,0]=4 381 B6R1.2 Brc1cncs1 Amb2455804 [1,0,0,0,0,0|2,1,0]=4 382 B6R1.2 Brc1cscn1 Amb2447456 [1,0,0,0,0,0|3,0,0]=4 383 B6R1.2 Brc1ncc[nH]1 Amb10068556 [1,0,0,0,0,0|3,0,0]=4 384 B6R1.2 Brc1ncco1 Amb10071482 [1,0,0,0,0,0|2,0,0]=3 385 B6R1.2 C=C1CC=CN1 Amb25745630 [1,0,0,0,0,0|1,0,2]=4 386 B6R1.2 CC1=CCC=C1 Amb22410851 [1,0,0,0,0,0|1,0,1]=3 387 B6R1.2 CC1=CCCO1 Amb20621083 [1,0,0,0,0,0|0,0,2]=3 388 B6R1.2 CC1C=CC=C1 Amb16224918 [1,0,0,0,0,0|1,0,1]=3 389 B6R1.2 CC1C=CC=N1 Amb25026197 [1,0,0,0,0,0|1,0,1]=3 390 B6R1.2 CC1C=CCN1 Amb24120626 [1,0,0,0,0,0|1,0,2]=4 391 B6R1.2 CC1CC=CS1 Amb24383307 [1,0,0,0,0,0|0,1,2]=4 392 B6R1.2 CC1CCC=C1 Amb17674168 [1,0,0,0,0,0|1,0,2]=4 393 B6R1.2 CC1COC=C1 Amb22001724 [1,0,0,0,0,0|2,0,1]=4 394 B6R1.2 CC1NC=CN1 Amb25835750 [1,0,0,0,0,0|2,0,1]=4 395 B6R1.2 CC=1C=NCN1 Amb24638349 [1,0,0,0,0,0|2,0,1]=4 396 B6R1.2 CC=1CN=CC1 Amb25810885 [1,0,0,0,0,0|2,0,0]=3 397 B6R1.2 C[n+]1ccc[s]1 Amb22896462 [1,0,0,0,0,0|1,1,0]=3 398 B6R1.2 C[n+]1cccs1 Amb10552415 [1,0,0,0,0,0|1,1,0]=3 399 B6R1.2 C[n]1[n]cc[n]1 Amb22491223 [1,0,0,0,0,0|3,0,0]=4 400 B6R1.2 C[n]1c[nH+]cc1 Amb22756354 [1,0,0,0,0,0|3,0,0]=4 401 B6R1.2 C[n]1c[n]cc1 Amb22337440 [1,0,0,0,0,0|3,0,0]=4 402 B6R1.2 C[n]1c[n]cc1 Amb22337441 [1,0,0,0,0,0|3,0,0]=4 403 B6R1.2 Cc1[nH]c[p][n]1 Amb24452160 [1,0,0,0,0,0|3,0,0]=4 404 B6R1.2 Cc1[n][n]co1 Amb20171395 [1,0,0,0,0,0|2,0,0]=3 405 B6R1.2 Cc1[n]c[n]o1 Amb25684624 [1,0,0,0,0,0|2,0,0]=3 406 B6R1.2 Cc1[n]cco1 Amb22757206 [1,0,0,0,0,0|1,0,0]=2 407 B6R1.2 Cc1c[nH][n][n]1 Amb19957384 [1,0,0,0,0,0|3,0,0]=4 408 B6R1.2 Cc1c[nH][n][n]1 Amb22499971 [1,0,0,0,0,0|3,0,0]=4 409 B6R1.2 Cc1c[nH]cc1 Amb10603704 [1,0,0,0,0,0|2,0,0]=3 410 B6R1.2 Cc1c[nH]nc1 Amb10843801 [1,0,0,0,0,0|3,0,0]=4 411 B6R1.2 Cc1c[nH]nc1 Amb1911519 [1,0,0,0,0,0|3,0,0]=4 412 B6R1.2 Cc1c[n][s]c1 Amb22370679 [1,0,0,0,0,0|3,0,0]=4 413 B6R1.2 Cc1c[n]co1 Amb23403175 [1,0,0,0,0,0|1,0,0]=2 414 B6R1.2 Cc1c[n]o[n]1 Amb19958318 [1,0,0,0,0,0|3,0,0]=4 415 B6R1.2 Cc1c[p][nH][n]1 Amb25773965 [1,0,0,0,0,0|3,0,0]=4 416 B6R1.2 Cc1cc[n][s]1 Amb22734260 [1,0,0,0,0,0|1,1,0]=3 417 B6R1.2 Cc1cc[s][n]1 Amb20621563 [1,0,0,0,0,0|2,0,0]=3 418 B6R1.2 Cc1ccco1 Amb2447070 [1,0,0,0,0,0|0,0,0]=1 419 B6R1.2 Cc1cccs1 Amb2447069 [1,0,0,0,0,0|0,1,0]=2 420 B6R1.2 Cc1ccn[nH]1 Amb2236077 [1,0,0,0,0,0|2,0,0]=3 421 B6R1.2 Cc1coc[n]1 Amb20241591 [1,0,0,0,0,0|2,0,0]=3 422 B6R1.2 Cc1cocc1 Amb2447077 [1,0,0,0,0,0|2,0,0]=3 423 B6R1.2 Cc1cscc1 Amb2447071 [1,0,0,0,0,0|2,0,0]=3 424 B6R1.2 Cc1cscn1 Amb1163532 [1,0,0,0,0,0|2,0,0]=3 425 B6R1.2 Cc1n[nH]cn1 Amb2445800 [1,0,0,0,0,0|3,0,0]=4 426 B6R1.2 Cc1ncc[nH]1 Amb1159210 [1,0,0,0,0,0|2,0,0]=3 427 B6R1.2 Cc1ncco1 Amb17399783 [1,0,0,0,0,0|1,0,0]=2 428 B6R1.2 Cc1nccs1 Amb2455765 [1,0,0,0,0,0|1,1,0]=3 429 B6R1.2 ClC1=CCC=C1 Amb22584067 [1,0,0,0,0,0|2,0,1]=4 430 B6R1.2 ClC1C=CC=C1 Amb25780001 [1,0,0,0,0,0|2,0,1]=4 431 B6R1.2 Cl[n]1cccc1 Amb25774278 [1,0,0,0,0,0|3,0,0]=4 432 B6R1.2 Clc1[n]cco1 Amb22054705 [1,0,0,0,0,0|2,0,0]=3 433 B6R1.2 Clc1c[nH]cc1 Amb22490961 [1,0,0,0,0,0|3,0,0]=4 434 B6R1.2 Clc1c[n]c[s]1 Amb21864727 [1,0,0,0,0,0|2,1,0]=4 435 B6R1.2 Clc1cc[nH][n]1 Amb20241888 [1,0,0,0,0,0|3,0,0]=4 436 B6R1.2 Clc1cc[s][n]1 Amb21927817 [1,0,0,0,0,0|3,0,0]=4 437 B6R1.2 Clc1ccc[nH]1 Amb17672350 [1,0,0,0,0,0|2,0,0]=3 438 B6R1.2 Clc1cocc1 Amb24333769 [1,0,0,0,0,0|3,0,0]=4 439 B6R1.2 Clc1cscn1 Amb10602719 [1,0,0,0,0,0|3,0,0]=4 440 B6R1.2 Clc1ncc[nH]1 Amb10068570 [1,0,0,0,0,0|3,0,0]=4 441 B6R1.2 Clc1nccs1 Amb2455949 [1,0,0,0,0,0|2,1,0]=4 442 B6R1.2 Cn1cccn1 Amb1088902 [1,0,0,0,0,0|2,0,0]=3 443 B6R1.2 Cn1ccnn1 Amb13883817 [1,0,0,0,0,0|3,0,0]=4 444 B6R1.2 FC1=CCCO1 Amb24322815 [1,0,0,0,0,0|1,0,2]=4 445 B6R1.2 Fc1[nH]cc[n]1 Amb22436838 [1,0,0,0,0,0|3,0,0]=4 446 B6R1.2 Fc1[n]cc[s]1 Amb20621379 [1,0,0,0,0,0|2,1,0]=4 447 B6R1.2 Fc1c[nH]cn1 Amb16234263 [1,0,0,0,0,0|3,0,0]=4 448 B6R1.2 Fc1c[n]co1 Amb25364574 [1,0,0,0,0,0|2,0,0]=3 449 B6R1.2 Fc1c[s]c[n]1 Amb24097116 [1,0,0,0,0,0|3,0,0]=4 450 B6R1.2 Fc1cc[nH][n]1 Amb21858977 [1,0,0,0,0,0|3,0,0]=4 451 B6R1.2 Fc1cscc1 Amb13783621 [1,0,0,0,0,0|3,0,0]=4 452 B6R1.2 Fc1ncc[nH]1 Amb16234262 [1,0,0,0,0,0|3,0,0]=4 453 B6R1.2 IC1=CCCO1 Amb24322816 [1,0,0,0,0,0|1,0,2]=4 454 B6R1.2 IC1C=CC=C1 Amb25189843 [1,0,0,0,0,0|2,0,1]=4 455 B6R1.2 Ic1[n]cco1 Amb23439118 [1,0,0,0,0,0|2,0,0]=3 456 B6R1.2 Ic1c[nH]cc1 Amb24763803 [1,0,0,0,0,0|3,0,0]=4 457 B6R1.2 Ic1c[n]c[s]1 Amb24087561 [1,0,0,0,0,0|2,1,0]=4 458 B6R1.2 Ic1c[s]c[n]1 Amb22057367 [1,0,0,0,0,0|3,0,0]=4 459 B6R1.2 Ic1cc[nH]n1 Amb10975340 [1,0,0,0,0,0|3,0,0]=4 460 B6R1.2 Ic1cc[n][s]1 Amb25136169 [1,0,0,0,0,0|2,1,0]=4 461 B6R1.2 Ic1cc[n]o1 Amb25793636 [1,0,0,0,0,0|2,0,0]=3 462 B6R1.2 Ic1ccc[nH]1 Amb25663213 [1,0,0,0,0,0|2,0,0]=3 463 B6R1.2 Ic1ccco1 Amb17672748 [1,0,0,0,0,0|1,0,0]=2 464 B6R1.2 Ic1cnc[nH]1 Amb2455806 [1,0,0,0,0,0|3,0,0]=4 465 B6R1.2 Ic1coc[n]1 Amb24620615 [1,0,0,0,0,0|3,0,0]=4 466 B6R1.2 Ic1cocc1 Amb24686192 [1,0,0,0,0,0|3,0,0]=4 467 B6R1.2 N=C1NC=CS1 Amb22166858 [1,0,0,0,0,0|2,1,0]=4 468 B6R1.2 NC1C=CC=C1 Amb25351781 [1,0,0,0,0,0|2,0,1]=4 469 B6R1.2 NC=1C=CCN1 Amb25208790 [1,0,0,0,0,0|2,0,1]=4 470 B6R1.2 N[n]1ccc[n]1 Amb22233569 [1,0,0,0,0,0|3,0,0]=4 471 B6R1.2 Nc1[nH]cc[nH+]1 Amb10574070 [1,0,0,0,0,0|3,0,0]=4 472 B6R1.2 Nc1[n][n]co1 Amb19516986 [1,0,0,0,0,0|3,0,0]=4 473 B6R1.2 Nc1[n]c[n]o1 Amb18943952 [1,0,0,0,0,0|3,0,0]=4 474 B6R1.2 Nc1[s]cc[s+]1 Amb24479163 [1,0,0,0,0,0|2,1,0]=4 475 B6R1.2 Nc1c[nH]c[n]1 Amb20247901 [1,0,0,0,0,0|3,0,0]=4 476 B6R1.2 Nc1c[nH]c[n]1 Amb20620264 [1,0,0,0,0,0|3,0,0]=4 477 B6R1.2 Nc1c[nH]cc1 Amb18065305 [1,0,0,0,0,0|3,0,0]=4 478 B6R1.2 Nc1c[nH]cc1 Amb22491642 [1,0,0,0,0,0|3,0,0]=4 479 B6R1.2 Nc1c[n]co1 Amb21962026 [1,0,0,0,0,0|2,0,0]=3 480 B6R1.2 Nc1c[n]co1 Amb21963496 [1,0,0,0,0,0|2,0,0]=3 481 B6R1.2 Nc1c[s]c[n]1 Amb22495658 [1,0,0,0,0,0|3,0,0]=4 482 B6R1.2 Nc1c[s]cc1 Amb19515444 [1,0,0,0,0,0|3,0,0]=4 483 B6R1.2 Nc1c[s]cc1 Amb22405919 [1,0,0,0,0,0|3,0,0]=4 484 B6R1.2 Nc1cc[nH][n]1 Amb20241114 [1,0,0,0,0,0|3,0,0]=4 485 B6R1.2 Nc1cc[nH][n]1 Amb22002683 [1,0,0,0,0,0|3,0,0]=4 486 B6R1.2 Nc1cc[nH]n1 Amb2235300 [1,0,0,0,0,0|3,0,0]=4 487 B6R1.2 Nc1cc[n][s]1 Amb18203020 [1,0,0,0,0,0|2,1,0]=4 488 B6R1.2 Nc1cc[s][n]1 Amb22235783 [1,0,0,0,0,0|3,0,0]=4 489 B6R1.2 Nc1ccc[s]1 Amb21857748 [1,0,0,0,0,0|1,1,0]=3 490 B6R1.2 Nc1ccco1 Amb18203215 [1,0,0,0,0,0|1,0,0]=2 491 B6R1.2 Nc1cccs1 Amb10603635 [1,0,0,0,0,0|1,1,0]=3 492 B6R1.2 Nc1ccn[nH]1 Amb1930440 [1,0,0,0,0,0|3,0,0]=4 493 B6R1.2 Nc1ccsc1 Amb17935671 [1,0,0,0,0,0|3,0,0]=4 494 B6R1.2 Nc1coc[n]1 Amb22002224 [1,0,0,0,0,0|3,0,0]=4 495 B6R1.2 Nc1coc[n]1 Amb22284836 [1,0,0,0,0,0|3,0,0]=4 496 B6R1.2 Nc1cocc1 Amb22230735 [1,0,0,0,0,0|3,0,0]=4 497 B6R1.2 Nc1cscc1 Amb13889594 [1,0,0,0,0,0|3,0,0]=4 498 B6R1.2 Nc1cscn1 Amb10600518 [1,0,0,0,0,0|3,0,0]=4 499 B6R1.2 O=C1C=CCN1 Amb20241082 [1,0,0,0,0,0|1,0,2]=4 500 B6R1.2 O=C1C=CCS1 Amb22336458 [1,0,0,0,0,0|0,1,2]=4 501 B6R1.2 O=C1C=CN=N1 Amb22230022 [1,0,0,0,0,0|2,0,1]=4 502 B6R1.2 O=C1C=CNN1 Amb19958916 [1,0,0,0,0,0|2,0,1]=4 503 B6R1.2 O=C1C=CON1 Amb22055592 [1,0,0,0,0,0|2,0,1]=4 504 B6R1.2 O=C1C=CSN1 Amb19895016 [1,0,0,0,0,0|2,0,1]=4 505 B6R1.2 O=C1C=NC=C1 Amb25746212 [1,0,0,0,0,0|2,0,1]=4 506 B6R1.2 O=C1C=NC=N1 Amb25662161 [1,0,0,0,0,0|2,0,1]=4 507 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,0,0,0|1,0,2]=4 508 B6R1.2 O=C1CC=CN1 Amb22235167 [1,0,0,0,0,0|1,0,2]=4 509 B6R1.2 O=C1CN=CO1 Amb24333834 [1,0,0,0,0,0|1,0,2]=4 510 B6R1.2 O=C1CNC=C1 Amb22234991 [1,0,0,0,0,0|2,0,1]=4 511 B6R1.2 O=C1COC=C1 Amb24107591 [1,0,0,0,0,0|2,0,1]=4 512 B6R1.2 O=C1CSC=C1 Amb22736500 [1,0,0,0,0,0|2,0,1]=4 513 B6R1.2 O=C1N=CC=N1 Amb25138138 [1,0,0,0,0,0|2,0,1]=4 514 B6R1.2 O=C1N=CCO1 Amb25024901 [1,0,0,0,0,0|1,0,2]=4 515 B6R1.2 O=C1NC=CN1 Amb19516737 [1,0,0,0,0,0|2,0,1]=4 516 B6R1.2 O=C1NC=CO1 Amb20671008 [1,0,0,0,0,0|1,0,1]=3 517 B6R1.2 O=C1NC=CS1 Amb19271596 [1,0,0,0,0,0|1,1,1]=4 518 B6R1.2 O=C1NN=CO1 Amb20667671 [1,0,0,0,0,0|2,0,1]=4 519 B6R1.2 O=C1OC=CO1 Amb20239430 [1,0,0,0,0,0|1,0,1]=3 520 B6R1.2 OC1C=CC=N1 Amb24566703 [1,0,0,0,0,0|1,0,1]=3 521 B6R1.2 OC1CC=NO1 Amb25146255 [1,0,0,0,0,0|1,0,2]=4 522 B6R1.2 OC1CCC=C1 Amb17593023 [1,0,0,0,0,0|1,0,2]=4 523 B6R1.2 OC1COC=C1 Amb25194606 [1,0,0,0,0,0|2,0,1]=4 524 B6R1.2 OC1N=CC=N1 Amb24566708 [1,0,0,0,0,0|2,0,1]=4 525 B6R1.2 ON1CC=CC1 Amb24560441 [1,0,0,0,0,0|2,0,1]=4 526 B6R1.2 O[C@H]1CCC=C1 Amb25146308 [1,0,0,0,0,0|1,0,2]=4 527 B6R1.2 O[C@H]1COC=C1 Amb25855065 [1,0,0,0,0,0|2,0,1]=4 528 B6R1.2 Oc1[n][n]c[s]1 Amb19516957 [1,0,0,0,0,0|2,1,0]=4 529 B6R1.2 Oc1[n][n]co1 Amb22586631 [1,0,0,0,0,0|2,0,0]=3 530 B6R1.2 Oc1[n]c[n][s]1 Amb24432869 [1,0,0,0,0,0|2,1,0]=4 531 B6R1.2 Oc1c[nH][n]c1 Amb22275902 [1,0,0,0,0,0|3,0,0]=4 532 B6R1.2 Oc1c[nH][n]c1 Amb22587301 [1,0,0,0,0,0|3,0,0]=4 533 B6R1.2 Oc1c[nH]c[n]1 Amb25147553 [1,0,0,0,0,0|2,0,0]=3 534 B6R1.2 Oc1c[nH]cc1 Amb24317462 [1,0,0,0,0,0|2,0,0]=3 535 B6R1.2 Oc1c[n]co1 Amb25301524 [1,0,0,0,0,0|1,0,0]=2 536 B6R1.2 Oc1c[n]oc1 Amb24601068 [1,0,0,0,0,0|3,0,0]=4 537 B6R1.2 Oc1cc[n][s]1 Amb24599867 [1,0,0,0,0,0|1,1,0]=3 538 B6R1.2 Oc1cc[n]o1 Amb25807641 [1,0,0,0,0,0|1,0,0]=2 539 B6R1.2 Oc1cc[s][n]1 Amb22371253 [1,0,0,0,0,0|2,0,0]=3 540 B6R1.2 Oc1ccco1 Amb22230736 [1,0,0,0,0,0|0,0,0]=1 541 B6R1.2 Oc1cccs1 Amb17201836 [1,0,0,0,0,0|0,1,0]=2 542 B6R1.2 Oc1ccn[nH]1 Amb17621677 [1,0,0,0,0,0|2,0,0]=3 543 B6R1.2 Oc1cco[n]1 Amb22736007 [1,0,0,0,0,0|2,0,0]=3 544 B6R1.2 Oc1cncs1 Amb10599639 [1,0,0,0,0,0|1,1,0]=3 545 B6R1.2 Oc1cnn[nH]1 Amb17593024 [1,0,0,0,0,0|3,0,0]=4 546 B6R1.2 Oc1cnsn1 Amb1107309 [1,0,0,0,0,0|3,0,0]=4 547 B6R1.2 Oc1coc[n]1 Amb25284479 [1,0,0,0,0,0|2,0,0]=3 548 B6R1.2 Oc1cscc1 Amb16231253 [1,0,0,0,0,0|2,0,0]=3 549 B6R1.2 Oc1cscn1 Amb10600519 [1,0,0,0,0,0|2,0,0]=3 550 B6R1.2 Oc1n[nH]cn1 Amb10880693 [1,0,0,0,0,0|3,0,0]=4 551 B6R1.2 On1cccn1 Amb10067876 [1,0,0,0,0,0|2,0,0]=3 552 B6R1.2 On1cncc1 Amb10552377 [1,0,0,0,0,0|3,0,0]=4 553 B6R1.2 Pc1[nH]cc[n]1 Amb25132165 [1,0,0,0,0,0|3,0,0]=4 554 B6R1.2 S=C1C=CSS1 Amb19132030 [1,0,0,0,0,0|1,2,0]=4 555 B6R1.2 S=C1CC=CO1 Amb25365370 [1,0,0,0,0,0|0,1,1]=3 556 B6R1.2 S=C1CCC=C1 Amb25147777 [1,0,0,0,0,0|1,1,1]=4 557 B6R1.2 S=C1NC=CN1 Amb19148165 [1,0,0,0,0,0|2,1,0]=4 558 B6R1.2 S=C1NC=CO1 Amb21936248 [1,0,0,0,0,0|1,1,0]=3 559 B6R1.2 S=C1NC=CS1 Amb22492748 [1,0,0,0,0,0|1,2,0]=4 560 B6R1.2 S=C1SC=CS1 Amb20001458 [1,0,0,0,0,0|1,2,0]=4 561 B6R1.2 S=c1scc[nH]1 Amb10552375 [1,0,0,0,0,0|1,2,0]=4 562 B6R1.2 Sc1c[n]c[nH]1 Amb24723086 [1,0,0,0,0,0|2,1,0]=4 563 B6R1.2 Sc1c[n]c[s]1 Amb24090165 [1,0,0,0,0,0|1,2,0]=4 564 B6R1.2 Sc1c[s]c[n]1 Amb24099741 [1,0,0,0,0,0|2,1,0]=4 565 B6R1.2 Sc1ccc[nH]1 Amb25833767 [1,0,0,0,0,0|1,1,0]=3 566 B6R1.2 Sc1cscc1 Amb16232450 [1,0,0,0,0,0|2,1,0]=4 567 B6R1.2 Sc1nccs1 Amb1137208 [1,0,0,0,0,0|1,2,0]=4 568 B6R1.2 [13CH3]c1ccco1 Amb22367321 [1,0,0,0,0,0|0,0,0]=1 569 B6R1.2 [Li]C1C=CC=C1 Amb22054138 [1,0,0,0,0,0|2,0,1]=4 570 B6R1.2 [Li]c1cccs1 Amb17939215 [1,0,0,0,0,0|1,1,0]=3 571 B6R1.2 [Mn]C=1CC=CC1 Amb22169701 [1,0,0,0,0,0|2,0,0]=3 572 B6R1.2 [NH3+]c1[nH]cc[n]1 Amb22730013 [1,0,0,0,0,0|3,0,0]=4 573 B6R1.2 [Na]C1C=CC=C1 Amb22338129 [1,0,0,0,0,0|2,0,1]=4 574 B6R1.2 [SiH3]c1[n]cc[s]1 Amb24085062 [1,0,0,0,0,0|1,2,0]=4 575 B6R1.2 [SiH3]c1ccco1 Amb24511582 [1,0,0,0,0,0|0,1,0]=2 576 B6R1.2 [Tl]C1C=CC=C1 Amb22338319 [1,0,0,0,0,0|2,0,1]=4 577 B8R1.1 BrCC1=CC(=O)OC1 Amb17935686 [0,1,0,0,0,0|3,0,0]=4 578 B8R1.1 BrCc1c[s]c(I)c1 Amb24483165 [0,1,0,0,0,0|3,0,0]=4 579 B8R1.1 Brc1[n]c(CBr)c[s]1 Amb22233677 [0,1,0,0,0,0|3,0,0]=4 580 B8R1.1 Brc1[n]c(CBr)co1 Amb24483215 [0,1,0,0,0,0|3,0,0]=4 581 B8R1.1 Brc1[n]c(CI)c[s]1 Amb24556725 [0,1,0,0,0,0|3,0,0]=4 582 B8R1.1 Brc1[n]cc(CBr)[s]1 Amb21963241 [0,1,0,0,0,0|2,1,0]=4 583 B8R1.1 Brc1[n]oc(CBr)[n]1 Amb22002580 [0,1,0,0,0,0|3,0,0]=4 584 B8R1.1 Brc1c[n]c(CBr)o1 Amb25132633 [0,1,0,0,0,0|2,0,0]=3 585 B8R1.1 Brc1c[s]c(CBr)[n]1 Amb22886695 [0,1,0,0,0,0|2,1,0]=4 586 B8R1.1 Brc1c[s]c(c1)[Mg]Br Amb22897329 [0,1,0,0,0,0|2,1,0]=4 587 B8R1.1 Brc1cc(CBr)co1 Amb22736912 [0,1,0,0,0,0|3,0,0]=4 588 B8R1.1 Brc1cc(CBr)o[n]1 Amb22233936 [0,1,0,0,0,0|2,0,0]=3 589 B8R1.1 Brc1cc(CI)[s]c1 Amb24354485 [0,1,0,0,0,0|1,1,0]=3 590 B8R1.1 Brc1cc(CI)co1 Amb25298011 [0,1,0,0,0,0|3,0,0]=4 591 B8R1.1 Brc1cc(on1)C=O Amb10602266 [0,1,0,0,0,0|1,0,2]=4 592 B8R1.1 Brc1cc(sc1)C=O Amb1806177 [0,1,0,0,0,0|0,1,2]=4 593 B8R1.1 Brc1ccc(CBr)[s]1 Amb22735998 [0,1,0,0,0,0|1,1,0]=3 594 B8R1.1 Brc1ccc(CBr)o1 Amb22498773 [0,1,0,0,0,0|1,0,0]=2 595 B8R1.1 Brc1ccc(CI)[s]1 Amb25080467 [0,1,0,0,0,0|1,1,0]=3 596 B8R1.1 Brc1ccc([Mg]Br)[s]1 Amb22897555 [0,1,0,0,0,0|2,1,0]=4 597 B8R1.1 Brc1ccc([s]1)[Zn]Br Amb22000379 [0,1,0,0,0,0|2,1,0]=4 598 B8R1.1 Brc1ccc(o1)C#N Amb1058729 [0,1,0,0,0,0|1,0,1]=3 599 B8R1.1 Brc1ccc(o1)C=O Amb1153092 [0,1,0,0,0,0|0,0,2]=3 600 B8R1.1 Brc1ccc(s1)C=C Amb17594904 [0,1,0,0,0,0|1,1,1]=4 601 B8R1.1 Brc1ccc(s1)C=O Amb1161542 [0,1,0,0,0,0|0,1,2]=4 602 B8R1.1 Brc1coc(CBr)c1 Amb25113984 [0,1,0,0,0,0|1,0,0]=2 603 B8R1.1 Brc1ncc(o1)C=O Amb10067561 [0,1,0,0,0,0|1,0,2]=4 604 B8R1.1 C#Cc1[n]cc(Br)o1 Amb25682488 [0,1,0,0,0,0|2,0,1]=4 605 B8R1.1 C#Cc1[n]cc(N)o1 Amb24527680 [0,1,0,0,0,0|2,0,1]=4 606 B8R1.1 C#Cc1cc(Br)c[s]1 Amb25063735 [0,1,0,0,0,0|1,1,1]=4 607 B8R1.1 C#Cc1cc(Br)co1 Amb24518887 [0,1,0,0,0,0|1,0,1]=3 608 B8R1.1 C#Cc1ccc(Br)o1 Amb25132971 [0,1,0,0,0,0|1,0,1]=3 609 B8R1.1 C#Cc1ccc(Cl)[s]1 Amb21964540 [0,1,0,0,0,0|1,1,1]=4 610 B8R1.1 C#Cc1ccc(F)[s]1 Amb24269206 [0,1,0,0,0,0|1,1,1]=4 611 B8R1.1 C=C1COC(CO)C1 Amb25662542 [0,1,0,0,0,0|0,0,3]=4 612 B8R1.1 C=CC1=CCC(=O)O1 Amb24695919 [0,1,0,0,0,0|1,0,2]=4 613 B8R1.1 C=CC=1BC(N)=CC1 Amb25113952 [0,1,0,0,0,0|2,0,1]=4 614 B8R1.1 C=C[C@@H]1C=CC(=O)O1 Amb25106519 [0,1,0,0,0,0|1,0,2]=4 615 B8R1.1 C=Cc1[n]cc(N)o1 Amb24518672 [0,1,0,0,0,0|2,0,1]=4 616 B8R1.1 C=Cc1cc(Br)c[s]1 Amb25742529 [0,1,0,0,0,0|1,1,1]=4 617 B8R1.1 C=Cc1ccc(Br)o1 Amb25264206 [0,1,0,0,0,0|1,0,1]=3 618 B8R1.1 C=Cc1ccc(Cl)o1 Amb25684642 [0,1,0,0,0,0|1,0,1]=3 619 B8R1.1 C=Cc1ccc(N)[nH]1 Amb24610963 [0,1,0,0,0,0|2,0,1]=4 620 B8R1.1 C=Cc1ccc(N)[s]1 Amb25312448 [0,1,0,0,0,0|1,1,1]=4 621 B8R1.1 CC1=CCC(CO)O1 Amb24386881 [0,1,0,0,0,0|0,0,2]=3 622 B8R1.1 CC1C=C(CO)CO1 Amb25346209 [0,1,0,0,0,0|2,0,1]=4 623 B8R1.1 CC1C=CC(CO)O1 Amb25700454 [0,1,0,0,0,0|0,0,2]=3 624 B8R1.1 CC1C=CC(CO)S1 Amb25306440 [0,1,0,0,0,0|0,1,2]=4 625 B8R1.1 CC1CCC(CO)=C1 Amb24733187 [0,1,0,0,0,0|1,0,2]=4 626 B8R1.1 CC=1CC(=CC1)C#N Amb22229825 [0,1,0,0,0,0|2,0,1]=4 627 B8R1.1 CC=1CC(C=O)=CC1 Amb22229827 [0,1,0,0,0,0|1,0,2]=4 628 B8R1.1 CC=1CC=C(CC)C1 Amb22229283 [0,1,0,0,0,0|2,0,1]=4 629 B8R1.1 CC=1C[C@H](CO)CC1 Amb24481425 [0,1,0,0,0,0|1,0,2]=4 630 B8R1.1 CCC1=CNC(=N)S1 Amb19303419 [0,1,0,0,0,0|2,1,0]=4 631 B8R1.1 CCC1=CNC(=O)N1 Amb20669270 [0,1,0,0,0,0|3,0,0]=4 632 B8R1.1 CCC1=COC(=O)N1 Amb25276478 [0,1,0,0,0,0|3,0,0]=4 633 B8R1.1 CCC1=NCC(=O)O1 Amb25238829 [0,1,0,0,0,0|2,0,1]=4 634 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,1,0,0,0,0|1,0,1]=3 635 B8R1.1 CCC1C=CC(=O)S1 Amb24638103 [0,1,0,0,0,0|1,1,1]=4 636 B8R1.1 CCC1CC(=O)C=C1 Amb25713811 [0,1,0,0,0,0|2,0,1]=4 637 B8R1.1 CCC=1CC(=O)OC1 Amb24759211 [0,1,0,0,0,0|3,0,0]=4 638 B8R1.1 CCC=1COC(=O)C1 Amb24686984 [0,1,0,0,0,0|3,0,0]=4 639 B8R1.1 CC[n]1cc(Br)cc1 Amb24317676 [0,1,0,0,0,0|3,0,0]=4 640 B8R1.1 CC[n]1cc(C)c[n]1 Amb23597149 [0,1,0,0,0,0|3,0,0]=4 641 B8R1.1 CC[n]1cc(C)cc1 Amb24628187 [0,1,0,0,0,0|3,0,0]=4 642 B8R1.1 CC[n]1cc(N)c[n]1 Amb22587161 [0,1,0,0,0,0|3,0,0]=4 643 B8R1.1 CC[n]1cc(N)cc1 Amb24317669 [0,1,0,0,0,0|3,0,0]=4 644 B8R1.1 CC[n]1cc(S)c[n]1 Amb23447156 [0,1,0,0,0,0|3,0,0]=4 645 B8R1.1 CC[n]1ccc(I)[n]1 Amb19929455 [0,1,0,0,0,0|3,0,0]=4 646 B8R1.1 CC[n]1ccc(O)[n]1 Amb25332241 [0,1,0,0,0,0|3,0,0]=4 647 B8R1.1 CCc1[nH]cc(N)[n]1 Amb24317700 [0,1,0,0,0,0|3,0,0]=4 648 B8R1.1 CCc1[nH]cc(O)[n]1 Amb25162786 [0,1,0,0,0,0|3,0,0]=4 649 B8R1.1 CCc1[n][n]c(Br)o1 Amb18564049 [0,1,0,0,0,0|3,0,0]=4 650 B8R1.1 CCc1[n][n]c(Cl)o1 Amb18063247 [0,1,0,0,0,0|3,0,0]=4 651 B8R1.1 CCc1[n][n]c(I)o1 Amb25851146 [0,1,0,0,0,0|3,0,0]=4 652 B8R1.1 CCc1[n]c(Cl)c[s]1 Amb25807436 [0,1,0,0,0,0|2,1,0]=4 653 B8R1.1 CCc1[n]c(N)[n]o1 Amb18833074 [0,1,0,0,0,0|3,0,0]=4 654 B8R1.1 CCc1[n]cc(Br)[s]1 Amb22587370 [0,1,0,0,0,0|2,1,0]=4 655 B8R1.1 CCc1[n]cc(Br)o1 Amb25709768 [0,1,0,0,0,0|2,0,0]=3 656 B8R1.1 CCc1[n]cc(Cl)[s]1 Amb25308325 [0,1,0,0,0,0|2,1,0]=4 657 B8R1.1 CCc1[n]cc(N)o1 Amb18559669 [0,1,0,0,0,0|2,0,0]=3 658 B8R1.1 CCc1c[nH]c(C)c1 Amb17672337 [0,1,0,0,0,0|3,0,0]=4 659 B8R1.1 CCc1c[nH]c(Cl)[n]1 Amb25808916 [0,1,0,0,0,0|3,0,0]=4 660 B8R1.1 CCc1c[nH]c(N)[n]1 Amb22755915 [0,1,0,0,0,0|3,0,0]=4 661 B8R1.1 CCc1c[nH]c(S)[n]1 Amb20669267 [0,1,0,0,0,0|3,0,0]=4 662 B8R1.1 CCc1c[n](C)c[n]1 Amb25749227 [0,1,0,0,0,0|3,0,0]=4 663 B8R1.1 CCc1c[n](C)cc1 Amb24511523 [0,1,0,0,0,0|3,0,0]=4 664 B8R1.1 CCc1c[n](N)cc1 Amb24565365 [0,1,0,0,0,0|3,0,0]=4 665 B8R1.1 CCc1c[n]c(Br)o1 Amb25830436 [0,1,0,0,0,0|2,0,0]=3 666 B8R1.1 CCc1c[n]c(I)[s]1 Amb25841619 [0,1,0,0,0,0|2,1,0]=4 667 B8R1.1 CCc1c[n]c(I)o1 Amb24543344 [0,1,0,0,0,0|2,0,0]=3 668 B8R1.1 CCc1c[n]c(N)[s]1 Amb19892881 [0,1,0,0,0,0|2,1,0]=4 669 B8R1.1 CCc1c[n]c(N)o1 Amb18947812 [0,1,0,0,0,0|2,0,0]=3 670 B8R1.1 CCc1c[n]c(S)[s]1 Amb24463342 [0,1,0,0,0,0|2,1,0]=4 671 B8R1.1 CCc1c[n]c(S)o1 Amb24483103 [0,1,0,0,0,0|2,0,0]=3 672 B8R1.1 CCc1c[s]c(Cl)[n]1 Amb19314652 [0,1,0,0,0,0|3,0,0]=4 673 B8R1.1 CCc1c[s]c(I)[n]1 Amb25360657 [0,1,0,0,0,0|3,0,0]=4 674 B8R1.1 CCc1c[s]c(N)[n]1 Amb19373233 [0,1,0,0,0,0|3,0,0]=4 675 B8R1.1 CCc1c[s]c(N)[n]1 Amb22587237 [0,1,0,0,0,0|3,0,0]=4 676 B8R1.1 CCc1c[s]c(O)c1 Amb20617197 [0,1,0,0,0,0|3,0,0]=4 677 B8R1.1 CCc1c[s]c(S)[n]1 Amb20179414 [0,1,0,0,0,0|3,0,0]=4 678 B8R1.1 CCc1cc(Br)[n]o1 Amb24417269 [0,1,0,0,0,0|2,0,0]=3 679 B8R1.1 CCc1cc(Br)c[s]1 Amb20619491 [0,1,0,0,0,0|1,1,0]=3 680 B8R1.1 CCc1cc(Br)o[n]1 Amb25790044 [0,1,0,0,0,0|3,0,0]=4 681 B8R1.1 CCc1cc(C)c[nH]1 Amb17672338 [0,1,0,0,0,0|2,0,0]=3 682 B8R1.1 CCc1cc(Cl)[n]o1 Amb24483200 [0,1,0,0,0,0|2,0,0]=3 683 B8R1.1 CCc1cc(Cl)c[s]1 Amb25120850 [0,1,0,0,0,0|1,1,0]=3 684 B8R1.1 CCc1cc(N)[s][n]1 Amb18202941 [0,1,0,0,0,0|3,0,0]=4 685 B8R1.1 CCc1cc(N)c[nH]1 Amb18676431 [0,1,0,0,0,0|2,0,0]=3 686 B8R1.1 CCc1cc(N)c[s]1 Amb18143965 [0,1,0,0,0,0|1,1,0]=3 687 B8R1.1 CCc1cc(O)[n]o1 Amb22754624 [0,1,0,0,0,0|2,0,0]=3 688 B8R1.1 CCc1cc(O)o[n]1 Amb24481108 [0,1,0,0,0,0|3,0,0]=4 689 B8R1.1 CCc1cc([nH]n1)N Amb10066906 [0,1,0,0,0,0|3,0,0]=4 690 B8R1.1 CCc1cc([nH]n1)O Amb1042478 [0,1,0,0,0,0|3,0,0]=4 691 B8R1.1 CCc1cc(no1)N Amb10552510 [0,1,0,0,0,0|2,0,0]=3 692 B8R1.1 CCc1cc[n](C)[n]1 Amb19651438 [0,1,0,0,0,0|3,0,0]=4 693 B8R1.1 CCc1ccc(C)[nH]1 Amb17672339 [0,1,0,0,0,0|2,0,0]=3 694 B8R1.1 CCc1ccc(Cl)[s]1 Amb25811685 [0,1,0,0,0,0|1,1,0]=3 695 B8R1.1 CCc1ccc(I)[s]1 Amb24332471 [0,1,0,0,0,0|1,1,0]=3 696 B8R1.1 CCc1ccc(N)[nH]1 Amb18676453 [0,1,0,0,0,0|2,0,0]=3 697 B8R1.1 CCc1ccc(O)[s]1 Amb20617898 [0,1,0,0,0,0|1,1,0]=3 698 B8R1.1 CCc1ccc(S)s1 Amb17939214 [0,1,0,0,0,0|1,1,0]=3 699 B8R1.1 CCc1ccc(o1)Br Amb10600653 [0,1,0,0,0,0|1,0,0]=2 700 B8R1.1 CCc1ccc(o1)N Amb10600654 [0,1,0,0,0,0|1,0,0]=2 701 B8R1.1 CCc1ccc(s1)Br Amb10600651 [0,1,0,0,0,0|1,1,0]=3 702 B8R1.1 CCc1ccc(s1)C Amb15691670 [0,1,0,0,0,0|1,1,0]=3 703 B8R1.1 CCc1ccc(s1)N Amb10600652 [0,1,0,0,0,0|1,1,0]=3 704 B8R1.1 CCc1cnc(s1)Br Amb10600915 [0,1,0,0,0,0|2,1,0]=4 705 B8R1.1 CCc1cnc(s1)Cl Amb13884346 [0,1,0,0,0,0|2,1,0]=4 706 B8R1.1 CCc1cnc(s1)O Amb13884345 [0,1,0,0,0,0|2,1,0]=4 707 B8R1.1 CCc1coc(N)[n]1 Amb18946528 [0,1,0,0,0,0|3,0,0]=4 708 B8R1.1 CCc1coc(c1)Br Amb10600657 [0,1,0,0,0,0|3,0,0]=4 709 B8R1.1 CCc1coc(c1)N Amb10600658 [0,1,0,0,0,0|3,0,0]=4 710 B8R1.1 CCc1csc(c1)Br Amb10600655 [0,1,0,0,0,0|3,0,0]=4 711 B8R1.1 CCc1csc(c1)N Amb10600656 [0,1,0,0,0,0|3,0,0]=4 712 B8R1.1 CCc1csc(n1)Br Amb10600916 [0,1,0,0,0,0|3,0,0]=4 713 B8R1.1 CCc1csc(n1)N Amb13884087 [0,1,0,0,0,0|3,0,0]=4 714 B8R1.1 CCc1nc(cs1)Br Amb10599930 [0,1,0,0,0,0|2,1,0]=4 715 B8R1.1 CCc1nc(cs1)N Amb10599932 [0,1,0,0,0,0|2,1,0]=4 716 B8R1.1 CCc1nc(cs1)O Amb10599933 [0,1,0,0,0,0|2,1,0]=4 717 B8R1.1 CCc1nc(no1)Br Amb15701617 [0,1,0,0,0,0|3,0,0]=4 718 B8R1.1 CCc1nc(no1)Cl Amb15701619 [0,1,0,0,0,0|3,0,0]=4 719 B8R1.1 CCc1ncc([nH]1)Cl Amb16230995 [0,1,0,0,0,0|3,0,0]=4 720 B8R1.1 CCc1ncc(s1)Br Amb10600222 [0,1,0,0,0,0|2,1,0]=4 721 B8R1.1 CCc1ncc(s1)N Amb10600224 [0,1,0,0,0,0|2,1,0]=4 722 B8R1.1 CCc1ncc(s1)O Amb10600225 [0,1,0,0,0,0|2,1,0]=4 723 B8R1.1 CCc1nnc(o1)N Amb1107974 [0,1,0,0,0,0|3,0,0]=4 724 B8R1.1 CCc1nnc(o1)O Amb15701524 [0,1,0,0,0,0|3,0,0]=4 725 B8R1.1 CCn1cc(cn1)I Amb16230353 [0,1,0,0,0,0|3,0,0]=4 726 B8R1.1 CCn1cc(cn1)O Amb1945379 [0,1,0,0,0,0|3,0,0]=4 727 B8R1.1 CCn1ccc(n1)Br Amb16230988 [0,1,0,0,0,0|3,0,0]=4 728 B8R1.1 CCn1ccc(n1)C Amb1953494 [0,1,0,0,0,0|3,0,0]=4 729 B8R1.1 CCn1ccc(n1)N Amb2178417 [0,1,0,0,0,0|3,0,0]=4 730 B8R1.1 CNc1cc(Br)[n]o1 Amb25245070 [0,1,0,0,0,0|3,0,0]=4 731 B8R1.1 CNc1cc(Br)c[s]1 Amb18565046 [0,1,0,0,0,0|2,1,0]=4 732 B8R1.1 CNc1ccc(Br)[s]1 Amb18055073 [0,1,0,0,0,0|2,1,0]=4 733 B8R1.1 CNc1ccc(Cl)[s]1 Amb18055066 [0,1,0,0,0,0|2,1,0]=4 734 B8R1.1 COC1=CC(=O)CO1 Amb25831195 [0,1,0,0,0,0|2,0,1]=4 735 B8R1.1 COC1=CCC(=O)O1 Amb24695758 [0,1,0,0,0,0|2,0,1]=4 736 B8R1.1 COC1C=CC(=O)O1 Amb22490509 [0,1,0,0,0,0|2,0,1]=4 737 B8R1.1 CO[C@@H]1C=CC(=O)O1 Amb25144040 [0,1,0,0,0,0|2,0,1]=4 738 B8R1.1 COc1cc(Br)c[s]1 Amb25827956 [0,1,0,0,0,0|2,1,0]=4 739 B8R1.1 COc1cc(Br)co1 Amb25204360 [0,1,0,0,0,0|2,0,0]=3 740 B8R1.1 COc1cc(I)c[s]1 Amb25663329 [0,1,0,0,0,0|2,1,0]=4 741 B8R1.1 COc1cc(no1)N Amb10602950 [0,1,0,0,0,0|3,0,0]=4 742 B8R1.1 COc1ccc(Br)[nH]1 Amb18191033 [0,1,0,0,0,0|3,0,0]=4 743 B8R1.1 COc1ccc(Br)[s]1 Amb18190248 [0,1,0,0,0,0|2,1,0]=4 744 B8R1.1 COc1ccc(F)o1 Amb25783067 [0,1,0,0,0,0|2,0,0]=3 745 B8R1.1 COc1ccc(I)o1 Amb25304106 [0,1,0,0,0,0|2,0,0]=3 746 B8R1.1 COc1ccc(N)[s]1 Amb18202776 [0,1,0,0,0,0|2,1,0]=4 747 B8R1.1 COc1ccc(N)o1 Amb18203371 [0,1,0,0,0,0|2,0,0]=3 748 B8R1.1 CSc1[n]c(Br)co1 Amb25662577 [0,1,0,0,0,0|3,0,0]=4 749 B8R1.1 CSc1cc(Br)c[s]1 Amb25844408 [0,1,0,0,0,0|2,1,0]=4 750 B8R1.1 CSc1cc(Br)co1 Amb24728302 [0,1,0,0,0,0|2,0,0]=3 751 B8R1.1 CSc1cc(N)c[s]1 Amb25180115 [0,1,0,0,0,0|2,1,0]=4 752 B8R1.1 CSc1ccc(C)s1 Amb17672797 [0,1,0,0,0,0|2,1,0]=4 753 B8R1.1 CSc1ccc(I)[s]1 Amb24616101 [0,1,0,0,0,0|2,1,0]=4 754 B8R1.1 CSc1ccc(N)[nH]1 Amb18203243 [0,1,0,0,0,0|3,0,0]=4 755 B8R1.1 CSc1ccc(o1)C Amb10070287 [0,1,0,0,0,0|2,0,0]=3 756 B8R1.1 C[C@@H]1C=C[C@@H](CO)O1 Amb24582826 [0,1,0,0,0,0|0,0,2]=3 757 B8R1.1 C[n]1[n]cc(CO)[n]1 Amb23541044 [0,1,0,0,0,0|3,0,0]=4 758 B8R1.1 C[n]1c[n]c(CBr)c1 Amb23412322 [0,1,0,0,0,0|3,0,0]=4 759 B8R1.1 C[n]1c[n]c(CCl)c1 Amb22491527 [0,1,0,0,0,0|3,0,0]=4 760 B8R1.1 C[n]1c[n]c(CN)c1 Amb19515964 [0,1,0,0,0,0|3,0,0]=4 761 B8R1.1 C[n]1c[n]c(CN)c1 Amb24183553 [0,1,0,0,0,0|3,0,0]=4 762 B8R1.1 C[n]1c[n]c(CO)c1 Amb22001751 [0,1,0,0,0,0|2,0,0]=3 763 B8R1.1 C[n]1c[n]c(CS)c1 Amb24416571 [0,1,0,0,0,0|2,1,0]=4 764 B8R1.1 C[n]1cc(CCl)cc1 Amb18860985 [0,1,0,0,0,0|3,0,0]=4 765 B8R1.1 C[n]1cc(CN)cc1 Amb18062067 [0,1,0,0,0,0|3,0,0]=4 766 B8R1.1 C[n]1cc(CO)cc1 Amb18221599 [0,1,0,0,0,0|2,0,0]=3 767 B8R1.1 C[n]1ccc(CBr)[n]1 Amb21963342 [0,1,0,0,0,0|3,0,0]=4 768 B8R1.1 C[n]1ccc(CCl)[n]1 Amb19895007 [0,1,0,0,0,0|3,0,0]=4 769 B8R1.1 C[n]1ccc(CCl)[n]1 Amb21927825 [0,1,0,0,0,0|3,0,0]=4 770 B8R1.1 C[n]1ccc(CI)[n]1 Amb25060865 [0,1,0,0,0,0|3,0,0]=4 771 B8R1.1 C[n]1ccc(CN)[n]1 Amb22491210 [0,1,0,0,0,0|3,0,0]=4 772 B8R1.1 C\C=C\1/C=CC(=O)O1 Amb24558315 [0,1,0,0,0,0|1,0,1]=3 773 B8R1.1 C\N=C\1/C=CC(=O)O1 Amb24707968 [0,1,0,0,0,0|2,0,0]=3 774 B8R1.1 Cc1[nH+]c(CCl)c[s]1 Amb24113844 [0,1,0,0,0,0|3,0,0]=4 775 B8R1.1 Cc1[nH]c(CCl)c[n]1 Amb24053086 [0,1,0,0,0,0|3,0,0]=4 776 B8R1.1 Cc1[nH]cc(CBr)[n]1 Amb25134978 [0,1,0,0,0,0|3,0,0]=4 777 B8R1.1 Cc1[nH]cc(CC)[n]1 Amb20621592 [0,1,0,0,0,0|3,0,0]=4 778 B8R1.1 Cc1[n][n]c(CN)o1 Amb22898772 [0,1,0,0,0,0|3,0,0]=4 779 B8R1.1 Cc1[n][n]c(CO)[s]1 Amb23481003 [0,1,0,0,0,0|2,1,0]=4 780 B8R1.1 Cc1[n][n]c(CS)o1 Amb24721866 [0,1,0,0,0,0|2,1,0]=4 781 B8R1.1 Cc1[n]c(CBr)c[s]1 Amb22002132 [0,1,0,0,0,0|3,0,0]=4 782 B8R1.1 Cc1[n]c(CBr)c[s]1 Amb24183793 [0,1,0,0,0,0|3,0,0]=4 783 B8R1.1 Cc1[n]c(CBr)o[n]1 Amb23450282 [0,1,0,0,0,0|3,0,0]=4 784 B8R1.1 Cc1[n]c(CC)c[s]1 Amb24459593 [0,1,0,0,0,0|3,0,0]=4 785 B8R1.1 Cc1[n]c(CI)co1 Amb24718310 [0,1,0,0,0,0|3,0,0]=4 786 B8R1.1 Cc1[n]c(CN)c[s]1 Amb22264762 [0,1,0,0,0,0|3,0,0]=4 787 B8R1.1 Cc1[n]c(CO)[nH][n]1 Amb19516916 [0,1,0,0,0,0|3,0,0]=4 788 B8R1.1 Cc1[n]c(CO)[nH][n]1 Amb22587427 [0,1,0,0,0,0|3,0,0]=4 789 B8R1.1 Cc1[n]c(CO)[s][n]1 Amb25744080 [0,1,0,0,0,0|2,1,0]=4 790 B8R1.1 Cc1[n]cc(C#N)o1 Amb23437345 [0,1,0,0,0,0|2,0,1]=4 791 B8R1.1 Cc1[n]cc(CBr)[s]1 Amb18917874 [0,1,0,0,0,0|2,1,0]=4 792 B8R1.1 Cc1[n]cc(CBr)[s]1 Amb23400747 [0,1,0,0,0,0|2,1,0]=4 793 B8R1.1 Cc1[n]cc(CC)[s]1 Amb24081495 [0,1,0,0,0,0|2,1,0]=4 794 B8R1.1 Cc1[n]cc(CCl)[s]1 Amb23401945 [0,1,0,0,0,0|2,1,0]=4 795 B8R1.1 Cc1[n]cc(CCl)o1 Amb23437341 [0,1,0,0,0,0|2,0,0]=3 796 B8R1.1 Cc1[n]cc(CN)[s]1 Amb22752801 [0,1,0,0,0,0|2,1,0]=4 797 B8R1.1 Cc1[n]cc(CN)o1 Amb23437344 [0,1,0,0,0,0|2,0,0]=3 798 B8R1.1 Cc1[n]cc(o1)SC Amb24742037 [0,1,0,0,0,0|3,0,0]=4 799 B8R1.1 Cc1c[nH]c(CN)[n]1 Amb22388576 [0,1,0,0,0,0|3,0,0]=4 800 B8R1.1 Cc1c[nH]c(CO)[n]1 Amb19649044 [0,1,0,0,0,0|2,0,0]=3 801 B8R1.1 Cc1c[nH]c(CS)[n]1 Amb24426635 [0,1,0,0,0,0|2,1,0]=4 802 B8R1.1 Cc1c[n][n](CCl)c1 Amb24268828 [0,1,0,0,0,0|3,0,0]=4 803 B8R1.1 Cc1c[n]c(C#N)o1 Amb25080137 [0,1,0,0,0,0|2,0,1]=4 804 B8R1.1 Cc1c[n]c(CC)o1 Amb25312627 [0,1,0,0,0,0|2,0,0]=3 805 B8R1.1 Cc1c[n]c(CCl)[nH]1 Amb24649701 [0,1,0,0,0,0|3,0,0]=4 806 B8R1.1 Cc1c[n]c(CCl)[s]1 Amb21959906 [0,1,0,0,0,0|2,1,0]=4 807 B8R1.1 Cc1c[n]c(CCl)o1 Amb19375353 [0,1,0,0,0,0|2,0,0]=3 808 B8R1.1 Cc1c[n]c(CN)[s]1 Amb21959892 [0,1,0,0,0,0|2,1,0]=4 809 B8R1.1 Cc1c[n]c(CO)o1 Amb22039458 [0,1,0,0,0,0|1,0,0]=2 810 B8R1.1 Cc1c[n]c(NC)o1 Amb24689223 [0,1,0,0,0,0|3,0,0]=4 811 B8R1.1 Cc1c[s]c(CBr)[n]1 Amb23571389 [0,1,0,0,0,0|2,1,0]=4 812 B8R1.1 Cc1c[s]c(CC)c1 Amb25270747 [0,1,0,0,0,0|1,1,0]=3 813 B8R1.1 Cc1c[s]c(CI)[n]1 Amb25800621 [0,1,0,0,0,0|2,1,0]=4 814 B8R1.1 Cc1c[s]c(CN)[n]1 Amb22899001 [0,1,0,0,0,0|2,1,0]=4 815 B8R1.1 Cc1c[s]c(CO)[n]1 Amb21959671 [0,1,0,0,0,0|1,1,0]=3 816 B8R1.1 Cc1cc(C#C)o[n]1 Amb25772961 [0,1,0,0,0,0|2,0,1]=4 817 B8R1.1 Cc1cc(C=O)oc1 Amb18124164 [0,1,0,0,0,0|0,0,2]=3 818 B8R1.1 Cc1cc(CBr)[n][s]1 Amb25124375 [0,1,0,0,0,0|3,0,0]=4 819 B8R1.1 Cc1cc(CBr)[s]c1 Amb25363165 [0,1,0,0,0,0|1,1,0]=3 820 B8R1.1 Cc1cc(CBr)co1 Amb25173604 [0,1,0,0,0,0|3,0,0]=4 821 B8R1.1 Cc1cc(CC)[n][nH]1 Amb22893503 [0,1,0,0,0,0|3,0,0]=4 822 B8R1.1 Cc1cc(CC)[n]o1 Amb23590095 [0,1,0,0,0,0|3,0,0]=4 823 B8R1.1 Cc1cc(CC)co1 Amb24637259 [0,1,0,0,0,0|3,0,0]=4 824 B8R1.1 Cc1cc(CC)o[n]1 Amb24524276 [0,1,0,0,0,0|2,0,0]=3 825 B8R1.1 Cc1cc(CCl)[nH][n]1 Amb22547737 [0,1,0,0,0,0|3,0,0]=4 826 B8R1.1 Cc1cc(CCl)[s][n]1 Amb25104938 [0,1,0,0,0,0|2,1,0]=4 827 B8R1.1 Cc1cc(CI)[n]o1 Amb24729100 [0,1,0,0,0,0|3,0,0]=4 828 B8R1.1 Cc1cc(CN)[nH][n]1 Amb22586655 [0,1,0,0,0,0|3,0,0]=4 829 B8R1.1 Cc1cc(CN)[n]o1 Amb22586666 [0,1,0,0,0,0|3,0,0]=4 830 B8R1.1 Cc1cc(CN)[s][n]1 Amb18138196 [0,1,0,0,0,0|2,1,0]=4 831 B8R1.1 Cc1cc(CN)[s]c1 Amb22496138 [0,1,0,0,0,0|1,1,0]=3 832 B8R1.1 Cc1cc(CN)c[s]1 Amb18202501 [0,1,0,0,0,0|3,0,0]=4 833 B8R1.1 Cc1cc(CN)o[n]1 Amb22284238 [0,1,0,0,0,0|2,0,0]=3 834 B8R1.1 Cc1cc(CO)[n][s]1 Amb24456114 [0,1,0,0,0,0|2,0,0]=3 835 B8R1.1 Cc1cc(CO)co1 Amb22170482 [0,1,0,0,0,0|2,0,0]=3 836 B8R1.1 Cc1cc(CO)o[n]1 Amb24094149 [0,1,0,0,0,0|1,0,0]=2 837 B8R1.1 Cc1cc(CO)oc1 Amb24066149 [0,1,0,0,0,0|0,0,0]=1 838 B8R1.1 Cc1cc(NN)o[n]1 Amb25127850 [0,1,0,0,0,0|3,0,0]=4 839 B8R1.1 Cc1cc([nH]c1)CO Amb10069985 [0,1,0,0,0,0|1,0,0]=2 840 B8R1.1 Cc1cc([nH]n1)CCl Amb16249371 [0,1,0,0,0,0|3,0,0]=4 841 B8R1.1 Cc1cc(n[nH]1)CN Amb17064180 [0,1,0,0,0,0|3,0,0]=4 842 B8R1.1 Cc1cc(n[nH]1)CO Amb2389411 [0,1,0,0,0,0|2,0,0]=3 843 B8R1.1 Cc1cc(no1)CCl Amb1154147 [0,1,0,0,0,0|3,0,0]=4 844 B8R1.1 Cc1cc(no1)CN Amb2154782 [0,1,0,0,0,0|3,0,0]=4 845 B8R1.1 Cc1cc(on1)C#N Amb15701525 [0,1,0,0,0,0|2,0,1]=4 846 B8R1.1 Cc1cc(on1)CN Amb10610510 [0,1,0,0,0,0|2,0,0]=3 847 B8R1.1 Cc1cc(on1)CN Amb1911547 [0,1,0,0,0,0|2,0,0]=3 848 B8R1.1 Cc1cc(sc1)C=O Amb2447336 [0,1,0,0,0,0|0,1,2]=4 849 B8R1.1 Cc1cc[n](CCl)[n]1 Amb21811926 [0,1,0,0,0,0|3,0,0]=4 850 B8R1.1 Cc1ccc(C=C)[nH]1 Amb25090830 [0,1,0,0,0,0|2,0,1]=4 851 B8R1.1 Cc1ccc(C=C)o1 Amb22126655 [0,1,0,0,0,0|1,0,1]=3 852 B8R1.1 Cc1ccc(CBr)[nH]1 Amb24502253 [0,1,0,0,0,0|2,0,0]=3 853 B8R1.1 Cc1ccc(CBr)[s]1 Amb18325317 [0,1,0,0,0,0|1,1,0]=3 854 B8R1.1 Cc1ccc(CC)o1 Amb22235241 [0,1,0,0,0,0|1,0,0]=2 855 B8R1.1 Cc1ccc(CCl)[nH]1 Amb25315059 [0,1,0,0,0,0|2,0,0]=3 856 B8R1.1 Cc1ccc(CI)o1 Amb25853805 [0,1,0,0,0,0|1,0,0]=2 857 B8R1.1 Cc1ccc(CN)[nH]1 Amb23148016 [0,1,0,0,0,0|2,0,0]=3 858 B8R1.1 Cc1ccc(CO)[nH]1 Amb23149153 [0,1,0,0,0,0|1,0,0]=2 859 B8R1.1 Cc1ccc(NC)[s]1 Amb24715157 [0,1,0,0,0,0|2,1,0]=4 860 B8R1.1 Cc1ccc(NN)[nH]1 Amb24122408 [0,1,0,0,0,0|3,0,0]=4 861 B8R1.1 Cc1ccc(NN)[s]1 Amb22504634 [0,1,0,0,0,0|2,1,0]=4 862 B8R1.1 Cc1ccc(OC)[s]1 Amb25108498 [0,1,0,0,0,0|2,1,0]=4 863 B8R1.1 Cc1ccc([nH]1)C#N Amb17622030 [0,1,0,0,0,0|2,0,1]=4 864 B8R1.1 Cc1ccc([nH]1)OC Amb24122404 [0,1,0,0,0,0|3,0,0]=4 865 B8R1.1 Cc1ccc([s]1)[Zn]Br Amb22000502 [0,1,0,0,0,0|2,1,0]=4 866 B8R1.1 Cc1ccc(o1)C#N Amb1152445 [0,1,0,0,0,0|1,0,1]=3 867 B8R1.1 Cc1ccc(o1)C=O Amb1151338 [0,1,0,0,0,0|0,0,2]=3 868 B8R1.1 Cc1ccc(o1)CBr Amb16234119 [0,1,0,0,0,0|1,0,0]=2 869 B8R1.1 Cc1ccc(o1)CN Amb1124819 [0,1,0,0,0,0|1,0,0]=2 870 B8R1.1 Cc1ccc(o1)CO Amb1856157 [0,1,0,0,0,0|0,0,0]=1 871 B8R1.1 Cc1ccc(s1)C=O Amb2447398 [0,1,0,0,0,0|0,1,2]=4 872 B8R1.1 Cc1cnc(s1)CCl Amb16187170 [0,1,0,0,0,0|2,1,0]=4 873 B8R1.1 Cc1coc(C#C)[n]1 Amb25270459 [0,1,0,0,0,0|2,0,1]=4 874 B8R1.1 Cc1coc(C#N)[n]1 Amb24596197 [0,1,0,0,0,0|2,0,1]=4 875 B8R1.1 Cc1coc(CC)c1 Amb24451308 [0,1,0,0,0,0|1,0,0]=2 876 B8R1.1 Cc1coc(CN)[n]1 Amb18221697 [0,1,0,0,0,0|2,0,0]=3 877 B8R1.1 Cc1coc(CN)[n]1 Amb22886200 [0,1,0,0,0,0|2,0,0]=3 878 B8R1.1 Cc1coc(CO)[n]1 Amb24718309 [0,1,0,0,0,0|1,0,0]=2 879 B8R1.1 Cc1coc(NC)[n]1 Amb24401063 [0,1,0,0,0,0|3,0,0]=4 880 B8R1.1 Cc1coc(NN)[n]1 Amb18641723 [0,1,0,0,0,0|3,0,0]=4 881 B8R1.1 Cc1coc([n]1)SC Amb24734394 [0,1,0,0,0,0|3,0,0]=4 882 B8R1.1 Cc1csc(n1)CCl Amb10607778 [0,1,0,0,0,0|2,1,0]=4 883 B8R1.1 Cc1nc(co1)CBr Amb10071199 [0,1,0,0,0,0|3,0,0]=4 884 B8R1.1 Cc1nc(co1)CCl Amb15701383 [0,1,0,0,0,0|3,0,0]=4 885 B8R1.1 Cc1nc(co1)CN Amb10071201 [0,1,0,0,0,0|3,0,0]=4 886 B8R1.1 Cc1nc(co1)CO Amb10071198 [0,1,0,0,0,0|2,0,0]=3 887 B8R1.1 Cc1nc(cs1)CCl Amb1152226 [0,1,0,0,0,0|3,0,0]=4 888 B8R1.1 Cc1nc(cs1)CCl Amb2455685 [0,1,0,0,0,0|3,0,0]=4 889 B8R1.1 Cc1nc(cs1)CO Amb1106426 [0,1,0,0,0,0|2,0,0]=3 890 B8R1.1 Cc1nc(cs1)CS Amb17108588 [0,1,0,0,0,0|2,1,0]=4 891 B8R1.1 Cc1nc(on1)CCl Amb1093255 [0,1,0,0,0,0|3,0,0]=4 892 B8R1.1 Cc1nc(on1)CN Amb10609559 [0,1,0,0,0,0|3,0,0]=4 893 B8R1.1 Cc1ncc(o1)CBr Amb10071205 [0,1,0,0,0,0|2,0,0]=3 894 B8R1.1 Cc1ncc(o1)CN Amb10071207 [0,1,0,0,0,0|2,0,0]=3 895 B8R1.1 Cc1ncc(o1)CO Amb10071203 [0,1,0,0,0,0|1,0,0]=2 896 B8R1.1 Cc1ncc(s1)CCl Amb10609724 [0,1,0,0,0,0|2,1,0]=4 897 B8R1.1 Cc1ncc(s1)CO Amb10609700 [0,1,0,0,0,0|1,1,0]=3 898 B8R1.1 Cc1nnc(o1)CCl Amb1090444 [0,1,0,0,0,0|3,0,0]=4 899 B8R1.1 Cc1nnc(o1)CN Amb10192566 [0,1,0,0,0,0|3,0,0]=4 900 B8R1.1 Cc1nnc(o1)CN Amb1102627 [0,1,0,0,0,0|3,0,0]=4 901 B8R1.1 ClC=1C=C\C(\C1)=C\Cl Amb24523705 [0,1,0,0,0,0|2,0,1]=4 902 B8R1.1 ClC[n]1ccc(Br)[n]1 Amb24753387 [0,1,0,0,0,0|3,0,0]=4 903 B8R1.1 ClCc1[n]c(Br)[n]o1 Amb23558158 [0,1,0,0,0,0|3,0,0]=4 904 B8R1.1 ClCc1[n]c(Br)c[s]1 Amb24583736 [0,1,0,0,0,0|2,1,0]=4 905 B8R1.1 ClCc1[n]c(Br)co1 Amb25125913 [0,1,0,0,0,0|2,0,0]=3 906 B8R1.1 ClCc1[n]cc(Br)[s]1 Amb22235032 [0,1,0,0,0,0|2,1,0]=4 907 B8R1.1 ClCc1[n]cc(I)[s]1 Amb24682625 [0,1,0,0,0,0|2,1,0]=4 908 B8R1.1 ClCc1c[s]c(I)[n]1 Amb25224091 [0,1,0,0,0,0|3,0,0]=4 909 B8R1.1 ClCc1cc(no1)Br Amb2455697 [0,1,0,0,0,0|2,0,0]=3 910 B8R1.1 ClCc1ccc(s1)Cl Amb1105441 [0,1,0,0,0,0|1,1,0]=3 911 B8R1.1 ClCc1cnc(s1)Cl Amb2455673 [0,1,0,0,0,0|2,1,0]=4 912 B8R1.1 ClCc1coc(Br)[n]1 Amb25249762 [0,1,0,0,0,0|3,0,0]=4 913 B8R1.1 ClCc1coc(Br)c1 Amb24661874 [0,1,0,0,0,0|3,0,0]=4 914 B8R1.1 ClCc1csc(c1)Br Amb10609258 [0,1,0,0,0,0|3,0,0]=4 915 B8R1.1 ClCc1csc(c1)C Amb17093913 [0,1,0,0,0,0|3,0,0]=4 916 B8R1.1 ClCc1csc(n1)Br Amb2455941 [0,1,0,0,0,0|3,0,0]=4 917 B8R1.1 ClCc1csc(n1)Cl Amb2455967 [0,1,0,0,0,0|3,0,0]=4 918 B8R1.1 Clc1[n]c(CBr)co1 Amb21858007 [0,1,0,0,0,0|3,0,0]=4 919 B8R1.1 Clc1[n]c(CCl)co1 Amb24421916 [0,1,0,0,0,0|3,0,0]=4 920 B8R1.1 Clc1[n]oc(CCl)[n]1 Amb24723160 [0,1,0,0,0,0|3,0,0]=4 921 B8R1.1 Clc1c[nH]c(CCl)c1 Amb24704458 [0,1,0,0,0,0|2,0,0]=3 922 B8R1.1 Clc1c[n]c(CCl)[s]1 Amb22011587 [0,1,0,0,0,0|2,1,0]=4 923 B8R1.1 Clc1cc(CBr)[n][s]1 Amb25276325 [0,1,0,0,0,0|3,0,0]=4 924 B8R1.1 Clc1cc(CBr)o[n]1 Amb24407827 [0,1,0,0,0,0|2,0,0]=3 925 B8R1.1 Clc1cc([nH]c1)C=O Amb10601712 [0,1,0,0,0,0|1,0,2]=4 926 B8R1.1 Clc1ccc(C=C)s1 Amb17672604 [0,1,0,0,0,0|1,1,1]=4 927 B8R1.1 Clc1ccc(CBr)[s]1 Amb19375092 [0,1,0,0,0,0|1,1,0]=3 928 B8R1.1 Clc1ccc(CBr)o1 Amb24452907 [0,1,0,0,0,0|1,0,0]=2 929 B8R1.1 Clc1ccc(CCl)o1 Amb24433248 [0,1,0,0,0,0|1,0,0]=2 930 B8R1.1 Clc1ccc(CI)[s]1 Amb24481391 [0,1,0,0,0,0|1,1,0]=3 931 B8R1.1 Clc1ccc([Mg]Br)[s]1 Amb22000363 [0,1,0,0,0,0|2,1,0]=4 932 B8R1.1 Clc1ccc([s]1)SCl Amb24756847 [0,1,0,0,0,0|2,1,0]=4 933 B8R1.1 Clc1ccc([s]1)[Zn]Br Amb22000383 [0,1,0,0,0,0|2,1,0]=4 934 B8R1.1 Clc1ccc(o1)C=O Amb1157854 [0,1,0,0,0,0|0,0,2]=3 935 B8R1.1 Clc1ccc(o1)[Hg]Cl Amb22360222 [0,1,0,0,0,0|2,0,0]=3 936 B8R1.1 Clc1ccc(s1)C=O Amb1159320 [0,1,0,0,0,0|0,1,2]=4 937 B8R1.1 Cn1cc(nc1)CCl Amb2455671 [0,1,0,0,0,0|3,0,0]=4 938 B8R1.1 Cn1cc(nn1)CO Amb17538034 [0,1,0,0,0,0|3,0,0]=4 939 B8R1.1 Cn1ccc(n1)CN Amb1934808 [0,1,0,0,0,0|3,0,0]=4 940 B8R1.1 FC[n]1cc(Br)c[n]1 Amb25175379 [0,1,0,0,0,0|3,0,0]=4 941 B8R1.1 FC[n]1ccc(Br)[n]1 Amb24559578 [0,1,0,0,0,0|3,0,0]=4 942 B8R1.1 FCc1[n]cc(Br)[s]1 Amb25178291 [0,1,0,0,0,0|2,1,0]=4 943 B8R1.1 FCc1[n]cc(Br)o1 Amb25270260 [0,1,0,0,0,0|2,0,0]=3 944 B8R1.1 FCc1c[nH]c(Br)[n]1 Amb25276718 [0,1,0,0,0,0|3,0,0]=4 945 B8R1.1 FCc1c[s]c(Br)[n]1 Amb25300757 [0,1,0,0,0,0|3,0,0]=4 946 B8R1.1 Fc1cc(CBr)c[s]1 Amb24743447 [0,1,0,0,0,0|3,0,0]=4 947 B8R1.1 Fc1cc(CCl)c[s]1 Amb24639511 [0,1,0,0,0,0|3,0,0]=4 948 B8R1.1 Fc1ccc(CBr)[s]1 Amb24270964 [0,1,0,0,0,0|1,1,0]=3 949 B8R1.1 Fc1ccc(CCl)[s]1 Amb24054148 [0,1,0,0,0,0|1,1,0]=3 950 B8R1.1 Fc1ccc(s1)C=O Amb10249047 [0,1,0,0,0,0|0,1,2]=4 951 B8R1.1 Ic1ccc(o1)C=O Amb1669363 [0,1,0,0,0,0|0,0,2]=3 952 B8R1.1 N#CC1C=CC(=O)O1 Amb24481486 [0,1,0,0,0,0|1,0,2]=4 953 B8R1.1 N#Cc1cc(Br)c[nH]1 Amb19517039 [0,1,0,0,0,0|2,0,1]=4 954 B8R1.1 N#Cc1cc(Br)co1 Amb24446618 [0,1,0,0,0,0|1,0,1]=3 955 B8R1.1 N#Cc1cc(Cl)c[nH]1 Amb18124313 [0,1,0,0,0,0|2,0,1]=4 956 B8R1.1 N#Cc1cc(Cl)c[s]1 Amb21857072 [0,1,0,0,0,0|1,1,1]=4 957 B8R1.1 N#Cc1cc(Cl)co1 Amb23537459 [0,1,0,0,0,0|1,0,1]=3 958 B8R1.1 N#Cc1cc(F)c[s]1 Amb22490413 [0,1,0,0,0,0|1,1,1]=4 959 B8R1.1 N#Cc1cc(I)c[nH]1 Amb22498193 [0,1,0,0,0,0|2,0,1]=4 960 B8R1.1 N#Cc1cc(I)c[s]1 Amb24679382 [0,1,0,0,0,0|1,1,1]=4 961 B8R1.1 N#Cc1cc(O)c[s]1 Amb25851080 [0,1,0,0,0,0|1,1,1]=4 962 B8R1.1 N#Cc1ccc(Br)[nH]1 Amb21857252 [0,1,0,0,0,0|2,0,1]=4 963 B8R1.1 N#Cc1ccc(Cl)o1 Amb18642557 [0,1,0,0,0,0|1,0,1]=3 964 B8R1.1 N#Cc1ccc(F)[s]1 Amb18642494 [0,1,0,0,0,0|1,1,1]=4 965 B8R1.1 N#Cc1ccc(F)o1 Amb24623154 [0,1,0,0,0,0|1,0,1]=3 966 B8R1.1 N#Cc1ccc(I)[nH]1 Amb22498445 [0,1,0,0,0,0|2,0,1]=4 967 B8R1.1 N#Cc1ccc(I)[s]1 Amb21964152 [0,1,0,0,0,0|1,1,1]=4 968 B8R1.1 N#Cc1ccc(I)o1 Amb22052210 [0,1,0,0,0,0|1,0,1]=3 969 B8R1.1 NC1CC(C=C1)CO Amb17607971 [0,1,0,0,0,0|1,0,2]=4 970 B8R1.1 NCC1=CC(=O)NN1 Amb18833072 [0,1,0,0,0,0|3,0,0]=4 971 B8R1.1 NCC1=CC(=O)NO1 Amb18833042 [0,1,0,0,0,0|2,0,0]=3 972 B8R1.1 NCC1=CC(=O)NS1 Amb19134059 [0,1,0,0,0,0|2,1,0]=4 973 B8R1.1 NCC1=CNC(=O)N1 Amb18908264 [0,1,0,0,0,0|3,0,0]=4 974 B8R1.1 NCC1=CSC(=O)N1 Amb20669453 [0,1,0,0,0,0|3,0,0]=4 975 B8R1.1 NCC=1CC=C(Br)C1 Amb25197825 [0,1,0,0,0,0|2,0,0]=3 976 B8R1.1 NCC=1COC(=O)C1 Amb24634773 [0,1,0,0,0,0|3,0,0]=4 977 B8R1.1 NCc1[nH]c(O)c[n]1 Amb18860309 [0,1,0,0,0,0|3,0,0]=4 978 B8R1.1 NCc1[nH]nc(c1)C Amb2154783 [0,1,0,0,0,0|3,0,0]=4 979 B8R1.1 NCc1[n][n]c(S)o1 Amb18222732 [0,1,0,0,0,0|3,0,0]=4 980 B8R1.1 NCc1[n][n]c(S)o1 Amb22551845 [0,1,0,0,0,0|3,0,0]=4 981 B8R1.1 NCc1[n]c(Br)[n]o1 Amb18190899 [0,1,0,0,0,0|3,0,0]=4 982 B8R1.1 NCc1[n]c(Br)c[s]1 Amb22491035 [0,1,0,0,0,0|2,1,0]=4 983 B8R1.1 NCc1[n]cc(Br)[s]1 Amb22491236 [0,1,0,0,0,0|2,1,0]=4 984 B8R1.1 NCc1[n]cc(Br)[s]1 Amb24078539 [0,1,0,0,0,0|2,1,0]=4 985 B8R1.1 NCc1[n]cc(Cl)[s]1 Amb22756252 [0,1,0,0,0,0|2,1,0]=4 986 B8R1.1 NCc1[n]cc(Cl)[s]1 Amb24723328 [0,1,0,0,0,0|2,1,0]=4 987 B8R1.1 NCc1[n]cc(I)[s]1 Amb24461980 [0,1,0,0,0,0|2,1,0]=4 988 B8R1.1 NCc1c[n]c(Br)[s]1 Amb18190441 [0,1,0,0,0,0|2,1,0]=4 989 B8R1.1 NCc1c[n]c(Br)[s]1 Amb22500649 [0,1,0,0,0,0|2,1,0]=4 990 B8R1.1 NCc1c[n]c(Br)[s]1 Amb22899247 [0,1,0,0,0,0|2,1,0]=4 991 B8R1.1 NCc1c[n]c(Cl)[s]1 Amb19957495 [0,1,0,0,0,0|2,1,0]=4 992 B8R1.1 NCc1c[n]c(Cl)o1 Amb25376952 [0,1,0,0,0,0|2,0,0]=3 993 B8R1.1 NCc1c[s]c(Br)[n]1 Amb18190453 [0,1,0,0,0,0|3,0,0]=4 994 B8R1.1 NCc1c[s]c(Cl)[n]1 Amb22396134 [0,1,0,0,0,0|3,0,0]=4 995 B8R1.1 NCc1c[s]c(Cl)[n]1 Amb22904371 [0,1,0,0,0,0|3,0,0]=4 996 B8R1.1 NCc1c[s]c(Cl)c1 Amb22235040 [0,1,0,0,0,0|3,0,0]=4 997 B8R1.1 NCc1c[s]c(Cl)c1 Amb22752253 [0,1,0,0,0,0|3,0,0]=4 998 B8R1.1 NCc1c[s]c(I)c1 Amb24533929 [0,1,0,0,0,0|3,0,0]=4 999 B8R1.1 NCc1c[s]c(O)[n]1 Amb22059307 [0,1,0,0,0,0|3,0,0]=4 1000 B8R1.1 NCc1c[s]c(S)[n]1 Amb22296984 [0,1,0,0,0,0|3,0,0]=4 1001 B8R1.1 NCc1cc(Br)[n]o1 Amb19957482 [0,1,0,0,0,0|2,0,0]=3 1002 B8R1.1 NCc1cc(Br)[n]o1 Amb22489854 [0,1,0,0,0,0|2,0,0]=3 1003 B8R1.1 NCc1cc(Br)c[nH]1 Amb18908986 [0,1,0,0,0,0|2,0,0]=3 1004 B8R1.1 NCc1cc(Br)c[s]1 Amb22388572 [0,1,0,0,0,0|1,1,0]=3 1005 B8R1.1 NCc1cc(Cl)c[nH]1 Amb18251131 [0,1,0,0,0,0|2,0,0]=3 1006 B8R1.1 NCc1cc(Cl)c[s]1 Amb18251310 [0,1,0,0,0,0|1,1,0]=3 1007 B8R1.1 NCc1cc(Cl)co1 Amb23537475 [0,1,0,0,0,0|1,0,0]=2 1008 B8R1.1 NCc1cc(O)[n][nH]1 Amb22546337 [0,1,0,0,0,0|3,0,0]=4 1009 B8R1.1 NCc1cc(cs1)Br Amb10067673 [0,1,0,0,0,0|1,1,0]=3 1010 B8R1.1 NCc1cc(no1)Br Amb10067252 [0,1,0,0,0,0|2,0,0]=3 1011 B8R1.1 NCc1cc(no1)O Amb17618160 [0,1,0,0,0,0|2,0,0]=3 1012 B8R1.1 NCc1ccc(Br)o1 Amb22500479 [0,1,0,0,0,0|1,0,0]=2 1013 B8R1.1 NCc1ccc(Cl)[s]1 Amb22739673 [0,1,0,0,0,0|1,1,0]=3 1014 B8R1.1 NCc1ccc(F)[s]1 Amb23440031 [0,1,0,0,0,0|1,1,0]=3 1015 B8R1.1 NCc1ccc(F)[s]1 Amb24054066 [0,1,0,0,0,0|1,1,0]=3 1016 B8R1.1 NCc1ccc(I)[s]1 Amb25763380 [0,1,0,0,0,0|1,1,0]=3 1017 B8R1.1 NCc1ccc(S)[s]1 Amb25703112 [0,1,0,0,0,0|1,1,0]=3 1018 B8R1.1 NCc1ccc(o1)Br Amb1099320 [0,1,0,0,0,0|1,0,0]=2 1019 B8R1.1 NCc1ccc(s1)N Amb17477843 [0,1,0,0,0,0|1,1,0]=3 1020 B8R1.1 NCc1coc(Br)[n]1 Amb25095869 [0,1,0,0,0,0|3,0,0]=4 1021 B8R1.1 NCc1coc(Cl)[n]1 Amb25746718 [0,1,0,0,0,0|3,0,0]=4 1022 B8R1.1 NCc1coc(Cl)c1 Amb25722992 [0,1,0,0,0,0|3,0,0]=4 1023 B8R1.1 NCc1coc(I)[n]1 Amb24697523 [0,1,0,0,0,0|3,0,0]=4 1024 B8R1.1 NCc1csc(c1)Br Amb13951463 [0,1,0,0,0,0|3,0,0]=4 1025 B8R1.1 NCc1csc(n1)C Amb11012602 [0,1,0,0,0,0|3,0,0]=4 1026 B8R1.1 NCc1csc(n1)N Amb10607503 [0,1,0,0,0,0|3,0,0]=4 1027 B8R1.1 NNc1ccc(Br)[s]1 Amb18190243 [0,1,0,0,0,0|2,1,0]=4 1028 B8R1.1 N[C@@H]1C[C@H](CO)C=C1 Amb19149051 [0,1,0,0,0,0|1,0,2]=4 1029 B8R1.1 N[C@@H]1C[C@H](CO)C=C1 Amb24182040 [0,1,0,0,0,0|1,0,2]=4 1030 B8R1.1 N[C@H]1C[C@H](C=C1)CO Amb16231083 [0,1,0,0,0,0|1,0,2]=4 1031 B8R1.1 N[n]1ccc(CO)[n]1 Amb24554449 [0,1,0,0,0,0|2,0,0]=3 1032 B8R1.1 Nc1[nH]cc(CF)[n]1 Amb25202378 [0,1,0,0,0,0|3,0,0]=4 1033 B8R1.1 Nc1[nH]cc(CN)[n]1 Amb24087591 [0,1,0,0,0,0|3,0,0]=4 1034 B8R1.1 Nc1[nH]cc(CN)[n]1 Amb25345869 [0,1,0,0,0,0|3,0,0]=4 1035 B8R1.1 Nc1[nH]cc(CO)[n]1 Amb24073798 [0,1,0,0,0,0|2,0,0]=3 1036 B8R1.1 Nc1[n][n]c(CCl)o1 Amb20248818 [0,1,0,0,0,0|3,0,0]=4 1037 B8R1.1 Nc1[n][n]c(CCl)o1 Amb25772763 [0,1,0,0,0,0|3,0,0]=4 1038 B8R1.1 Nc1[n][n]c(CF)o1 Amb25311360 [0,1,0,0,0,0|3,0,0]=4 1039 B8R1.1 Nc1[n][n]c(CN)o1 Amb18221743 [0,1,0,0,0,0|3,0,0]=4 1040 B8R1.1 Nc1[n][n]c(CO)[s]1 Amb18944236 [0,1,0,0,0,0|2,1,0]=4 1041 B8R1.1 Nc1[n][n]c(CO)o1 Amb22549321 [0,1,0,0,0,0|2,0,0]=3 1042 B8R1.1 Nc1[n]c(CBr)co1 Amb25706264 [0,1,0,0,0,0|3,0,0]=4 1043 B8R1.1 Nc1[n]c(CF)c[s]1 Amb24555658 [0,1,0,0,0,0|3,0,0]=4 1044 B8R1.1 Nc1[n]c(CF)co1 Amb25269877 [0,1,0,0,0,0|3,0,0]=4 1045 B8R1.1 Nc1[n]c(CN)c[s]1 Amb19299857 [0,1,0,0,0,0|3,0,0]=4 1046 B8R1.1 Nc1[n]c(CN)co1 Amb25055112 [0,1,0,0,0,0|3,0,0]=4 1047 B8R1.1 Nc1[n]c(CO)c[s]1 Amb22284118 [0,1,0,0,0,0|2,0,0]=3 1048 B8R1.1 Nc1[n]c(CO)co1 Amb22756375 [0,1,0,0,0,0|2,0,0]=3 1049 B8R1.1 Nc1[n]c(CS)c[s]1 Amb24099806 [0,1,0,0,0,0|2,1,0]=4 1050 B8R1.1 Nc1[n]cc(C=O)o1 Amb23400983 [0,1,0,0,0,0|1,0,2]=4 1051 B8R1.1 Nc1[n]cc(CCl)[s]1 Amb23555845 [0,1,0,0,0,0|2,1,0]=4 1052 B8R1.1 Nc1[n]cc(CCl)[s]1 Amb24081486 [0,1,0,0,0,0|2,1,0]=4 1053 B8R1.1 Nc1[n]cc(CN)[s]1 Amb18278704 [0,1,0,0,0,0|2,1,0]=4 1054 B8R1.1 Nc1[n]cc(CO)[s]1 Amb22899164 [0,1,0,0,0,0|1,1,0]=3 1055 B8R1.1 Nc1[n]cc(CO)o1 Amb25104500 [0,1,0,0,0,0|1,0,0]=2 1056 B8R1.1 Nc1[n]oc(CN)[n]1 Amb18833040 [0,1,0,0,0,0|3,0,0]=4 1057 B8R1.1 Nc1c[n]c(CN)[s]1 Amb25784213 [0,1,0,0,0,0|2,1,0]=4 1058 B8R1.1 Nc1c[s]c(CF)[n]1 Amb24739298 [0,1,0,0,0,0|2,1,0]=4 1059 B8R1.1 Nc1c[s]c(CN)[n]1 Amb18203229 [0,1,0,0,0,0|2,1,0]=4 1060 B8R1.1 Nc1c[s]c(CO)[n]1 Amb25345230 [0,1,0,0,0,0|1,1,0]=3 1061 B8R1.1 Nc1cc(C#N)[s]c1 Amb18642138 [0,1,0,0,0,0|1,1,1]=4 1062 B8R1.1 Nc1cc(C#N)[s]c1 Amb22491051 [0,1,0,0,0,0|1,1,1]=4 1063 B8R1.1 Nc1cc(C#N)o[n]1 Amb18833128 [0,1,0,0,0,0|2,0,1]=4 1064 B8R1.1 Nc1cc(C=O)[s]c1 Amb18679453 [0,1,0,0,0,0|0,1,2]=4 1065 B8R1.1 Nc1cc(C=O)oc1 Amb18833113 [0,1,0,0,0,0|0,0,2]=3 1066 B8R1.1 Nc1cc(CF)[nH][n]1 Amb25745457 [0,1,0,0,0,0|3,0,0]=4 1067 B8R1.1 Nc1cc(CN)[nH][n]1 Amb24638252 [0,1,0,0,0,0|3,0,0]=4 1068 B8R1.1 Nc1cc(CN)[n]o1 Amb25239036 [0,1,0,0,0,0|3,0,0]=4 1069 B8R1.1 Nc1cc(CN)c[s]1 Amb18251120 [0,1,0,0,0,0|3,0,0]=4 1070 B8R1.1 Nc1cc(CO)[nH][n]1 Amb20619735 [0,1,0,0,0,0|2,0,0]=3 1071 B8R1.1 Nc1cc(CO)[nH][n]1 Amb22279583 [0,1,0,0,0,0|2,0,0]=3 1072 B8R1.1 Nc1cc(CO)[n]o1 Amb24656810 [0,1,0,0,0,0|2,0,0]=3 1073 B8R1.1 Nc1cc(CO)o[n]1 Amb18124249 [0,1,0,0,0,0|1,0,0]=2 1074 B8R1.1 Nc1ccc(C#N)o1 Amb18203412 [0,1,0,0,0,0|1,0,1]=3 1075 B8R1.1 Nc1ccc(C=O)[nH]1 Amb18203402 [0,1,0,0,0,0|1,0,2]=4 1076 B8R1.1 Nc1ccc(C=O)[s]1 Amb18202442 [0,1,0,0,0,0|0,1,2]=4 1077 B8R1.1 Nc1ccc(C=O)o1 Amb18833112 [0,1,0,0,0,0|0,0,2]=3 1078 B8R1.1 Nc1ccc(CO)[s]1 Amb25743937 [0,1,0,0,0,0|0,1,0]=2 1079 B8R1.1 Nc1ccc(CS)o1 Amb24365127 [0,1,0,0,0,0|0,1,0]=2 1080 B8R1.1 Nc1ccc(N=O)[s]1 Amb24481305 [0,1,0,0,0,0|1,1,1]=4 1081 B8R1.1 Nc1ccc([s]1)SN Amb24061436 [0,1,0,0,0,0|2,1,0]=4 1082 B8R1.1 Nc1ccc(s1)C#N Amb17477844 [0,1,0,0,0,0|1,1,1]=4 1083 B8R1.1 Nc1coc(CO)[n]1 Amb25699026 [0,1,0,0,0,0|1,0,0]=2 1084 B8R1.1 Nc1nc(cs1)CBr Amb10603715 [0,1,0,0,0,0|3,0,0]=4 1085 B8R1.1 Nc1nc(cs1)CO Amb1101129 [0,1,0,0,0,0|2,0,0]=3 1086 B8R1.1 Nc1ncc(s1)CO Amb16231070 [0,1,0,0,0,0|1,1,0]=3 1087 B8R1.1 O=C1C=C(C=O)ON1 Amb22498283 [0,1,0,0,0,0|1,0,2]=4 1088 B8R1.1 O=C1C=C(CCl)CO1 Amb24481317 [0,1,0,0,0,0|3,0,0]=4 1089 B8R1.1 O=C1C=C(CF)CO1 Amb23556961 [0,1,0,0,0,0|3,0,0]=4 1090 B8R1.1 O=C1C=CC(CBr)O1 Amb24423424 [0,1,0,0,0,0|1,0,1]=3 1091 B8R1.1 O=C1C=C\C(=C/Br)\S1 Amb25025140 [0,1,0,0,0,0|1,1,1]=4 1092 B8R1.1 O=C1C=C\C(=C/Cl)\S1 Amb25745343 [0,1,0,0,0,0|1,1,1]=4 1093 B8R1.1 O=C1C=C\C(=C\Br)\O1 Amb25102498 [0,1,0,0,0,0|1,0,1]=3 1094 B8R1.1 O=C1C=C\C(=C\Br)\S1 Amb25258329 [0,1,0,0,0,0|1,1,1]=4 1095 B8R1.1 O=C1CC=C(CBr)O1 Amb24469203 [0,1,0,0,0,0|1,0,1]=3 1096 B8R1.1 O=C1CCC(CCl)=C1 Amb24645790 [0,1,0,0,0,0|2,0,1]=4 1097 B8R1.1 O=C1NC(CS)=CN1 Amb25223870 [0,1,0,0,0,0|2,1,0]=4 1098 B8R1.1 O=C1NC=C(CCl)O1 Amb24603386 [0,1,0,0,0,0|2,0,0]=3 1099 B8R1.1 O=C1NN=C(CCl)O1 Amb24607862 [0,1,0,0,0,0|3,0,0]=4 1100 B8R1.1 O=C1NN=C(CS)O1 Amb25372258 [0,1,0,0,0,0|2,1,0]=4 1101 B8R1.1 O=C1OC(CBr)=CO1 Amb22491256 [0,1,0,0,0,0|2,0,0]=3 1102 B8R1.1 O=C1OC(CCl)=CO1 Amb25226799 [0,1,0,0,0,0|2,0,0]=3 1103 B8R1.1 O=CC1C=CC(=O)O1 Amb24528815 [0,1,0,0,0,0|0,0,3]=4 1104 B8R1.1 O=Cc1c[n]c(Cl)o1 Amb24628339 [0,1,0,0,0,0|1,0,2]=4 1105 B8R1.1 O=Cc1cc(Cl)[n]o1 Amb24078706 [0,1,0,0,0,0|1,0,2]=4 1106 B8R1.1 O=Cc1cc(Cl)c[s]1 Amb18644304 [0,1,0,0,0,0|0,1,2]=4 1107 B8R1.1 O=Cc1cc(Cl)co1 Amb18642825 [0,1,0,0,0,0|0,0,2]=3 1108 B8R1.1 O=Cc1cc(F)c[nH]1 Amb18833082 [0,1,0,0,0,0|1,0,2]=4 1109 B8R1.1 O=Cc1cc(F)c[s]1 Amb18832536 [0,1,0,0,0,0|0,1,2]=4 1110 B8R1.1 O=Cc1cc(F)co1 Amb18833044 [0,1,0,0,0,0|0,0,2]=3 1111 B8R1.1 O=Cc1cc(I)c[nH]1 Amb21964579 [0,1,0,0,0,0|1,0,2]=4 1112 B8R1.1 O=Cc1cc(I)c[s]1 Amb21962048 [0,1,0,0,0,0|0,1,2]=4 1113 B8R1.1 O=Cc1cc(I)co1 Amb24678241 [0,1,0,0,0,0|0,0,2]=3 1114 B8R1.1 O=Cc1ccc(Br)[nH]1 Amb18647726 [0,1,0,0,0,0|1,0,2]=4 1115 B8R1.1 O=Cc1ccc(Cl)[nH]1 Amb18642733 [0,1,0,0,0,0|1,0,2]=4 1116 B8R1.1 O=Cc1ccc(F)[nH]1 Amb18833084 [0,1,0,0,0,0|1,0,2]=4 1117 B8R1.1 O=Cc1ccc(F)o1 Amb18203364 [0,1,0,0,0,0|0,0,2]=3 1118 B8R1.1 O=Cc1ccc(I)[nH]1 Amb22498190 [0,1,0,0,0,0|1,0,2]=4 1119 B8R1.1 O=Cc1ccc(I)[s]1 Amb20621479 [0,1,0,0,0,0|0,1,2]=4 1120 B8R1.1 OC1C=C[C@@H](CBr)O1 Amb24483168 [0,1,0,0,0,0|1,0,2]=4 1121 B8R1.1 OC1CC(CO)C=C1 Amb25715824 [0,1,0,0,0,0|1,0,2]=4 1122 B8R1.1 OCC1=CCC(O)O1 Amb25662345 [0,1,0,0,0,0|0,0,2]=3 1123 B8R1.1 OCC1=COC(=O)O1 Amb25214922 [0,1,0,0,0,0|1,0,0]=2 1124 B8R1.1 OCC1=COC(=S)N1 Amb24483070 [0,1,0,0,0,0|2,0,0]=3 1125 B8R1.1 OCC1=CSC(=S)S1 Amb25284581 [0,1,0,0,0,0|1,1,0]=3 1126 B8R1.1 OCC1=NC(=O)CS1 Amb25739997 [0,1,0,0,0,0|1,1,1]=4 1127 B8R1.1 OCC1=NNC(=O)C1 Amb17593181 [0,1,0,0,0,0|2,0,1]=4 1128 B8R1.1 OCC1=NNC(=O)O1 Amb24579278 [0,1,0,0,0,0|2,0,0]=3 1129 B8R1.1 OCC1C=CC(=O)N1 Amb24544831 [0,1,0,0,0,0|1,0,1]=3 1130 B8R1.1 OCC1CC(=O)CO1 Amb24117838 [0,1,0,0,0,0|0,0,3]=4 1131 B8R1.1 OCC1CC(Br)=NO1 Amb23449512 [0,1,0,0,0,0|1,0,2]=4 1132 B8R1.1 OCC1CC=C(Cl)C1 Amb23594524 [0,1,0,0,0,0|1,0,2]=4 1133 B8R1.1 OCC1CCC(=O)O1 Amb20240701 [0,1,0,0,0,0|0,0,3]=4 1134 B8R1.1 OCC1CN=C(S)O1 Amb25092005 [0,1,0,0,0,0|1,0,2]=4 1135 B8R1.1 OCC1COC(=S)O1 Amb24353008 [0,1,0,0,0,0|1,0,2]=4 1136 B8R1.1 OCC1OCC(=O)O1 Amb24643063 [0,1,0,0,0,0|1,0,2]=4 1137 B8R1.1 OCC=1COC(=O)C1 Amb23557062 [0,1,0,0,0,0|2,0,0]=3 1138 B8R1.1 OCC=1NC(=O)NN1 Amb25359694 [0,1,0,0,0,0|3,0,0]=4 1139 B8R1.1 OCC=1NSC(=S)N1 Amb24060386 [0,1,0,0,0,0|3,0,0]=4 1140 B8R1.1 OC[C@@H]1CC(=O)C=C1 Amb25373368 [0,1,0,0,0,0|1,0,1]=3 1141 B8R1.1 OC[C@@H]1CC(Br)=NO1 Amb24504219 [0,1,0,0,0,0|1,0,2]=4 1142 B8R1.1 OC[C@@H]1CNC(=O)O1 Amb24183552 [0,1,0,0,0,0|1,0,2]=4 1143 B8R1.1 OC[C@H]1C=CC(=O)N1 Amb25225281 [0,1,0,0,0,0|1,0,1]=3 1144 B8R1.1 OC[C@H]1CC(=O)C=C1 Amb25093663 [0,1,0,0,0,0|1,0,1]=3 1145 B8R1.1 OC[C@H]1CNC(=O)O1 Amb22737250 [0,1,0,0,0,0|1,0,2]=4 1146 B8R1.1 OC[n]1c[n]c(Br)[n]1 Amb22893536 [0,1,0,0,0,0|3,0,0]=4 1147 B8R1.1 OC[n]1c[n]c(Cl)[n]1 Amb22895831 [0,1,0,0,0,0|3,0,0]=4 1148 B8R1.1 OC[n]1ccc(I)[n]1 Amb25349687 [0,1,0,0,0,0|2,0,0]=3 1149 B8R1.1 OCc1[nH][n]c(Br)[n]1 Amb22492293 [0,1,0,0,0,0|3,0,0]=4 1150 B8R1.1 OCc1[nH]cc(Br)[n]1 Amb22493990 [0,1,0,0,0,0|2,0,0]=3 1151 B8R1.1 OCc1[nH]cc(I)[n]1 Amb24505161 [0,1,0,0,0,0|2,0,0]=3 1152 B8R1.1 OCc1[n][n]c(Br)[s]1 Amb23437049 [0,1,0,0,0,0|2,1,0]=4 1153 B8R1.1 OCc1[n][n]c(Cl)[s]1 Amb20242061 [0,1,0,0,0,0|2,1,0]=4 1154 B8R1.1 OCc1[n][n]c(S)o1 Amb25025211 [0,1,0,0,0,0|2,0,0]=3 1155 B8R1.1 OCc1[n]c(Br)[n]o1 Amb25225866 [0,1,0,0,0,0|2,0,0]=3 1156 B8R1.1 OCc1[n]c(Br)c[s]1 Amb22002368 [0,1,0,0,0,0|1,1,0]=3 1157 B8R1.1 OCc1[n]cc(Br)[s]1 Amb21962693 [0,1,0,0,0,0|1,1,0]=3 1158 B8R1.1 OCc1[n]cc(Cl)[s]1 Amb23439248 [0,1,0,0,0,0|1,1,0]=3 1159 B8R1.1 OCc1[n]cc(I)[s]1 Amb25144821 [0,1,0,0,0,0|1,1,0]=3 1160 B8R1.1 OCc1c[nH]c(Br)[n]1 Amb20670861 [0,1,0,0,0,0|2,0,0]=3 1161 B8R1.1 OCc1c[nH]c(Cl)[n]1 Amb25214661 [0,1,0,0,0,0|2,0,0]=3 1162 B8R1.1 OCc1c[n](Br)c[n]1 Amb20248163 [0,1,0,0,0,0|2,0,0]=3 1163 B8R1.1 OCc1c[s]c(Br)[n]1 Amb22587174 [0,1,0,0,0,0|2,0,0]=3 1164 B8R1.1 OCc1c[s]c(Cl)c1 Amb21864616 [0,1,0,0,0,0|2,0,0]=3 1165 B8R1.1 OCc1c[s]c(F)[n]1 Amb24099809 [0,1,0,0,0,0|2,0,0]=3 1166 B8R1.1 OCc1c[s]c(F)c1 Amb24733326 [0,1,0,0,0,0|2,0,0]=3 1167 B8R1.1 OCc1c[s]c(S)[n]1 Amb22297669 [0,1,0,0,0,0|2,0,0]=3 1168 B8R1.1 OCc1cc(Br)[nH][n]1 Amb23402761 [0,1,0,0,0,0|2,0,0]=3 1169 B8R1.1 OCc1cc(Br)c[nH]1 Amb22233860 [0,1,0,0,0,0|1,0,0]=2 1170 B8R1.1 OCc1cc(Br)co1 Amb21857563 [0,1,0,0,0,0|0,0,0]=1 1171 B8R1.1 OCc1cc(Cl)[n]o1 Amb24099300 [0,1,0,0,0,0|1,0,0]=2 1172 B8R1.1 OCc1cc(Cl)c[nH]1 Amb24457009 [0,1,0,0,0,0|1,0,0]=2 1173 B8R1.1 OCc1cc(Cl)c[s]1 Amb23439217 [0,1,0,0,0,0|0,1,0]=2 1174 B8R1.1 OCc1cc(Cl)co1 Amb23537660 [0,1,0,0,0,0|0,0,0]=1 1175 B8R1.1 OCc1cc(F)co1 Amb24735910 [0,1,0,0,0,0|0,0,0]=1 1176 B8R1.1 OCc1cc(I)c[nH]1 Amb22498450 [0,1,0,0,0,0|1,0,0]=2 1177 B8R1.1 OCc1cc(I)co1 Amb24516430 [0,1,0,0,0,0|0,0,0]=1 1178 B8R1.1 OCc1cc(no1)Br Amb2455736 [0,1,0,0,0,0|1,0,0]=2 1179 B8R1.1 OCc1ccc(Cl)o1 Amb22498874 [0,1,0,0,0,0|0,0,0]=1 1180 B8R1.1 OCc1ccc(F)[s]1 Amb19892820 [0,1,0,0,0,0|0,1,0]=2 1181 B8R1.1 OCc1ccc(F)o1 Amb24696625 [0,1,0,0,0,0|0,0,0]=1 1182 B8R1.1 OCc1ccc(o1)Br Amb1111133 [0,1,0,0,0,0|0,0,0]=1 1183 B8R1.1 OCc1ccc(s1)Br Amb1110302 [0,1,0,0,0,0|0,1,0]=2 1184 B8R1.1 OCc1cnc(o1)Br Amb10067560 [0,1,0,0,0,0|1,0,0]=2 1185 B8R1.1 OCc1cnc(s1)Br Amb2455708 [0,1,0,0,0,0|1,1,0]=3 1186 B8R1.1 OCc1cnc(s1)Cl Amb2455674 [0,1,0,0,0,0|1,1,0]=3 1187 B8R1.1 OCc1cnn(c1)C Amb1229161 [0,1,0,0,0,0|3,0,0]=4 1188 B8R1.1 OCc1coc(Br)c1 Amb22736839 [0,1,0,0,0,0|2,0,0]=3 1189 B8R1.1 OCc1coc(I)c1 Amb24560087 [0,1,0,0,0,0|2,0,0]=3 1190 B8R1.1 OCc1coc(n1)Br Amb10067557 [0,1,0,0,0,0|2,0,0]=3 1191 B8R1.1 OCc1coc(n1)Cl Amb10603118 [0,1,0,0,0,0|2,0,0]=3 1192 B8R1.1 OCc1csc(n1)Br Amb2455707 [0,1,0,0,0,0|2,0,0]=3 1193 B8R1.1 OCc1csc(n1)Cl Amb10067282 [0,1,0,0,0,0|2,0,0]=3 1194 B8R1.1 OCc1n[nH]c(c1)O Amb10067864 [0,1,0,0,0,0|2,0,0]=3 1195 B8R1.1 OCc1nc(n[nH]1)Br Amb15701504 [0,1,0,0,0,0|3,0,0]=4 1196 B8R1.1 OCc1nc(n[nH]1)Cl Amb19134565 [0,1,0,0,0,0|3,0,0]=4 1197 B8R1.1 OCc1ncn(n1)C Amb15695296 [0,1,0,0,0,0|3,0,0]=4 1198 B8R1.1 OCc1noc(n1)C Amb1102718 [0,1,0,0,0,0|3,0,0]=4 1199 B8R1.1 OCn1cc(cn1)Cl Amb1946089 [0,1,0,0,0,0|2,0,0]=3 1200 B8R1.1 ONc1[n]c(Br)c[s]1 Amb25296351 [0,1,0,0,0,0|2,1,0]=4 1201 B8R1.1 O[C@@H]1C=C[C@@H](CO)O1 Amb25234779 [0,1,0,0,0,0|0,0,2]=3 1202 B8R1.1 O[C@H]1C=C[C@@H](CO)O1 Amb25261846 [0,1,0,0,0,0|0,0,2]=3 1203 B8R1.1 O[C@H]1C[C@H](CO)C=C1 Amb25317230 [0,1,0,0,0,0|1,0,2]=4 1204 B8R1.1 O\N=C\1/C=CC(=O)N1 Amb24481583 [0,1,0,0,0,0|2,0,0]=3 1205 B8R1.1 Oc1[n]c(CO)[n]o1 Amb25283057 [0,1,0,0,0,0|3,0,0]=4 1206 B8R1.1 Oc1[n]cc(CO)[s]1 Amb25065418 [0,1,0,0,0,0|1,1,0]=3 1207 B8R1.1 Oc1c[n]c(CF)[s]1 Amb24741354 [0,1,0,0,0,0|2,1,0]=4 1208 B8R1.1 Oc1c[s]c(CF)[n]1 Amb24741348 [0,1,0,0,0,0|2,1,0]=4 1209 B8R1.1 Oc1cc(CO)o[n]1 Amb24331438 [0,1,0,0,0,0|1,0,0]=2 1210 B8R1.1 Oc1cc(CS)oc1 Amb25330756 [0,1,0,0,0,0|0,1,0]=2 1211 B8R1.1 Oc1cc(on1)CCl Amb2444789 [0,1,0,0,0,0|2,0,0]=3 1212 B8R1.1 Oc1ccc(C=O)[s]1 Amb24741796 [0,1,0,0,0,0|0,1,2]=4 1213 B8R1.1 Oc1ccc(CO)o1 Amb25142895 [0,1,0,0,0,0|0,0,0]=1 1214 B8R1.1 Oc1ccc(N=O)o1 Amb24610956 [0,1,0,0,0,0|1,0,1]=3 1215 B8R1.1 S=C1NC(CBr)=CS1 Amb24637885 [0,1,0,0,0,0|3,0,0]=4 1216 B8R1.1 SCc1[n][n]c(Br)o1 Amb24459790 [0,1,0,0,0,0|2,1,0]=4 1217 B8R1.1 SCc1c[n]c(Cl)[s]1 Amb25770173 [0,1,0,0,0,0|1,2,0]=4 1218 B8R1.1 SCc1c[s]c(Br)[n]1 Amb22298102 [0,1,0,0,0,0|2,1,0]=4 1219 B8R1.1 SCc1cc(Br)c[s]1 Amb24483181 [0,1,0,0,0,0|0,2,0]=3 1220 B8R1.1 SCc1cc(Cl)co1 Amb25765416 [0,1,0,0,0,0|0,1,0]=2 1221 B8R1.1 SCc1cc(I)co1 Amb25310706 [0,1,0,0,0,0|0,1,0]=2 1222 B8R1.1 SCc1ccc(Br)o1 Amb24702374 [0,1,0,0,0,0|0,1,0]=2 1223 B8R1.1 SCc1csc(c1)C Amb16628924 [0,1,0,0,0,0|2,1,0]=4 1224 B8R1.1 Sc1[n]c(CCl)c[s]1 Amb22298439 [0,1,0,0,0,0|3,0,0]=4 1225 B8R1.1 Sc1[n]c(CS)c[s]1 Amb22298242 [0,1,0,0,0,0|2,1,0]=4 1226 B8R1.7 BrC(Br)c1c[s]c[n]1 Amb24677540 [0,1,0,0,0,0|3,0,0]=4 1227 B8R1.7 BrC(Br)c1cocc1 Amb25811674 [0,1,0,0,0,0|3,0,0]=4 1228 B8R1.7 C=C(Cl)c1ccc[s]1 Amb24511598 [0,1,0,0,0,0|1,1,1]=4 1229 B8R1.7 C=C(N)c1ccc[nH]1 Amb24566747 [0,1,0,0,0,0|2,0,1]=4 1230 B8R1.7 C=C(N)c1ccco1 Amb25025940 [0,1,0,0,0,0|1,0,1]=3 1231 B8R1.7 C=C(O)c1ccc[s]1 Amb24061433 [0,1,0,0,0,0|0,1,1]=3 1232 B8R1.7 CB(C)c1ccc[s]1 Amb25196684 [0,1,0,0,0,0|2,1,0]=4 1233 B8R1.7 CC(=C)c1c[n]co1 Amb25364289 [0,1,0,0,0,0|2,0,1]=4 1234 B8R1.7 CC(=C)c1ccco1 Amb24532306 [0,1,0,0,0,0|1,0,1]=3 1235 B8R1.7 CC(=N)c1ccc[nH]1 Amb25377507 [0,1,0,0,0,0|2,0,1]=4 1236 B8R1.7 CC(=N)c1ccc[s]1 Amb25223960 [0,1,0,0,0,0|1,1,1]=4 1237 B8R1.7 CC(=O)c1[n]cco1 Amb19958429 [0,1,0,0,0,0|1,0,2]=4 1238 B8R1.7 CC(=O)c1c[n]co1 Amb24737064 [0,1,0,0,0,0|1,0,2]=4 1239 B8R1.7 CC(=O)c1cc[n]o1 Amb20242198 [0,1,0,0,0,0|1,0,2]=4 1240 B8R1.7 CC(=O)c1ccc[nH]1 Amb1151321 [0,1,0,0,0,0|1,0,2]=4 1241 B8R1.7 CC(=O)c1ccc[se]1 Amb17673999 [0,1,0,0,0,0|0,1,2]=4 1242 B8R1.7 CC(=S)c1ccc[nH]1 Amb24481346 [0,1,0,0,0,0|1,1,1]=4 1243 B8R1.7 CC(=S)c1ccco1 Amb25223522 [0,1,0,0,0,0|0,1,1]=3 1244 B8R1.7 CC(Br)c1[n]cc[s]1 Amb21862178 [0,1,0,0,0,0|2,1,0]=4 1245 B8R1.7 CC(Br)c1c[s]cc1 Amb23450038 [0,1,0,0,0,0|3,0,0]=4 1246 B8R1.7 CC(C)=C1C=CC=C1 Amb22043296 [0,1,0,0,0,0|2,0,1]=4 1247 B8R1.7 CC(C)C1C=CC=C1 Amb22736083 [0,1,0,0,0,0|2,0,1]=4 1248 B8R1.7 CC(C)C=1CC=CC1 Amb22227970 [0,1,0,0,0,0|2,0,0]=3 1249 B8R1.7 CC(C)[c-]1cccc1 Amb25209567 [0,1,0,0,0,0|2,0,1]=4 1250 B8R1.7 CC(C)c1[n][n]co1 Amb20171396 [0,1,0,0,0,0|3,0,0]=4 1251 B8R1.7 CC(C)c1c[nH]cc1 Amb25169371 [0,1,0,0,0,0|3,0,0]=4 1252 B8R1.7 CC(C)c1c[n]c[s]1 Amb22001688 [0,1,0,0,0,0|2,1,0]=4 1253 B8R1.7 CC(C)c1c[n]co1 Amb24641479 [0,1,0,0,0,0|2,0,0]=3 1254 B8R1.7 CC(C)c1cc[cH-]c1 Amb22336213 [0,1,0,0,0,0|2,0,1]=4 1255 B8R1.7 CC(C)c1ccc[nH]1 Amb17666650 [0,1,0,0,0,0|2,0,0]=3 1256 B8R1.7 CC(C)c1ccco1 Amb22168231 [0,1,0,0,0,0|1,0,0]=2 1257 B8R1.7 CC(C)c1cccs1 Amb17689449 [0,1,0,0,0,0|1,1,0]=3 1258 B8R1.7 CC(Cl)C1=CCCO1 Amb25058501 [0,1,0,0,0,0|1,0,2]=4 1259 B8R1.7 CC(Cl)c1[n]c[n]o1 Amb19375376 [0,1,0,0,0,0|3,0,0]=4 1260 B8R1.7 CC(Cl)c1[n]cc[s]1 Amb20618291 [0,1,0,0,0,0|2,1,0]=4 1261 B8R1.7 CC(Cl)c1c[n]c[nH]1 Amb24615922 [0,1,0,0,0,0|3,0,0]=4 1262 B8R1.7 CC(Cl)c1c[s]cc1 Amb24373829 [0,1,0,0,0,0|3,0,0]=4 1263 B8R1.7 CC(Cl)c1cc[s][n]1 Amb24589102 [0,1,0,0,0,0|3,0,0]=4 1264 B8R1.7 CC(Cl)c1ccc[nH]1 Amb20615921 [0,1,0,0,0,0|2,0,0]=3 1265 B8R1.7 CC(N)C1=CCCO1 Amb24555155 [0,1,0,0,0,0|1,0,2]=4 1266 B8R1.7 CC(N)c1[nH]cc[n]1 Amb22587350 [0,1,0,0,0,0|3,0,0]=4 1267 B8R1.7 CC(N)c1[nH]cc[n]1 Amb22886495 [0,1,0,0,0,0|3,0,0]=4 1268 B8R1.7 CC(N)c1[n]cc[s]1 Amb21857830 [0,1,0,0,0,0|2,1,0]=4 1269 B8R1.7 CC(N)c1[n]cc[s]1 Amb21928079 [0,1,0,0,0,0|2,1,0]=4 1270 B8R1.7 CC(N)c1c[nH]cc1 Amb18893398 [0,1,0,0,0,0|3,0,0]=4 1271 B8R1.7 CC(N)c1c[n]co1 Amb22233789 [0,1,0,0,0,0|2,0,0]=3 1272 B8R1.7 CC(N)c1c[s]c[n]1 Amb21956129 [0,1,0,0,0,0|3,0,0]=4 1273 B8R1.7 CC(N)c1cc[n][s]1 Amb18202953 [0,1,0,0,0,0|2,1,0]=4 1274 B8R1.7 CC(N)c1cc[n]o1 Amb22496526 [0,1,0,0,0,0|2,0,0]=3 1275 B8R1.7 CC(N)c1cocc1 Amb20622299 [0,1,0,0,0,0|3,0,0]=4 1276 B8R1.7 CC(N)c1cocc1 Amb22011563 [0,1,0,0,0,0|3,0,0]=4 1277 B8R1.7 CC(O)C1CC=CC1 Amb24675955 [0,1,0,0,0,0|1,0,2]=4 1278 B8R1.7 CC(O)C1CCC=C1 Amb25734590 [0,1,0,0,0,0|1,0,2]=4 1279 B8R1.7 CC(O)[n]1c[n]cc1 Amb24334476 [0,1,0,0,0,0|3,0,0]=4 1280 B8R1.7 CC(O)[n]1ccc[n]1 Amb24386858 [0,1,0,0,0,0|2,0,0]=3 1281 B8R1.7 CC(O)c1[nH]cc[n]1 Amb24120336 [0,1,0,0,0,0|2,0,0]=3 1282 B8R1.7 CC(O)c1[n]cc[s]1 Amb19649204 [0,1,0,0,0,0|1,1,0]=3 1283 B8R1.7 CC(O)c1c[nH][n][n]1 Amb23401961 [0,1,0,0,0,0|3,0,0]=4 1284 B8R1.7 CC(O)c1c[nH]c[n]1 Amb22886902 [0,1,0,0,0,0|2,0,0]=3 1285 B8R1.7 CC(O)c1c[nH]c[n]1 Amb24399468 [0,1,0,0,0,0|2,0,0]=3 1286 B8R1.7 CC(O)c1c[n]c[s]1 Amb19515392 [0,1,0,0,0,0|1,1,0]=3 1287 B8R1.7 CC(O)c1c[n]oc1 Amb24474614 [0,1,0,0,0,0|3,0,0]=4 1288 B8R1.7 CC(O)c1c[s][n][n]1 Amb25797224 [0,1,0,0,0,0|3,0,0]=4 1289 B8R1.7 CC(O)c1ccc[nH]1 Amb20618684 [0,1,0,0,0,0|1,0,0]=2 1290 B8R1.7 CC(O)c1cco[n]1 Amb25758389 [0,1,0,0,0,0|2,0,0]=3 1291 B8R1.7 CC(O)c1coc[n]1 Amb24412519 [0,1,0,0,0,0|2,0,0]=3 1292 B8R1.7 CC(S)c1c[s]c[n]1 Amb25103852 [0,1,0,0,0,0|2,1,0]=4 1293 B8R1.7 CC(S)c1cocc1 Amb25727398 [0,1,0,0,0,0|2,1,0]=4 1294 B8R1.7 CC(c1cc[nH]n1)O Amb13951666 [0,1,0,0,0,0|2,0,0]=3 1295 B8R1.7 CC(c1ccco1)Cl Amb17138373 [0,1,0,0,0,0|1,0,0]=2 1296 B8R1.7 CC(c1ccco1)N Amb1154062 [0,1,0,0,0,0|1,0,0]=2 1297 B8R1.7 CC(c1cccs1)Br Amb17447081 [0,1,0,0,0,0|1,1,0]=3 1298 B8R1.7 CC(c1cccs1)Cl Amb17138413 [0,1,0,0,0,0|1,1,0]=3 1299 B8R1.7 CC(c1cccs1)N Amb1790688 [0,1,0,0,0,0|1,1,0]=3 1300 B8R1.7 CC(c1ccn[nH]1)C Amb15701492 [0,1,0,0,0,0|3,0,0]=4 1301 B8R1.7 CC(c1cocc1)O Amb2440797 [0,1,0,0,0,0|2,0,0]=3 1302 B8R1.7 CC(c1cscc1)N Amb13952135 [0,1,0,0,0,0|3,0,0]=4 1303 B8R1.7 CC(c1ncco1)C Amb17399790 [0,1,0,0,0,0|2,0,0]=3 1304 B8R1.7 CC(c1nccs1)C Amb10601014 [0,1,0,0,0,0|2,1,0]=4 1305 B8R1.7 CC(c1ncsc1)C Amb13884092 [0,1,0,0,0,0|3,0,0]=4 1306 B8R1.7 CC(c1nnco1)N Amb17079553 [0,1,0,0,0,0|3,0,0]=4 1307 B8R1.7 CC(n1cccn1)C Amb2582754 [0,1,0,0,0,0|3,0,0]=4 1308 B8R1.7 CN(C)c1ccco1 Amb24655902 [0,1,0,0,0,0|2,0,0]=3 1309 B8R1.7 CS(=O)c1ccco1 Amb25208644 [0,1,0,0,0,0|1,0,1]=3 1310 B8R1.7 C[C@@H](N)c1[nH]cc[n]1 Amb18203389 [0,1,0,0,0,0|3,0,0]=4 1311 B8R1.7 C[C@@H](N)c1[n][n]co1 Amb24626986 [0,1,0,0,0,0|3,0,0]=4 1312 B8R1.7 C[C@@H](N)c1[n]c[n]o1 Amb18833075 [0,1,0,0,0,0|3,0,0]=4 1313 B8R1.7 C[C@@H](N)c1[n]cc[s]1 Amb19115342 [0,1,0,0,0,0|2,1,0]=4 1314 B8R1.7 C[C@@H](N)c1[n]cc[s]1 Amb22754035 [0,1,0,0,0,0|2,1,0]=4 1315 B8R1.7 C[C@@H](N)c1[n]cco1 Amb19374517 [0,1,0,0,0,0|2,0,0]=3 1316 B8R1.7 C[C@@H](N)c1c[n]c[nH]1 Amb18203390 [0,1,0,0,0,0|3,0,0]=4 1317 B8R1.7 C[C@@H](N)c1c[n]c[s]1 Amb19374315 [0,1,0,0,0,0|2,1,0]=4 1318 B8R1.7 C[C@@H](N)c1c[n]co1 Amb22748747 [0,1,0,0,0,0|2,0,0]=3 1319 B8R1.7 C[C@@H](N)c1cc[nH][n]1 Amb18833101 [0,1,0,0,0,0|3,0,0]=4 1320 B8R1.7 C[C@@H](N)c1ccc[s]1 Amb19514729 [0,1,0,0,0,0|1,1,0]=3 1321 B8R1.7 C[C@@H](O)C=1CCCC1 Amb24545891 [0,1,0,0,0,0|1,0,2]=4 1322 B8R1.7 C[C@@H](O)c1[n]cc[s]1 Amb19338124 [0,1,0,0,0,0|1,1,0]=3 1323 B8R1.7 C[C@@H](O)c1c[nH][n][n]1 Amb24340091 [0,1,0,0,0,0|3,0,0]=4 1324 B8R1.7 C[C@@H](O)c1c[nH]c[n]1 Amb25296818 [0,1,0,0,0,0|2,0,0]=3 1325 B8R1.7 C[C@@H](O)c1c[nH]cc1 Amb24635383 [0,1,0,0,0,0|2,0,0]=3 1326 B8R1.7 C[C@@H](O)c1c[n]c[s]1 Amb19515388 [0,1,0,0,0,0|1,1,0]=3 1327 B8R1.7 C[C@@H](O)c1c[s]c[n]1 Amb24426954 [0,1,0,0,0,0|2,0,0]=3 1328 B8R1.7 C[C@@H](c1ccc[nH]1)O Amb13953007 [0,1,0,0,0,0|1,0,0]=2 1329 B8R1.7 C[C@@H](c1ccco1)N Amb13952985 [0,1,0,0,0,0|1,0,0]=2 1330 B8R1.7 C[C@@H](c1cccs1)N Amb13952997 [0,1,0,0,0,0|1,1,0]=3 1331 B8R1.7 C[C@@H](c1cccs1)O Amb13952996 [0,1,0,0,0,0|0,1,0]=2 1332 B8R1.7 C[C@@H](c1nccs1)N Amb17602653 [0,1,0,0,0,0|2,1,0]=4 1333 B8R1.7 C[C@H](N)c1[nH]cc[n]1 Amb25799863 [0,1,0,0,0,0|3,0,0]=4 1334 B8R1.7 C[C@H](N)c1[n][n]co1 Amb25364495 [0,1,0,0,0,0|3,0,0]=4 1335 B8R1.7 C[C@H](N)c1[n]c[n]o1 Amb24554562 [0,1,0,0,0,0|3,0,0]=4 1336 B8R1.7 C[C@H](N)c1[n]cc[s]1 Amb23385338 [0,1,0,0,0,0|2,1,0]=4 1337 B8R1.7 C[C@H](N)c1c[n]c[nH]1 Amb25296514 [0,1,0,0,0,0|3,0,0]=4 1338 B8R1.7 C[C@H](N)c1c[n]c[s]1 Amb24481398 [0,1,0,0,0,0|2,1,0]=4 1339 B8R1.7 C[C@H](N)c1c[s]cc1 Amb22641886 [0,1,0,0,0,0|3,0,0]=4 1340 B8R1.7 C[C@H](N)c1coc[n]1 Amb25222869 [0,1,0,0,0,0|3,0,0]=4 1341 B8R1.7 C[C@H](N)c1cocc1 Amb24455235 [0,1,0,0,0,0|3,0,0]=4 1342 B8R1.7 C[C@H](O)C1CC=CC1 Amb25144613 [0,1,0,0,0,0|1,0,2]=4 1343 B8R1.7 C[C@H](O)[C@@H]1C=CCO1 Amb24620929 [0,1,0,0,0,0|0,0,2]=3 1344 B8R1.7 C[C@H](O)[n]1cccc1 Amb25846939 [0,1,0,0,0,0|2,0,0]=3 1345 B8R1.7 C[C@H](O)c1c[nH][n][n]1 Amb24388096 [0,1,0,0,0,0|3,0,0]=4 1346 B8R1.7 C[C@H](O)c1c[nH]c[n]1 Amb25833712 [0,1,0,0,0,0|2,0,0]=3 1347 B8R1.7 C[C@H](O)c1c[nH]cc1 Amb25060835 [0,1,0,0,0,0|2,0,0]=3 1348 B8R1.7 C[C@H](O)c1c[n]c[s]1 Amb25697062 [0,1,0,0,0,0|1,1,0]=3 1349 B8R1.7 C[C@H](O)c1c[s]c[n]1 Amb24568211 [0,1,0,0,0,0|2,0,0]=3 1350 B8R1.7 C[C@H](O)c1cc[nH][n]1 Amb25103370 [0,1,0,0,0,0|2,0,0]=3 1351 B8R1.7 C[C@H](c1ccc[nH]1)O Amb13953008 [0,1,0,0,0,0|1,0,0]=2 1352 B8R1.7 C[C@H](c1ccco1)N Amb13952986 [0,1,0,0,0,0|1,0,0]=2 1353 B8R1.7 C[C@H](c1cccs1)N Amb13952998 [0,1,0,0,0,0|1,1,0]=3 1354 B8R1.7 C[C@H](c1cccs1)O Amb10603205 [0,1,0,0,0,0|0,1,0]=2 1355 B8R1.7 C[S+](C)c1ccc[nH]1 Amb25055802 [0,1,0,0,0,0|3,0,0]=4 1356 B8R1.7 ClB(Cl)c1ccc[s]1 Amb24637200 [0,1,0,0,0,0|2,1,0]=4 1357 B8R1.7 ClC(=O)c1cccs1 Amb1157175 [0,1,0,0,0,0|0,1,2]=4 1358 B8R1.7 ClC(Br)C1C=CCO1 Amb25745586 [0,1,0,0,0,0|1,0,2]=4 1359 B8R1.7 ClC(Cl)C1C=CCO1 Amb25115140 [0,1,0,0,0,0|1,0,2]=4 1360 B8R1.7 ClC(Cl)c1[n]cco1 Amb22277100 [0,1,0,0,0,0|2,0,0]=3 1361 B8R1.7 ClC(Cl)c1c[nH]cc1 Amb25253680 [0,1,0,0,0,0|3,0,0]=4 1362 B8R1.7 ClC(Cl)c1cc[nH][n]1 Amb24408894 [0,1,0,0,0,0|3,0,0]=4 1363 B8R1.7 ClC(Cl)c1ccco1 Amb25373858 [0,1,0,0,0,0|1,0,0]=2 1364 B8R1.7 ClP(Cl)c1ccc[nH]1 Amb24724775 [0,1,0,0,0,0|3,0,0]=4 1365 B8R1.7 ClP(Cl)c1ccco1 Amb24530199 [0,1,0,0,0,0|2,0,0]=3 1366 B8R1.7 FB(F)c1ccc[s]1 Amb25336805 [0,1,0,0,0,0|2,1,0]=4 1367 B8R1.7 FC(F)[n]1cccc1 Amb25374139 [0,1,0,0,0,0|3,0,0]=4 1368 B8R1.7 FC(F)c1[nH]cc[n]1 Amb24469028 [0,1,0,0,0,0|3,0,0]=4 1369 B8R1.7 FC(F)c1c[nH]c[n]1 Amb24435461 [0,1,0,0,0,0|3,0,0]=4 1370 B8R1.7 FC(F)c1c[s]c[n]1 Amb24632289 [0,1,0,0,0,0|3,0,0]=4 1371 B8R1.7 FC(F)c1c[s]cc1 Amb25376198 [0,1,0,0,0,0|3,0,0]=4 1372 B8R1.7 FC(F)c1ccc[nH]1 Amb20669755 [0,1,0,0,0,0|2,0,0]=3 1373 B8R1.7 FC(c1cc[nH]n1)F Amb10789268 [0,1,0,0,0,0|3,0,0]=4 1374 B8R1.7 N=C(O)c1coc[n]1 Amb21928044 [0,1,0,0,0,0|2,0,1]=4 1375 B8R1.7 NC(=N)c1[n]cco1 Amb25735054 [0,1,0,0,0,0|2,0,1]=4 1376 B8R1.7 NC(=N)c1c[n]co1 Amb25200229 [0,1,0,0,0,0|2,0,1]=4 1377 B8R1.7 NC(=N)c1ccc[nH]1 Amb22736696 [0,1,0,0,0,0|2,0,1]=4 1378 B8R1.7 NC(=N)c1ccco1 Amb13952844 [0,1,0,0,0,0|1,0,1]=3 1379 B8R1.7 NC(=O)c1[n]cco1 Amb21963562 [0,1,0,0,0,0|1,0,2]=4 1380 B8R1.7 NC(=O)c1c[n]co1 Amb22000976 [0,1,0,0,0,0|1,0,2]=4 1381 B8R1.7 NC(=O)c1ccc[nH]1 Amb10068201 [0,1,0,0,0,0|1,0,2]=4 1382 B8R1.7 NC(=S)c1[n]cco1 Amb24074267 [0,1,0,0,0,0|1,1,1]=4 1383 B8R1.7 NC(=S)c1c[n]co1 Amb21928050 [0,1,0,0,0,0|1,1,1]=4 1384 B8R1.7 NC(=S)c1ccc[nH]1 Amb21948859 [0,1,0,0,0,0|1,1,1]=4 1385 B8R1.7 NC(=S)c1ccco1 Amb2099744 [0,1,0,0,0,0|0,1,1]=3 1386 B8R1.7 NC(=S)c1cccs1 Amb1152349 [0,1,0,0,0,0|0,2,1]=4 1387 B8R1.7 NC(N)=C1C=CC=N1 Amb25711339 [0,1,0,0,0,0|2,0,1]=4 1388 B8R1.7 NS(=O)c1ccc[nH]1 Amb24516116 [0,1,0,0,0,0|2,0,1]=4 1389 B8R1.7 NS(=O)c1ccco1 Amb25216299 [0,1,0,0,0,0|1,0,1]=3 1390 B8R1.7 O=C(Br)c1ccc[nH]1 Amb24465473 [0,1,0,0,0,0|1,0,2]=4 1391 B8R1.7 O=C(Br)c1ccco1 Amb24093659 [0,1,0,0,0,0|0,0,2]=3 1392 B8R1.7 O=C(Cl)c1ccc[nH]1 Amb24090836 [0,1,0,0,0,0|1,0,2]=4 1393 B8R1.7 O=C(F)c1ccco1 Amb25223795 [0,1,0,0,0,0|0,0,2]=3 1394 B8R1.7 O=N(=O)c1ccc[s]1 Amb20621934 [0,1,0,0,0,0|1,1,1]=4 1395 B8R1.7 O=S(Cl)c1ccc[nH]1 Amb24518856 [0,1,0,0,0,0|2,0,1]=4 1396 B8R1.7 O=S(Cl)c1ccc[s]1 Amb18563780 [0,1,0,0,0,0|1,1,1]=4 1397 B8R1.7 OB(O)C1=CCCO1 Amb22168857 [0,1,0,0,0,0|1,0,2]=4 1398 B8R1.7 OB(O)C1C=CC=C1 Amb24718627 [0,1,0,0,0,0|2,0,1]=4 1399 B8R1.7 OB(O)c1[cH-]ccc1 Amb24121492 [0,1,0,0,0,0|2,0,0]=3 1400 B8R1.7 OB(O)c1[cH-]ccc1 Amb24121494 [0,1,0,0,0,0|2,0,0]=3 1401 B8R1.7 OB(O)c1[cH-]ccc1 Amb24122588 [0,1,0,0,0,0|2,0,0]=3 1402 B8R1.7 OB(O)c1[cH-]ccc1 Amb24122589 [0,1,0,0,0,0|2,0,0]=3 1403 B8R1.7 OB(O)c1[nH]cc[n]1 Amb19958132 [0,1,0,0,0,0|3,0,0]=4 1404 B8R1.7 OB(O)c1[n]cco1 Amb20242285 [0,1,0,0,0,0|2,0,0]=3 1405 B8R1.7 OB(O)c1c[nH]c[n]1 Amb20247925 [0,1,0,0,0,0|3,0,0]=4 1406 B8R1.7 OB(O)c1c[nH]cc1 Amb20241300 [0,1,0,0,0,0|3,0,0]=4 1407 B8R1.7 OB(O)c1c[n]c[s]1 Amb24055141 [0,1,0,0,0,0|2,1,0]=4 1408 B8R1.7 OB(O)c1c[n]co1 Amb20248129 [0,1,0,0,0,0|2,0,0]=3 1409 B8R1.7 OB(O)c1c[s]c[n]1 Amb19958736 [0,1,0,0,0,0|3,0,0]=4 1410 B8R1.7 OB(O)c1cc[nH][n]1 Amb21856513 [0,1,0,0,0,0|3,0,0]=4 1411 B8R1.7 OB(O)c1cc[nH][n]1 Amb22587704 [0,1,0,0,0,0|3,0,0]=4 1412 B8R1.7 OB(O)c1cc[n][s]1 Amb22756461 [0,1,0,0,0,0|2,1,0]=4 1413 B8R1.7 OB(O)c1cc[s][n]1 Amb25172183 [0,1,0,0,0,0|3,0,0]=4 1414 B8R1.7 OB(O)c1ccc[nH]1 Amb20247926 [0,1,0,0,0,0|2,0,0]=3 1415 B8R1.7 OB(O)c1cco[n]1 Amb24725864 [0,1,0,0,0,0|3,0,0]=4 1416 B8R1.7 OB(O)c1coc[n]1 Amb24105534 [0,1,0,0,0,0|3,0,0]=4 1417 B8R1.7 OB(O)c1ncc[nH]1 Amb17942804 [0,1,0,0,0,0|3,0,0]=4 1418 B8R1.7 OB(c1ccc[se]1)O Amb10070609 [0,1,0,0,0,0|1,1,0]=3 1419 B8R1.7 OB(c1ccco1)O Amb2235054 [0,1,0,0,0,0|1,0,0]=2 1420 B8R1.7 OB(c1ccn[nH]1)O Amb1092532 [0,1,0,0,0,0|3,0,0]=4 1421 B8R1.7 OB(c1cocc1)O Amb2456008 [0,1,0,0,0,0|3,0,0]=4 1422 B8R1.7 OB(c1cscc1)O Amb2456056 [0,1,0,0,0,0|3,0,0]=4 1423 B8R1.7 OC(=O)C1=CC=CC1 Amb10574923 [0,1,0,0,0,0|1,0,1]=3 1424 B8R1.7 OC(=O)C1=CCCO1 Amb19148920 [0,1,0,0,0,0|0,0,3]=4 1425 B8R1.7 OC(=O)C1C=CCO1 Amb18641762 [0,1,0,0,0,0|0,0,3]=4 1426 B8R1.7 OC(=O)C=1C=CCN1 Amb25178644 [0,1,0,0,0,0|1,0,2]=4 1427 B8R1.7 OC(=O)C=1CC=CC1 Amb24553923 [0,1,0,0,0,0|1,0,1]=3 1428 B8R1.7 OC(=O)c1[n][n]co1 Amb21964326 [0,1,0,0,0,0|2,0,1]=4 1429 B8R1.7 OC(=O)c1[n]cco1 Amb22899196 [0,1,0,0,0,0|1,0,1]=3 1430 B8R1.7 OC(=O)c1c[nH]cn1 Amb1969735 [0,1,0,0,0,0|2,0,1]=4 1431 B8R1.7 OC(=O)c1c[n][n]o1 Amb24651283 [0,1,0,0,0,0|2,0,1]=4 1432 B8R1.7 OC(=O)c1c[s]c[n]1 Amb21953919 [0,1,0,0,0,0|2,0,1]=4 1433 B8R1.7 OC(=O)c1cc[nH]c1 Amb17942956 [0,1,0,0,0,0|2,0,1]=4 1434 B8R1.7 OC(=O)c1cc[s][n]1 Amb19894963 [0,1,0,0,0,0|2,0,1]=4 1435 B8R1.7 OC(=O)c1ccc[nH]1 Amb1154382 [0,1,0,0,0,0|1,0,1]=3 1436 B8R1.7 OC(=O)c1ccc[pH]1 Amb24690352 [0,1,0,0,0,0|1,0,1]=3 1437 B8R1.7 OC(=O)c1ccc[s]1 Amb22730855 [0,1,0,0,0,0|0,1,1]=3 1438 B8R1.7 OC(=O)c1ccn[nH]1 Amb1301347 [0,1,0,0,0,0|2,0,1]=4 1439 B8R1.7 OC(=O)c1ccno1 Amb1152220 [0,1,0,0,0,0|1,0,1]=3 1440 B8R1.7 OC(=O)c1ccns1 Amb1091955 [0,1,0,0,0,0|1,1,1]=4 1441 B8R1.7 OC(=O)c1cnco1 Amb1158212 [0,1,0,0,0,0|1,0,1]=3 1442 B8R1.7 OC(=O)c1cncs1 Amb1158214 [0,1,0,0,0,0|1,1,1]=4 1443 B8R1.7 OC(=O)c1cocn1 Amb10071584 [0,1,0,0,0,0|2,0,1]=4 1444 B8R1.7 OC(=O)c1cscc1 Amb1156673 [0,1,0,0,0,0|2,0,1]=4 1445 B8R1.7 OC(=O)c1cscn1 Amb17039667 [0,1,0,0,0,0|2,0,1]=4 1446 B8R1.7 OC(=O)c1cscn1 Amb2455731 [0,1,0,0,0,0|2,0,1]=4 1447 B8R1.7 OC(=S)[n]1cccc1 Amb24060867 [0,1,0,0,0,0|2,0,1]=4 1448 B8R1.7 OC(=S)c1c[n]c[s]1 Amb24756433 [0,1,0,0,0,0|1,1,1]=4 1449 B8R1.7 OC(=S)c1c[s]c[n]1 Amb24099736 [0,1,0,0,0,0|2,0,1]=4 1450 B8R1.7 OC(=S)c1ccco1 Amb20621386 [0,1,0,0,0,0|0,0,1]=2 1451 B8R1.7 OC(O)[n]1c[n]cc1 Amb24355222 [0,1,0,0,0,0|3,0,0]=4 1452 B8R1.7 OC(O)c1ccc[s]1 Amb25220947 [0,1,0,0,0,0|0,1,0]=2 1453 B8R1.7 OC(O)c1ccco1 Amb25745778 [0,1,0,0,0,0|0,0,0]=1 1454 B8R1.7 OS(=O)c1c[nH]cc1 Amb18221892 [0,1,0,0,0,0|3,0,0]=4 1455 B8R1.7 OS(=O)c1ccc[nH]1 Amb24651386 [0,1,0,0,0,0|2,0,0]=3 1456 B8R1.7 OS(=O)c1ccc[s]1 Amb18063457 [0,1,0,0,0,0|1,1,0]=3 1457 B8R1.7 S=C(Cl)c1ccc[s]1 Amb25223491 [0,1,0,0,0,0|0,2,1]=4 1458 B8R1.7 SC(=S)c1ccco1 Amb25024360 [0,1,0,0,0,0|0,1,1]=3 1459 B8R1.7 [O-]C(=O)c1[n]cco1 Amb19889813 [0,1,0,0,0,0|1,0,2]=4 1460 B8R1.7 [O-]C(=O)c1ccco1 Amb22748857 [0,1,0,0,0,0|0,0,2]=3 1461 B8R1.7 [O-]C(=O)c1ccco1 Amb22753185 [0,1,0,0,0,0|0,0,2]=3 1462 B8R1.7 [O-]C(=O)c1cccs1 Amb10067272 [0,1,0,0,0,0|0,1,2]=4 1463 B8R1.7 [O-]C(=O)c1cccs1 Amb10071470 [0,1,0,0,0,0|0,1,2]=4 1464 B8R1.7 [O-]S(=O)c1ccc[s]1 Amb19944454 [0,1,0,0,0,0|1,1,1]=4 1465 B8R1.7 [O-][N+](=O)c1ccc[nH]1 Amb19958161 [0,1,0,0,0,0|2,0,1]=4 1466 B8R1.7 [O-][N+](=O)c1ccco1 Amb10573954 [0,1,0,0,0,0|1,0,1]=3 1467 B8R1.7 [O-][N+](=O)c1cccs1 Amb1208024 [0,1,0,0,0,0|1,1,1]=4 1468 B8R1.8 BrC#Cc1cccs1 Amb17940364 [0,1,0,0,0,0|1,1,1]=4 1469 B8R1.8 BrCCC1OC=CO1 Amb25185124 [0,1,0,0,0,0|2,0,1]=4 1470 B8R1.8 BrCC[n]1cccc1 Amb17933298 [0,1,0,0,0,0|3,0,0]=4 1471 B8R1.8 BrCCc1[n]cc[s]1 Amb25189038 [0,1,0,0,0,0|2,1,0]=4 1472 B8R1.8 BrCCc1c[nH]cc1 Amb18862863 [0,1,0,0,0,0|3,0,0]=4 1473 B8R1.8 BrCCc1c[n]c[nH]1 Amb24483232 [0,1,0,0,0,0|3,0,0]=4 1474 B8R1.8 BrCCc1c[s]c[n]1 Amb24357977 [0,1,0,0,0,0|3,0,0]=4 1475 B8R1.8 BrCCc1c[s]cc1 Amb18325324 [0,1,0,0,0,0|3,0,0]=4 1476 B8R1.8 BrCCc1cc[n][s]1 Amb24622827 [0,1,0,0,0,0|2,1,0]=4 1477 B8R1.8 BrCCc1ccc[nH]1 Amb25312927 [0,1,0,0,0,0|2,0,0]=3 1478 B8R1.8 BrCCc1ccco1 Amb22752866 [0,1,0,0,0,0|1,0,0]=2 1479 B8R1.8 BrCCc1cccs1 Amb16234134 [0,1,0,0,0,0|1,1,0]=3 1480 B8R1.8 BrCCc1cocc1 Amb19374721 [0,1,0,0,0,0|3,0,0]=4 1481 B8R1.8 Br\C=C/c1ccc[s]1 Amb25286558 [0,1,0,0,0,0|1,1,1]=4 1482 B8R1.8 Br\C=C/c1ccco1 Amb24505348 [0,1,0,0,0,0|1,0,1]=3 1483 B8R1.8 Br\C=C\c1ccc[s]1 Amb25305690 [0,1,0,0,0,0|1,1,1]=4 1484 B8R1.8 C#CC[n]1ccc[n]1 Amb19373110 [0,1,0,0,0,0|3,0,0]=4 1485 B8R1.8 C#CCc1c[nH]cc1 Amb25111553 [0,1,0,0,0,0|3,0,0]=4 1486 B8R1.8 C#CCc1c[s]cc1 Amb24653945 [0,1,0,0,0,0|3,0,0]=4 1487 B8R1.8 C#CSc1ccc[s]1 Amb25270779 [0,1,0,0,0,0|1,1,1]=4 1488 B8R1.8 C(c1ccno1)C#N Amb1106087 [0,1,0,0,0,0|2,0,0]=3 1489 B8R1.8 C(c1cnco1)C#N Amb10071197 [0,1,0,0,0,0|2,0,0]=3 1490 B8R1.8 C(c1cocn1)C#N Amb10071195 [0,1,0,0,0,0|3,0,0]=4 1491 B8R1.8 C=C=Cc1ccc[s]1 Amb25258062 [0,1,0,0,0,0|1,1,1]=4 1492 B8R1.8 C=CCc1[nH]cc[n]1 Amb22733979 [0,1,0,0,0,0|3,0,0]=4 1493 B8R1.8 C=CCc1c[nH]cc1 Amb24426386 [0,1,0,0,0,0|3,0,0]=4 1494 B8R1.8 C=CCc1c[s]c[n]1 Amb24737039 [0,1,0,0,0,0|3,0,0]=4 1495 B8R1.8 C=CCc1cc[nH][n]1 Amb24353819 [0,1,0,0,0,0|3,0,0]=4 1496 B8R1.8 C=CCc1cc[s][n]1 Amb25804826 [0,1,0,0,0,0|3,0,0]=4 1497 B8R1.8 C=CCc1ccc[nH]1 Amb25075519 [0,1,0,0,0,0|2,0,0]=3 1498 B8R1.8 C=CCc1cocc1 Amb24729373 [0,1,0,0,0,0|3,0,0]=4 1499 B8R1.8 C=CNc1ccco1 Amb24516221 [0,1,0,0,0,0|1,0,1]=3 1500 B8R1.8 C=CSc1ccc[nH]1 Amb24481497 [0,1,0,0,0,0|2,0,1]=4 1501 B8R1.8 C=NCc1[n]cc[s]1 Amb24517142 [0,1,0,0,0,0|2,1,0]=4 1502 B8R1.8 CC#Cc1ccco1 Amb24596672 [0,1,0,0,0,0|1,0,1]=3 1503 B8R1.8 CCCc1[n][n]co1 Amb20171389 [0,1,0,0,0,0|3,0,0]=4 1504 B8R1.8 CCCc1cc[nH][n]1 Amb22059626 [0,1,0,0,0,0|3,0,0]=4 1505 B8R1.8 CCCc1ccco1 Amb10070288 [0,1,0,0,0,0|1,0,0]=2 1506 B8R1.8 CCCc1ccsc1 Amb17689448 [0,1,0,0,0,0|3,0,0]=4 1507 B8R1.8 CCCc1cocc1 Amb24332079 [0,1,0,0,0,0|3,0,0]=4 1508 B8R1.8 CCCc1cscn1 Amb13884094 [0,1,0,0,0,0|3,0,0]=4 1509 B8R1.8 CCN[n]1cccc1 Amb25277204 [0,1,0,0,0,0|3,0,0]=4 1510 B8R1.8 CCNc1[nH]cc[n]1 Amb20668385 [0,1,0,0,0,0|3,0,0]=4 1511 B8R1.8 CCNc1[nH]cc[n]1 Amb22059268 [0,1,0,0,0,0|3,0,0]=4 1512 B8R1.8 CCNc1[n]cc[s]1 Amb22755883 [0,1,0,0,0,0|2,1,0]=4 1513 B8R1.8 CCNc1[n]cco1 Amb25744100 [0,1,0,0,0,0|2,0,0]=3 1514 B8R1.8 CCNc1c[nH]cc1 Amb25717948 [0,1,0,0,0,0|3,0,0]=4 1515 B8R1.8 CCNc1c[n]c[nH]1 Amb25223483 [0,1,0,0,0,0|3,0,0]=4 1516 B8R1.8 CCNc1c[n]c[s]1 Amb25360802 [0,1,0,0,0,0|2,1,0]=4 1517 B8R1.8 CCNc1c[s]c[n]1 Amb24099720 [0,1,0,0,0,0|3,0,0]=4 1518 B8R1.8 CCNc1c[s]cc1 Amb25743947 [0,1,0,0,0,0|3,0,0]=4 1519 B8R1.8 CCNc1cc[nH][n]1 Amb18285711 [0,1,0,0,0,0|3,0,0]=4 1520 B8R1.8 CCNc1cc[s][n]1 Amb25732749 [0,1,0,0,0,0|3,0,0]=4 1521 B8R1.8 CCNc1ccc[s]1 Amb18055004 [0,1,0,0,0,0|1,1,0]=3 1522 B8R1.8 CCNc1cco[n]1 Amb18285707 [0,1,0,0,0,0|3,0,0]=4 1523 B8R1.8 CCOc1c[nH]cn1 Amb13883552 [0,1,0,0,0,0|3,0,0]=4 1524 B8R1.8 CCOc1c[n]c[s]1 Amb24511805 [0,1,0,0,0,0|2,1,0]=4 1525 B8R1.8 CCOc1c[s]c[n]1 Amb24086633 [0,1,0,0,0,0|3,0,0]=4 1526 B8R1.8 CCOc1cc[s][n]1 Amb24689281 [0,1,0,0,0,0|3,0,0]=4 1527 B8R1.8 CCOc1ccc[nH]1 Amb22756799 [0,1,0,0,0,0|2,0,0]=3 1528 B8R1.8 CCOc1ccco1 Amb25222294 [0,1,0,0,0,0|1,0,0]=2 1529 B8R1.8 CCOc1nccs1 Amb2455931 [0,1,0,0,0,0|2,1,0]=4 1530 B8R1.8 CCSc1c[nH]c[n]1 Amb25131599 [0,1,0,0,0,0|3,0,0]=4 1531 B8R1.8 CCSc1c[nH]cc1 Amb24481314 [0,1,0,0,0,0|3,0,0]=4 1532 B8R1.8 CCSc1cccs1 Amb17845323 [0,1,0,0,0,0|1,1,0]=3 1533 B8R1.8 CNCc1[nH]cc[n]1 Amb21959916 [0,1,0,0,0,0|3,0,0]=4 1534 B8R1.8 CNCc1[n][n]co1 Amb18284503 [0,1,0,0,0,0|3,0,0]=4 1535 B8R1.8 CNCc1[n]c[n]o1 Amb20629188 [0,1,0,0,0,0|3,0,0]=4 1536 B8R1.8 CNCc1[n]cc[s]1 Amb21959839 [0,1,0,0,0,0|2,1,0]=4 1537 B8R1.8 CNCc1c[nH]c[n]1 Amb18964301 [0,1,0,0,0,0|3,0,0]=4 1538 B8R1.8 CNCc1c[nH]cc1 Amb18062155 [0,1,0,0,0,0|3,0,0]=4 1539 B8R1.8 CNCc1c[n]c[s]1 Amb22728233 [0,1,0,0,0,0|2,1,0]=4 1540 B8R1.8 CNCc1c[s]c[n]1 Amb22586641 [0,1,0,0,0,0|3,0,0]=4 1541 B8R1.8 CNCc1c[s]c[n]1 Amb24079179 [0,1,0,0,0,0|3,0,0]=4 1542 B8R1.8 CNCc1cc[n][nH]1 Amb22586652 [0,1,0,0,0,0|3,0,0]=4 1543 B8R1.8 CNCc1cc[n][s]1 Amb24552327 [0,1,0,0,0,0|2,1,0]=4 1544 B8R1.8 CNCc1cc[n]o1 Amb22831413 [0,1,0,0,0,0|2,0,0]=3 1545 B8R1.8 CNCc1ccco1 Amb1153202 [0,1,0,0,0,0|1,0,0]=2 1546 B8R1.8 CNCc1cccs1 Amb1152299 [0,1,0,0,0,0|1,1,0]=3 1547 B8R1.8 CNCc1cco[n]1 Amb22491522 [0,1,0,0,0,0|3,0,0]=4 1548 B8R1.8 CNCc1cocc1 Amb17658965 [0,1,0,0,0,0|3,0,0]=4 1549 B8R1.8 CNCc1cscc1 Amb1154137 [0,1,0,0,0,0|3,0,0]=4 1550 B8R1.8 COC[n]1ccc[n]1 Amb22546249 [0,1,0,0,0,0|2,0,0]=3 1551 B8R1.8 COC[n]1cccc1 Amb23401113 [0,1,0,0,0,0|2,0,0]=3 1552 B8R1.8 COCc1[n]cc[s]1 Amb24097144 [0,1,0,0,0,0|1,1,0]=3 1553 B8R1.8 COCc1c[n]c[nH]1 Amb22748650 [0,1,0,0,0,0|2,0,0]=3 1554 B8R1.8 COCc1cc[nH][n]1 Amb23536453 [0,1,0,0,0,0|2,0,0]=3 1555 B8R1.8 COCc1ccc[nH]1 Amb24715907 [0,1,0,0,0,0|1,0,0]=2 1556 B8R1.8 COCc1ccc[s]1 Amb25169518 [0,1,0,0,0,0|0,1,0]=2 1557 B8R1.8 COCc1ccco1 Amb24116969 [0,1,0,0,0,0|0,0,0]=1 1558 B8R1.8 COCc1coc[n]1 Amb24333768 [0,1,0,0,0,0|2,0,0]=3 1559 B8R1.8 COCc1cocc1 Amb25180531 [0,1,0,0,0,0|2,0,0]=3 1560 B8R1.8 COCc1n[nH]cn1 Amb10608517 [0,1,0,0,0,0|3,0,0]=4 1561 B8R1.8 COCn1cncc1 Amb10552509 [0,1,0,0,0,0|3,0,0]=4 1562 B8R1.8 COCn1cncn1 Amb10568538 [0,1,0,0,0,0|3,0,0]=4 1563 B8R1.8 CONc1c[s]c[n]1 Amb24541175 [0,1,0,0,0,0|3,0,0]=4 1564 B8R1.8 CSCc1[nH]cc[n]1 Amb24577331 [0,1,0,0,0,0|2,1,0]=4 1565 B8R1.8 CSCc1[n]cc[s]1 Amb24718768 [0,1,0,0,0,0|1,2,0]=4 1566 B8R1.8 CSCc1cc[nH][n]1 Amb23536452 [0,1,0,0,0,0|2,1,0]=4 1567 B8R1.8 CSCc1ccc[nH]1 Amb25082991 [0,1,0,0,0,0|1,1,0]=3 1568 B8R1.8 C[SiH2]Oc1ccco1 Amb25025922 [0,1,0,0,0,0|1,1,0]=3 1569 B8R1.8 C\C=C\c1c[n]co1 Amb25746946 [0,1,0,0,0,0|2,0,1]=4 1570 B8R1.8 C\C=C\c1ccco1 Amb25375449 [0,1,0,0,0,0|1,0,1]=3 1571 B8R1.8 C\N=C\c1ccco1 Amb25186851 [0,1,0,0,0,0|1,0,1]=3 1572 B8R1.8 ClC#Cc1ccc[s]1 Amb24578988 [0,1,0,0,0,0|1,1,1]=4 1573 B8R1.8 ClCC[n]1ccc[n]1 Amb20622682 [0,1,0,0,0,0|3,0,0]=4 1574 B8R1.8 ClCC[n]1cccc1 Amb19944678 [0,1,0,0,0,0|3,0,0]=4 1575 B8R1.8 ClCCc1[nH]cc[n]1 Amb21962091 [0,1,0,0,0,0|3,0,0]=4 1576 B8R1.8 ClCCc1[nH]cc[n]1 Amb22587511 [0,1,0,0,0,0|3,0,0]=4 1577 B8R1.8 ClCCc1[n][n]co1 Amb24660505 [0,1,0,0,0,0|3,0,0]=4 1578 B8R1.8 ClCCc1c[nH]c[n]1 Amb22169609 [0,1,0,0,0,0|3,0,0]=4 1579 B8R1.8 ClCCc1c[nH]c[n]1 Amb22234194 [0,1,0,0,0,0|3,0,0]=4 1580 B8R1.8 ClCCc1c[nH]cc1 Amb18222716 [0,1,0,0,0,0|3,0,0]=4 1581 B8R1.8 ClCCc1cc[nH][n]1 Amb24427342 [0,1,0,0,0,0|3,0,0]=4 1582 B8R1.8 ClCCc1cc[s][n]1 Amb24565283 [0,1,0,0,0,0|3,0,0]=4 1583 B8R1.8 ClCCc1ccco1 Amb24555129 [0,1,0,0,0,0|1,0,0]=2 1584 B8R1.8 ClCCc1cco[n]1 Amb25177951 [0,1,0,0,0,0|3,0,0]=4 1585 B8R1.8 ClCCc1cscn1 Amb10608058 [0,1,0,0,0,0|3,0,0]=4 1586 B8R1.8 ClCSc1[n]cco1 Amb24731778 [0,1,0,0,0,0|2,0,0]=3 1587 B8R1.8 ClC[SiH2]c1ccc[s]1 Amb25060138 [0,1,0,0,0,0|1,1,0]=3 1588 B8R1.8 ClC[SiH2]c1ccco1 Amb24481375 [0,1,0,0,0,0|1,0,0]=2 1589 B8R1.8 ClNCc1coc[n]1 Amb22499365 [0,1,0,0,0,0|3,0,0]=4 1590 B8R1.8 ClSCc1ccco1 Amb24708258 [0,1,0,0,0,0|0,1,0]=2 1591 B8R1.8 Cl[Mg]Cc1ccco1 Amb20242525 [0,1,0,0,0,0|1,0,0]=2 1592 B8R1.8 Cl\C=C/c1ccco1 Amb25746738 [0,1,0,0,0,0|1,0,1]=3 1593 B8R1.8 Cl\C=C\c1ccc[s]1 Amb24635042 [0,1,0,0,0,0|1,1,1]=4 1594 B8R1.8 FCC[n]1ccc[n]1 Amb23449774 [0,1,0,0,0,0|3,0,0]=4 1595 B8R1.8 ICC[n]1ccc[n]1 Amb24735338 [0,1,0,0,0,0|3,0,0]=4 1596 B8R1.8 ICCc1c[s]cc1 Amb25857183 [0,1,0,0,0,0|3,0,0]=4 1597 B8R1.8 ICCc1ccc[s]1 Amb25106538 [0,1,0,0,0,0|1,1,0]=3 1598 B8R1.8 I\C=C\c1ccc[s]1 Amb25663240 [0,1,0,0,0,0|1,1,1]=4 1599 B8R1.8 I\C=C\c1ccco1 Amb24697510 [0,1,0,0,0,0|1,0,1]=3 1600 B8R1.8 N#CC[n]1cccc1 Amb22292336 [0,1,0,0,0,0|3,0,0]=4 1601 B8R1.8 N#CCc1[cH-]ccc1 Amb24122587 [0,1,0,0,0,0|2,0,0]=3 1602 B8R1.8 N#CCc1[n]cco1 Amb22055989 [0,1,0,0,0,0|2,0,0]=3 1603 B8R1.8 N#CCc1c[nH]cc1 Amb18224239 [0,1,0,0,0,0|3,0,0]=4 1604 B8R1.8 N#CCc1c[n]c[s]1 Amb18917901 [0,1,0,0,0,0|2,1,0]=4 1605 B8R1.8 N#CCc1ccc[nH]1 Amb19372852 [0,1,0,0,0,0|2,0,0]=3 1606 B8R1.8 N#CCc1cco[n]1 Amb19373962 [0,1,0,0,0,0|3,0,0]=4 1607 B8R1.8 N#CCc1cocc1 Amb18640634 [0,1,0,0,0,0|3,0,0]=4 1608 B8R1.8 N#CCc1cscc1 Amb1155425 [0,1,0,0,0,0|3,0,0]=4 1609 B8R1.8 N#CCn1cccn1 Amb1946504 [0,1,0,0,0,0|3,0,0]=4 1610 B8R1.8 N#CSc1ccc[nH]1 Amb24435226 [0,1,0,0,0,0|2,0,1]=4 1611 B8R1.8 N#CSc1ccco1 Amb24676937 [0,1,0,0,0,0|1,0,1]=3 1612 B8R1.8 N#C[Hg]c1ccco1 Amb22360264 [0,1,0,0,0,0|1,0,1]=3 1613 B8R1.8 N=CCc1c[n]c[nH]1 Amb25163733 [0,1,0,0,0,0|3,0,0]=4 1614 B8R1.8 NCC[C@@H]1C=CCO1 Amb25717373 [0,1,0,0,0,0|1,0,2]=4 1615 B8R1.8 NCC[n]1ccc[n]1 Amb21954209 [0,1,0,0,0,0|3,0,0]=4 1616 B8R1.8 NCC[n]1ccc[n]1 Amb22284088 [0,1,0,0,0,0|3,0,0]=4 1617 B8R1.8 NCC[n]1cccc1 Amb22757166 [0,1,0,0,0,0|3,0,0]=4 1618 B8R1.8 NCC[n]1cccc1 Amb22904207 [0,1,0,0,0,0|3,0,0]=4 1619 B8R1.8 NCCc1[nH]cc[n]1 Amb19373032 [0,1,0,0,0,0|3,0,0]=4 1620 B8R1.8 NCCc1[nH]cc[n]1 Amb22752058 [0,1,0,0,0,0|3,0,0]=4 1621 B8R1.8 NCCc1[n]c[n]o1 Amb20622798 [0,1,0,0,0,0|3,0,0]=4 1622 B8R1.8 NCCc1c[nH]c[n]1 Amb22167389 [0,1,0,0,0,0|3,0,0]=4 1623 B8R1.8 NCCc1c[nH]c[n]1 Amb22265029 [0,1,0,0,0,0|3,0,0]=4 1624 B8R1.8 NCCc1c[nH]c[n]1 Amb22265030 [0,1,0,0,0,0|3,0,0]=4 1625 B8R1.8 NCCc1c[nH]c[n]1 Amb22396005 [0,1,0,0,0,0|3,0,0]=4 1626 B8R1.8 NCCc1c[nH]cc1 Amb18061637 [0,1,0,0,0,0|3,0,0]=4 1627 B8R1.8 NCCc1c[nH]cn1 Amb1101977 [0,1,0,0,0,0|3,0,0]=4 1628 B8R1.8 NCCc1c[n]c[nH]1 Amb22489452 [0,1,0,0,0,0|3,0,0]=4 1629 B8R1.8 NCCc1c[n]c[s]1 Amb22491501 [0,1,0,0,0,0|2,1,0]=4 1630 B8R1.8 NCCc1c[n]c[s]1 Amb22491503 [0,1,0,0,0,0|2,1,0]=4 1631 B8R1.8 NCCc1cc[nH][n]1 Amb21961487 [0,1,0,0,0,0|3,0,0]=4 1632 B8R1.8 NCCc1cc[s][n]1 Amb18832148 [0,1,0,0,0,0|3,0,0]=4 1633 B8R1.8 NCCc1ccc[nH]1 Amb18281448 [0,1,0,0,0,0|2,0,0]=3 1634 B8R1.8 NCCc1ccc[nH]1 Amb22497242 [0,1,0,0,0,0|2,0,0]=3 1635 B8R1.8 NCCc1ccc[nH]1 Amb22751407 [0,1,0,0,0,0|2,0,0]=3 1636 B8R1.8 NCCc1ccco1 Amb1080943 [0,1,0,0,0,0|1,0,0]=2 1637 B8R1.8 NCCc1ccco1 Amb22587649 [0,1,0,0,0,0|1,0,0]=2 1638 B8R1.8 NCCc1cccs1 Amb1073690 [0,1,0,0,0,0|1,1,0]=3 1639 B8R1.8 NCCc1ccn[nH]1 Amb17621964 [0,1,0,0,0,0|3,0,0]=4 1640 B8R1.8 NCCc1cocc1 Amb18833105 [0,1,0,0,0,0|3,0,0]=4 1641 B8R1.8 NCCc1cscc1 Amb2236392 [0,1,0,0,0,0|3,0,0]=4 1642 B8R1.8 NCCc1cscn1 Amb17935894 [0,1,0,0,0,0|3,0,0]=4 1643 B8R1.8 NCCc1nccs1 Amb10072657 [0,1,0,0,0,0|2,1,0]=4 1644 B8R1.8 NCCc1nccs1 Amb15741139 [0,1,0,0,0,0|2,1,0]=4 1645 B8R1.8 NCCc1nnco1 Amb17079560 [0,1,0,0,0,0|3,0,0]=4 1646 B8R1.8 NCCn1cccc1 Amb2422800 [0,1,0,0,0,0|3,0,0]=4 1647 B8R1.8 NCCn1cccn1 Amb1099286 [0,1,0,0,0,0|3,0,0]=4 1648 B8R1.8 NNCC1=CCCO1 Amb24505186 [0,1,0,0,0,0|1,0,2]=4 1649 B8R1.8 NNCc1[nH]cc[n]1 Amb25328254 [0,1,0,0,0,0|3,0,0]=4 1650 B8R1.8 NNCc1c[n]c[s]1 Amb19664525 [0,1,0,0,0,0|2,1,0]=4 1651 B8R1.8 NNCc1cc[n][s]1 Amb24548952 [0,1,0,0,0,0|2,1,0]=4 1652 B8R1.8 NNCc1cc[s][n]1 Amb25358721 [0,1,0,0,0,0|3,0,0]=4 1653 B8R1.8 NNCc1ccc[nH]1 Amb19664692 [0,1,0,0,0,0|2,0,0]=3 1654 B8R1.8 NNCc1ccc[s]1 Amb22587449 [0,1,0,0,0,0|1,1,0]=3 1655 B8R1.8 NNCc1cco[n]1 Amb24465273 [0,1,0,0,0,0|3,0,0]=4 1656 B8R1.8 NOCC=1CCCC1 Amb24729896 [0,1,0,0,0,0|1,0,2]=4 1657 B8R1.8 NOCc1[n]c[nH][n]1 Amb24643333 [0,1,0,0,0,0|3,0,0]=4 1658 B8R1.8 NOCc1c[nH][n]c1 Amb25141382 [0,1,0,0,0,0|3,0,0]=4 1659 B8R1.8 NOCc1c[nH]cc1 Amb25045375 [0,1,0,0,0,0|2,0,0]=3 1660 B8R1.8 NOCc1c[n]c[nH]1 Amb24760953 [0,1,0,0,0,0|2,0,0]=3 1661 B8R1.8 NOCc1c[n]c[s]1 Amb24454699 [0,1,0,0,0,0|1,1,0]=3 1662 B8R1.8 NOCc1c[s]c[n]1 Amb24086590 [0,1,0,0,0,0|2,0,0]=3 1663 B8R1.8 NOCc1c[s]cc1 Amb24746528 [0,1,0,0,0,0|2,0,0]=3 1664 B8R1.8 NOCc1cc[n]o1 Amb24483082 [0,1,0,0,0,0|1,0,0]=2 1665 B8R1.8 NOCc1ccc[s]1 Amb25189036 [0,1,0,0,0,0|0,1,0]=2 1666 B8R1.8 NOCc1ccco1 Amb25141783 [0,1,0,0,0,0|0,0,0]=1 1667 B8R1.8 NOCc1cocc1 Amb24564546 [0,1,0,0,0,0|2,0,0]=3 1668 B8R1.8 N\C=C\C=1BC=CC1 Amb24482577 [0,1,0,0,0,0|2,0,1]=4 1669 B8R1.8 N\C=C\c1[n]cco1 Amb24696858 [0,1,0,0,0,0|2,0,1]=4 1670 B8R1.8 N\C=C\c1ccc[s]1 Amb25745218 [0,1,0,0,0,0|1,1,1]=4 1671 B8R1.8 N\N=C\c1ccc[nH]1 Amb25090365 [0,1,0,0,0,0|2,0,1]=4 1672 B8R1.8 N\N=C\c1ccco1 Amb24370911 [0,1,0,0,0,0|1,0,1]=3 1673 B8R1.8 O=C=Cc1ccco1 Amb25025665 [0,1,0,0,0,0|0,0,2]=3 1674 B8R1.8 O=C=Nc1c[n]co1 Amb25276160 [0,1,0,0,0,0|1,0,2]=4 1675 B8R1.8 O=C=Nc1cc[n]o1 Amb18061875 [0,1,0,0,0,0|1,0,2]=4 1676 B8R1.8 O=CC[n]1cccc1 Amb18203408 [0,1,0,0,0,0|2,0,1]=4 1677 B8R1.8 O=CCc1[n][n]co1 Amb22886659 [0,1,0,0,0,0|2,0,1]=4 1678 B8R1.8 O=CCc1c[nH]c[n]1 Amb18124130 [0,1,0,0,0,0|2,0,1]=4 1679 B8R1.8 O=CCc1c[n]co1 Amb24653904 [0,1,0,0,0,0|1,0,1]=3 1680 B8R1.8 O=CCc1c[s]c[n]1 Amb24469342 [0,1,0,0,0,0|2,0,1]=4 1681 B8R1.8 O=CCc1ccc[nH]1 Amb24763675 [0,1,0,0,0,0|1,0,1]=3 1682 B8R1.8 O=CCc1ccco1 Amb17089526 [0,1,0,0,0,0|0,0,1]=2 1683 B8R1.8 O=CCc1cccs1 Amb17089527 [0,1,0,0,0,0|0,1,1]=3 1684 B8R1.8 O=CCc1cocc1 Amb18641576 [0,1,0,0,0,0|2,0,1]=4 1685 B8R1.8 O=COc1ccc[nH]1 Amb24756546 [0,1,0,0,0,0|1,0,2]=4 1686 B8R1.8 OCCC1=CCC=C1 Amb25700126 [0,1,0,0,0,0|1,0,1]=3 1687 B8R1.8 OCCC1C=CC=C1 Amb25356398 [0,1,0,0,0,0|1,0,1]=3 1688 B8R1.8 OCCC1C=CCO1 Amb24553966 [0,1,0,0,0,0|0,0,2]=3 1689 B8R1.8 OCCC1CC=CC1 Amb24482557 [0,1,0,0,0,0|1,0,2]=4 1690 B8R1.8 OCCC=1CC=CC1 Amb25795365 [0,1,0,0,0,0|1,0,0]=2 1691 B8R1.8 OCCC=1CCCC1 Amb25333041 [0,1,0,0,0,0|1,0,2]=4 1692 B8R1.8 OCCC=1CNCC1 Amb24656485 [0,1,0,0,0,0|2,0,1]=4 1693 B8R1.8 OCC[C@@H]1CCC=C1 Amb25810186 [0,1,0,0,0,0|1,0,2]=4 1694 B8R1.8 OCC[C@H]1CCC=C1 Amb25220996 [0,1,0,0,0,0|1,0,2]=4 1695 B8R1.8 OCC[n+]1c[s]cc1 Amb24518966 [0,1,0,0,0,0|3,0,0]=4 1696 B8R1.8 OCCc1[nH]c[n][n]1 Amb25714270 [0,1,0,0,0,0|3,0,0]=4 1697 B8R1.8 OCCc1[n][n]co1 Amb22500316 [0,1,0,0,0,0|2,0,0]=3 1698 B8R1.8 OCCc1[n]cc[s]1 Amb22235225 [0,1,0,0,0,0|1,1,0]=3 1699 B8R1.8 OCCc1c[nH][n][n]1 Amb19514744 [0,1,0,0,0,0|3,0,0]=4 1700 B8R1.8 OCCc1c[nH]cc1 Amb18860246 [0,1,0,0,0,0|2,0,0]=3 1701 B8R1.8 OCCc1c[nH]nc1 Amb1935046 [0,1,0,0,0,0|3,0,0]=4 1702 B8R1.8 OCCc1c[n][s][n]1 Amb24643038 [0,1,0,0,0,0|3,0,0]=4 1703 B8R1.8 OCCc1c[n]c[nH]1 Amb22436833 [0,1,0,0,0,0|2,0,0]=3 1704 B8R1.8 OCCc1c[n]c[s]1 Amb22371829 [0,1,0,0,0,0|1,1,0]=3 1705 B8R1.8 OCCc1c[s]c[n]1 Amb23536235 [0,1,0,0,0,0|2,0,0]=3 1706 B8R1.8 OCCc1cc[nH][n]1 Amb22728903 [0,1,0,0,0,0|2,0,0]=3 1707 B8R1.8 OCCc1cc[n][s]1 Amb23441022 [0,1,0,0,0,0|1,1,0]=3 1708 B8R1.8 OCCc1ccc[nH]1 Amb17593146 [0,1,0,0,0,0|1,0,0]=2 1709 B8R1.8 OCCc1ccco1 Amb17089516 [0,1,0,0,0,0|0,0,0]=1 1710 B8R1.8 OCCc1cccs1 Amb2099445 [0,1,0,0,0,0|0,1,0]=2 1711 B8R1.8 OCCc1cocc1 Amb25802261 [0,1,0,0,0,0|2,0,0]=3 1712 B8R1.8 OCCc1cocn1 Amb17399797 [0,1,0,0,0,0|2,0,0]=3 1713 B8R1.8 OCCc1conc1 Amb1971497 [0,1,0,0,0,0|3,0,0]=4 1714 B8R1.8 OCNc1[n]c[n][s]1 Amb22497924 [0,1,0,0,0,0|2,1,0]=4 1715 B8R1.8 ON=Cc1c[n]c[nH]1 Amb24394914 [0,1,0,0,0,0|2,0,1]=4 1716 B8R1.8 ON=Cc1c[n]c[s]1 Amb24469825 [0,1,0,0,0,0|1,1,1]=4 1717 B8R1.8 ON=Cc1c[s]c[n]1 Amb25074840 [0,1,0,0,0,0|2,0,1]=4 1718 B8R1.8 ONCc1[nH]cc[n]1 Amb25826668 [0,1,0,0,0,0|2,0,0]=3 1719 B8R1.8 ONCc1c[nH]cc1 Amb25677397 [0,1,0,0,0,0|2,0,0]=3 1720 B8R1.8 ONCc1c[s][n][n]1 Amb25071099 [0,1,0,0,0,0|3,0,0]=4 1721 B8R1.8 ONCc1ccc[nH]1 Amb25071150 [0,1,0,0,0,0|1,0,0]=2 1722 B8R1.8 ONCc1ccc[s]1 Amb23449451 [0,1,0,0,0,0|0,1,0]=2 1723 B8R1.8 ONCc1ccco1 Amb23449450 [0,1,0,0,0,0|0,0,0]=1 1724 B8R1.8 ONCc1coc[n]1 Amb24622144 [0,1,0,0,0,0|2,0,0]=3 1725 B8R1.8 O\C=C/C=1[BH2-][O+]=CC1 Amb25225381 [0,1,0,0,0,0|2,0,1]=4 1726 B8R1.8 O\C=C\C=1[BH2-][O+]=CC1 Amb24583060 [0,1,0,0,0,0|2,0,1]=4 1727 B8R1.8 O\N=C/c1ccco1 Amb10068736 [0,1,0,0,0,0|0,0,1]=2 1728 B8R1.8 O\N=C\C=1CC=CC1 Amb24748669 [0,1,0,0,0,0|1,0,1]=3 1729 B8R1.8 O\N=C\c1[n]cc[s]1 Amb22736216 [0,1,0,0,0,0|1,1,1]=4 1730 B8R1.8 O\N=C\c1c[nH]c[n]1 Amb21953000 [0,1,0,0,0,0|2,0,1]=4 1731 B8R1.8 O\N=C\c1c[nH]cc1 Amb22491065 [0,1,0,0,0,0|2,0,1]=4 1732 B8R1.8 O\N=C\c1c[n]c[s]1 Amb24524534 [0,1,0,0,0,0|1,1,1]=4 1733 B8R1.8 S=C=Nc1ccco1 Amb24743299 [0,1,0,0,0,0|0,1,1]=3 1734 B8R1.8 SCC[n]1ccc[n]1 Amb20624016 [0,1,0,0,0,0|2,1,0]=4 1735 B8R1.8 SCCc1[nH]cc[n]1 Amb25300992 [0,1,0,0,0,0|2,1,0]=4 1736 B8R1.8 SCCc1[n]cc[s]1 Amb20621112 [0,1,0,0,0,0|1,2,0]=4 1737 B8R1.8 SCCc1c[nH]cc1 Amb18560654 [0,1,0,0,0,0|2,1,0]=4 1738 B8R1.8 SCCc1c[n]c[nH]1 Amb25848932 [0,1,0,0,0,0|2,1,0]=4 1739 B8R1.8 SCCc1c[s]c[n]1 Amb25356281 [0,1,0,0,0,0|2,1,0]=4 1740 B8R1.8 SCCc1c[s]cc1 Amb25300451 [0,1,0,0,0,0|2,1,0]=4 1741 B8R1.8 SCCc1ccco1 Amb24511324 [0,1,0,0,0,0|0,1,0]=2 1742 B8R1.8 SCCc1cccs1 Amb17399886 [0,1,0,0,0,0|0,2,0]=3 1743 B8R1.8 [C-]#[N+]Cc1ccco1 Amb1981056 [0,1,0,0,0,0|1,0,0]=2 1744 B8R1.8 [N-]=[N+]=Nc1ccc[s]1 Amb25756826 [0,1,0,0,0,0|2,1,0]=4 1745 B8R1.8 [NH3+]CC[n]1ccc[nH+]1 Amb20671463 [0,1,0,0,0,0|3,0,0]=4 1746 B8R1.8 [O-][N+]#Cc1ccc[s]1 Amb25195389 [0,1,0,0,0,0|0,1,2]=4 1747 B8R1.11 BrCc1[n][nH]cc1I Amb25785797 [0,1,0,0,0,0|3,0,0]=4 1748 B8R1.11 BrCc1[s]ccc1I Amb25327114 [0,1,0,0,0,0|1,1,0]=3 1749 B8R1.11 BrCc1cocc1I Amb25178742 [0,1,0,0,0,0|3,0,0]=4 1750 B8R1.11 Brc1cc[s]c1CBr Amb25793641 [0,1,0,0,0,0|1,1,0]=3 1751 B8R1.11 Brc1ccoc1CBr Amb24539408 [0,1,0,0,0,0|1,0,0]=2 1752 B8R1.11 Brc1ccoc1[Zn]Br Amb22898070 [0,1,0,0,0,0|2,0,0]=3 1753 B8R1.11 Brc1occc1CBr Amb24684501 [0,1,0,0,0,0|3,0,0]=4 1754 B8R1.11 C#Cc1[s]ccc1Br Amb25063906 [0,1,0,0,0,0|1,1,1]=4 1755 B8R1.11 C#Cc1[s]ccc1Cl Amb24360339 [0,1,0,0,0,0|1,1,1]=4 1756 B8R1.11 C=C1OC=CC1CO Amb25115945 [0,1,0,0,0,0|2,0,1]=4 1757 B8R1.11 C=Cc1occc1Br Amb24350839 [0,1,0,0,0,0|1,0,1]=3 1758 B8R1.11 CC1=CCCC1CO Amb25804911 [0,1,0,0,0,0|1,0,2]=4 1759 B8R1.11 CC1C=CCC1CO Amb25169524 [0,1,0,0,0,0|1,0,2]=4 1760 B8R1.11 CCN1CC=CC1=O Amb24511710 [0,1,0,0,0,0|3,0,0]=4 1761 B8R1.11 CC[n]1[n]ccc1Cl Amb23539596 [0,1,0,0,0,0|3,0,0]=4 1762 B8R1.11 CC[n]1[n]ccc1F Amb22008909 [0,1,0,0,0,0|3,0,0]=4 1763 B8R1.11 CC[n]1[n]ccc1I Amb22008931 [0,1,0,0,0,0|3,0,0]=4 1764 B8R1.11 CC[n]1[n]ccc1O Amb25724305 [0,1,0,0,0,0|3,0,0]=4 1765 B8R1.11 CC[n]1ccc[n+]1[O-] Amb24365860 [0,1,0,0,0,0|3,0,0]=4 1766 B8R1.11 CC[n]1cccc1C Amb24541070 [0,1,0,0,0,0|3,0,0]=4 1767 B8R1.11 CC[n]1cccc1Cl Amb24687481 [0,1,0,0,0,0|3,0,0]=4 1768 B8R1.11 CC[n]1cccc1N Amb25745952 [0,1,0,0,0,0|3,0,0]=4 1769 B8R1.11 CC[n]1cccc1O Amb24707823 [0,1,0,0,0,0|3,0,0]=4 1770 B8R1.11 CCc1[nH][n]cc1N Amb18203391 [0,1,0,0,0,0|3,0,0]=4 1771 B8R1.11 CCc1[nH]c[n]c1Br Amb25336978 [0,1,0,0,0,0|3,0,0]=4 1772 B8R1.11 CCc1[nH]c[n]c1N Amb25375055 [0,1,0,0,0,0|3,0,0]=4 1773 B8R1.11 CCc1[nH]ccc1C Amb17938705 [0,1,0,0,0,0|2,0,0]=3 1774 B8R1.11 CCc1[nH]ncc1C Amb10569858 [0,1,0,0,0,0|3,0,0]=4 1775 B8R1.11 CCc1[n][nH]cc1Br Amb19516933 [0,1,0,0,0,0|3,0,0]=4 1776 B8R1.11 CCc1[n][nH]cc1I Amb22500690 [0,1,0,0,0,0|3,0,0]=4 1777 B8R1.11 CCc1[n]c[s]c1Br Amb20617306 [0,1,0,0,0,0|3,0,0]=4 1778 B8R1.11 CCc1[n]c[s]c1N Amb18946568 [0,1,0,0,0,0|3,0,0]=4 1779 B8R1.11 CCc1[n]cc[n]1N Amb25053354 [0,1,0,0,0,0|3,0,0]=4 1780 B8R1.11 CCc1[n]cc[n]1O Amb24418522 [0,1,0,0,0,0|3,0,0]=4 1781 B8R1.11 CCc1[n]coc1Br Amb24518890 [0,1,0,0,0,0|3,0,0]=4 1782 B8R1.11 CCc1[s]c[n]c1Br Amb20617256 [0,1,0,0,0,0|2,1,0]=4 1783 B8R1.11 CCc1[s]c[n]c1N Amb24317504 [0,1,0,0,0,0|2,1,0]=4 1784 B8R1.11 CCc1[s]ccc1Cl Amb25025710 [0,1,0,0,0,0|1,1,0]=3 1785 B8R1.11 CCc1[s]ccc1N Amb18642543 [0,1,0,0,0,0|1,1,0]=3 1786 B8R1.11 CCc1c[nH]cc1C Amb17672340 [0,1,0,0,0,0|3,0,0]=4 1787 B8R1.11 CCc1c[s]cc1Br Amb25343120 [0,1,0,0,0,0|3,0,0]=4 1788 B8R1.11 CCc1ccc[n]1C Amb25746861 [0,1,0,0,0,0|2,0,0]=3 1789 B8R1.11 CCc1ccc[n]1N Amb20621247 [0,1,0,0,0,0|2,0,0]=3 1790 B8R1.11 CCc1ccoc1Br Amb13884533 [0,1,0,0,0,0|3,0,0]=4 1791 B8R1.11 CCc1ccsc1Br Amb13884511 [0,1,0,0,0,0|3,0,0]=4 1792 B8R1.11 CCc1o[n]cc1N Amb18203377 [0,1,0,0,0,0|2,0,0]=3 1793 B8R1.11 CCc1occc1F Amb25223961 [0,1,0,0,0,0|1,0,0]=2 1794 B8R1.11 CCn1nccc1Br Amb17622040 [0,1,0,0,0,0|3,0,0]=4 1795 B8R1.11 CCn1nccc1N Amb1107883 [0,1,0,0,0,0|3,0,0]=4 1796 B8R1.11 CNc1[s]ccc1N Amb21857339 [0,1,0,0,0,0|2,1,0]=4 1797 B8R1.11 CNc1ccc[n]1C Amb25718849 [0,1,0,0,0,0|3,0,0]=4 1798 B8R1.11 COc1[s]ccc1Br Amb24082781 [0,1,0,0,0,0|2,1,0]=4 1799 B8R1.11 COc1[s]ccc1Cl Amb25342492 [0,1,0,0,0,0|2,1,0]=4 1800 B8R1.11 COc1[s]ccc1N Amb19895576 [0,1,0,0,0,0|2,1,0]=4 1801 B8R1.11 COc1ccc[n]1C Amb25124314 [0,1,0,0,0,0|3,0,0]=4 1802 B8R1.11 COc1occc1Br Amb25063328 [0,1,0,0,0,0|2,0,0]=3 1803 B8R1.11 CSc1[s]ccc1O Amb25239140 [0,1,0,0,0,0|2,1,0]=4 1804 B8R1.11 CSc1ccc[n]1C Amb24332974 [0,1,0,0,0,0|3,0,0]=4 1805 B8R1.11 C[C@H]1C=CC[C@H]1CO Amb25235760 [0,1,0,0,0,0|1,0,2]=4 1806 B8R1.11 C[n]1[n]ccc1CBr Amb18790494 [0,1,0,0,0,0|3,0,0]=4 1807 B8R1.11 C[n]1[n]ccc1CBr Amb24269193 [0,1,0,0,0,0|3,0,0]=4 1808 B8R1.11 C[n]1[n]ccc1CCl Amb22587488 [0,1,0,0,0,0|3,0,0]=4 1809 B8R1.11 C[n]1[n]ccc1CN Amb21953680 [0,1,0,0,0,0|3,0,0]=4 1810 B8R1.11 C[n]1[n]ccc1NO Amb24401126 [0,1,0,0,0,0|3,0,0]=4 1811 B8R1.11 C[n]1c[n][n]c1CO Amb19516680 [0,1,0,0,0,0|3,0,0]=4 1812 B8R1.11 C[n]1c[n]cc1CBr Amb23412323 [0,1,0,0,0,0|3,0,0]=4 1813 B8R1.11 C[n]1c[n]cc1CCl Amb20623570 [0,1,0,0,0,0|3,0,0]=4 1814 B8R1.11 C[n]1c[n]cc1CF Amb25234232 [0,1,0,0,0,0|3,0,0]=4 1815 B8R1.11 C[n]1c[n]cc1CI Amb24759889 [0,1,0,0,0,0|3,0,0]=4 1816 B8R1.11 C[n]1c[n]cc1CN Amb22499497 [0,1,0,0,0,0|3,0,0]=4 1817 B8R1.11 C[n]1c[n]cc1CN Amb22886412 [0,1,0,0,0,0|3,0,0]=4 1818 B8R1.11 C[n]1c[n]cc1CS Amb25294856 [0,1,0,0,0,0|2,1,0]=4 1819 B8R1.11 C[n]1cc[n]c1CBr Amb22301112 [0,1,0,0,0,0|3,0,0]=4 1820 B8R1.11 C[n]1cc[n]c1CBr Amb23385230 [0,1,0,0,0,0|3,0,0]=4 1821 B8R1.11 C[n]1cc[n]c1CF Amb22757473 [0,1,0,0,0,0|3,0,0]=4 1822 B8R1.11 C[n]1cc[n]c1CI Amb22301113 [0,1,0,0,0,0|3,0,0]=4 1823 B8R1.11 C[n]1cc[n]c1CN Amb21864560 [0,1,0,0,0,0|3,0,0]=4 1824 B8R1.11 C[n]1cc[n]c1CO Amb20668539 [0,1,0,0,0,0|2,0,0]=3 1825 B8R1.11 C[n]1cc[n]c1CS Amb22301114 [0,1,0,0,0,0|2,1,0]=4 1826 B8R1.11 C[n]1cc[n]c1NO Amb25303561 [0,1,0,0,0,0|3,0,0]=4 1827 B8R1.11 C[n]1cccc1CBr Amb22301108 [0,1,0,0,0,0|2,0,0]=3 1828 B8R1.11 C[n]1cccc1CCl Amb22301109 [0,1,0,0,0,0|2,0,0]=3 1829 B8R1.11 C[n]1cccc1CI Amb22301110 [0,1,0,0,0,0|2,0,0]=3 1830 B8R1.11 C[n]1cccc1CN Amb21959692 [0,1,0,0,0,0|2,0,0]=3 1831 B8R1.11 C[n]1cccc1CS Amb22301111 [0,1,0,0,0,0|1,1,0]=3 1832 B8R1.11 C[n]1cccc1C[O-] Amb22411415 [0,1,0,0,0,0|1,0,1]=3 1833 B8R1.11 C\C=C/1\CC=CC1=O Amb25044340 [0,1,0,0,0,0|2,0,1]=4 1834 B8R1.11 C\C=C/1\OC=CC1=O Amb25217811 [0,1,0,0,0,0|1,0,1]=3 1835 B8R1.11 C\C=C\1/CC=CC1=O Amb25189062 [0,1,0,0,0,0|2,0,1]=4 1836 B8R1.11 Cc1[nH][n][n]c1CO Amb25712097 [0,1,0,0,0,0|3,0,0]=4 1837 B8R1.11 Cc1[nH]c[n]c1CC Amb22733857 [0,1,0,0,0,0|3,0,0]=4 1838 B8R1.11 Cc1[nH]c[n]c1CN Amb18948209 [0,1,0,0,0,0|3,0,0]=4 1839 B8R1.11 Cc1[nH]c[n]c1CN Amb20623532 [0,1,0,0,0,0|3,0,0]=4 1840 B8R1.11 Cc1[nH]c[n]c1CO Amb22489503 [0,1,0,0,0,0|2,0,0]=3 1841 B8R1.11 Cc1[nH]ccc1CN Amb18833115 [0,1,0,0,0,0|3,0,0]=4 1842 B8R1.11 Cc1[n][s]cc1CO Amb23441231 [0,1,0,0,0,0|3,0,0]=4 1843 B8R1.11 Cc1[n]c[nH]c1CBr Amb25115115 [0,1,0,0,0,0|3,0,0]=4 1844 B8R1.11 Cc1[n]c[nH]c1CN Amb21960003 [0,1,0,0,0,0|3,0,0]=4 1845 B8R1.11 Cc1[n]c[s]c1CBr Amb19073775 [0,1,0,0,0,0|2,1,0]=4 1846 B8R1.11 Cc1[n]c[s]c1CBr Amb22587583 [0,1,0,0,0,0|2,1,0]=4 1847 B8R1.11 Cc1[n]c[s]c1CC Amb19515914 [0,1,0,0,0,0|2,1,0]=4 1848 B8R1.11 Cc1[n]c[s]c1CCl Amb22586997 [0,1,0,0,0,0|2,1,0]=4 1849 B8R1.11 Cc1[n]c[s]c1CN Amb21959884 [0,1,0,0,0,0|2,1,0]=4 1850 B8R1.11 Cc1[n]coc1CBr Amb22268316 [0,1,0,0,0,0|2,0,0]=3 1851 B8R1.11 Cc1[n]coc1CI Amb22268293 [0,1,0,0,0,0|2,0,0]=3 1852 B8R1.11 Cc1[n]coc1CS Amb22268324 [0,1,0,0,0,0|1,1,0]=3 1853 B8R1.11 Cc1[n]coc1OC Amb22044262 [0,1,0,0,0,0|3,0,0]=4 1854 B8R1.11 Cc1[n]occ1CO Amb24062155 [0,1,0,0,0,0|3,0,0]=4 1855 B8R1.11 Cc1[s][n][n]c1CO Amb22886784 [0,1,0,0,0,0|3,0,0]=4 1856 B8R1.11 Cc1[s]c[n]c1CBr Amb22500463 [0,1,0,0,0,0|3,0,0]=4 1857 B8R1.11 Cc1[s]c[n]c1CC Amb24117157 [0,1,0,0,0,0|3,0,0]=4 1858 B8R1.11 Cc1[s]c[n]c1CCl Amb19516837 [0,1,0,0,0,0|3,0,0]=4 1859 B8R1.11 Cc1[s]c[n]c1CCl Amb21961684 [0,1,0,0,0,0|3,0,0]=4 1860 B8R1.11 Cc1[s]c[n]c1CN Amb18202948 [0,1,0,0,0,0|3,0,0]=4 1861 B8R1.11 Cc1[s]c[n]c1CN Amb22899790 [0,1,0,0,0,0|3,0,0]=4 1862 B8R1.11 Cc1[s]c[n]c1CO Amb22587438 [0,1,0,0,0,0|2,0,0]=3 1863 B8R1.11 Cc1[s]ccc1CC Amb25313892 [0,1,0,0,0,0|3,0,0]=4 1864 B8R1.11 Cc1[s]ccc1CN Amb18203029 [0,1,0,0,0,0|3,0,0]=4 1865 B8R1.11 Cc1c(CO)nc[nH]1 Amb1158089 [0,1,0,0,0,0|2,0,0]=3 1866 B8R1.11 Cc1c(CO)nc[nH]1 Amb2371581 [0,1,0,0,0,0|2,0,0]=3 1867 B8R1.11 Cc1c[nH][n]c1CN Amb18833103 [0,1,0,0,0,0|3,0,0]=4 1868 B8R1.11 Cc1c[nH]cc1CO Amb23441156 [0,1,0,0,0,0|2,0,0]=3 1869 B8R1.11 Cc1c[n][nH]c1CBr Amb24688250 [0,1,0,0,0,0|3,0,0]=4 1870 B8R1.11 Cc1c[n][s]c1CCl Amb24403412 [0,1,0,0,0,0|2,1,0]=4 1871 B8R1.11 Cc1c[n][s]c1CO Amb24482066 [0,1,0,0,0,0|1,1,0]=3 1872 B8R1.11 Cc1c[n]oc1CBr Amb25675743 [0,1,0,0,0,0|2,0,0]=3 1873 B8R1.11 Cc1c[n]oc1CO Amb24467683 [0,1,0,0,0,0|1,0,0]=2 1874 B8R1.11 Cc1c[s]cc1CC Amb25376402 [0,1,0,0,0,0|3,0,0]=4 1875 B8R1.11 Cc1c[s]cc1CCl Amb20528471 [0,1,0,0,0,0|3,0,0]=4 1876 B8R1.11 Cc1c[s]cc1CO Amb24483178 [0,1,0,0,0,0|2,0,0]=3 1877 B8R1.11 Cc1c[s]cc1CS Amb20528443 [0,1,0,0,0,0|2,1,0]=4 1878 B8R1.11 Cc1cc[nH]c1C#N Amb18122561 [0,1,0,0,0,0|2,0,1]=4 1879 B8R1.11 Cc1cc[n][n]1CO Amb25239952 [0,1,0,0,0,0|2,0,0]=3 1880 B8R1.11 Cc1cc[s]c1C#C Amb22489883 [0,1,0,0,0,0|1,1,1]=4 1881 B8R1.11 Cc1cc[s]c1C=C Amb24532317 [0,1,0,0,0,0|1,1,1]=4 1882 B8R1.11 Cc1cc[s]c1CBr Amb18325320 [0,1,0,0,0,0|1,1,0]=3 1883 B8R1.11 Cc1cc[s]c1CC Amb25069402 [0,1,0,0,0,0|1,1,0]=3 1884 B8R1.11 Cc1cc[s]c1CS Amb24526885 [0,1,0,0,0,0|0,2,0]=3 1885 B8R1.11 Cc1cc[s]c1OC Amb25064766 [0,1,0,0,0,0|2,1,0]=4 1886 B8R1.11 Cc1cc[s]c1[Zn]Br Amb22000458 [0,1,0,0,0,0|2,1,0]=4 1887 B8R1.11 Cc1ccoc1C#N Amb25352891 [0,1,0,0,0,0|1,0,1]=3 1888 B8R1.11 Cc1ccoc1CBr Amb18183895 [0,1,0,0,0,0|1,0,0]=2 1889 B8R1.11 Cc1co[n]c1CO Amb24593199 [0,1,0,0,0,0|2,0,0]=3 1890 B8R1.11 Cc1cocc1CCl Amb24585018 [0,1,0,0,0,0|3,0,0]=4 1891 B8R1.11 Cc1n[nH]cc1CO Amb16231071 [0,1,0,0,0,0|3,0,0]=4 1892 B8R1.11 Cc1nc[nH]c1CCl Amb17938085 [0,1,0,0,0,0|3,0,0]=4 1893 B8R1.11 Cc1nc[nH]c1CCl Amb2455847 [0,1,0,0,0,0|3,0,0]=4 1894 B8R1.11 Cc1ncoc1C#N Amb17843583 [0,1,0,0,0,0|2,0,1]=4 1895 B8R1.11 Cc1ncoc1CCl Amb17399824 [0,1,0,0,0,0|2,0,0]=3 1896 B8R1.11 Cc1ncoc1CN Amb17399791 [0,1,0,0,0,0|2,0,0]=3 1897 B8R1.11 Cc1o[n]cc1CO Amb22754687 [0,1,0,0,0,0|3,0,0]=4 1898 B8R1.11 Cc1oc[n]c1CCl Amb22157185 [0,1,0,0,0,0|3,0,0]=4 1899 B8R1.11 Cc1oc[n]c1CI Amb24534106 [0,1,0,0,0,0|3,0,0]=4 1900 B8R1.11 Cc1oc[n]c1CN Amb18833092 [0,1,0,0,0,0|3,0,0]=4 1901 B8R1.11 Cc1occc1CBr Amb18183894 [0,1,0,0,0,0|3,0,0]=4 1902 B8R1.11 Cc1occc1CN Amb10609995 [0,1,0,0,0,0|3,0,0]=4 1903 B8R1.11 Cc1occc1CS Amb24538700 [0,1,0,0,0,0|2,1,0]=4 1904 B8R1.11 Cc1ocnc1CO Amb15701316 [0,1,0,0,0,0|2,0,0]=3 1905 B8R1.11 ClC/1=CC=C\C1=C\Cl Amb25798374 [0,1,0,0,0,0|2,0,1]=4 1906 B8R1.11 ClCc1[n][nH]cc1I Amb24701147 [0,1,0,0,0,0|3,0,0]=4 1907 B8R1.11 ClCc1[n][s]cc1Br Amb25288373 [0,1,0,0,0,0|3,0,0]=4 1908 B8R1.11 ClCc1[n]c[s]c1Br Amb25175746 [0,1,0,0,0,0|3,0,0]=4 1909 B8R1.11 ClCc1[s]c[n]c1Br Amb24532816 [0,1,0,0,0,0|2,1,0]=4 1910 B8R1.11 ClCc1[s]ccc1I Amb25327164 [0,1,0,0,0,0|1,1,0]=3 1911 B8R1.11 ClCc1cc[s]c1I Amb25218063 [0,1,0,0,0,0|3,0,0]=4 1912 B8R1.11 ClCc1nccn1C Amb1092563 [0,1,0,0,0,0|3,0,0]=4 1913 B8R1.11 ClCc1nccn1C Amb1154142 [0,1,0,0,0,0|3,0,0]=4 1914 B8R1.11 ClCc1sccc1Br Amb10610432 [0,1,0,0,0,0|1,1,0]=3 1915 B8R1.11 Clc1[n]c[s]c1CBr Amb24449980 [0,1,0,0,0,0|2,1,0]=4 1916 B8R1.11 Clc1[s]c[n]c1CCl Amb25341911 [0,1,0,0,0,0|3,0,0]=4 1917 B8R1.11 Clc1c[s][n]c1CBr Amb25250653 [0,1,0,0,0,0|3,0,0]=4 1918 B8R1.11 Clc1c[s]cc1CBr Amb25195523 [0,1,0,0,0,0|3,0,0]=4 1919 B8R1.11 Clc1c[s]cc1CCl Amb25211871 [0,1,0,0,0,0|3,0,0]=4 1920 B8R1.11 Clc1cc[n][n]1CBr Amb22753203 [0,1,0,0,0,0|3,0,0]=4 1921 B8R1.11 Clc1cc[s]c1CCl Amb24620455 [0,1,0,0,0,0|1,1,0]=3 1922 B8R1.11 Clc1cc[s]c1CI Amb25246606 [0,1,0,0,0,0|1,1,0]=3 1923 B8R1.11 Clc1oc[n]c1CCl Amb25173602 [0,1,0,0,0,0|3,0,0]=4 1924 B8R1.11 Clc1occc1CCl Amb25772586 [0,1,0,0,0,0|3,0,0]=4 1925 B8R1.11 Cn1cncc1CCl Amb10607768 [0,1,0,0,0,0|3,0,0]=4 1926 B8R1.11 Cn1nccc1CN Amb1945791 [0,1,0,0,0,0|3,0,0]=4 1927 B8R1.11 Cn1ncnc1CO Amb10603121 [0,1,0,0,0,0|3,0,0]=4 1928 B8R1.11 Fc1c[s]cc1CCl Amb25253064 [0,1,0,0,0,0|3,0,0]=4 1929 B8R1.11 N#Cc1[nH]ccc1Cl Amb24763743 [0,1,0,0,0,0|2,0,1]=4 1930 B8R1.11 N#Cc1[nH]ccc1I Amb22498189 [0,1,0,0,0,0|2,0,1]=4 1931 B8R1.11 N#Cc1[nH]ccc1O Amb25662089 [0,1,0,0,0,0|2,0,1]=4 1932 B8R1.11 N#Cc1[s]ccc1O Amb18642297 [0,1,0,0,0,0|1,1,1]=4 1933 B8R1.11 NCc1[nH][n]cc1Br Amb19351465 [0,1,0,0,0,0|3,0,0]=4 1934 B8R1.11 NCc1[nH][n]cc1Br Amb22499485 [0,1,0,0,0,0|3,0,0]=4 1935 B8R1.11 NCc1[n][nH]cc1Br Amb18185545 [0,1,0,0,0,0|3,0,0]=4 1936 B8R1.11 NCc1[n][nH]cc1I Amb23449614 [0,1,0,0,0,0|3,0,0]=4 1937 B8R1.11 NCc1[n]c[s]c1Br Amb23400579 [0,1,0,0,0,0|3,0,0]=4 1938 B8R1.11 NCc1[n]c[s]c1Cl Amb23400578 [0,1,0,0,0,0|3,0,0]=4 1939 B8R1.11 NCc1[n]cc[n]1O Amb24422100 [0,1,0,0,0,0|3,0,0]=4 1940 B8R1.11 NCc1[s]c[n]c1Br Amb18190431 [0,1,0,0,0,0|2,1,0]=4 1941 B8R1.11 NCc1[s]c[n]c1Cl Amb24385220 [0,1,0,0,0,0|2,1,0]=4 1942 B8R1.11 NCc1[s]c[n]c1O Amb25855879 [0,1,0,0,0,0|2,1,0]=4 1943 B8R1.11 NCc1[s]ccc1Br Amb18280696 [0,1,0,0,0,0|1,1,0]=3 1944 B8R1.11 NCc1[s]ccc1Cl Amb22406102 [0,1,0,0,0,0|1,1,0]=3 1945 B8R1.11 NCc1[s]ccc1F Amb22642190 [0,1,0,0,0,0|1,1,0]=3 1946 B8R1.11 NCc1c[s]cc1O Amb24387771 [0,1,0,0,0,0|3,0,0]=4 1947 B8R1.11 NCc1cc[s]c1Cl Amb24699492 [0,1,0,0,0,0|3,0,0]=4 1948 B8R1.11 NCc1ccc[n]1N Amb24542688 [0,1,0,0,0,0|2,0,0]=3 1949 B8R1.11 NCc1ccoc1Cl Amb25128829 [0,1,0,0,0,0|3,0,0]=4 1950 B8R1.11 NCc1ccsc1Br Amb17722051 [0,1,0,0,0,0|3,0,0]=4 1951 B8R1.11 NCc1nccn1C Amb1099139 [0,1,0,0,0,0|3,0,0]=4 1952 B8R1.11 NCc1nccn1C Amb2154784 [0,1,0,0,0,0|3,0,0]=4 1953 B8R1.11 NCc1o[n]cc1Cl Amb25746473 [0,1,0,0,0,0|2,0,0]=3 1954 B8R1.11 NCc1occc1Br Amb18191028 [0,1,0,0,0,0|1,0,0]=2 1955 B8R1.11 NCc1sccc1Br Amb13951625 [0,1,0,0,0,0|1,1,0]=3 1956 B8R1.11 NCc1sccc1C Amb1128389 [0,1,0,0,0,0|1,1,0]=3 1957 B8R1.11 NCc1sccc1Cl Amb10069119 [0,1,0,0,0,0|1,1,0]=3 1958 B8R1.11 NNc1[s]ccc1Br Amb24523151 [0,1,0,0,0,0|2,1,0]=4 1959 B8R1.11 NNc1occc1Br Amb24445422 [0,1,0,0,0,0|2,0,0]=3 1960 B8R1.11 N[n]1[n]ccc1CO Amb25343894 [0,1,0,0,0,0|2,0,0]=3 1961 B8R1.11 N[n]1cccc1C#N Amb18203413 [0,1,0,0,0,0|2,0,1]=4 1962 B8R1.11 N[n]1cccc1C#N Amb19958421 [0,1,0,0,0,0|2,0,1]=4 1963 B8R1.11 N[n]1cccc1C=O Amb22496148 [0,1,0,0,0,0|1,0,2]=4 1964 B8R1.11 Nc1[nH]c[n]c1CN Amb24481310 [0,1,0,0,0,0|3,0,0]=4 1965 B8R1.11 Nc1[n]o[n]c1CO Amb22527953 [0,1,0,0,0,0|3,0,0]=4 1966 B8R1.11 Nc1[s][n][n]c1CO Amb18523724 [0,1,0,0,0,0|3,0,0]=4 1967 B8R1.11 Nc1[s]ccc1CN Amb18202904 [0,1,0,0,0,0|3,0,0]=4 1968 B8R1.11 Nc1c[n][nH]c1CO Amb22495429 [0,1,0,0,0,0|2,0,0]=3 1969 B8R1.11 Nc1cc[nH]c1C#N Amb22751192 [0,1,0,0,0,0|2,0,1]=4 1970 B8R1.11 Nc1cc[s]c1C#N Amb18642210 [0,1,0,0,0,0|1,1,1]=4 1971 B8R1.11 Nc1cc[s]c1C#N Amb22233883 [0,1,0,0,0,0|1,1,1]=4 1972 B8R1.11 Nc1cc[s]c1C=O Amb18202433 [0,1,0,0,0,0|0,1,2]=4 1973 B8R1.11 Nc1cc[s]c1C=S Amb25383386 [0,1,0,0,0,0|0,2,1]=4 1974 B8R1.11 Nc1cc[s]c1CN Amb18251119 [0,1,0,0,0,0|1,1,0]=3 1975 B8R1.11 Nc1ccoc1C#N Amb18122708 [0,1,0,0,0,0|1,0,1]=3 1976 B8R1.11 Nc1ccoc1C=O Amb18203397 [0,1,0,0,0,0|0,0,2]=3 1977 B8R1.11 Nc1ccoc1C=S Amb25790738 [0,1,0,0,0,0|0,1,1]=3 1978 B8R1.11 O=C1C=CSN1CCl Amb24391788 [0,1,0,0,0,0|2,1,0]=4 1979 B8R1.11 O=CC1=CC=CC1[Na] Amb24646434 [0,1,0,0,0,0|1,0,2]=4 1980 B8R1.11 O=CC1OC=CC1=O Amb25301009 [0,1,0,0,0,0|0,0,3]=4 1981 B8R1.11 O=Cc1[nH]ccc1Br Amb16232050 [0,1,0,0,0,0|1,0,2]=4 1982 B8R1.11 O=Cc1[nH]ccc1Cl Amb18124328 [0,1,0,0,0,0|1,0,2]=4 1983 B8R1.11 O=Cc1[nH]ccc1I Amb22498188 [0,1,0,0,0,0|1,0,2]=4 1984 B8R1.11 O=Cc1[s]ccc1F Amb18832537 [0,1,0,0,0,0|0,1,2]=4 1985 B8R1.11 O=Cc1o[n]cc1Br Amb18191116 [0,1,0,0,0,0|1,0,2]=4 1986 B8R1.11 O=Cc1o[n]cc1Cl Amb18199347 [0,1,0,0,0,0|1,0,2]=4 1987 B8R1.11 O=Cc1occc1Br Amb2447448 [0,1,0,0,0,0|0,0,2]=3 1988 B8R1.11 O=Cc1occc1Cl Amb18202965 [0,1,0,0,0,0|0,0,2]=3 1989 B8R1.11 O=Cc1occc1F Amb18203365 [0,1,0,0,0,0|0,0,2]=3 1990 B8R1.11 O=Cc1occc1I Amb25089234 [0,1,0,0,0,0|0,0,2]=3 1991 B8R1.11 OC1C=COC1CO Amb24390406 [0,1,0,0,0,0|0,0,2]=3 1992 B8R1.11 OC1CC=CC1CO Amb24738079 [0,1,0,0,0,0|1,0,2]=4 1993 B8R1.11 OCC1=CCCC1=O Amb15693428 [0,1,0,0,0,0|1,0,2]=4 1994 B8R1.11 OCC1=CCCC1O Amb25226276 [0,1,0,0,0,0|1,0,2]=4 1995 B8R1.11 OCC1=CCOC1=O Amb25286254 [0,1,0,0,0,0|2,0,1]=4 1996 B8R1.11 OCC1N=COC1=O Amb24511756 [0,1,0,0,0,0|2,0,1]=4 1997 B8R1.11 OCN1C=CSC1=S Amb25272011 [0,1,0,0,0,0|3,0,0]=4 1998 B8R1.11 OCN1N=COC1=O Amb25120122 [0,1,0,0,0,0|3,0,0]=4 1999 B8R1.11 OCN1SC=CC1=O Amb23441691 [0,1,0,0,0,0|1,1,0]=3 2000 B8R1.11 OC[C@@H]1OC=CC1=O Amb17678799 [0,1,0,0,0,0|0,0,1]=2 2001 B8R1.11 OC[C@H]1OC=CC1=O Amb25319926 [0,1,0,0,0,0|0,0,1]=2 2002 B8R1.11 OC[n]1[n]ccc1Cl Amb25769289 [0,1,0,0,0,0|2,0,0]=3 2003 B8R1.11 OCc1[nH][n]cc1Cl Amb25726905 [0,1,0,0,0,0|2,0,0]=3 2004 B8R1.11 OCc1[nH]c[n]c1Br Amb25765852 [0,1,0,0,0,0|2,0,0]=3 2005 B8R1.11 OCc1[nH]c[n]c1F Amb25092426 [0,1,0,0,0,0|2,0,0]=3 2006 B8R1.11 OCc1[nH]ccc1Cl Amb24401060 [0,1,0,0,0,0|1,0,0]=2 2007 B8R1.11 OCc1[n][nH]cc1Br Amb23568529 [0,1,0,0,0,0|2,0,0]=3 2008 B8R1.11 OCc1[n][nH]cc1I Amb23449600 [0,1,0,0,0,0|2,0,0]=3 2009 B8R1.11 OCc1[n][s]cc1Br Amb24704816 [0,1,0,0,0,0|2,0,0]=3 2010 B8R1.11 OCc1[n]c[nH]c1Cl Amb25238705 [0,1,0,0,0,0|2,0,0]=3 2011 B8R1.11 OCc1[n]c[s]c1Br Amb22748664 [0,1,0,0,0,0|2,0,0]=3 2012 B8R1.11 OCc1[n]c[s]c1Cl Amb23400577 [0,1,0,0,0,0|2,0,0]=3 2013 B8R1.11 OCc1[n]coc1Br Amb25244708 [0,1,0,0,0,0|2,0,0]=3 2014 B8R1.11 OCc1[s]c[n]c1Cl Amb22276071 [0,1,0,0,0,0|1,1,0]=3 2015 B8R1.11 OCc1[s]ccc1Br Amb18330307 [0,1,0,0,0,0|0,1,0]=2 2016 B8R1.11 OCc1[s]ccc1Cl Amb21961457 [0,1,0,0,0,0|0,1,0]=2 2017 B8R1.11 OCc1[s]ccc1F Amb22490780 [0,1,0,0,0,0|0,1,0]=2 2018 B8R1.11 OCc1[s]ccc1I Amb25366864 [0,1,0,0,0,0|0,1,0]=2 2019 B8R1.11 OCc1c[s]cc1F Amb24515604 [0,1,0,0,0,0|2,0,0]=3 2020 B8R1.11 OCc1cc[s]c1F Amb25822861 [0,1,0,0,0,0|2,0,0]=3 2021 B8R1.11 OCc1cnnn1C Amb17538038 [0,1,0,0,0,0|3,0,0]=4 2022 B8R1.11 OCc1nccn1C Amb1679789 [0,1,0,0,0,0|2,0,0]=3 2023 B8R1.11 OCc1nnsc1Cl Amb1109942 [0,1,0,0,0,0|3,0,0]=4 2024 B8R1.11 OCc1occc1Br Amb22498871 [0,1,0,0,0,0|0,0,0]=1 2025 B8R1.11 OCc1sccc1N Amb10067607 [0,1,0,0,0,0|0,1,0]=2 2026 B8R1.11 OCc1scnc1Br Amb10603160 [0,1,0,0,0,0|1,1,0]=3 2027 B8R1.11 O[C@@H]1C=CC[C@@H]1CO Amb24514501 [0,1,0,0,0,0|1,0,2]=4 2028 B8R1.11 O[C@@H]1C=CO[C@H]1CO Amb25376799 [0,1,0,0,0,0|0,0,2]=3 2029 B8R1.11 O[C@@H]1CC=C[C@@H]1CO Amb25224455 [0,1,0,0,0,0|1,0,2]=4 2030 B8R1.11 O[C@H]1C=CC[C@@H]1CO Amb24748605 [0,1,0,0,0,0|1,0,2]=4 2031 B8R1.11 O[C@H]1C=CC[C@H]1CO Amb22233136 [0,1,0,0,0,0|1,0,2]=4 2032 B8R1.11 O\C=C/1\N=COC1=O Amb25850590 [0,1,0,0,0,0|2,0,1]=4 2033 B8R1.11 O\C=C/1\OC=CC1=O Amb24579097 [0,1,0,0,0,0|0,0,1]=2 2034 B8R1.11 Oc1[n][s][n]c1CO Amb25371339 [0,1,0,0,0,0|3,0,0]=4 2035 B8R1.11 Oc1c[nH][n]c1CBr Amb25295493 [0,1,0,0,0,0|3,0,0]=4 2036 B8R1.11 Oc1ccoc1CS Amb25849935 [0,1,0,0,0,0|0,1,0]=2 2037 B8R1.11 SCc1occc1Br Amb24717193 [0,1,0,0,0,0|0,1,0]=2 2038 B8R1.11 SCc1occc1I Amb25085081 [0,1,0,0,0,0|0,1,0]=2 2039 B8R1.52 CC1(CCl)C=CC=C1 Amb24560925 [0,1,0,0,0,0|2,0,1]=4 2040 B8R1.52 CC1(CO)C=CCN1 Amb24426743 [0,1,0,0,0,0|1,0,2]=4 2041 B8R1.52 C[C@]1(CO)C=CCO1 Amb24718331 [0,1,0,0,0,0|0,0,2]=3 2042 B8R1.52 C[C@]1(CO)CCC=C1 Amb25796339 [0,1,0,0,0,0|1,0,2]=4 2043 B8R1.52 OCC1(O)CC=CC1 Amb25296176 [0,1,0,0,0,0|1,0,2]=4 2044 B6R0.1 C/C(CO)=C\C=C Amb17843900 [0,0,1,0,0,0|1,0,0]=2 2045 B6R0.1 C=C(CCO)CO Amb25825219 [0,0,1,0,0,0|2,0,1]=4 2046 B6R0.1 C=C(CO)CC#C Amb25802984 [0,0,1,0,0,0|1,0,2]=4 2047 B6R0.1 C=C(CO)CCN Amb24426567 [0,0,1,0,0,0|2,0,1]=4 2048 B6R0.1 C=C=CC(=O)CCl Amb24378639 [0,0,1,0,0,0|1,0,2]=4 2049 B6R0.1 C=CC(=O)OC=C Amb22231745 [0,0,1,0,0,0|2,0,1]=4 2050 B6R0.1 C=CCC(=C)C=O Amb18120415 [0,0,1,0,0,0|1,0,2]=4 2051 B6R0.1 C=CCC(=C)CBr Amb24692702 [0,0,1,0,0,0|2,0,0]=3 2052 B6R0.1 C=CCC(=C)CN Amb24551059 [0,0,1,0,0,0|2,0,0]=3 2053 B6R0.1 C=CCC(=C)CO Amb25854150 [0,0,1,0,0,0|1,0,0]=2 2054 B6R0.1 C=CCC(=O)CCl Amb25703593 [0,0,1,0,0,0|1,0,2]=4 2055 B6R0.1 C=CCC(Br)CO Amb24399232 [0,0,1,0,0,0|1,0,2]=4 2056 B6R0.1 C=CCC(Cl)CO Amb25807468 [0,0,1,0,0,0|1,0,2]=4 2057 B6R0.1 C=CCC(N)CO Amb24745656 [0,0,1,0,0,0|1,0,2]=4 2058 B6R0.1 C=CCC(O)CBr Amb24478446 [0,0,1,0,0,0|1,0,2]=4 2059 B6R0.1 C=CCC(O)CF Amb25345890 [0,0,1,0,0,0|1,0,2]=4 2060 B6R0.1 C=CCC(O)CI Amb25746456 [0,0,1,0,0,0|1,0,2]=4 2061 B6R0.1 C=CCC(O)CN Amb22304831 [0,0,1,0,0,0|1,0,2]=4 2062 B6R0.1 C=CC[C@@H](N)CO Amb24088744 [0,0,1,0,0,0|1,0,2]=4 2063 B6R0.1 C=CC[C@@H](O)CCl Amb22736714 [0,0,1,0,0,0|1,0,2]=4 2064 B6R0.1 C=CC[C@@H](O)CI Amb24419791 [0,0,1,0,0,0|1,0,2]=4 2065 B6R0.1 C=CC[C@H](Br)CO Amb24479036 [0,0,1,0,0,0|1,0,2]=4 2066 B6R0.1 C=CC[C@H](N)CO Amb24088875 [0,0,1,0,0,0|1,0,2]=4 2067 B6R0.1 C=CC[C@H](N)CO Amb25732908 [0,0,1,0,0,0|1,0,2]=4 2068 B6R0.1 C=CC[C@H](O)CCl Amb22736707 [0,0,1,0,0,0|1,0,2]=4 2069 B6R0.1 C=CNC(=O)NO Amb25339032 [0,0,1,0,0,0|2,0,1]=4 2070 B6R0.1 C=COC(=O)CBr Amb22732072 [0,0,1,0,0,0|2,0,0]=3 2071 B6R0.1 C=COC(=O)CCl Amb22045210 [0,0,1,0,0,0|2,0,0]=3 2072 B6R0.1 C=COC(=O)CI Amb17934194 [0,0,1,0,0,0|2,0,0]=3 2073 B6R0.1 C=C\C=C(/Br)\C=O Amb25277164 [0,0,1,0,0,0|1,0,2]=4 2074 B6R0.1 C=C\C=C(\Br)/C=O Amb18126250 [0,0,1,0,0,0|1,0,2]=4 2075 B6R0.1 CC(CO)=CC#N Amb25723080 [0,0,1,0,0,0|2,0,1]=4 2076 B6R0.1 CC(CO)=CC=N Amb25057805 [0,0,1,0,0,0|2,0,0]=3 2077 B6R0.1 CC(CO)=CCCl Amb25175010 [0,0,1,0,0,0|2,0,1]=4 2078 B6R0.1 CC(CO)=CCO Amb25296164 [0,0,1,0,0,0|2,0,1]=4 2079 B6R0.1 CC(CO)CC=C Amb17593084 [0,0,1,0,0,0|1,0,2]=4 2080 B6R0.1 CC(CO)OC=O Amb25026452 [0,0,1,0,0,0|1,0,2]=4 2081 B6R0.1 CC=CC(O)CC Amb22228839 [0,0,1,0,0,0|1,0,2]=4 2082 B6R0.1 CCC(=C)CC=O Amb24445213 [0,0,1,0,0,0|3,0,0]=4 2083 B6R0.1 CCC(=O)C=C=C Amb17593059 [0,0,1,0,0,0|1,0,2]=4 2084 B6R0.1 CCC(=O)\C=C/N Amb24625829 [0,0,1,0,0,0|2,0,1]=4 2085 B6R0.1 CCC(=O)\C=C\Br Amb25286103 [0,0,1,0,0,0|2,0,1]=4 2086 B6R0.1 CCC(=O)\C=C\Cl Amb17593220 [0,0,1,0,0,0|2,0,1]=4 2087 B6R0.1 CCC(=O)\C=C\O Amb25326651 [0,0,1,0,0,0|2,0,1]=4 2088 B6R0.1 CCC(Cl)=CC=O Amb25224351 [0,0,1,0,0,0|3,0,0]=4 2089 B6R0.1 CCC(N)OC=C Amb24479833 [0,0,1,0,0,0|2,0,1]=4 2090 B6R0.1 CCC(O)CC=C Amb22734219 [0,0,1,0,0,0|1,0,2]=4 2091 B6R0.1 CCC(O)\C=C\I Amb25258606 [0,0,1,0,0,0|2,0,1]=4 2092 B6R0.1 CCOC(=C)CO Amb23585492 [0,0,1,0,0,0|0,0,2]=3 2093 B6R0.1 CCOC(=C)CS Amb25314283 [0,0,1,0,0,0|0,1,2]=4 2094 B6R0.1 CCOC(=N)CO Amb17593094 [0,0,1,0,0,0|1,0,2]=4 2095 B6R0.1 CCOC(=S)CO Amb25720817 [0,0,1,0,0,0|1,0,2]=4 2096 B6R0.1 CC[C@@H](O)CC=C Amb22898757 [0,0,1,0,0,0|1,0,2]=4 2097 B6R0.1 CC[C@H](O)CC=C Amb25832194 [0,0,1,0,0,0|1,0,2]=4 2098 B6R0.1 CC\C=C(/C)\CO Amb22347713 [0,0,1,0,0,0|1,0,2]=4 2099 B6R0.1 CC\C=C(\C)/CO Amb24677771 [0,0,1,0,0,0|1,0,2]=4 2100 B6R0.1 CC\C=C(\F)/CO Amb25692315 [0,0,1,0,0,0|1,0,2]=4 2101 B6R0.1 CNC(=O)OC=C Amb24334277 [0,0,1,0,0,0|3,0,0]=4 2102 B6R0.1 COCC(=C)CO Amb24523815 [0,0,1,0,0,0|2,0,1]=4 2103 B6R0.1 CO\C=C(/F)\CO Amb22546782 [0,0,1,0,0,0|2,0,1]=4 2104 B6R0.1 C[C@@H](CO)CC=C Amb25167493 [0,0,1,0,0,0|1,0,2]=4 2105 B6R0.1 C[C@H](CO)CC=C Amb25026058 [0,0,1,0,0,0|1,0,2]=4 2106 B6R0.1 C\C(\C=O)=C/C=C Amb24559820 [0,0,1,0,0,0|1,0,2]=4 2107 B6R0.1 C\C(\C=O)=C\C=C Amb18638851 [0,0,1,0,0,0|1,0,2]=4 2108 B6R0.1 C\C(\CBr)=C\C=C Amb24655132 [0,0,1,0,0,0|2,0,0]=3 2109 B6R0.1 C\C(\CBr)=C\C=O Amb18645750 [0,0,1,0,0,0|3,0,0]=4 2110 B6R0.1 C\C(\CC)=C/C=C Amb24480536 [0,0,1,0,0,0|2,0,0]=3 2111 B6R0.1 C\C(\CC)=C\C=O Amb18120877 [0,0,1,0,0,0|3,0,0]=4 2112 B6R0.1 C\C(\CCl)=C\C=O Amb25326191 [0,0,1,0,0,0|3,0,0]=4 2113 B6R0.1 C\C(\CN)=C\C=C Amb25173819 [0,0,1,0,0,0|2,0,0]=3 2114 B6R0.1 C\C(\CO)=C/C=O Amb24417925 [0,0,1,0,0,0|2,0,0]=3 2115 B6R0.1 C\C(\CO)=C/CCl Amb24479475 [0,0,1,0,0,0|2,0,1]=4 2116 B6R0.1 C\C(\CO)=C/CN Amb22831517 [0,0,1,0,0,0|2,0,1]=4 2117 B6R0.1 C\C(\CO)=C/CN Amb25727740 [0,0,1,0,0,0|2,0,1]=4 2118 B6R0.1 C\C(\CO)=C\C=C Amb25229626 [0,0,1,0,0,0|1,0,0]=2 2119 B6R0.1 C\C=C/C(=O)CO Amb24530239 [0,0,1,0,0,0|0,0,2]=3 2120 B6R0.1 C\C=C/C(O)CBr Amb24333663 [0,0,1,0,0,0|1,0,2]=4 2121 B6R0.1 C\C=C\C(=N)NO Amb25024615 [0,0,1,0,0,0|2,0,1]=4 2122 B6R0.1 C\C=C\C(=O)CO Amb24633379 [0,0,1,0,0,0|0,0,2]=3 2123 B6R0.1 C\C=C\C(=O)NO Amb25076258 [0,0,1,0,0,0|1,0,2]=4 2124 B6R0.1 C\C=C\C(N)CO Amb25702422 [0,0,1,0,0,0|1,0,2]=4 2125 B6R0.1 C\C=C\C(O)CBr Amb25201492 [0,0,1,0,0,0|1,0,2]=4 2126 B6R0.1 C\C=C\C(O)CC Amb22731799 [0,0,1,0,0,0|1,0,2]=4 2127 B6R0.1 C\C=C\C(O)CN Amb18639704 [0,0,1,0,0,0|1,0,2]=4 2128 B6R0.1 C\C=C\[C@H](C)CO Amb25381306 [0,0,1,0,0,0|1,0,2]=4 2129 B6R0.1 ClC=CC(=O)CCl Amb13952715 [0,0,1,0,0,0|2,0,1]=4 2130 B6R0.1 NC\C=C(\Cl)/CO Amb25326641 [0,0,1,0,0,0|2,0,1]=4 2131 B6R0.1 O=C(CCl)\C=C\Br Amb24595386 [0,0,1,0,0,0|2,0,1]=4 2132 B6R0.1 O=C(CCl)\C=C\Cl Amb20620940 [0,0,1,0,0,0|2,0,1]=4 2133 B6R0.1 OC(CCl)\C=C/Cl Amb25747323 [0,0,1,0,0,0|2,0,1]=4 2134 B6R0.1 OC(CCl)\C=C\Cl Amb25292974 [0,0,1,0,0,0|2,0,1]=4 2135 B6R0.1 OC(CO)\C=C\Br Amb25744914 [0,0,1,0,0,0|1,0,1]=3 2136 B6R0.1 OCC(Cl)=CCCl Amb24547941 [0,0,1,0,0,0|2,0,1]=4 2137 B6R0.1 OCC(O)CC=O Amb25243032 [0,0,1,0,0,0|1,0,2]=4 2138 B6R0.1 OC[C@H](O)CC=O Amb24595645 [0,0,1,0,0,0|1,0,2]=4 2139 B6R0.1 OC\C(\F)=C/CO Amb25769384 [0,0,1,0,0,0|2,0,1]=4 2140 B6R0.6 Br\C=C\C=C\C=O Amb16233577 [0,0,1,0,0,0|1,0,2]=4 2141 B6R0.6 C#C\C=C/C=CBr Amb24365394 [0,0,1,0,0,0|2,0,1]=4 2142 B6R0.6 C#C\C=C\CCO Amb25720784 [0,0,1,0,0,0|1,0,2]=4 2143 B6R0.6 C=C=COCCO Amb25721997 [0,0,1,0,0,0|0,0,2]=3 2144 B6R0.6 C=CC=C=CCO Amb25296077 [0,0,1,0,0,0|1,0,0]=2 2145 B6R0.6 C=CC=C\C=C\Br Amb24595200 [0,0,1,0,0,0|2,0,1]=4 2146 B6R0.6 C=CC=C\C=C\O Amb25788961 [0,0,1,0,0,0|1,0,1]=3 2147 B6R0.6 C=CCC#CCO Amb24479025 [0,0,1,0,0,0|1,0,2]=4 2148 B6R0.6 C=CCCOCO Amb22338634 [0,0,1,0,0,0|2,0,1]=4 2149 B6R0.6 C=CCOCCI Amb24739964 [0,0,1,0,0,0|1,0,2]=4 2150 B6R0.6 C=CCOCCN Amb19033754 [0,0,1,0,0,0|1,0,2]=4 2151 B6R0.6 C=CCOCCS Amb24333486 [0,0,1,0,0,0|0,1,2]=4 2152 B6R0.6 C=CC\C=C\CBr Amb24739614 [0,0,1,0,0,0|2,0,1]=4 2153 B6R0.6 C=CC\C=C\CCl Amb24468971 [0,0,1,0,0,0|2,0,1]=4 2154 B6R0.6 C=CC\C=C\CI Amb24540086 [0,0,1,0,0,0|2,0,1]=4 2155 B6R0.6 C=CC\C=C\CN Amb18120761 [0,0,1,0,0,0|2,0,1]=4 2156 B6R0.6 C=CSCCCO Amb25026486 [0,0,1,0,0,0|2,0,1]=4 2157 B6R0.6 C=C\C=C\CCBr Amb24557796 [0,0,1,0,0,0|2,0,1]=4 2158 B6R0.6 C=C\C=C\CCCl Amb25093985 [0,0,1,0,0,0|2,0,1]=4 2159 B6R0.6 C=C\C=C\CCN Amb18639048 [0,0,1,0,0,0|2,0,1]=4 2160 B6R0.6 C=C\C=C\CCO Amb24480746 [0,0,1,0,0,0|1,0,1]=3 2161 B6R0.6 CCNOCC=C Amb24543090 [0,0,1,0,0,0|2,0,1]=4 2162 B6R0.6 CCO\C=C\C=O Amb18639560 [0,0,1,0,0,0|2,0,1]=4 2163 B6R0.6 CCS\C=C\C=O Amb18641909 [0,0,1,0,0,0|2,0,1]=4 2164 B6R0.6 CC\C=C/CC=O Amb18639157 [0,0,1,0,0,0|1,0,2]=4 2165 B6R0.6 CC\C=C\C=CCl Amb25211158 [0,0,1,0,0,0|2,0,0]=3 2166 B6R0.6 CC\C=C\CC=C Amb25275369 [0,0,1,0,0,0|2,0,1]=4 2167 B6R0.6 CC\C=C\CC=O Amb25136370 [0,0,1,0,0,0|1,0,2]=4 2168 B6R0.6 CNC\C=C/CO Amb24479692 [0,0,1,0,0,0|2,0,1]=4 2169 B6R0.6 COC\C=C\CO Amb25662350 [0,0,1,0,0,0|2,0,1]=4 2170 B6R0.6 CO\C=C\CCO Amb24661187 [0,0,1,0,0,0|2,0,1]=4 2171 B6R0.6 CSC\C=C\CO Amb24387294 [0,0,1,0,0,0|2,0,1]=4 2172 B6R0.6 C\C=C/C=C/C=O Amb25095226 [0,0,1,0,0,0|1,0,2]=4 2173 B6R0.6 C\C=C/C=C\C=O Amb25827595 [0,0,1,0,0,0|1,0,2]=4 2174 B6R0.6 C\C=C/CCCO Amb17614951 [0,0,1,0,0,0|1,0,2]=4 2175 B6R0.6 C\C=C\C=C/C=O Amb25270064 [0,0,1,0,0,0|1,0,2]=4 2176 B6R0.6 C\C=C\C=CC#N Amb25238391 [0,0,1,0,0,0|2,0,1]=4 2177 B6R0.6 C\C=C\C=C\C=C Amb25843234 [0,0,1,0,0,0|2,0,1]=4 2178 B6R0.6 C\C=C\C=C\CC Amb25145643 [0,0,1,0,0,0|2,0,0]=3 2179 B6R0.6 C\C=C\C=C\CN Amb18639062 [0,0,1,0,0,0|2,0,0]=3 2180 B6R0.6 C\C=C\C=C\CN Amb24117256 [0,0,1,0,0,0|2,0,0]=3 2181 B6R0.6 C\C=C\CCCO Amb22347882 [0,0,1,0,0,0|1,0,2]=4 2182 B6R0.6 C\C=C\OCCCl Amb25076175 [0,0,1,0,0,0|1,0,2]=4 2183 B6R0.6 ClC=C\C=C\CCl Amb25252938 [0,0,1,0,0,0|2,0,0]=3 2184 B6R0.6 Cl\C=C\C=C/CCl Amb25347938 [0,0,1,0,0,0|2,0,0]=3 2185 B6R0.6 Cl\C=C\OCCCl Amb24481099 [0,0,1,0,0,0|2,0,1]=4 2186 B6R0.6 N#C\C=C/C=C\Br Amb24381689 [0,0,1,0,0,0|2,0,1]=4 2187 B6R0.6 N#C\C=C\CCO Amb18639029 [0,0,1,0,0,0|1,0,2]=4 2188 B6R0.6 N=CCOCCO Amb24407453 [0,0,1,0,0,0|1,0,2]=4 2189 B6R0.6 N\C=C\C=CC=N Amb24479787 [0,0,1,0,0,0|2,0,1]=4 2190 B6R0.6 N\C=C\C=C\C=O Amb25702448 [0,0,1,0,0,0|1,0,2]=4 2191 B6R0.6 O=C\C=C\C=C/Cl Amb25270002 [0,0,1,0,0,0|1,0,2]=4 2192 B6R0.6 O=C\C=C\C=C=O Amb25024653 [0,0,1,0,0,0|0,0,3]=4 2193 B6R0.6 O=C\C=C\CCF Amb25723268 [0,0,1,0,0,0|1,0,2]=4 2194 B6R0.6 OCC#CC=C=C Amb17593052 [0,0,1,0,0,0|1,0,2]=4 2195 B6R0.6 OCC#C\C=C\Cl Amb25746505 [0,0,1,0,0,0|1,0,2]=4 2196 B6R0.6 OCC=NCCO Amb24507433 [0,0,1,0,0,0|1,0,2]=4 2197 B6R0.6 OCCC#CC=C Amb17593058 [0,0,1,0,0,0|1,0,2]=4 2198 B6R0.6 OCCC=C=CBr Amb25211653 [0,0,1,0,0,0|1,0,2]=4 2199 B6R0.6 OCCCC=C=C Amb10605300 [0,0,1,0,0,0|1,0,2]=4 2200 B6R0.6 OCCOCC=O Amb24060822 [0,0,1,0,0,0|1,0,2]=4 2201 B6R0.6 OCC\C=C\C=O Amb18119862 [0,0,1,0,0,0|0,0,2]=3 2202 B6R0.6 OCC\C=C\CBr Amb24608445 [0,0,1,0,0,0|1,0,2]=4 2203 B6R0.6 OC\C=C\C=C\Cl Amb25697166 [0,0,1,0,0,0|1,0,0]=2 2204 B6R0.6 OC\C=C\CCBr Amb24720101 [0,0,1,0,0,0|1,0,2]=4 2205 B6R0.6 O\C=C\C=C/C=O Amb25804174 [0,0,1,0,0,0|0,0,2]=3 2206 B6R0.6 O\C=C\CCCO Amb24480597 [0,0,1,0,0,0|0,0,2]=3 2207 B6R0.6 O\N=C\C=CC=O Amb25326694 [0,0,1,0,0,0|1,0,1]=3 2208 B6R0.6 [N-]=[N+]=N\C=C\CO Amb25176226 [0,0,1,0,0,0|3,0,0]=4 2209 B6R0.6 [O-]\C=C\C=C\C=O Amb17619483 [0,0,1,0,0,0|0,0,3]=4 2210 B6R0.9 C=C\C(\CCl)=C/Cl Amb25026187 [0,0,1,0,0,0|3,0,0]=4 2211 B6R0.9 C=C\C(\CCl)=C\Cl Amb24616265 [0,0,1,0,0,0|3,0,0]=4 2212 B6R0.9 CC=C(CBr)OC Amb25258340 [0,0,1,0,0,0|1,0,2]=4 2213 B6R0.9 CC=C(CI)OC Amb25176571 [0,0,1,0,0,0|1,0,2]=4 2214 B6R0.9 CCC(=CBr)OC Amb24400630 [0,0,1,0,0,0|2,0,1]=4 2215 B6R0.9 CCC(CO)=C=C Amb25056939 [0,0,1,0,0,0|1,0,2]=4 2216 B6R0.9 CCC(CO)C=C Amb21858662 [0,0,1,0,0,0|1,0,2]=4 2217 B6R0.9 CC[C@H](CO)C=C Amb25283278 [0,0,1,0,0,0|1,0,2]=4 2218 B6R0.9 CC\C(\C=C)=C/Br Amb24523667 [0,0,1,0,0,0|3,0,0]=4 2219 B6R0.9 CC\C(\CO)=C/Br Amb25061874 [0,0,1,0,0,0|2,0,1]=4 2220 B6R0.9 CN[C@@H](CO)C=C Amb25044465 [0,0,1,0,0,0|1,0,2]=4 2221 B6R0.9 COC(CBr)C=C Amb25186970 [0,0,1,0,0,0|1,0,2]=4 2222 B6R0.9 COC(CI)C=C Amb24332607 [0,0,1,0,0,0|1,0,2]=4 2223 B6R0.9 COC(CO)C=C Amb22228508 [0,0,1,0,0,0|0,0,2]=3 2224 B6R0.9 COC(CO)C=O Amb18640344 [0,0,1,0,0,0|1,0,2]=4 2225 B6R0.9 CO[C@@H](CO)C=O Amb24639077 [0,0,1,0,0,0|1,0,2]=4 2226 B6R0.9 CO[C@H](CO)C=C Amb24397960 [0,0,1,0,0,0|0,0,2]=3 2227 B6R0.9 CO\C(=C\O)\C=O Amb24383108 [0,0,1,0,0,0|1,0,2]=4 2228 B6R0.9 CSC(CO)C=C Amb25256720 [0,0,1,0,0,0|0,1,2]=4 2229 B6R0.9 C\C=C(\CC)/C=C Amb25024610 [0,0,1,0,0,0|2,0,1]=4 2230 B6R0.9 C\C=C(\CO)/C#N Amb18638994 [0,0,1,0,0,0|2,0,1]=4 2231 B6R0.9 C\C=C(\CO)/C=C Amb25810653 [0,0,1,0,0,0|1,0,1]=3 2232 B8R2.27 OC1C2CC1C=C2 Amb25138194 [0,0,0,1,0,0|1,0,2]=4 2233 B8R2.27 O[C@@H]1[C@@H]2C[C@H]1C=C2 Amb24431003 [0,0,0,1,0,0|1,0,2]=4 2234 B8R2.34 C1CC2C=CC1O2 Amb24545043 [0,0,0,1,0,0|1,0,2]=4 2235 B8R2.55 C1CC12C=CC=C2 Amb22234070 [0,0,0,1,0,0|2,0,1]=4 2236 B6R1.6 BrCC=1CCC1 Amb24652455 [0,0,0,0,1,0|1,0,2]=4 2237 B6R1.6 OCC1CCO1 Amb21960943 [0,0,0,0,1,0|0,0,3]=4 2238 B6R1.6 OCC=1CCC1 Amb25744805 [0,0,0,0,1,0|0,0,2]=3 2239 B6R1.6 OC[C@H]1CCO1 Amb24559274 [0,0,0,0,1,0|0,0,3]=4 2240 B8R1.2 BrCC1=CCOCO1 Amb25322013 [0,0,0,0,0,1|1,0,2]=4 2241 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [0,0,0,0,0,1|2,0,0]=3 2242 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [0,0,0,0,0,1|2,0,0]=3 2243 B8R1.2 BrCc1c[n]c[n]c1 Amb22001742 [0,0,0,0,0,1|3,0,0]=4 2244 B8R1.2 BrCc1c[n]c[n]c1 Amb22751382 [0,0,0,0,0,1|3,0,0]=4 2245 B8R1.2 BrCc1c[n]cc[n]1 Amb22498353 [0,0,0,0,0,1|2,0,0]=3 2246 B8R1.2 BrCc1cc[n]c[n]1 Amb21963500 [0,0,0,0,0,1|2,0,0]=3 2247 B8R1.2 BrCc1cc[n]c[n]1 Amb22235520 [0,0,0,0,0,1|2,0,0]=3 2248 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [0,0,0,0,0,1|2,0,0]=3 2249 B8R1.2 BrCc1ccc[n][n]1 Amb22234747 [0,0,0,0,0,1|2,0,0]=3 2250 B8R1.2 BrCc1cccc[n]1 Amb22751621 [0,0,0,0,0,1|2,0,0]=3 2251 B8R1.2 BrCc1cccnn1 Amb10070423 [0,0,0,0,0,1|2,0,0]=3 2252 B8R1.2 BrCc1cnccn1 Amb16185761 [0,0,0,0,0,1|2,0,0]=3 2253 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [0,0,0,0,0,1|2,0,0]=3 2254 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [0,0,0,0,0,1|3,0,0]=4 2255 B8R1.2 Br[Mg]c1[n]ccc[n]1 Amb22897398 [0,0,0,0,0,1|3,0,0]=4 2256 B8R1.2 Br[Mg]c1cc[n]cc1 Amb22897371 [0,0,0,0,0,1|3,0,0]=4 2257 B8R1.2 Br[Mg]c1cccc[n]1 Amb22000542 [0,0,0,0,0,1|3,0,0]=4 2258 B8R1.2 Br[Zn]c1[n]ccc[n]1 Amb22897779 [0,0,0,0,0,1|3,0,0]=4 2259 B8R1.2 Br[Zn]c1cc[n]cc1 Amb22897889 [0,0,0,0,0,1|3,0,0]=4 2260 B8R1.2 Br[Zn]c1cccc[n]1 Amb22000378 [0,0,0,0,0,1|3,0,0]=4 2261 B8R1.2 Br[Zn]c1cccnc1 Amb13890843 [0,0,0,0,0,1|3,0,0]=4 2262 B8R1.2 C#Cc1[n]ccc[n]1 Amb19957825 [0,0,0,0,0,1|2,0,1]=4 2263 B8R1.2 C#Cc1c[n]cc[n]1 Amb19895048 [0,0,0,0,0,1|2,0,1]=4 2264 B8R1.2 C#Cc1cc[n]c[n]1 Amb20670972 [0,0,0,0,0,1|2,0,1]=4 2265 B8R1.2 C#Cc1ccc[n][n]1 Amb23439062 [0,0,0,0,0,1|2,0,1]=4 2266 B8R1.2 C#Cc1cccnc1 Amb10067163 [0,0,0,0,0,1|2,0,1]=4 2267 B8R1.2 C#Cc1ccncc1 Amb13891877 [0,0,0,0,0,1|2,0,1]=4 2268 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [0,0,0,0,0,1|2,0,1]=4 2269 B8R1.2 C=Cc1[n]ccc[n]1 Amb23411991 [0,0,0,0,0,1|2,0,1]=4 2270 B8R1.2 C=Cc1cc[n]c[n]1 Amb24056360 [0,0,0,0,0,1|2,0,1]=4 2271 B8R1.2 C=Cc1ccc[n][n]1 Amb25026421 [0,0,0,0,0,1|2,0,1]=4 2272 B8R1.2 C=Cc1ccccc1 Amb22337033 [0,0,0,0,0,1|2,0,1]=4 2273 B8R1.2 C=Cc1ccccc1 Amb22337871 [0,0,0,0,0,1|2,0,1]=4 2274 B8R1.2 C=Cc1ccccc1 Amb22337937 [0,0,0,0,0,1|2,0,1]=4 2275 B8R1.2 C=Cc1ccccc1 Amb22338204 [0,0,0,0,0,1|2,0,1]=4 2276 B8R1.2 C=Cc1ccccc1 Amb22338475 [0,0,0,0,0,1|2,0,1]=4 2277 B8R1.2 C=Cc1ccccc1 Amb22351316 [0,0,0,0,0,1|2,0,1]=4 2278 B8R1.2 C=Cc1ccccc1 Amb22731028 [0,0,0,0,0,1|2,0,1]=4 2279 B8R1.2 C=Cc1ccccc1 Amb22733123 [0,0,0,0,0,1|2,0,1]=4 2280 B8R1.2 C=Cc1cccnc1 Amb10071930 [0,0,0,0,0,1|2,0,1]=4 2281 B8R1.2 C=Nc1ccccc1 Amb24605672 [0,0,0,0,0,1|3,0,0]=4 2282 B8R1.2 CCC1=CCC=CN1 Amb24524490 [0,0,0,0,0,1|2,0,0]=3 2283 B8R1.2 CCC=1CC=CCC1 Amb22227940 [0,0,0,0,0,1|2,0,0]=3 2284 B8R1.2 CC[n+]1ccccc1 Amb22739693 [0,0,0,0,0,1|3,0,0]=4 2285 B8R1.2 CCc1[n]ccc[n]1 Amb24095641 [0,0,0,0,0,1|2,0,0]=3 2286 B8R1.2 CCc1c[n]c[n]c1 Amb24097063 [0,0,0,0,0,1|3,0,0]=4 2287 B8R1.2 CCc1c[n]cc[n]1 Amb20620291 [0,0,0,0,0,1|2,0,0]=3 2288 B8R1.2 CCc1cc[n]c[n]1 Amb20242304 [0,0,0,0,0,1|2,0,0]=3 2289 B8R1.2 CCc1ccccc1 Amb22336270 [0,0,0,0,0,1|2,0,0]=3 2290 B8R1.2 CCc1ccccc1 Amb22366965 [0,0,0,0,0,1|2,0,0]=3 2291 B8R1.2 CCc1ccccc1 Amb2447474 [0,0,0,0,0,1|2,0,0]=3 2292 B8R1.2 CNc1c[n]cc[n]1 Amb22292455 [0,0,0,0,0,1|3,0,0]=4 2293 B8R1.2 CNc1cc[n]c[n]1 Amb18944730 [0,0,0,0,0,1|3,0,0]=4 2294 B8R1.2 CNc1ccc[n][n]1 Amb18947507 [0,0,0,0,0,1|3,0,0]=4 2295 B8R1.2 CNc1cnccn1 Amb1102655 [0,0,0,0,0,1|3,0,0]=4 2296 B8R1.2 COC1=CCC=CC1 Amb10842162 [0,0,0,0,0,1|3,0,0]=4 2297 B8R1.2 COC=1CCC=CC1 Amb22348084 [0,0,0,0,0,1|3,0,0]=4 2298 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [0,0,0,0,0,1|3,0,0]=4 2299 B8R1.2 CO[13c]1ccccc1 Amb22362658 [0,0,0,0,0,1|3,0,0]=4 2300 B8R1.2 COc1cc[n]cc1 Amb24079672 [0,0,0,0,0,1|3,0,0]=4 2301 B8R1.2 COc1cccnc1 Amb10573360 [0,0,0,0,0,1|3,0,0]=4 2302 B8R1.2 COc1ccncn1 Amb15692928 [0,0,0,0,0,1|3,0,0]=4 2303 B8R1.2 CPc1ccccc1 Amb25341327 [0,0,0,0,0,1|3,0,0]=4 2304 B8R1.2 CSc1[n]ccc[n]1 Amb22295856 [0,0,0,0,0,1|3,0,0]=4 2305 B8R1.2 CSc1c[n]ccc1 Amb24087396 [0,0,0,0,0,1|3,0,0]=4 2306 B8R1.2 CSc1cc[n]cc1 Amb24103013 [0,0,0,0,0,1|3,0,0]=4 2307 B8R1.2 CSc1ccc[n][n]1 Amb24473964 [0,0,0,0,0,1|3,0,0]=4 2308 B8R1.2 CSc1cccc[n]1 Amb24081200 [0,0,0,0,0,1|3,0,0]=4 2309 B8R1.2 CSc1ncccn1 Amb2455862 [0,0,0,0,0,1|3,0,0]=4 2310 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [0,0,0,0,0,1|2,0,0]=3 2311 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [0,0,0,0,0,1|2,1,0]=4 2312 B8R1.2 ClC=C1C=COC=C1 Amb24470181 [0,0,0,0,0,1|2,0,1]=4 2313 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,0,0,0,0,1|1,0,2]=4 2314 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [0,0,0,0,0,1|2,0,0]=3 2315 B8R1.2 ClCc1[n]c[n]c[n]1 Amb24711924 [0,0,0,0,0,1|3,0,0]=4 2316 B8R1.2 ClCc1c[n]c[n]c1 Amb20671193 [0,0,0,0,0,1|3,0,0]=4 2317 B8R1.2 ClCc1cc[n]c[n]1 Amb21864735 [0,0,0,0,0,1|2,0,0]=3 2318 B8R1.2 ClCc1cc[n]c[n]1 Amb22491514 [0,0,0,0,0,1|2,0,0]=3 2319 B8R1.2 ClCc1ccc[n][n]1 Amb21960122 [0,0,0,0,0,1|2,0,0]=3 2320 B8R1.2 ClCc1ccc[n][n]1 Amb22000870 [0,0,0,0,0,1|2,0,0]=3 2321 B8R1.2 ClCc1cccc[n]1 Amb22489454 [0,0,0,0,0,1|2,0,0]=3 2322 B8R1.2 ClCc1ccccc1 Amb22363332 [0,0,0,0,0,1|2,0,0]=3 2323 B8R1.2 ClCc1ccncc1 Amb1933717 [0,0,0,0,0,1|2,0,0]=3 2324 B8R1.2 ClCc1cnccn1 Amb15741173 [0,0,0,0,0,1|2,0,0]=3 2325 B8R1.2 ClCc1cncnc1 Amb10605864 [0,0,0,0,0,1|3,0,0]=4 2326 B8R1.2 ClNc1cccc[n]1 Amb24481501 [0,0,0,0,0,1|3,0,0]=4 2327 B8R1.2 ClSc1[n]ccc[n]1 Amb24061353 [0,0,0,0,0,1|3,0,0]=4 2328 B8R1.2 ClSc1cc[n]cc1 Amb24099593 [0,0,0,0,0,1|3,0,0]=4 2329 B8R1.2 ClSc1ccccc1 Amb10575597 [0,0,0,0,0,1|3,0,0]=4 2330 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [0,0,0,0,0,1|2,0,0]=3 2331 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [0,0,0,0,0,1|2,1,0]=4 2332 B8R1.2 FCc1[n]ccc[n]1 Amb25746002 [0,0,0,0,0,1|2,0,0]=3 2333 B8R1.2 FCc1c[n]ccc1 Amb25259171 [0,0,0,0,0,1|2,0,0]=3 2334 B8R1.2 FCc1cc[n]cc1 Amb22372287 [0,0,0,0,0,1|2,0,0]=3 2335 B8R1.2 FCc1cccc[n]1 Amb24093657 [0,0,0,0,0,1|2,0,0]=3 2336 B8R1.2 FCc1ccccc1 Amb10838335 [0,0,0,0,0,1|2,0,0]=3 2337 B8R1.2 FNc1cccc[n]1 Amb25320751 [0,0,0,0,0,1|3,0,0]=4 2338 B8R1.2 FSc1ccccc1 Amb25198589 [0,0,0,0,0,1|3,0,0]=4 2339 B8R1.2 ICc1cc[n]cc1 Amb22489735 [0,0,0,0,0,1|2,0,0]=3 2340 B8R1.2 ICc1cc[n]cc1 Amb22748952 [0,0,0,0,0,1|2,0,0]=3 2341 B8R1.2 ICc1cccnc1 Amb10602162 [0,0,0,0,0,1|2,0,0]=3 2342 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [0,0,0,0,0,1|3,0,0]=4 2343 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [0,0,0,0,0,1|3,0,0]=4 2344 B8R1.2 I[Se]c1ccccc1 Amb10601593 [0,0,0,0,0,1|3,0,0]=4 2345 B8R1.2 N#CC=1CC=CNC1 Amb24505083 [0,0,0,0,0,1|2,0,1]=4 2346 B8R1.2 N#Cc1ccccc1 Amb21864642 [0,0,0,0,0,1|2,0,1]=4 2347 B8R1.2 N#Cc1ccccc1 Amb22167299 [0,0,0,0,0,1|2,0,1]=4 2348 B8R1.2 N#Cc1cccnc1 Amb1792577 [0,0,0,0,0,1|2,0,1]=4 2349 B8R1.2 N#Cc1ccncn1 Amb13884090 [0,0,0,0,0,1|2,0,1]=4 2350 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [0,0,0,0,0,1|3,0,0]=4 2351 B8R1.2 N#[N+]c1cccnc1 Amb17674245 [0,0,0,0,0,1|3,0,0]=4 2352 B8R1.2 N=Cc1c[n]ccc1 Amb24062509 [0,0,0,0,0,1|2,0,1]=4 2353 B8R1.2 N=Cc1cccc[n]1 Amb24081259 [0,0,0,0,0,1|2,0,1]=4 2354 B8R1.2 N=Nc1[n]ccc[n]1 Amb24104343 [0,0,0,0,0,1|3,0,0]=4 2355 B8R1.2 N=Nc1cc[n]c[n]1 Amb24091443 [0,0,0,0,0,1|3,0,0]=4 2356 B8R1.2 N=Nc1cccc[n]1 Amb24104371 [0,0,0,0,0,1|3,0,0]=4 2357 B8R1.2 NCC1=CC=CCO1 Amb25128002 [0,0,0,0,0,1|1,0,0]=2 2358 B8R1.2 NCC1CCC=CO1 Amb16233709 [0,0,0,0,0,1|1,0,2]=4 2359 B8R1.2 NCC=1COCCC1 Amb24329061 [0,0,0,0,0,1|1,0,2]=4 2360 B8R1.2 NC[C@@H]1CCC=CO1 Amb25309281 [0,0,0,0,0,1|1,0,2]=4 2361 B8R1.2 NC[C@H]1CCC=CO1 Amb24585156 [0,0,0,0,0,1|1,0,2]=4 2362 B8R1.2 NC[n+]1ccccc1 Amb24716810 [0,0,0,0,0,1|3,0,0]=4 2363 B8R1.2 NCc1[n][n]cc[n]1 Amb18203401 [0,0,0,0,0,1|3,0,0]=4 2364 B8R1.2 NCc1[n]c[n]c[n]1 Amb18860197 [0,0,0,0,0,1|3,0,0]=4 2365 B8R1.2 NCc1[n]ccc[n]1 Amb20668380 [0,0,0,0,0,1|2,0,0]=3 2366 B8R1.2 NCc1[n]ccc[n]1 Amb22267718 [0,0,0,0,0,1|2,0,0]=3 2367 B8R1.2 NCc1[n]ccc[n]1 Amb22491384 [0,0,0,0,0,1|2,0,0]=3 2368 B8R1.2 NCc1c[n][n]c[n]1 Amb25762955 [0,0,0,0,0,1|3,0,0]=4 2369 B8R1.2 NCc1c[n][n]cc1 Amb19957512 [0,0,0,0,0,1|3,0,0]=4 2370 B8R1.2 NCc1c[n][n]cc1 Amb22405863 [0,0,0,0,0,1|3,0,0]=4 2371 B8R1.2 NCc1c[n]c[n][n]1 Amb18203400 [0,0,0,0,0,1|3,0,0]=4 2372 B8R1.2 NCc1c[n]c[n]c1 Amb22899160 [0,0,0,0,0,1|3,0,0]=4 2373 B8R1.2 NCc1cc[n]cc1 Amb20620293 [0,0,0,0,0,1|2,0,0]=3 2374 B8R1.2 NCc1cc[n]cc1 Amb20622010 [0,0,0,0,0,1|2,0,0]=3 2375 B8R1.2 NCc1ccc[n][n]1 Amb24183396 [0,0,0,0,0,1|2,0,0]=3 2376 B8R1.2 NCc1cccc[n]1 Amb20620292 [0,0,0,0,0,1|2,0,0]=3 2377 B8R1.2 NCc1cccc[n]1 Amb22274458 [0,0,0,0,0,1|2,0,0]=3 2378 B8R1.2 NCc1ccccc1 Amb19958612 [0,0,0,0,0,1|2,0,0]=3 2379 B8R1.2 NCc1ccccc1 Amb22052549 [0,0,0,0,0,1|2,0,0]=3 2380 B8R1.2 NCc1ccccc1 Amb23459863 [0,0,0,0,0,1|2,0,0]=3 2381 B8R1.2 NCc1ccccc1 Amb24325406 [0,0,0,0,0,1|2,0,0]=3 2382 B8R1.2 NCc1cccnc1 Amb1481403 [0,0,0,0,0,1|2,0,0]=3 2383 B8R1.2 NCc1cccnc1 Amb2189172 [0,0,0,0,0,1|2,0,0]=3 2384 B8R1.2 NCc1ccncc1 Amb1156526 [0,0,0,0,0,1|2,0,0]=3 2385 B8R1.2 NCc1cnccn1 Amb10067734 [0,0,0,0,0,1|2,0,0]=3 2386 B8R1.2 NCc1cnccn1 Amb1099257 [0,0,0,0,0,1|2,0,0]=3 2387 B8R1.2 NCc1ncccn1 Amb10068909 [0,0,0,0,0,1|2,0,0]=3 2388 B8R1.2 NCc1ncccn1 Amb1139642 [0,0,0,0,0,1|2,0,0]=3 2389 B8R1.2 NCc1nccnc1 Amb10068908 [0,0,0,0,0,1|2,0,0]=3 2390 B8R1.2 NNc1[n]ccc[n]1 Amb22587655 [0,0,0,0,0,1|3,0,0]=4 2391 B8R1.2 NNc1cc[n]c[n]1 Amb22011554 [0,0,0,0,0,1|3,0,0]=4 2392 B8R1.2 NNc1cc[n]c[n]1 Amb22757340 [0,0,0,0,0,1|3,0,0]=4 2393 B8R1.2 NNc1cc[n]cc1 Amb19893272 [0,0,0,0,0,1|3,0,0]=4 2394 B8R1.2 NNc1cccc[n]1 Amb22494294 [0,0,0,0,0,1|3,0,0]=4 2395 B8R1.2 NNc1ccccc1 Amb22002446 [0,0,0,0,0,1|3,0,0]=4 2396 B8R1.2 NNc1ccccc1 Amb22166856 [0,0,0,0,0,1|3,0,0]=4 2397 B8R1.2 NNc1ccccc1 Amb22731573 [0,0,0,0,0,1|3,0,0]=4 2398 B8R1.2 NNc1ccccn1 Amb1104567 [0,0,0,0,0,1|3,0,0]=4 2399 B8R1.2 NNc1cccnc1 Amb10177783 [0,0,0,0,0,1|3,0,0]=4 2400 B8R1.2 NNc1cccnc1 Amb16192849 [0,0,0,0,0,1|3,0,0]=4 2401 B8R1.2 NNc1cccnc1 Amb2092671 [0,0,0,0,0,1|3,0,0]=4 2402 B8R1.2 NNc1cccnn1 Amb16185786 [0,0,0,0,0,1|3,0,0]=4 2403 B8R1.2 NNc1cccnn1 Amb16231295 [0,0,0,0,0,1|3,0,0]=4 2404 B8R1.2 NNc1cnccn1 Amb1111598 [0,0,0,0,0,1|3,0,0]=4 2405 B8R1.2 NNc1ncccn1 Amb1114665 [0,0,0,0,0,1|3,0,0]=4 2406 B8R1.2 NNc1ncccn1 Amb2182937 [0,0,0,0,0,1|3,0,0]=4 2407 B8R1.2 NOc1cccc[n]1 Amb24101187 [0,0,0,0,0,1|3,0,0]=4 2408 B8R1.2 NOc1ccccc1 Amb18123833 [0,0,0,0,0,1|3,0,0]=4 2409 B8R1.2 NOc1ccccc1 Amb22231364 [0,0,0,0,0,1|3,0,0]=4 2410 B8R1.2 NSc1[n]ccc[n]1 Amb24061351 [0,0,0,0,0,1|3,0,0]=4 2411 B8R1.2 NSc1cc[n]cc1 Amb24575022 [0,0,0,0,0,1|3,0,0]=4 2412 B8R1.2 NSc1cccc[n]1 Amb24061291 [0,0,0,0,0,1|3,0,0]=4 2413 B8R1.2 N\N=C\1/C=CC=CN1 Amb22732534 [0,0,0,0,0,1|3,0,0]=4 2414 B8R1.2 O=Bc1ccccc1 Amb25221658 [0,0,0,0,0,1|2,0,1]=4 2415 B8R1.2 O=CC1C=CC=CO1 Amb25053141 [0,0,0,0,0,1|0,0,3]=4 2416 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [0,0,0,0,0,1|1,0,2]=4 2417 B8R1.2 O=Cc1cc[n]cc1 Amb20672039 [0,0,0,0,0,1|1,0,2]=4 2418 B8R1.2 O=Nc1[n]ccc[n]1 Amb24084910 [0,0,0,0,0,1|2,0,1]=4 2419 B8R1.2 O=Nc1c[n]cc[n]1 Amb24601195 [0,0,0,0,0,1|2,0,1]=4 2420 B8R1.2 O=Nc1cc[n]c[n]1 Amb24070598 [0,0,0,0,0,1|2,0,1]=4 2421 B8R1.2 O=S=C1C=CC=CN1 Amb25679690 [0,0,0,0,0,1|2,0,1]=4 2422 B8R1.2 O=S=C1C=CNC=C1 Amb24606190 [0,0,0,0,0,1|2,0,1]=4 2423 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [0,0,0,0,0,1|1,0,2]=4 2424 B8R1.2 O=[I]c1ccccc1 Amb15692855 [0,0,0,0,0,1|2,0,1]=4 2425 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,0,0,0,0,1|0,0,2]=3 2426 B8R1.2 OCC1=CCNC=C1 Amb25662609 [0,0,0,0,0,1|1,0,1]=3 2427 B8R1.2 OCC1=COCCO1 Amb19319714 [0,0,0,0,0,1|0,0,2]=3 2428 B8R1.2 OCC1CC=CCO1 Amb25316226 [0,0,0,0,0,1|0,0,2]=3 2429 B8R1.2 OCC1CCCC=C1 Amb17593156 [0,0,0,0,0,1|1,0,2]=4 2430 B8R1.2 OCC=1CCCCC1 Amb24122911 [0,0,0,0,0,1|1,0,2]=4 2431 B8R1.2 OCC=1CCCOC1 Amb24426430 [0,0,0,0,0,1|0,0,3]=4 2432 B8R1.2 OCC=1CCCON1 Amb25675358 [0,0,0,0,0,1|0,0,3]=4 2433 B8R1.2 OCC=1CCNCC1 Amb24105368 [0,0,0,0,0,1|1,0,2]=4 2434 B8R1.2 OCC=1CNCCC1 Amb25189014 [0,0,0,0,0,1|1,0,2]=4 2435 B8R1.2 OCC=1CNCNC1 Amb24612315 [0,0,0,0,0,1|2,0,1]=4 2436 B8R1.2 OCC=1COCCC1 Amb24329074 [0,0,0,0,0,1|0,0,2]=3 2437 B8R1.2 OCN1C=CNC=C1 Amb17938355 [0,0,0,0,0,1|2,0,0]=3 2438 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [0,0,0,0,0,1|1,0,0]=2 2439 B8R1.2 OC[C@@H]1C=CCCO1 Amb25284318 [0,0,0,0,0,1|0,0,2]=3 2440 B8R1.2 OC[C@@H]1CC=CCC1 Amb25143197 [0,0,0,0,0,1|1,0,2]=4 2441 B8R1.2 OC[C@@H]1CC=CCO1 Amb25106053 [0,0,0,0,0,1|0,0,2]=3 2442 B8R1.2 OC[C@@H]1CCC=CO1 Amb24361884 [0,0,0,0,0,1|0,0,2]=3 2443 B8R1.2 OC[C@@H]1CCCC=C1 Amb25682189 [0,0,0,0,0,1|1,0,2]=4 2444 B8R1.2 OC[C@H]1C=CCCO1 Amb24545780 [0,0,0,0,0,1|0,0,2]=3 2445 B8R1.2 OCc1[n]c[n]c[n]1 Amb25045759 [0,0,0,0,0,1|2,0,0]=3 2446 B8R1.2 OCc1c[n][n]cc1 Amb21856410 [0,0,0,0,0,1|2,0,0]=3 2447 B8R1.2 OCc1c[n]c[n][n]1 Amb25045661 [0,0,0,0,0,1|2,0,0]=3 2448 B8R1.2 OCc1c[n]ccc1 Amb20622013 [0,0,0,0,0,1|1,0,0]=2 2449 B8R1.2 OCc1c[n]ccc1 Amb22434305 [0,0,0,0,0,1|1,0,0]=2 2450 B8R1.2 OCc1cc[n]cc1 Amb24183964 [0,0,0,0,0,1|1,0,0]=2 2451 B8R1.2 OCc1ccccn1 Amb16231923 [0,0,0,0,0,1|1,0,0]=2 2452 B8R1.2 OCc1ccncc1 Amb16231990 [0,0,0,0,0,1|1,0,0]=2 2453 B8R1.2 ONc1cc[n]c[n]1 Amb25802402 [0,0,0,0,0,1|2,0,0]=3 2454 B8R1.2 ONc1cccc[n]1 Amb25057797 [0,0,0,0,0,1|2,0,0]=3 2455 B8R1.2 ONc1ccccc1 Amb17672282 [0,0,0,0,0,1|2,0,0]=3 2456 B8R1.2 ONc1ccccc1 Amb22445293 [0,0,0,0,0,1|2,0,0]=3 2457 B8R1.2 OSc1cccc[n]1 Amb24061294 [0,0,0,0,0,1|2,0,0]=3 2458 B8R1.2 OSc1ccccc1 Amb25200260 [0,0,0,0,0,1|2,0,0]=3 2459 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [0,0,0,0,0,1|1,0,0]=2 2460 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [0,0,0,0,0,1|1,0,0]=2 2461 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [0,0,0,0,0,1|2,0,0]=3 2462 B8R1.2 S=Cc1cc[n]c[n]1 Amb24437755 [0,0,0,0,0,1|1,1,1]=4 2463 B8R1.2 S=Nc1c[n]ccc1 Amb24085398 [0,0,0,0,0,1|2,1,0]=4 2464 B8R1.2 S=Nc1cccc[n]1 Amb24101381 [0,0,0,0,0,1|2,1,0]=4 2465 B8R1.2 SCc1c[n]c[n]c1 Amb24546720 [0,0,0,0,0,1|2,1,0]=4 2466 B8R1.2 SCc1c[n]ccc1 Amb21984718 [0,0,0,0,0,1|1,1,0]=3 2467 B8R1.2 SCc1cc[n]c[n]1 Amb24099658 [0,0,0,0,0,1|1,1,0]=3 2468 B8R1.2 SCc1cc[n]cc1 Amb22008603 [0,0,0,0,0,1|1,1,0]=3 2469 B8R1.2 SCc1cccc[n]1 Amb20622005 [0,0,0,0,0,1|1,1,0]=3 2470 B8R1.2 SSc1[n]ccc[n]1 Amb24061352 [0,0,0,0,0,1|2,1,0]=4 2471 B8R1.2 SSc1cccc[n]1 Amb24061331 [0,0,0,0,0,1|2,1,0]=4 2472 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [0,0,0,0,0,1|2,0,0]=3 2473 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [0,0,0,0,0,1|2,0,0]=3 2474 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [0,0,0,0,0,1|2,0,1]=4 2475 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [0,0,0,0,0,1|2,0,1]=4 2476 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [0,0,0,0,0,1|2,0,1]=4 2477 B8R1.2 [C-]#[N+]c1cccc[n]1 Amb25840846 [0,0,0,0,0,1|3,0,0]=4 2478 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [0,0,0,0,0,1|3,0,0]=4 2479 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [0,0,0,0,0,1|3,0,0]=4 2480 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [0,0,0,0,0,1|2,0,0]=3 2481 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [0,0,0,0,0,1|2,0,0]=3 2482 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [0,0,0,0,0,1|3,0,0]=4 2483 B8R1.2 [Na]Oc1ccccn1 Amb10552457 [0,0,0,0,0,1|3,0,0]=4 2484 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [0,0,0,0,0,1|3,0,0]=4 2485 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [0,0,0,0,0,1|1,0,1]=3 2486 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [0,0,0,0,0,1|2,0,0]=3 2487 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [0,0,0,0,0,1|3,0,0]=4 2488 B8R1.2 c1ccnnc1C#N Amb13884089 [0,0,0,0,0,1|2,0,1]=4 2489 B5R0.1 C/C=C/C(C)=O Amb17940030 [1,0,1,0,0,0|0,0,2]=4 2490 B5R0.1 C=C=CC(O)=O Amb24391957 [1,0,1,0,0,0|0,0,2]=4 2491 B5R0.1 C=CCB(O)O Amb20240823 [1,0,1,0,0,0|1,0,1]=4 2492 B5R0.1 C=CCC(O)O Amb25144470 [1,0,1,0,0,0|0,0,2]=4 2493 B5R0.1 CC(=C)CC=C Amb22347764 [1,0,1,0,0,0|1,0,0]=3 2494 B5R0.1 CC(=C)NC=O Amb25065862 [1,0,1,0,0,0|2,0,0]=4 2495 B5R0.1 CC(=C)\C=C/C Amb22733448 [1,0,1,0,0,0|1,0,1]=4 2496 B5R0.1 CC(=C)\C=C/Cl Amb25123259 [1,0,1,0,0,0|2,0,0]=4 2497 B5R0.1 CC(=C)\C=C\Br Amb25242010 [1,0,1,0,0,0|2,0,0]=4 2498 B5R0.1 CC(=C)\C=C\Cl Amb24526409 [1,0,1,0,0,0|2,0,0]=4 2499 B5R0.1 CC(=C)\C=C\I Amb25299248 [1,0,1,0,0,0|2,0,0]=4 2500 B5R0.1 CC(=O)C=C=C Amb23447108 [1,0,1,0,0,0|0,0,2]=4 2501 B5R0.1 CC(=O)NC=C Amb24323579 [1,0,1,0,0,0|1,0,1]=4 2502 B5R0.1 CC(=O)OC=C Amb21618930 [1,0,1,0,0,0|1,0,0]=3 2503 B5R0.1 CC(=O)OC=C Amb22338143 [1,0,1,0,0,0|1,0,0]=3 2504 B5R0.1 CC(=O)OC=C Amb22338476 [1,0,1,0,0,0|1,0,0]=3 2505 B5R0.1 CC(=O)OC=C Amb22366845 [1,0,1,0,0,0|1,0,0]=3 2506 B5R0.1 CC(=O)OC=O Amb25283525 [1,0,1,0,0,0|2,0,0]=4 2507 B5R0.1 CC(=O)O[13CH]=[13CH2] Amb22351356 [1,0,1,0,0,0|1,0,0]=3 2508 B5R0.1 CC(=O)\C=C/N Amb25147403 [1,0,1,0,0,0|1,0,1]=4 2509 B5R0.1 CC(=O)\C=C\Br Amb25803449 [1,0,1,0,0,0|1,0,1]=4 2510 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [1,0,1,0,0,0|1,0,1]=4 2511 B5R0.1 CC(=O)\C=C\I Amb25269482 [1,0,1,0,0,0|1,0,1]=4 2512 B5R0.1 CC(=S)NC=C Amb24689648 [1,0,1,0,0,0|1,1,0]=4 2513 B5R0.1 CC(C)=CC=C Amb22229813 [1,0,1,0,0,0|1,0,0]=3 2514 B5R0.1 CC(C)OC=C Amb22230777 [1,0,1,0,0,0|0,0,2]=4 2515 B5R0.1 CC(O)C=C=C Amb24379095 [1,0,1,0,0,0|0,0,2]=4 2516 B5R0.1 CC(O)OC=C Amb25215838 [1,0,1,0,0,0|0,0,2]=4 2517 B5R0.1 CC(O)\C=C/Br Amb25809927 [1,0,1,0,0,0|1,0,1]=4 2518 B5R0.1 CC(O)\C=C/Cl Amb24635620 [1,0,1,0,0,0|1,0,1]=4 2519 B5R0.1 CC(O)\C=C/I Amb24373761 [1,0,1,0,0,0|1,0,1]=4 2520 B5R0.1 CC(O)\C=C\Br Amb24519445 [1,0,1,0,0,0|1,0,1]=4 2521 B5R0.1 CC(O)\C=C\Cl Amb25264104 [1,0,1,0,0,0|1,0,1]=4 2522 B5R0.1 CC=CC(C)=O Amb24061083 [1,0,1,0,0,0|0,0,2]=4 2523 B5R0.1 C[C@@H](O)CC=C Amb22225370 [1,0,1,0,0,0|0,0,2]=4 2524 B5R0.1 C[C@@H](O)\C=C\I Amb24334105 [1,0,1,0,0,0|1,0,1]=4 2525 B5R0.1 C[C@H](O)CC=C Amb22226758 [1,0,1,0,0,0|0,0,2]=4 2526 B5R0.1 C\C(\Br)=C\C=O Amb18124620 [1,0,1,0,0,0|2,0,0]=4 2527 B5R0.1 C\C(\Cl)=C/C=O Amb18640408 [1,0,1,0,0,0|2,0,0]=4 2528 B5R0.1 C\C(\I)=C/C=O Amb25095164 [1,0,1,0,0,0|2,0,0]=4 2529 B5R0.1 C\C(\I)=C\C=O Amb24424054 [1,0,1,0,0,0|2,0,0]=4 2530 B5R0.1 C\C(\N)=N\C=C Amb24448988 [1,0,1,0,0,0|2,0,0]=4 2531 B5R0.1 C\C=C/B(O)O Amb24547752 [1,0,1,0,0,0|1,0,1]=4 2532 B5R0.1 C\C=C\C(C)=C Amb22733185 [1,0,1,0,0,0|1,0,1]=4 2533 B5R0.1 C\C=C\[C@H](C)O Amb25145549 [1,0,1,0,0,0|0,0,2]=4 2534 B5R0.1 NC(=O)OC=C Amb17621270 [1,0,1,0,0,0|1,0,1]=4 2535 B5R0.1 OB(O)\C=C\Cl Amb25241162 [1,0,1,0,0,0|2,0,0]=4 2536 B5R0.1 OB(\C=C\C)O Amb2447259 [1,0,1,0,0,0|1,0,1]=4 2537 B5R0.1 OC(=O)\C=C/Br Amb18644453 [1,0,1,0,0,0|1,0,1]=4 2538 B5R0.1 OC(=O)\C=C\F Amb24417763 [1,0,1,0,0,0|1,0,1]=4 2539 B5R0.1 OC(=O)\C=C\I Amb20242758 [1,0,1,0,0,0|1,0,1]=4 2540 B5R0.1 [O-]\C=C\C(=O)C Amb15772268 [1,0,1,0,0,0|1,0,1]=4 2541 B5R0.1 [O-]\C=C\C(=O)C Amb2228039 [1,0,1,0,0,0|1,0,1]=4 2542 B5R0.2 C=C/C=C/C=C Amb17939040 [1,0,1,0,0,0|1,0,1]=4 2543 B5R0.2 C=CCOC=O Amb22051694 [1,0,1,0,0,0|0,0,2]=4 2544 B5R0.2 C=CCOCO Amb25115933 [1,0,1,0,0,0|0,0,1]=3 2545 B5R0.2 C=CNCCO Amb24380906 [1,0,1,0,0,0|1,0,1]=4 2546 B5R0.2 C=COCC=C Amb17933943 [1,0,1,0,0,0|0,0,2]=4 2547 B5R0.2 C=C\C=C/C=O Amb25248524 [1,0,1,0,0,0|0,0,2]=4 2548 B5R0.2 C=C\C=C\C#N Amb17593012 [1,0,1,0,0,0|1,0,1]=4 2549 B5R0.2 C=C\C=C\CBr Amb24350542 [1,0,1,0,0,0|1,0,0]=3 2550 B5R0.2 C=C\C=C\CCl Amb24401492 [1,0,1,0,0,0|1,0,0]=3 2551 B5R0.2 C=NOCCO Amb25246977 [1,0,1,0,0,0|1,0,1]=4 2552 B5R0.2 CC=C=CCO Amb24657460 [1,0,1,0,0,0|0,0,2]=4 2553 B5R0.2 CC=C\C=C/Cl Amb25025604 [1,0,1,0,0,0|1,0,0]=3 2554 B5R0.2 CC=C\C=C\I Amb24333865 [1,0,1,0,0,0|1,0,0]=3 2555 B5R0.2 CCCOC=C Amb17940706 [1,0,1,0,0,0|1,0,1]=4 2556 B5R0.2 CCO/C=C/Cl Amb17689421 [1,0,1,0,0,0|1,0,1]=4 2557 B5R0.2 CCO\C=C/Br Amb2455970 [1,0,1,0,0,0|1,0,1]=4 2558 B5R0.2 CCO\C=C\Br Amb10068669 [1,0,1,0,0,0|1,0,1]=4 2559 B5R0.2 CC\C=C/C=C Amb25025160 [1,0,1,0,0,0|1,0,0]=3 2560 B5R0.2 CC\C=C/CO Amb10975881 [1,0,1,0,0,0|0,0,2]=4 2561 B5R0.2 CC\C=C\CO Amb22347892 [1,0,1,0,0,0|0,0,2]=4 2562 B5R0.2 CN\C=C\C=C Amb24560684 [1,0,1,0,0,0|2,0,0]=4 2563 B5R0.2 CN\C=C\C=O Amb24564349 [1,0,1,0,0,0|1,0,1]=4 2564 B5R0.2 COC=CC=C Amb22348083 [1,0,1,0,0,0|2,0,0]=4 2565 B5R0.2 CO\C=C\C=C Amb22733914 [1,0,1,0,0,0|2,0,0]=4 2566 B5R0.2 CO\C=C\CO Amb22522111 [1,0,1,0,0,0|1,0,1]=4 2567 B5R0.2 CS\C=C\C=O Amb25811358 [1,0,1,0,0,0|1,0,1]=4 2568 B5R0.2 C\C=C/CC=O Amb24728871 [1,0,1,0,0,0|0,0,2]=4 2569 B5R0.2 C\C=C/CCO Amb19930204 [1,0,1,0,0,0|0,0,2]=4 2570 B5R0.2 C\C=C\C=CBr Amb24519249 [1,0,1,0,0,0|1,0,0]=3 2571 B5R0.2 C\C=C\C=CCl Amb25025018 [1,0,1,0,0,0|1,0,0]=3 2572 B5R0.2 C\C=C\C=CN Amb25025494 [1,0,1,0,0,0|1,0,0]=3 2573 B5R0.2 C\C=C\C=C\N Amb25811440 [1,0,1,0,0,0|1,0,0]=3 2574 B5R0.2 C\C=C\CCO Amb24655557 [1,0,1,0,0,0|0,0,2]=4 2575 B5R0.2 ClC=C\C=C\Cl Amb24527807 [1,0,1,0,0,0|2,0,0]=4 2576 B5R0.2 Cl\C=C\C=C\Cl Amb25102528 [1,0,1,0,0,0|2,0,0]=4 2577 B5R0.2 NCCOC=C Amb17593030 [1,0,1,0,0,0|1,0,1]=4 2578 B5R0.2 NC\C=C/CO Amb20620204 [1,0,1,0,0,0|1,0,1]=4 2579 B5R0.2 NC\C=C\CO Amb24537239 [1,0,1,0,0,0|1,0,1]=4 2580 B5R0.2 O=C\C=C\C=O Amb17593019 [1,0,1,0,0,0|0,0,2]=4 2581 B5R0.2 O=C\C=C\CBr Amb18124626 [1,0,1,0,0,0|1,0,1]=4 2582 B5R0.2 O=C\C=C\CCl Amb18122401 [1,0,1,0,0,0|1,0,1]=4 2583 B5R0.2 O=C\C=C\CF Amb24569288 [1,0,1,0,0,0|1,0,1]=4 2584 B5R0.2 OC/C=C/C#C Amb17670556 [1,0,1,0,0,0|0,0,2]=4 2585 B5R0.2 OC=C\C=C\O Amb25024941 [1,0,1,0,0,0|0,0,0]=2 2586 B5R0.2 OCC#CC=C Amb17593015 [1,0,1,0,0,0|0,0,2]=4 2587 B5R0.2 OCCC=C=C Amb17593020 [1,0,1,0,0,0|0,0,2]=4 2588 B5R0.2 OCCC=NO Amb24581888 [1,0,1,0,0,0|1,0,1]=4 2589 B5R0.2 OCCOC=C Amb17674184 [1,0,1,0,0,0|0,0,1]=3 2590 B5R0.2 OCC\C=C\I Amb24332782 [1,0,1,0,0,0|1,0,1]=4 2591 B5R0.2 OC\C=C\C=O Amb24356008 [1,0,1,0,0,0|0,0,1]=3 2592 B5R0.2 OC\C=C\CBr Amb22054537 [1,0,1,0,0,0|1,0,1]=4 2593 B5R0.2 OC\C=C\CCl Amb17593109 [1,0,1,0,0,0|1,0,1]=4 2594 B5R0.2 OC\C=C\CO Amb22733427 [1,0,1,0,0,0|0,0,1]=3 2595 B5R0.2 OC\C=C\CS Amb24333763 [1,0,1,0,0,0|0,1,1]=4 2596 B5R0.2 ON=CC=NO Amb25209326 [1,0,1,0,0,0|2,0,0]=4 2597 B5R0.2 O\C=C\CCO Amb24333503 [1,0,1,0,0,0|0,0,1]=3 2598 B5R0.3 BrCC(=O)C=C Amb10602446 [1,0,1,0,0,0|1,0,1]=4 2599 B5R0.3 C=C(C=C)C=C Amb25025458 [1,0,1,0,0,0|1,0,1]=4 2600 B5R0.3 C=C(CCl)C=O Amb25173687 [1,0,1,0,0,0|2,0,0]=4 2601 B5R0.3 C=C(CO)C#C Amb24589005 [1,0,1,0,0,0|0,0,2]=4 2602 B5R0.3 C=C(CO)C#N Amb25146652 [1,0,1,0,0,0|1,0,1]=4 2603 B5R0.3 C=C(CO)CBr Amb25662398 [1,0,1,0,0,0|1,0,1]=4 2604 B5R0.3 C=C(CO)CCl Amb25709566 [1,0,1,0,0,0|1,0,1]=4 2605 B5R0.3 C=CC(=C)CBr Amb24451750 [1,0,1,0,0,0|1,0,0]=3 2606 B5R0.3 C=CC(=C)CCl Amb25698288 [1,0,1,0,0,0|1,0,0]=3 2607 B5R0.3 C=CC(=C)CI Amb24333877 [1,0,1,0,0,0|1,0,0]=3 2608 B5R0.3 C=CC(=C)CO Amb25146300 [1,0,1,0,0,0|0,0,0]=2 2609 B5R0.3 C=CC(=O)C=C Amb22265893 [1,0,1,0,0,0|1,0,1]=4 2610 B5R0.3 C=CC(=O)CI Amb24645771 [1,0,1,0,0,0|1,0,1]=4 2611 B5R0.3 C=CC(=O)CN Amb24334239 [1,0,1,0,0,0|1,0,1]=4 2612 B5R0.3 C=CC(=O)O[K] Amb22363270 [1,0,1,0,0,0|1,0,1]=4 2613 B5R0.3 C=CC(=O)O[Na] Amb22336198 [1,0,1,0,0,0|1,0,1]=4 2614 B5R0.3 C=CC(N)CO Amb19374935 [1,0,1,0,0,0|1,0,1]=4 2615 B5R0.3 C=CC(O)CS Amb25234516 [1,0,1,0,0,0|0,1,1]=4 2616 B5R0.3 C=C[C@@H](F)CO Amb24475877 [1,0,1,0,0,0|1,0,1]=4 2617 B5R0.3 C=C[C@@H](N)CO Amb19886656 [1,0,1,0,0,0|1,0,1]=4 2618 B5R0.3 C=C[C@@H](O)CO Amb22225315 [1,0,1,0,0,0|0,0,1]=3 2619 B5R0.3 C=C[C@H](F)CO Amb25043797 [1,0,1,0,0,0|1,0,1]=4 2620 B5R0.3 C=C[C@H](N)CO Amb25147462 [1,0,1,0,0,0|1,0,1]=4 2621 B5R0.3 C=C[C@H](O)CO Amb19888350 [1,0,1,0,0,0|0,0,1]=3 2622 B5R0.3 CC(=CBr)CO Amb17610042 [1,0,1,0,0,0|1,0,1]=4 2623 B5R0.3 CC(C=C)C=C Amb22337672 [1,0,1,0,0,0|1,0,1]=4 2624 B5R0.3 CC(C=C)ON Amb22896392 [1,0,1,0,0,0|1,0,1]=4 2625 B5R0.3 CC(C=C)ON Amb25146282 [1,0,1,0,0,0|1,0,1]=4 2626 B5R0.3 CC(CO)=C=C Amb25839359 [1,0,1,0,0,0|0,0,2]=4 2627 B5R0.3 CC(CO)=CI Amb24545825 [1,0,1,0,0,0|1,0,1]=4 2628 B5R0.3 CC(CO)C=C Amb22347861 [1,0,1,0,0,0|0,0,2]=4 2629 B5R0.3 CC=C(C)OC Amb25747357 [1,0,1,0,0,0|0,0,2]=4 2630 B5R0.3 CCC(=C)C=O Amb17940102 [1,0,1,0,0,0|2,0,0]=4 2631 B5R0.3 CC[C@@H](O)C=C Amb24529645 [1,0,1,0,0,0|1,0,1]=4 2632 B5R0.3 COC(=C)CBr Amb25177183 [1,0,1,0,0,0|1,0,1]=4 2633 B5R0.3 COC(=C)CO Amb25345119 [1,0,1,0,0,0|0,0,1]=3 2634 B5R0.3 COC(=O)C=C Amb22336504 [1,0,1,0,0,0|0,0,2]=4 2635 B5R0.3 COC(=O)C=C Amb22338013 [1,0,1,0,0,0|0,0,2]=4 2636 B5R0.3 COC(=O)C=C Amb22351400 [1,0,1,0,0,0|0,0,2]=4 2637 B5R0.3 COC(=O)C=C Amb22353461 [1,0,1,0,0,0|0,0,2]=4 2638 B5R0.3 COC(C)=CBr Amb24590077 [1,0,1,0,0,0|1,0,1]=4 2639 B5R0.3 COC(C)=CCl Amb25065366 [1,0,1,0,0,0|1,0,1]=4 2640 B5R0.3 COC(C)C=C Amb25232785 [1,0,1,0,0,0|0,0,2]=4 2641 B5R0.3 CSC(=C)CO Amb25334721 [1,0,1,0,0,0|0,1,1]=4 2642 B5R0.3 C[C@@H](CO)C=C Amb25145603 [1,0,1,0,0,0|0,0,2]=4 2643 B5R0.3 C\C(\C=C)=C/I Amb24652456 [1,0,1,0,0,0|2,0,0]=4 2644 B5R0.3 C\C(\C=C)=C\Cl Amb24751401 [1,0,1,0,0,0|2,0,0]=4 2645 B5R0.3 C\C(\C=C)=C\I Amb24512122 [1,0,1,0,0,0|2,0,0]=4 2646 B5R0.3 C\C(\C=C)=C\N Amb24560866 [1,0,1,0,0,0|2,0,0]=4 2647 B5R0.3 C\C(\C=C)=C\O Amb25808114 [1,0,1,0,0,0|0,0,2]=4 2648 B5R0.3 C\C=C(/C)\C=C Amb22347881 [1,0,1,0,0,0|1,0,1]=4 2649 B5R0.3 C\C=C(/F)\CO Amb22546797 [1,0,1,0,0,0|1,0,1]=4 2650 B5R0.3 C\C=C(\Br)/CO Amb25809972 [1,0,1,0,0,0|1,0,1]=4 2651 B5R0.3 C\C=C(\C)/C=C Amb24099382 [1,0,1,0,0,0|1,0,1]=4 2652 B5R0.3 C\C=C(\I)/CO Amb25046626 [1,0,1,0,0,0|1,0,1]=4 2653 B5R0.3 OC(C=C)CBr Amb10808128 [1,0,1,0,0,0|1,0,1]=4 2654 B5R0.3 OC(C=C)CCl Amb17593108 [1,0,1,0,0,0|1,0,1]=4 2655 B5R0.3 OC(C=C)CO Amb17610151 [1,0,1,0,0,0|0,0,1]=3 2656 B5R0.3 OC(CO)C=O Amb21618959 [1,0,1,0,0,0|1,0,1]=4 2657 B5R0.3 OCC(=O)C=O Amb17593031 [1,0,1,0,0,0|1,0,1]=4 2658 B5R0.3 OCC(Cl)=CCl Amb24567043 [1,0,1,0,0,0|2,0,0]=4 2659 B5R0.3 OC[C@@H](O)C=O Amb20242417 [1,0,1,0,0,0|1,0,1]=4 2660 B5R0.3 OC\C(\Br)=C\Br Amb22348400 [1,0,1,0,0,0|2,0,0]=4 2661 B5R0.3 OC\C(\F)=C/Cl Amb24423861 [1,0,1,0,0,0|2,0,0]=4 2662 B5R0.3 O[C@H](C=O)CO Amb16232009 [1,0,1,0,0,0|1,0,1]=4 2663 B5R0.3 O\C=C(\O)/C=O Amb22731841 [1,0,1,0,0,0|1,0,1]=4 2664 B5R1.1 C1=NC=C[NH2+]1 Amb25368421 [2,0,0,0,0,0|2,0,0]=4 2665 B5R1.1 C1C=CC=C1 Amb17938994 [2,0,0,0,0,0|1,0,0]=3 2666 B5R1.1 C1NC=CO1 Amb20242493 [2,0,0,0,0,0|1,0,1]=4 2667 B5R1.1 [C-]=1CC=CC1 Amb22231445 [2,0,0,0,0,0|1,0,1]=4 2668 B5R1.1 [cH-]1cccc1 Amb20246770 [2,0,0,0,0,0|1,0,0]=3 2669 B5R1.1 [cH-]1cccc1 Amb22049508 [2,0,0,0,0,0|1,0,0]=3 2670 B5R1.1 [cH-]1cccc1 Amb22338182 [2,0,0,0,0,0|1,0,0]=3 2671 B5R1.1 [cH-]1cccc1 Amb22338370 [2,0,0,0,0,0|1,0,0]=3 2672 B5R1.1 [cH-]1cccc1 Amb22338811 [2,0,0,0,0,0|1,0,0]=3 2673 B5R1.1 [cH-]1cccc1 Amb22351489 [2,0,0,0,0,0|1,0,0]=3 2674 B5R1.1 [cH-]1cccc1 Amb22351987 [2,0,0,0,0,0|1,0,0]=3 2675 B5R1.1 [cH-]1cccc1 Amb22351988 [2,0,0,0,0,0|1,0,0]=3 2676 B5R1.1 [cH-]1cccc1 Amb22351989 [2,0,0,0,0,0|1,0,0]=3 2677 B5R1.1 [cH-]1cccc1 Amb22353219 [2,0,0,0,0,0|1,0,0]=3 2678 B5R1.1 [cH-]1cccc1 Amb22363310 [2,0,0,0,0,0|1,0,0]=3 2679 B5R1.1 c1[15n]cc[15nH]1 Amb17616032 [2,0,0,0,0,0|2,0,0]=4 2680 B5R1.1 c1[nH]cc[n]1 Amb24324982 [2,0,0,0,0,0|2,0,0]=4 2681 B5R1.1 c1[nH]cc[n]1 Amb24325148 [2,0,0,0,0,0|2,0,0]=4 2682 B5R1.1 c1[nH]cc[p]1 Amb24334574 [2,0,0,0,0,0|2,0,0]=4 2683 B5R1.1 c1c[15n][13cH][15nH]1 Amb22338981 [2,0,0,0,0,0|2,0,0]=4 2684 B5R1.1 c1c[n]o[n]1 Amb25024407 [2,0,0,0,0,0|2,0,0]=4 2685 B5R1.1 c1ccns1 Amb1090456 [2,0,0,0,0,0|1,1,0]=4 2686 B5R1.1 c1ncc[nH]1 Amb16192914 [2,0,0,0,0,0|2,0,0]=4 2687 B5R1.1 c:1:c:c:c:[Te]1 Amb22731086 [2,0,0,0,0,0|0,1,0]=3 2688 B5R1.1 o1cnnc1 Amb10552366 [2,0,0,0,0,0|2,0,0]=4 2689 B7R0.2 C=C(Br)C[C@H](O)CO Amb25369386 [0,1,1,0,0,0|0,0,2]=4 2690 B7R0.2 C=C(Cl)CC(O)CO Amb24482396 [0,1,1,0,0,0|0,0,2]=4 2691 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [0,1,1,0,0,0|0,0,2]=4 2692 B7R0.2 CC(=C)C[C@H](O)CO Amb25235652 [0,1,1,0,0,0|0,0,2]=4 2693 B7R0.2 CC(=C)OC(=O)CCl Amb24599988 [0,1,1,0,0,0|2,0,0]=4 2694 B7R0.2 CC(=N)\C=C(\O)/CO Amb25307564 [0,1,1,0,0,0|0,0,1]=3 2695 B7R0.2 CC(=O)OC(=C)CC Amb25202254 [0,1,1,0,0,0|1,0,1]=4 2696 B7R0.2 CC(=O)OC(=C)CCl Amb25378300 [0,1,1,0,0,0|1,0,1]=4 2697 B7R0.2 CC(=O)\C=C(/O)\CF Amb25134101 [0,1,1,0,0,0|1,0,1]=4 2698 B7R0.2 CC(C)=CC(O)CO Amb25144589 [0,1,1,0,0,0|0,0,2]=4 2699 B7R0.2 CC(CCl)=CC(=C)Cl Amb24481326 [0,1,1,0,0,0|2,0,0]=4 2700 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [0,1,1,0,0,0|2,0,0]=4 2701 B7R0.2 C\C(\CCl)=C/C(C)=C Amb24629131 [0,1,1,0,0,0|2,0,0]=4 2702 B7R0.2 C\C(\CO)=C/C(C)=O Amb25240045 [0,1,1,0,0,0|1,0,1]=4 2703 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [0,1,1,0,0,0|2,0,0]=4 2704 B7R0.2 C\C(\CO)=C\C(C)=O Amb24518297 [0,1,1,0,0,0|1,0,1]=4 2705 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [0,1,1,0,0,0|2,0,0]=4 2706 B7R0.2 OCC(O)C=C(Cl)Cl Amb25848600 [0,1,1,0,0,0|1,0,1]=4 2707 B7R0.3 C=C(CO)OCC#C Amb25077959 [0,1,1,0,0,0|0,0,2]=4 2708 B7R0.3 C=CCCC(=C)CO Amb25849790 [0,1,1,0,0,0|1,0,0]=3 2709 B7R0.3 C=CCCC(=O)CO Amb25763185 [0,1,1,0,0,0|0,0,2]=4 2710 B7R0.3 C=CCC[C@H](O)CO Amb25847350 [0,1,1,0,0,0|0,0,2]=4 2711 B7R0.3 C=CCOC(=C)C=O Amb18641684 [0,1,1,0,0,0|0,0,2]=4 2712 B7R0.3 C=CCOC(=O)CBr Amb24634325 [0,1,1,0,0,0|2,0,0]=4 2713 B7R0.3 C=CCOC(=O)CN Amb18641828 [0,1,1,0,0,0|2,0,0]=4 2714 B7R0.3 C=CCOC(=O)CO Amb24475151 [0,1,1,0,0,0|1,0,0]=3 2715 B7R0.3 C=CCOC(=O)NO Amb24457536 [0,1,1,0,0,0|2,0,0]=4 2716 B7R0.3 C=CC\C=C(/Cl)\CCl Amb25241974 [0,1,1,0,0,0|2,0,0]=4 2717 B7R0.3 C=CC\C=C(\Cl)/CBr Amb24588501 [0,1,1,0,0,0|2,0,0]=4 2718 B7R0.3 C=C\C=C\[C@H](O)CO Amb25337152 [0,1,1,0,0,0|0,0,1]=3 2719 B7R0.3 CC(CO)=C=CC=C Amb24733189 [0,1,1,0,0,0|1,0,0]=3 2720 B7R0.3 CC(CO)\C=C\C=O Amb24744749 [0,1,1,0,0,0|1,0,1]=4 2721 B7R0.3 CCC(=C)\C=C\C=O Amb24669094 [0,1,1,0,0,0|2,0,0]=4 2722 B7R0.3 CCC(=O)OCC=C Amb22050537 [0,1,1,0,0,0|2,0,0]=4 2723 B7R0.3 CCC(=O)\C=C/C=O Amb25770041 [0,1,1,0,0,0|1,0,1]=4 2724 B7R0.3 CCC(=O)\C=C\C=C Amb25372992 [0,1,1,0,0,0|1,0,1]=4 2725 B7R0.3 CCC(=O)\C=C\C=O Amb18641682 [0,1,1,0,0,0|1,0,1]=4 2726 B7R0.3 CCC(=S)OCC=C Amb22168285 [0,1,1,0,0,0|2,0,0]=4 2727 B7R0.3 CCC(C)=CCC=C Amb22230003 [0,1,1,0,0,0|2,0,0]=4 2728 B7R0.3 CCC(\C=C\C=O)O Amb16233610 [0,1,1,0,0,0|1,0,1]=4 2729 B7R0.3 CCOCC(=C)CO Amb25222257 [0,1,1,0,0,0|0,0,2]=4 2730 B7R0.3 CC[C@@H](O)\C=C\C=O Amb24678734 [0,1,1,0,0,0|1,0,1]=4 2731 B7R0.3 CC\C(\C)=C\CC=C Amb24694420 [0,1,1,0,0,0|2,0,0]=4 2732 B7R0.3 CC\C=C\[C@@H](O)CO Amb25721479 [0,1,1,0,0,0|0,0,2]=4 2733 B7R0.3 CC\C=C\[C@H](O)CO Amb24353158 [0,1,1,0,0,0|0,0,2]=4 2734 B7R0.3 CO\C=C\C(=C)CO Amb24504937 [0,1,1,0,0,0|1,0,1]=4 2735 B7R0.3 CO\C=C\C(=O)CO Amb25240406 [0,1,1,0,0,0|0,0,2]=4 2736 B7R0.3 C[C@@H](CO)OCC=C Amb25228448 [0,1,1,0,0,0|0,0,2]=4 2737 B7R0.3 C[C@H](CO)\C=C\C=C Amb25832753 [0,1,1,0,0,0|1,0,1]=4 2738 B7R0.3 C\C(\CCl)=C\CC=C Amb24515098 [0,1,1,0,0,0|2,0,0]=4 2739 B7R0.3 C\C(\CO)=C\CC=C Amb24363586 [0,1,1,0,0,0|1,0,0]=3 2740 B7R0.3 C\C=C\CC(=C)CO Amb25256052 [0,1,1,0,0,0|1,0,0]=3 2741 B7R0.3 OC(CO)CCC=C Amb10071251 [0,1,1,0,0,0|0,0,2]=4 2742 B7R0.3 OC(CO)\C=C\CO Amb25855770 [0,1,1,0,0,0|0,0,2]=4 2743 B7R0.3 OCC(=O)\C=C/C=O Amb18641763 [0,1,1,0,0,0|0,0,1]=3 2744 B7R0.3 OCC(=O)\C=C\C=O Amb24574003 [0,1,1,0,0,0|0,0,1]=3 2745 B7R0.3 OCC(O)C\C=C\Cl Amb25169326 [0,1,1,0,0,0|0,0,2]=4 2746 B7R0.3 OCC(O)\C=C\C=O Amb24611201 [0,1,1,0,0,0|0,0,1]=3 2747 B7R0.5 C=C(CC=C)C(O)=O Amb18641687 [0,1,1,0,0,0|1,0,1]=4 2748 B7R0.5 C=C\C=C(/Cl)\C(O)=O Amb18642910 [0,1,1,0,0,0|1,0,1]=4 2749 B7R0.5 C=C\C=C(/F)\C(O)=O Amb24402288 [0,1,1,0,0,0|1,0,1]=4 2750 B7R0.5 C=C\C=C(\N)/C(O)=O Amb25306109 [0,1,1,0,0,0|1,0,1]=4 2751 B7R0.5 CC(C(=O)OC=C)O Amb17593197 [0,1,1,0,0,0|1,0,0]=3 2752 B7R0.5 CC(Cl)C(=O)OC=C Amb25740914 [0,1,1,0,0,0|2,0,0]=4 2753 B7R0.5 CC(O)C(=C)CC=C Amb25135005 [0,1,1,0,0,0|1,0,0]=3 2754 B7R0.5 CC(O)C(O)CC=C Amb24734248 [0,1,1,0,0,0|0,0,2]=4 2755 B7R0.5 CC(O)\C(\Br)=C\C=C Amb24674850 [0,1,1,0,0,0|1,0,0]=3 2756 B7R0.5 CCOC(=C)C(C)O Amb25716098 [0,1,1,0,0,0|0,0,2]=4 2757 B7R0.5 C[C@@H](O)C(O)CC=C Amb25344994 [0,1,1,0,0,0|0,0,2]=4 2758 B7R0.5 C[C@@H](O)[C@@H](O)C=C=C Amb24457432 [0,1,1,0,0,0|0,0,2]=4 2759 B7R0.5 C[C@@H](O)[C@H](O)CC=C Amb25106054 [0,1,1,0,0,0|0,0,2]=4 2760 B7R0.5 C[C@@H](O)[C@H](O)\C=C\C Amb25083940 [0,1,1,0,0,0|0,0,2]=4 2761 B7R0.5 C[C@H](N)C(=O)OC=C Amb24404926 [0,1,1,0,0,0|2,0,0]=4 2762 B7R0.5 C[C@H](O)C(=O)CC=C Amb24676785 [0,1,1,0,0,0|0,0,2]=4 2763 B7R0.5 C[C@H](O)[C@@H](O)C=C=C Amb25722136 [0,1,1,0,0,0|0,0,2]=4 2764 B7R0.5 C\C(=C/C=C)\C(O)=O Amb25258956 [0,1,1,0,0,0|1,0,1]=4 2765 B7R0.5 C\C=C/C(=O)C(C)O Amb24481478 [0,1,1,0,0,0|0,0,2]=4 2766 B7R0.5 C\C=C\C(=O)C(C)O Amb24644349 [0,1,1,0,0,0|0,0,2]=4 2767 B7R0.5 C\C=C\C(=O)[C@H](C)O Amb25241352 [0,1,1,0,0,0|0,0,2]=4 2768 B7R0.5 OC(=O)C(O)=CC=O Amb25339531 [0,1,1,0,0,0|1,0,1]=4 2769 B7R0.5 OC(=O)\C(\O)=C\C=O Amb25082413 [0,1,1,0,0,0|1,0,1]=4 2770 B7R0.7 C=CCC(=O)CCO Amb25052792 [0,1,1,0,0,0|0,0,2]=4 2771 B7R0.7 C=CCC(O)CCO Amb24379908 [0,1,1,0,0,0|0,0,2]=4 2772 B7R0.7 C=CC[C@@H](O)CCO Amb25762096 [0,1,1,0,0,0|0,0,2]=4 2773 B7R0.7 C=CC[C@H](O)CCO Amb25219225 [0,1,1,0,0,0|0,0,2]=4 2774 B7R0.7 C=COC(=O)CCI Amb17934195 [0,1,1,0,0,0|2,0,0]=4 2775 B7R0.7 C=COC(=O)CCO Amb24591909 [0,1,1,0,0,0|1,0,0]=3 2776 B7R0.7 CCCC(O)=CC=O Amb25745986 [0,1,1,0,0,0|2,0,0]=4 2777 B7R0.7 CCC\C(\C)=C\C=C Amb24577361 [0,1,1,0,0,0|2,0,0]=4 2778 B7R0.7 CCC\C(\O)=C\C=O Amb24481551 [0,1,1,0,0,0|2,0,0]=4 2779 B7R0.7 CCOC(=O)OC=C Amb25746316 [0,1,1,0,0,0|2,0,0]=4 2780 B7R0.7 CNC\C(\C)=C\C=C Amb24621842 [0,1,1,0,0,0|2,0,0]=4 2781 B7R0.7 COCC(=O)NC=C Amb25026167 [0,1,1,0,0,0|1,0,1]=4 2782 B7R0.7 COCC(C)OC=C Amb24556890 [0,1,1,0,0,0|0,0,2]=4 2783 B7R0.7 COCC(O)CC=C Amb25222392 [0,1,1,0,0,0|0,0,2]=4 2784 B7R0.7 C\C(=C\CO)\C=C=C Amb25129770 [0,1,1,0,0,0|1,0,1]=4 2785 B7R0.7 C\C(\CC=C)=C\CO Amb24363583 [0,1,1,0,0,0|1,0,1]=4 2786 B7R0.7 C\C(\CCO)=C\C=C Amb25135010 [0,1,1,0,0,0|1,0,0]=3 2787 B7R0.7 C\C=C\C(=O)CCO Amb25373363 [0,1,1,0,0,0|0,0,2]=4 2788 B7R0.7 C\C=C\C(C)=CCO Amb24581728 [0,1,1,0,0,0|1,0,1]=4 2789 B7R0.10 C=CC(Cl)C(O)CO Amb24443794 [0,1,1,0,0,0|0,0,2]=4 2790 B7R0.10 C=CC(N)C(O)CO Amb18641922 [0,1,1,0,0,0|0,0,2]=4 2791 B7R0.10 C=CC(O)C(O)CO Amb25082759 [0,1,1,0,0,0|0,0,2]=4 2792 B7R0.10 C=CC(O)[C@H](O)CO Amb25716025 [0,1,1,0,0,0|0,0,2]=4 2793 B7R0.10 C=C[C@@H](N)[C@@H](O)CO Amb24655125 [0,1,1,0,0,0|0,0,2]=4 2794 B7R0.10 C=C[C@H](F)[C@@H](O)CO Amb25317504 [0,1,1,0,0,0|0,0,2]=4 2795 B7R0.10 C=C[C@H](N)[C@@H](O)CO Amb25727169 [0,1,1,0,0,0|0,0,2]=4 2796 B7R0.10 C=C[C@H](O)[C@@H](O)CO Amb25280157 [0,1,1,0,0,0|0,0,2]=4 2797 B7R0.10 CC(=C=C)C(O)CO Amb25144082 [0,1,1,0,0,0|0,0,2]=4 2798 B7R0.10 CC(C=C)C(O)CO Amb24749640 [0,1,1,0,0,0|0,0,2]=4 2799 B7R0.10 CC(CO)C(=O)C=C Amb25370664 [0,1,1,0,0,0|1,0,1]=4 2800 B7R0.10 CC[C@@H](O)C(=C)C=C Amb25763977 [0,1,1,0,0,0|1,0,1]=4 2801 B7R0.10 CC[C@H](O)C(=C)C=C Amb25239977 [0,1,1,0,0,0|1,0,1]=4 2802 B7R0.10 CN(CO)C(=O)C=C Amb25284221 [0,1,1,0,0,0|2,0,0]=4 2803 B7R0.10 C[C@@H](C=C)[C@H](O)CO Amb25045441 [0,1,1,0,0,0|0,0,2]=4 2804 B7R0.10 C[C@H](C=C)[C@H](O)CO Amb25802112 [0,1,1,0,0,0|0,0,2]=4 2805 B7R0.10 C\C(\C=C)=C(/F)\CCl Amb24481327 [0,1,1,0,0,0|2,0,0]=4 2806 B7R0.10 C\C(\C=C)=C(\C)/CO Amb24474539 [0,1,1,0,0,0|1,0,0]=3 2807 B7R0.10 C\C(\CCl)=C(\Cl)/C=C Amb25844326 [0,1,1,0,0,0|2,0,0]=4 2808 B7R0.10 C\C=C(\C)/C(O)CO Amb25284457 [0,1,1,0,0,0|0,0,2]=4 2809 B7R0.10 C\C=C(\C)/[C@@H](O)CO Amb25769225 [0,1,1,0,0,0|0,0,2]=4 2810 B7R0.10 C\C=C(\C)/[C@H](O)CO Amb24472342 [0,1,1,0,0,0|0,0,2]=4 2811 B7R0.11 CC(O)(CC=C)CO Amb24332903 [0,1,1,0,0,0|0,0,2]=4 2812 B7R0.11 C[C@](O)(CC=C)CO Amb25346292 [0,1,1,0,0,0|0,0,2]=4 2813 B7R0.12 C=CC(CO)CC=C Amb25832441 [0,1,1,0,0,0|1,0,1]=4 2814 B7R0.12 C=CCC(CO)C=O Amb18641802 [0,1,1,0,0,0|1,0,1]=4 2815 B7R0.12 C=CCC(CO)CO Amb24450577 [0,1,1,0,0,0|0,0,2]=4 2816 B7R0.12 C=CC\C(\CO)=C/Cl Amb25074610 [0,1,1,0,0,0|1,0,0]=3 2817 B7R0.12 C=CC\C(\CO)=C/F Amb25142858 [0,1,1,0,0,0|1,0,0]=3 2818 B7R0.12 COC(CO)\C=C/Cl Amb25286355 [0,1,1,0,0,0|1,0,1]=4 2819 B7R0.1 C#CC=C\C=C\CCl Amb25025748 [0,1,1,0,0,0|2,0,0]=4 2820 B7R0.1 C#C\C=C\C=C\CBr Amb25227459 [0,1,1,0,0,0|2,0,0]=4 2821 B7R0.1 C#C\C=C\C=C\CCl Amb25747011 [0,1,1,0,0,0|2,0,0]=4 2822 B7R0.1 C=CC#C\C=C\CO Amb25145330 [0,1,1,0,0,0|1,0,1]=4 2823 B7R0.1 C=CC=C\C=C\CBr Amb24627093 [0,1,1,0,0,0|2,0,0]=4 2824 B7R0.1 C=CC=C\C=C\CO Amb25136336 [0,1,1,0,0,0|1,0,0]=3 2825 B7R0.1 C=CCC=C=CCBr Amb24332787 [0,1,1,0,0,0|2,0,0]=4 2826 B7R0.1 C=CCC=C\C=C\Cl Amb24549928 [0,1,1,0,0,0|2,0,0]=4 2827 B7R0.1 C=CCOCCCO Amb25097051 [0,1,1,0,0,0|0,0,2]=4 2828 B7R0.1 C=CCOCCON Amb25200990 [0,1,1,0,0,0|0,0,2]=4 2829 B7R0.1 C=CC\C=C/C=C/Cl Amb25778307 [0,1,1,0,0,0|2,0,0]=4 2830 B7R0.1 CCCO\C=C\C=O Amb25300597 [0,1,1,0,0,0|1,0,1]=4 2831 B7R0.1 CCC\C=C\C=CBr Amb24615080 [0,1,1,0,0,0|2,0,0]=4 2832 B7R0.1 CCC\C=C\C=C\Br Amb25701400 [0,1,1,0,0,0|2,0,0]=4 2833 B7R0.1 CCC\C=C\C=C\Cl Amb25765579 [0,1,1,0,0,0|2,0,0]=4 2834 B7R0.1 CC\C=C/C=C/C=O Amb25040049 [0,1,1,0,0,0|1,0,1]=4 2835 B7R0.1 CC\C=C/C=C\C=O Amb24666726 [0,1,1,0,0,0|1,0,1]=4 2836 B7R0.1 CC\C=C\C=C\CO Amb17614885 [0,1,1,0,0,0|1,0,0]=3 2837 B7R0.1 COCCOCC=C Amb21858464 [0,1,1,0,0,0|0,0,2]=4 2838 B7R0.1 COCC\C=C\CO Amb25084911 [0,1,1,0,0,0|0,0,2]=4 2839 B7R0.1 CO\C=C\C=CCO Amb25024935 [0,1,1,0,0,0|0,0,0]=2 2840 B7R0.1 C\C=C\C=CCC#N Amb25327731 [0,1,1,0,0,0|2,0,0]=4 2841 B7R0.1 C\C=C\C=C\C=N\O Amb24710705 [0,1,1,0,0,0|1,0,1]=4 2842 B7R0.1 C\C=C\C=C\CC#N Amb24758314 [0,1,1,0,0,0|2,0,0]=4 2843 B7R0.1 C\C=C\C=C\CNC Amb24613976 [0,1,1,0,0,0|2,0,0]=4 2844 B7R0.1 C\C=C\COCCO Amb24593801 [0,1,1,0,0,0|0,0,2]=4 2845 B7R0.1 C\C=C\C\C=C\CBr Amb24533552 [0,1,1,0,0,0|2,0,0]=4 2846 B7R0.1 ClC\C=C\C=C\CCl Amb25858355 [0,1,1,0,0,0|2,0,0]=4 2847 B7R0.1 NC\C=C\C=C\CN Amb25061151 [0,1,1,0,0,0|2,0,0]=4 2848 B7R0.1 O=CC=C\C=C\CBr Amb24614651 [0,1,1,0,0,0|1,0,1]=4 2849 B7R0.1 O=CC=C\C=C\CCl Amb25810586 [0,1,1,0,0,0|1,0,1]=4 2850 B7R0.1 O=CCC=C\C=C\Br Amb24691351 [0,1,1,0,0,0|1,0,1]=4 2851 B7R0.1 O=CC\C=C\C=CBr Amb24533959 [0,1,1,0,0,0|1,0,1]=4 2852 B7R0.1 O=C\C=C\C=C\CBr Amb25241523 [0,1,1,0,0,0|1,0,1]=4 2853 B7R0.1 OCCC\C=C\C=C Amb10605295 [0,1,1,0,0,0|1,0,1]=4 2854 B7R0.1 OCCC\C=C\C=O Amb25734444 [0,1,1,0,0,0|0,0,2]=4 2855 B7R0.1 OCC\C=C\C=CCl Amb24512121 [0,1,1,0,0,0|1,0,0]=3 2856 B7R0.1 OCC\C=C\CCO Amb17614949 [0,1,1,0,0,0|0,0,2]=4 2857 B7R0.1 OC\C=C/CCC=O Amb25827491 [0,1,1,0,0,0|0,0,2]=4 2858 B7R0.1 OC\C=C\C#CC=O Amb25746037 [0,1,1,0,0,0|0,0,2]=4 2859 B7R0.1 OC\C=C\C#CCO Amb24675318 [0,1,1,0,0,0|0,0,2]=4 2860 B7R0.1 OC\C=C\C=CCO Amb25278646 [0,1,1,0,0,0|0,0,0]=2 2861 B7R0.4 CC(=C)C=C=CCCl Amb24746804 [0,1,1,0,0,0|2,0,0]=4 2862 B7R0.4 CC(=C)\C=C\CCO Amb24474428 [0,1,1,0,0,0|1,0,1]=4 2863 B7R0.4 CC(=O)C\C=C\CO Amb24583096 [0,1,1,0,0,0|0,0,2]=4 2864 B7R0.4 CC(=O)S\C=C\CO Amb25098660 [0,1,1,0,0,0|1,0,1]=4 2865 B7R0.4 CC(O)COCC=C Amb22733640 [0,1,1,0,0,0|0,0,2]=4 2866 B7R0.4 CC(O)C\C=C\C=O Amb18641799 [0,1,1,0,0,0|0,0,2]=4 2867 B7R0.4 CC(O)\C=C\C=C\Cl Amb25359620 [0,1,1,0,0,0|1,0,0]=3 2868 B7R0.4 CCC\C=C\C(=C)O Amb24332587 [0,1,1,0,0,0|1,0,1]=4 2869 B7R0.4 CCS\C=C/C(O)=O Amb25200140 [0,1,1,0,0,0|2,0,0]=4 2870 B7R0.4 CCS\C=C\C(O)=O Amb18642902 [0,1,1,0,0,0|2,0,0]=4 2871 B7R0.4 C[C@@H](O)C\C=C\C=O Amb25310809 [0,1,1,0,0,0|0,0,2]=4 2872 B7R0.4 C[C@@H](O)C\C=C\CO Amb25852295 [0,1,1,0,0,0|0,0,2]=4 2873 B7R0.4 C[C@@H](O)\C=C\CC=C Amb25271299 [0,1,1,0,0,0|1,0,1]=4 2874 B7R0.4 C[C@H](O)\C=C\CC=C Amb24733217 [0,1,1,0,0,0|1,0,1]=4 2875 B7R0.4 C\C(\Br)=C\C=CCO Amb24334089 [0,1,1,0,0,0|1,0,0]=3 2876 B7R0.4 C\C(\O)=C\C=C/C=O Amb25096071 [0,1,1,0,0,0|0,0,2]=4 2877 B7R0.4 C\C(\O)=C\C=CC=O Amb24741180 [0,1,1,0,0,0|0,0,2]=4 2878 B7R0.4 C\C=C\C=C/C(C)O Amb22342426 [0,1,1,0,0,0|1,0,0]=3 2879 B7R0.4 C\C=C\C=CB(O)O Amb25316384 [0,1,1,0,0,0|2,0,0]=4 2880 B7R0.4 C\C=C\C=CC(C)N Amb24332073 [0,1,1,0,0,0|2,0,0]=4 2881 B7R0.4 C\C=C\C=C[C@H](C)O Amb24475166 [0,1,1,0,0,0|1,0,0]=3 2882 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [0,1,1,0,0,0|1,0,1]=4 2883 B7R0.4 C\C=C\C=C\C(C)Cl Amb24739688 [0,1,1,0,0,0|2,0,0]=4 2884 B7R0.4 C\C=C\OCC(C)O Amb24475190 [0,1,1,0,0,0|0,0,2]=4 2885 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [0,1,1,0,0,0|1,0,1]=4 2886 B7R0.4 NC\C=C\CC(O)=O Amb18641825 [0,1,1,0,0,0|1,0,1]=4 2887 B7R0.4 OC(=O)C\C=C/CS Amb18124361 [0,1,1,0,0,0|0,1,1]=4 2888 B7R0.4 OC(=O)C\C=C\CBr Amb18125611 [0,1,1,0,0,0|1,0,1]=4 2889 B7R0.4 OC(=O)C\C=C\CCl Amb18124409 [0,1,1,0,0,0|1,0,1]=4 2890 B7R0.4 OC(=O)C\C=C\CS Amb24693621 [0,1,1,0,0,0|0,1,1]=4 2891 B7R0.4 OC(=O)\C=C\C=CCl Amb24562254 [0,1,1,0,0,0|1,0,1]=4 2892 B7R0.4 OC(=O)\C=C\CCBr Amb25702661 [0,1,1,0,0,0|1,0,1]=4 2893 B7R0.4 OCCOC=C(Cl)Cl Amb24429408 [0,1,1,0,0,0|1,0,1]=4 2894 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [0,1,1,0,0,0|0,0,1]=3 2895 B7R0.4 OC\C=C\C=C(Cl)Cl Amb24706187 [0,1,1,0,0,0|1,0,0]=3 2896 B7R0.15 CC(=C)C(CO)C=C Amb24334037 [0,1,1,0,0,0|1,0,1]=4 2897 B7R0.15 CC(O)C(C=C)OC Amb25287051 [0,1,1,0,0,0|0,0,2]=4 2898 B7R0.15 COC(=C=C)C(O)C Amb17593188 [0,1,1,0,0,0|0,0,2]=4 2899 B7R0.15 COC(CO)C(=C)Cl Amb25080420 [0,1,1,0,0,0|0,0,2]=4 2900 B7R0.15 C[C@@H](O)[C@@H](C=C)OC Amb24363678 [0,1,1,0,0,0|0,0,2]=4 2901 B7R0.15 C[C@@H](O)[C@H](C=C)OC Amb24412954 [0,1,1,0,0,0|0,0,2]=4 2902 B7R0.18 CO[C@@](C)(CO)C=C Amb25306453 [0,1,1,0,0,0|0,0,2]=4 2903 B7R0.18 CO[C@](C)(CO)C=C Amb24733199 [0,1,1,0,0,0|0,0,2]=4 2904 B7R1.2 BrC1=CC(=O)OC1 Amb10067500 [1,1,0,0,0,0|0,0,2]=4 2905 B7R1.2 Brc1[n]c(Br)co1 Amb25836715 [1,1,0,0,0,0|2,0,0]=4 2906 B7R1.2 Brc1c[nH]c(Br)c1 Amb24514321 [1,1,0,0,0,0|2,0,0]=4 2907 B7R1.2 Brc1c[nH]c(n1)C Amb2455703 [1,1,0,0,0,0|2,0,0]=4 2908 B7R1.2 Brc1cc(I)[s]c1 Amb24320667 [1,1,0,0,0,0|1,1,0]=4 2909 B7R1.2 Brc1ccc(Br)[se]1 Amb24323652 [1,1,0,0,0,0|1,1,0]=4 2910 B7R1.2 Brc1ccc(Br)o1 Amb19651339 [1,1,0,0,0,0|1,0,0]=3 2911 B7R1.2 Brc1ccc(I)o1 Amb24632285 [1,1,0,0,0,0|1,0,0]=3 2912 B7R1.2 Brc1ccc(o1)[2H] Amb10597228 [1,1,0,0,0,0|1,0,0]=3 2913 B7R1.2 Brc1ccc(s1)Br Amb2447247 [1,1,0,0,0,0|1,1,0]=4 2914 B7R1.2 Brc1ccc(s1)[2H] Amb10597227 [1,1,0,0,0,0|1,1,0]=4 2915 B7R1.2 Brc1cnc(s1)C Amb10599426 [1,1,0,0,0,0|1,1,0]=4 2916 B7R1.2 Brc1coc(Br)c1 Amb20241410 [1,1,0,0,0,0|1,0,0]=3 2917 B7R1.2 Brc1csc(c1)Cl Amb10602627 [1,1,0,0,0,0|1,1,0]=4 2918 B7R1.2 Brc1csc(n1)C Amb2447041 [1,1,0,0,0,0|1,1,0]=4 2919 B7R1.2 Brc1csc(n1)O Amb10599938 [1,1,0,0,0,0|1,1,0]=4 2920 B7R1.2 Brc1noc(c1)C Amb10603673 [1,1,0,0,0,0|1,0,0]=3 2921 B7R1.2 Brc1noc(n1)C Amb15701413 [1,1,0,0,0,0|2,0,0]=4 2922 B7R1.2 C=C1C=CC(=O)O1 Amb22001002 [1,1,0,0,0,0|0,0,1]=3 2923 B7R1.2 C=C1CC(=O)C=C1 Amb24553656 [1,1,0,0,0,0|1,0,1]=4 2924 B7R1.2 CC1=CC(=N)NN1 Amb19866695 [1,1,0,0,0,0|2,0,0]=4 2925 B7R1.2 CC1=CC(=N)NO1 Amb22330538 [1,1,0,0,0,0|1,0,0]=3 2926 B7R1.2 CC1=CC(=O)C=C1 Amb24364191 [1,1,0,0,0,0|1,0,0]=3 2927 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [1,1,0,0,0,0|0,0,1]=3 2928 B7R1.2 CC1=CC(=O)N=N1 Amb20621717 [1,1,0,0,0,0|2,0,0]=4 2929 B7R1.2 CC1=CC(=O)NN1 Amb19770794 [1,1,0,0,0,0|2,0,0]=4 2930 B7R1.2 CC1=CC(=O)NO1 Amb19338707 [1,1,0,0,0,0|1,0,0]=3 2931 B7R1.2 CC1=CC(=S)CO1 Amb25026404 [1,1,0,0,0,0|0,0,1]=3 2932 B7R1.2 CC1=CCC(=O)N1 Amb24119179 [1,1,0,0,0,0|1,0,1]=4 2933 B7R1.2 CC1=CNC(=O)N1 Amb20667076 [1,1,0,0,0,0|2,0,0]=4 2934 B7R1.2 CC1=CNC(=O)O1 Amb22298623 [1,1,0,0,0,0|1,0,0]=3 2935 B7R1.2 CC1=COC(=N)N1 Amb20637145 [1,1,0,0,0,0|2,0,0]=4 2936 B7R1.2 CC1=COC(=O)O1 Amb24693155 [1,1,0,0,0,0|1,0,0]=3 2937 B7R1.2 CC1=CSC(=N)N1 Amb22166852 [1,1,0,0,0,0|2,0,0]=4 2938 B7R1.2 CC1=CSC(=O)N1 Amb19372452 [1,1,0,0,0,0|2,0,0]=4 2939 B7R1.2 CC1=CSC(=S)N1 Amb22732376 [1,1,0,0,0,0|2,0,0]=4 2940 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [1,1,0,0,0,0|2,0,0]=4 2941 B7R1.2 CC1=NNC(=S)O1 Amb19200119 [1,1,0,0,0,0|2,0,0]=4 2942 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [1,1,0,0,0,0|2,0,0]=4 2943 B7R1.2 CC1C=CC(=O)N1 Amb25248060 [1,1,0,0,0,0|1,0,1]=4 2944 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [1,1,0,0,0,0|0,0,1]=3 2945 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [1,1,0,0,0,0|0,1,1]=4 2946 B7R1.2 CC=1C=NC(=O)N1 Amb24754157 [1,1,0,0,0,0|2,0,0]=4 2947 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [1,1,0,0,0,0|1,0,1]=4 2948 B7R1.2 CC=1CNC(=O)C1 Amb24479892 [1,1,0,0,0,0|2,0,0]=4 2949 B7R1.2 CC=1COC(=O)C1 Amb22002703 [1,1,0,0,0,0|0,0,2]=4 2950 B7R1.2 CN1C=CC(=O)N1 Amb22233839 [1,1,0,0,0,0|2,0,0]=4 2951 B7R1.2 C[C@@H]1C=CC(=O)O1 Amb25114434 [1,1,0,0,0,0|0,0,1]=3 2952 B7R1.2 C[C@H]1C=CC(=O)O1 Amb13887292 [1,1,0,0,0,0|0,0,1]=3 2953 B7R1.2 C[n+]1cc(O)o[n]1 Amb22734265 [1,1,0,0,0,0|2,0,0]=4 2954 B7R1.2 C[n]1cc(Br)cc1 Amb18243475 [1,1,0,0,0,0|2,0,0]=4 2955 B7R1.2 C[n]1cc(Cl)cc1 Amb24478562 [1,1,0,0,0,0|2,0,0]=4 2956 B7R1.2 C[n]1cc(F)c[n]1 Amb23402169 [1,1,0,0,0,0|2,0,0]=4 2957 B7R1.2 C[n]1cc(I)cc1 Amb25324042 [1,1,0,0,0,0|2,0,0]=4 2958 B7R1.2 C[n]1cc(N)cc1 Amb18559366 [1,1,0,0,0,0|2,0,0]=4 2959 B7R1.2 C[n]1cc(N)cc1 Amb22498085 [1,1,0,0,0,0|2,0,0]=4 2960 B7R1.2 C[n]1cc(O)c[n]1 Amb21922897 [1,1,0,0,0,0|2,0,0]=4 2961 B7R1.2 C[n]1cc(O)c[n]1 Amb22736097 [1,1,0,0,0,0|2,0,0]=4 2962 B7R1.2 C[n]1ccc(F)[n]1 Amb23513617 [1,1,0,0,0,0|2,0,0]=4 2963 B7R1.2 C[n]1ccc(I)[n]1 Amb22492031 [1,1,0,0,0,0|2,0,0]=4 2964 B7R1.2 C[n]1ccc(O)[n]1 Amb22388466 [1,1,0,0,0,0|2,0,0]=4 2965 B7R1.2 C[n]1ccc(S)[n]1 Amb25169408 [1,1,0,0,0,0|2,0,0]=4 2966 B7R1.2 Cc1[nH]c(N)c[n]1 Amb18673420 [1,1,0,0,0,0|2,0,0]=4 2967 B7R1.2 Cc1[nH]c(N)c[n]1 Amb23401008 [1,1,0,0,0,0|2,0,0]=4 2968 B7R1.2 Cc1[nH]cc(Cl)[n]1 Amb22490506 [1,1,0,0,0,0|2,0,0]=4 2969 B7R1.2 Cc1[nH]cc(F)[n]1 Amb20671263 [1,1,0,0,0,0|2,0,0]=4 2970 B7R1.2 Cc1[nH]cc(O)[n]1 Amb25141134 [1,1,0,0,0,0|2,0,0]=4 2971 B7R1.2 Cc1[nH]nc(c1)C Amb1019544 [1,1,0,0,0,0|2,0,0]=4 2972 B7R1.2 Cc1[n][n]c(Cl)o1 Amb18062393 [1,1,0,0,0,0|2,0,0]=4 2973 B7R1.2 Cc1[n][n]c(I)o1 Amb25197940 [1,1,0,0,0,0|2,0,0]=4 2974 B7R1.2 Cc1[n]c(Br)co1 Amb25727162 [1,1,0,0,0,0|1,0,0]=3 2975 B7R1.2 Cc1[n]c(Cl)[n]o1 Amb19516836 [1,1,0,0,0,0|2,0,0]=4 2976 B7R1.2 Cc1[n]c(I)[n]o1 Amb25367958 [1,1,0,0,0,0|2,0,0]=4 2977 B7R1.2 Cc1[n]c(I)c[s]1 Amb22753883 [1,1,0,0,0,0|1,1,0]=4 2978 B7R1.2 Cc1[n]c(N)c[s]1 Amb22899571 [1,1,0,0,0,0|1,1,0]=4 2979 B7R1.2 Cc1[n]c(N)co1 Amb22011557 [1,1,0,0,0,0|1,0,0]=3 2980 B7R1.2 Cc1[n]c(N)co1 Amb22899203 [1,1,0,0,0,0|1,0,0]=3 2981 B7R1.2 Cc1[n]c(O)o[n]1 Amb19373400 [1,1,0,0,0,0|2,0,0]=4 2982 B7R1.2 Cc1[n]cc(C)o1 Amb23399817 [1,1,0,0,0,0|1,0,0]=3 2983 B7R1.2 Cc1[n]cc(I)[s]1 Amb24698969 [1,1,0,0,0,0|1,1,0]=4 2984 B7R1.2 Cc1[n]cc(N)o1 Amb18061806 [1,1,0,0,0,0|1,0,0]=3 2985 B7R1.2 Cc1[n]oc(C)[n]1 Amb24423387 [1,1,0,0,0,0|2,0,0]=4 2986 B7R1.2 Cc1c[n+]([O-])c[s]1 Amb24548052 [1,1,0,0,0,0|1,1,0]=4 2987 B7R1.2 Cc1c[nH]c(F)[n]1 Amb25077169 [1,1,0,0,0,0|2,0,0]=4 2988 B7R1.2 Cc1c[nH]c(I)[n]1 Amb22002277 [1,1,0,0,0,0|2,0,0]=4 2989 B7R1.2 Cc1c[nH]c(n1)Br Amb10069024 [1,1,0,0,0,0|2,0,0]=4 2990 B7R1.2 Cc1c[nH]c(n1)N Amb17108811 [1,1,0,0,0,0|2,0,0]=4 2991 B7R1.2 Cc1c[n](C)c[n]1 Amb20240808 [1,1,0,0,0,0|2,0,0]=4 2992 B7R1.2 Cc1c[n](C)cc1 Amb24333650 [1,1,0,0,0,0|2,0,0]=4 2993 B7R1.2 Cc1c[n](N)c[n]1 Amb24579054 [1,1,0,0,0,0|2,0,0]=4 2994 B7R1.2 Cc1c[n]c(Br)[s]1 Amb22388517 [1,1,0,0,0,0|1,1,0]=4 2995 B7R1.2 Cc1c[n]c(Br)o1 Amb24113164 [1,1,0,0,0,0|1,0,0]=3 2996 B7R1.2 Cc1c[n]c(Cl)o1 Amb19516434 [1,1,0,0,0,0|1,0,0]=3 2997 B7R1.2 Cc1c[n]c(Cl)o1 Amb24117495 [1,1,0,0,0,0|1,0,0]=3 2998 B7R1.2 Cc1c[n]c(F)[s]1 Amb23452578 [1,1,0,0,0,0|1,1,0]=4 2999 B7R1.2 Cc1c[n]c(I)[s]1 Amb25075187 [1,1,0,0,0,0|1,1,0]=4 3000 B7R1.2 Cc1c[n]c(N)[nH]1 Amb22001596 [1,1,0,0,0,0|2,0,0]=4 3001 B7R1.2 Cc1c[n]c(N)[nH]1 Amb22002611 [1,1,0,0,0,0|2,0,0]=4 3002 B7R1.2 Cc1c[n]c(N)[s]1 Amb24052810 [1,1,0,0,0,0|1,1,0]=4 3003 B7R1.2 Cc1c[n]c(N)o1 Amb18277977 [1,1,0,0,0,0|1,0,0]=3 3004 B7R1.2 Cc1c[s][n+](C)c1 Amb22450124 [1,1,0,0,0,0|1,1,0]=4 3005 B7R1.2 Cc1c[s]c(F)[n]1 Amb23452579 [1,1,0,0,0,0|2,0,0]=4 3006 B7R1.2 Cc1c[s]c(I)[n]1 Amb19335804 [1,1,0,0,0,0|2,0,0]=4 3007 B7R1.2 Cc1c[s]c(N)c1 Amb22498092 [1,1,0,0,0,0|1,1,0]=4 3008 B7R1.2 Cc1cc(Br)[n][nH]1 Amb19957973 [1,1,0,0,0,0|2,0,0]=4 3009 B7R1.2 Cc1cc(Br)[n][s]1 Amb25847114 [1,1,0,0,0,0|1,1,0]=4 3010 B7R1.2 Cc1cc(Br)[s][n]1 Amb18824941 [1,1,0,0,0,0|2,0,0]=4 3011 B7R1.2 Cc1cc(Br)c[nH]1 Amb18199424 [1,1,0,0,0,0|1,0,0]=3 3012 B7R1.2 Cc1cc(Br)co1 Amb18828030 [1,1,0,0,0,0|0,0,0]=2 3013 B7R1.2 Cc1cc(Br)o[n]1 Amb18190948 [1,1,0,0,0,0|2,0,0]=4 3014 B7R1.2 Cc1cc(C)on1 Amb17685548 [1,1,0,0,0,0|1,0,0]=3 3015 B7R1.2 Cc1cc(Cl)[n]o1 Amb24524072 [1,1,0,0,0,0|1,0,0]=3 3016 B7R1.2 Cc1cc(Cl)[s][n]1 Amb22755952 [1,1,0,0,0,0|2,0,0]=4 3017 B7R1.2 Cc1cc(Cl)co1 Amb25180623 [1,1,0,0,0,0|0,0,0]=2 3018 B7R1.2 Cc1cc(F)[s]c1 Amb25054484 [1,1,0,0,0,0|1,1,0]=4 3019 B7R1.2 Cc1cc(I)[n][nH]1 Amb21857564 [1,1,0,0,0,0|2,0,0]=4 3020 B7R1.2 Cc1cc(I)[s][n]1 Amb21927967 [1,1,0,0,0,0|2,0,0]=4 3021 B7R1.2 Cc1cc(I)[s]c1 Amb22496053 [1,1,0,0,0,0|1,1,0]=4 3022 B7R1.2 Cc1cc(I)o[n]1 Amb22754616 [1,1,0,0,0,0|2,0,0]=4 3023 B7R1.2 Cc1cc(N)[nH]c1 Amb18203096 [1,1,0,0,0,0|2,0,0]=4 3024 B7R1.2 Cc1cc(N)[n][s]1 Amb24480706 [1,1,0,0,0,0|1,1,0]=4 3025 B7R1.2 Cc1cc(N)[s]c1 Amb19958131 [1,1,0,0,0,0|1,1,0]=4 3026 B7R1.2 Cc1cc(N)c[nH]1 Amb18199372 [1,1,0,0,0,0|1,0,0]=3 3027 B7R1.2 Cc1cc(N)c[s]1 Amb18833057 [1,1,0,0,0,0|0,1,0]=3 3028 B7R1.2 Cc1cc(N)c[s]1 Amb22276155 [1,1,0,0,0,0|0,1,0]=3 3029 B7R1.2 Cc1cc(O)[s][n]1 Amb25132333 [1,1,0,0,0,0|1,1,0]=4 3030 B7R1.2 Cc1cc(O)[s]c1 Amb20617904 [1,1,0,0,0,0|0,1,0]=3 3031 B7R1.2 Cc1cc(O)c[s]1 Amb24523671 [1,1,0,0,0,0|0,1,0]=3 3032 B7R1.2 Cc1cc(O)co1 Amb24708163 [1,1,0,0,0,0|0,0,0]=2 3033 B7R1.2 Cc1cc(O)o[n]1 Amb22337742 [1,1,0,0,0,0|1,0,0]=3 3034 B7R1.2 Cc1cc(S)[nH][n]1 Amb20413330 [1,1,0,0,0,0|2,0,0]=4 3035 B7R1.2 Cc1cc([O-])o[n]1 Amb22264776 [1,1,0,0,0,0|1,0,1]=4 3036 B7R1.2 Cc1cc[n](N)[n]1 Amb25294398 [1,1,0,0,0,0|2,0,0]=4 3037 B7R1.2 Cc1ccc(Br)[nH]1 Amb18199425 [1,1,0,0,0,0|1,0,0]=3 3038 B7R1.2 Cc1ccc(Cl)o1 Amb25242029 [1,1,0,0,0,0|0,0,0]=2 3039 B7R1.2 Cc1ccc(F)[s]1 Amb24479469 [1,1,0,0,0,0|0,1,0]=3 3040 B7R1.2 Cc1ccc(I)o1 Amb25723970 [1,1,0,0,0,0|0,0,0]=2 3041 B7R1.2 Cc1ccc(N)[nH]1 Amb24122413 [1,1,0,0,0,0|1,0,0]=3 3042 B7R1.2 Cc1ccc(N)[s]1 Amb19890911 [1,1,0,0,0,0|0,1,0]=3 3043 B7R1.2 Cc1ccc(N)[s]1 Amb22498572 [1,1,0,0,0,0|0,1,0]=3 3044 B7R1.2 Cc1ccc(S)[s]1 Amb20623930 [1,1,0,0,0,0|0,1,0]=3 3045 B7R1.2 Cc1ccc([SiH3])[s]1 Amb24569460 [1,1,0,0,0,0|0,1,0]=3 3046 B7R1.2 Cc1ccc(o1)Br Amb10600628 [1,1,0,0,0,0|0,0,0]=2 3047 B7R1.2 Cc1ccc(o1)C Amb2447078 [1,1,0,0,0,0|0,0,0]=2 3048 B7R1.2 Cc1ccc(o1)N Amb10600629 [1,1,0,0,0,0|0,0,0]=2 3049 B7R1.2 Cc1ccc(s1)C Amb2447067 [1,1,0,0,0,0|0,1,0]=3 3050 B7R1.2 Cc1ccc(s1)Cl Amb16230980 [1,1,0,0,0,0|0,1,0]=3 3051 B7R1.2 Cc1ccc(s1)O Amb17593190 [1,1,0,0,0,0|0,1,0]=3 3052 B7R1.2 Cc1ccn(n1)C Amb1102391 [1,1,0,0,0,0|2,0,0]=4 3053 B7R1.2 Cc1cnc(s1)Br Amb10602022 [1,1,0,0,0,0|1,1,0]=4 3054 B7R1.2 Cc1cnc(s1)N Amb1952967 [1,1,0,0,0,0|1,1,0]=4 3055 B7R1.2 Cc1cnc(s1)O Amb13884319 [1,1,0,0,0,0|1,1,0]=4 3056 B7R1.2 Cc1cnn(c1)C Amb15692569 [1,1,0,0,0,0|2,0,0]=4 3057 B7R1.2 Cc1coc(Br)[n]1 Amb19958804 [1,1,0,0,0,0|2,0,0]=4 3058 B7R1.2 Cc1coc(C)c1 Amb22049832 [1,1,0,0,0,0|0,0,0]=2 3059 B7R1.2 Cc1coc(Cl)[n]1 Amb22728834 [1,1,0,0,0,0|2,0,0]=4 3060 B7R1.2 Cc1coc(S)[n]1 Amb24121247 [1,1,0,0,0,0|1,1,0]=4 3061 B7R1.2 Cc1coc(c1)Br Amb10600631 [1,1,0,0,0,0|1,0,0]=3 3062 B7R1.2 Cc1coc(c1)N Amb10600632 [1,1,0,0,0,0|1,0,0]=3 3063 B7R1.2 Cc1coc(n1)N Amb2455669 [1,1,0,0,0,0|2,0,0]=4 3064 B7R1.2 Cc1csc(N)n1 Amb17845150 [1,1,0,0,0,0|2,0,0]=4 3065 B7R1.2 Cc1csc(c1)Br Amb10600630 [1,1,0,0,0,0|1,1,0]=4 3066 B7R1.2 Cc1csc(n1)Br Amb2455686 [1,1,0,0,0,0|2,0,0]=4 3067 B7R1.2 Cc1csc(n1)N Amb1934780 [1,1,0,0,0,0|2,0,0]=4 3068 B7R1.2 Cc1csc(n1)N Amb1982046 [1,1,0,0,0,0|2,0,0]=4 3069 B7R1.2 Cc1csc(n1)O Amb17593194 [1,1,0,0,0,0|1,1,0]=4 3070 B7R1.2 Cc1n[nH]c(c1)N Amb10238858 [1,1,0,0,0,0|2,0,0]=4 3071 B7R1.2 Cc1n[nH]c(c1)N Amb1152371 [1,1,0,0,0,0|2,0,0]=4 3072 B7R1.2 Cc1ncc(s1)C Amb10576154 [1,1,0,0,0,0|1,1,0]=4 3073 B7R1.2 Cc1nnc(o1)N Amb1107346 [1,1,0,0,0,0|2,0,0]=4 3074 B7R1.2 Cc1nnc(o1)O Amb15701519 [1,1,0,0,0,0|2,0,0]=4 3075 B7R1.2 Cc1nnc(o1)S Amb1107237 [1,1,0,0,0,0|2,0,0]=4 3076 B7R1.2 Cc1noc(c1)N Amb1156064 [1,1,0,0,0,0|2,0,0]=4 3077 B7R1.2 Cc1nsc(c1)N Amb17621651 [1,1,0,0,0,0|2,0,0]=4 3078 B7R1.2 Cc1nsc(c1)N Amb2371635 [1,1,0,0,0,0|2,0,0]=4 3079 B7R1.2 Cc1occ(n1)C Amb15692404 [1,1,0,0,0,0|1,0,0]=3 3080 B7R1.2 Cc1onc(c1)C Amb1150307 [1,1,0,0,0,0|1,0,0]=3 3081 B7R1.2 Cc1scc([nH+]1)C Amb2566511 [1,1,0,0,0,0|1,1,0]=4 3082 B7R1.2 Cc1scc(c1)C Amb2447068 [1,1,0,0,0,0|0,1,0]=3 3083 B7R1.2 Cc1scc(n1)C Amb1161817 [1,1,0,0,0,0|1,1,0]=4 3084 B7R1.2 Clc1[n]c(Cl)co1 Amb25377934 [1,1,0,0,0,0|2,0,0]=4 3085 B7R1.2 Clc1c[nH]c(Cl)c1 Amb24511808 [1,1,0,0,0,0|2,0,0]=4 3086 B7R1.2 Clc1c[s]c(Cl)c1 Amb24056457 [1,1,0,0,0,0|1,1,0]=4 3087 B7R1.2 Clc1ccc(Cl)o1 Amb24061017 [1,1,0,0,0,0|1,0,0]=3 3088 B7R1.2 Clc1ccc(I)[s]1 Amb20620732 [1,1,0,0,0,0|1,1,0]=4 3089 B7R1.2 Clc1ccc(I)o1 Amb24752684 [1,1,0,0,0,0|1,0,0]=3 3090 B7R1.2 Clc1ccc(s1)Cl Amb2447120 [1,1,0,0,0,0|1,1,0]=4 3091 B7R1.2 Cn1cc(cn1)Br Amb2447654 [1,1,0,0,0,0|2,0,0]=4 3092 B7R1.2 Cn1ccc(n1)Br Amb10669443 [1,1,0,0,0,0|2,0,0]=4 3093 B7R1.2 Cn1ccc(n1)N Amb1154592 [1,1,0,0,0,0|2,0,0]=4 3094 B7R1.2 Fc1c[s]c(F)c1 Amb24411512 [1,1,0,0,0,0|1,1,0]=4 3095 B7R1.2 Fc1cc(Br)[nH]c1 Amb18199781 [1,1,0,0,0,0|2,0,0]=4 3096 B7R1.2 Fc1cc(Br)[s]c1 Amb18193378 [1,1,0,0,0,0|1,1,0]=4 3097 B7R1.2 Fc1cc(Br)oc1 Amb18199638 [1,1,0,0,0,0|1,0,0]=3 3098 B7R1.2 Fc1cc(Cl)c[s]1 Amb25744927 [1,1,0,0,0,0|1,1,0]=4 3099 B7R1.2 Fc1cc(I)[s]c1 Amb25351938 [1,1,0,0,0,0|1,1,0]=4 3100 B7R1.2 Fc1cc(I)c[s]1 Amb25301648 [1,1,0,0,0,0|1,1,0]=4 3101 B7R1.2 Fc1ccc(Br)[nH]1 Amb18828838 [1,1,0,0,0,0|2,0,0]=4 3102 B7R1.2 Fc1ccc(Br)[s]1 Amb18193111 [1,1,0,0,0,0|1,1,0]=4 3103 B7R1.2 Fc1ccc(Br)o1 Amb18199668 [1,1,0,0,0,0|1,0,0]=3 3104 B7R1.2 Fc1ccc(I)[s]1 Amb24269146 [1,1,0,0,0,0|1,1,0]=4 3105 B7R1.2 Fc1coc(F)c1 Amb25746010 [1,1,0,0,0,0|1,0,0]=3 3106 B7R1.2 IC1=CC(=O)OC1 Amb2455617 [1,1,0,0,0,0|0,0,2]=4 3107 B7R1.2 Ic1[n]c(I)co1 Amb25700929 [1,1,0,0,0,0|2,0,0]=4 3108 B7R1.2 Ic1[n]cc(I)o1 Amb24733906 [1,1,0,0,0,0|2,0,0]=4 3109 B7R1.2 N=C1C=CC(=N)N1 Amb25663065 [1,1,0,0,0,0|2,0,0]=4 3110 B7R1.2 N=C1C=CC(O)N1 Amb24065674 [1,1,0,0,0,0|1,0,1]=4 3111 B7R1.2 NC1=CC(=O)CO1 Amb24516411 [1,1,0,0,0,0|1,0,1]=4 3112 B7R1.2 NC1=CC(=O)NO1 Amb20103209 [1,1,0,0,0,0|2,0,0]=4 3113 B7R1.2 NC1C=CC(=O)O1 Amb24349779 [1,1,0,0,0,0|0,0,2]=4 3114 B7R1.2 N[n]1cc(O)cc1 Amb24741900 [1,1,0,0,0,0|2,0,0]=4 3115 B7R1.2 Nc1[n][n]c(O)o1 Amb20248810 [1,1,0,0,0,0|2,0,0]=4 3116 B7R1.2 Nc1[n]c(I)co1 Amb25335651 [1,1,0,0,0,0|2,0,0]=4 3117 B7R1.2 Nc1[n]c(N)co1 Amb25267769 [1,1,0,0,0,0|2,0,0]=4 3118 B7R1.2 Nc1[n]cc(Cl)o1 Amb25075968 [1,1,0,0,0,0|2,0,0]=4 3119 B7R1.2 Nc1[n]cc(O)[s]1 Amb24106035 [1,1,0,0,0,0|1,1,0]=4 3120 B7R1.2 Nc1c[nH]c(N)c1 Amb18200110 [1,1,0,0,0,0|2,0,0]=4 3121 B7R1.2 Nc1c[n](O)cc1 Amb25113426 [1,1,0,0,0,0|2,0,0]=4 3122 B7R1.2 Nc1c[s]c(N)c1 Amb18203357 [1,1,0,0,0,0|1,1,0]=4 3123 B7R1.2 Nc1c[s]c(O)[n]1 Amb24479842 [1,1,0,0,0,0|1,1,0]=4 3124 B7R1.2 Nc1cc(Br)[nH]c1 Amb18199640 [1,1,0,0,0,0|2,0,0]=4 3125 B7R1.2 Nc1cc(Br)[s]c1 Amb18648086 [1,1,0,0,0,0|1,1,0]=4 3126 B7R1.2 Nc1cc(Br)[s]c1 Amb19929503 [1,1,0,0,0,0|1,1,0]=4 3127 B7R1.2 Nc1cc(Br)c[nH]1 Amb18199649 [1,1,0,0,0,0|2,0,0]=4 3128 B7R1.2 Nc1cc(Br)c[s]1 Amb18564069 [1,1,0,0,0,0|1,1,0]=4 3129 B7R1.2 Nc1cc(Br)co1 Amb18819119 [1,1,0,0,0,0|1,0,0]=3 3130 B7R1.2 Nc1cc(Br)oc1 Amb18190961 [1,1,0,0,0,0|1,0,0]=3 3131 B7R1.2 Nc1cc(Cl)[s]c1 Amb22492848 [1,1,0,0,0,0|1,1,0]=4 3132 B7R1.2 Nc1cc(Cl)[s]c1 Amb22757511 [1,1,0,0,0,0|1,1,0]=4 3133 B7R1.2 Nc1cc(Cl)c[s]1 Amb23400218 [1,1,0,0,0,0|1,1,0]=4 3134 B7R1.2 Nc1cc(Cl)c[s]1 Amb23401708 [1,1,0,0,0,0|1,1,0]=4 3135 B7R1.2 Nc1cc(I)[s]c1 Amb25788262 [1,1,0,0,0,0|1,1,0]=4 3136 B7R1.2 Nc1cc(O)[n]o1 Amb18941358 [1,1,0,0,0,0|2,0,0]=4 3137 B7R1.2 Nc1ccc(Br)[nH]1 Amb18199648 [1,1,0,0,0,0|2,0,0]=4 3138 B7R1.2 Nc1ccc(Br)[s]1 Amb20241251 [1,1,0,0,0,0|1,1,0]=4 3139 B7R1.2 Nc1ccc(Br)[s]1 Amb22491952 [1,1,0,0,0,0|1,1,0]=4 3140 B7R1.2 Nc1ccc(Cl)[s]1 Amb18055064 [1,1,0,0,0,0|1,1,0]=4 3141 B7R1.2 Nc1ccc(Cl)[s]1 Amb19958824 [1,1,0,0,0,0|1,1,0]=4 3142 B7R1.2 Nc1ccc(Cl)[s]1 Amb23401704 [1,1,0,0,0,0|1,1,0]=4 3143 B7R1.2 Nc1ccc(Cl)o1 Amb25360216 [1,1,0,0,0,0|1,0,0]=3 3144 B7R1.2 Nc1ccc(F)[s]1 Amb18202738 [1,1,0,0,0,0|1,1,0]=4 3145 B7R1.2 Nc1ccc(F)o1 Amb18202898 [1,1,0,0,0,0|1,0,0]=3 3146 B7R1.2 Nc1ccc(N)[nH]1 Amb18200126 [1,1,0,0,0,0|2,0,0]=4 3147 B7R1.2 Nc1ccc(N)[s]1 Amb18203358 [1,1,0,0,0,0|1,1,0]=4 3148 B7R1.2 Nc1ccc(N)o1 Amb18203063 [1,1,0,0,0,0|1,0,0]=3 3149 B7R1.2 Nc1ccc(O)o1 Amb24526005 [1,1,0,0,0,0|0,0,0]=2 3150 B7R1.2 Nc1ccc(o1)Br Amb13884560 [1,1,0,0,0,0|1,0,0]=3 3151 B7R1.2 Nc1ccc(o1)[2H] Amb10597230 [1,1,0,0,0,0|1,0,0]=3 3152 B7R1.2 Nc1ccc(s1)Br Amb13884559 [1,1,0,0,0,0|1,1,0]=4 3153 B7R1.2 Nc1ccc(s1)[2H] Amb10597229 [1,1,0,0,0,0|1,1,0]=4 3154 B7R1.2 Nc1cnc(s1)C Amb10599444 [1,1,0,0,0,0|1,1,0]=4 3155 B7R1.2 Nc1cnn(c1)C Amb15740846 [1,1,0,0,0,0|2,0,0]=4 3156 B7R1.2 Nc1coc(N)c1 Amb18199155 [1,1,0,0,0,0|1,0,0]=3 3157 B7R1.2 Nc1csc(n1)C Amb10600549 [1,1,0,0,0,0|1,1,0]=4 3158 B7R1.2 Nc1n[nH]c(c1)C Amb2237128 [1,1,0,0,0,0|2,0,0]=4 3159 B7R1.2 Nc1noc(n1)C Amb15701234 [1,1,0,0,0,0|2,0,0]=4 3160 B7R1.2 Nc1nsc(c1)C Amb10576306 [1,1,0,0,0,0|1,1,0]=4 3161 B7R1.2 Nc1onc(c1)N Amb13951830 [1,1,0,0,0,0|2,0,0]=4 3162 B7R1.2 Nc1onc(c1)N Amb17622003 [1,1,0,0,0,0|2,0,0]=4 3163 B7R1.2 O=C1C=C(Cl)CO1 Amb25241116 [1,1,0,0,0,0|0,0,2]=4 3164 B7R1.2 O=C1C=CC(=O)N1 Amb1235242 [1,1,0,0,0,0|1,0,1]=4 3165 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [1,1,0,0,0,0|0,0,1]=3 3166 B7R1.2 O=C1C=CC(=O)O1 Amb22369065 [1,1,0,0,0,0|0,0,1]=3 3167 B7R1.2 O=C1C=CC(=O)S1 Amb24603022 [1,1,0,0,0,0|0,1,1]=4 3168 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [1,1,0,0,0,0|0,0,2]=4 3169 B7R1.2 O=C1C=CC(I)O1 Amb25325287 [1,1,0,0,0,0|0,0,2]=4 3170 B7R1.2 O=C1C=C[13C](=O)O1 Amb22367487 [1,1,0,0,0,0|0,0,1]=3 3171 B7R1.2 O=C1CC(=O)C=C1 Amb22338203 [1,1,0,0,0,0|1,0,1]=4 3172 B7R1.2 O=C1OC=C(C1)O Amb17621628 [1,1,0,0,0,0|0,0,2]=4 3173 B7R1.2 O=C1[13CH]=[13CH]C(=O)O1 Amb22353372 [1,1,0,0,0,0|0,0,1]=3 3174 B7R1.2 O=[13C]1C=C[13C](=O)O1 Amb22367373 [1,1,0,0,0,0|0,0,1]=3 3175 B7R1.2 O=[13C]1[13CH]=[13CH][13C](=O)O1 Amb22055653 [1,1,0,0,0,0|0,0,1]=3 3176 B7R1.2 OC1C=CC(=O)O1 Amb24544763 [1,1,0,0,0,0|0,0,1]=3 3177 B7R1.2 OC1C=CC(O)O1 Amb25332488 [1,1,0,0,0,0|0,0,2]=4 3178 B7R1.2 OC=1C=CC(=O)N1 Amb22552540 [1,1,0,0,0,0|1,0,0]=3 3179 B7R1.2 OC=1CNC(=O)C1 Amb20623530 [1,1,0,0,0,0|2,0,0]=4 3180 B7R1.2 OC=1CNC(=S)C1 Amb25025419 [1,1,0,0,0,0|2,0,0]=4 3181 B7R1.2 OC=1CSC(=S)C1 Amb25180779 [1,1,0,0,0,0|2,0,0]=4 3182 B7R1.2 ON1CC(=O)C=C1 Amb25286099 [1,1,0,0,0,0|2,0,0]=4 3183 B7R1.2 O[C@@H]1C=CC(=O)N1 Amb25844488 [1,1,0,0,0,0|1,0,1]=4 3184 B7R1.2 O[C@@H]1C=CC(=O)O1 Amb25064237 [1,1,0,0,0,0|0,0,1]=3 3185 B7R1.2 O[C@H]1C=CC(=O)O1 Amb24479542 [1,1,0,0,0,0|0,0,1]=3 3186 B7R1.2 O[n]1cc(Br)c[n]1 Amb22371900 [1,1,0,0,0,0|2,0,0]=4 3187 B7R1.2 O[n]1cc(I)c[n]1 Amb25757676 [1,1,0,0,0,0|2,0,0]=4 3188 B7R1.2 Oc1[n][n]c(F)o1 Amb20621707 [1,1,0,0,0,0|2,0,0]=4 3189 B7R1.2 Oc1[n]c(Cl)[n]o1 Amb24715664 [1,1,0,0,0,0|2,0,0]=4 3190 B7R1.2 Oc1[n]c(I)[n]o1 Amb24507600 [1,1,0,0,0,0|2,0,0]=4 3191 B7R1.2 Oc1[n]cc(Br)[s]1 Amb20617312 [1,1,0,0,0,0|1,1,0]=4 3192 B7R1.2 Oc1c[n](O)cc1 Amb25352119 [1,1,0,0,0,0|2,0,0]=4 3193 B7R1.2 Oc1c[n]c(Br)[s]1 Amb25137762 [1,1,0,0,0,0|1,1,0]=4 3194 B7R1.2 Oc1c[s]c(Br)[n]1 Amb18824582 [1,1,0,0,0,0|2,0,0]=4 3195 B7R1.2 Oc1cc(Br)[n][nH]1 Amb24383303 [1,1,0,0,0,0|2,0,0]=4 3196 B7R1.2 Oc1cc(Br)c[s]1 Amb18819059 [1,1,0,0,0,0|0,1,0]=3 3197 B7R1.2 Oc1cc(Cl)[s][n]1 Amb21858019 [1,1,0,0,0,0|2,0,0]=4 3198 B7R1.2 Oc1ccc(Br)[nH]1 Amb18819121 [1,1,0,0,0,0|1,0,0]=3 3199 B7R1.2 Oc1ccc(Br)[s]1 Amb18055072 [1,1,0,0,0,0|0,1,0]=3 3200 B7R1.2 Oc1ccc(Br)o1 Amb18199811 [1,1,0,0,0,0|0,0,0]=2 3201 B7R1.2 Oc1ccc(Cl)[s]1 Amb18055065 [1,1,0,0,0,0|0,1,0]=3 3202 B7R1.2 Oc1ccc(Cl)o1 Amb25723971 [1,1,0,0,0,0|0,0,0]=2 3203 B7R1.2 Oc1cnc(s1)C Amb10599445 [1,1,0,0,0,0|1,1,0]=4 3204 B7R1.2 Oc1csc(n1)C Amb10600550 [1,1,0,0,0,0|1,1,0]=4 3205 B7R1.2 Oc1noc(c1)C Amb2370655 [1,1,0,0,0,0|1,0,0]=3 3206 B7R1.2 Oc1nsc(c1)C Amb2420511 [1,1,0,0,0,0|1,1,0]=4 3207 B7R1.2 Oc1scc(n1)O Amb10599939 [1,1,0,0,0,0|1,1,0]=4 3208 B7R1.2 Sc1[n]cc(Cl)o1 Amb25822211 [1,1,0,0,0,0|1,1,0]=4 3209 B7R1.2 Sc1[n]cc(I)o1 Amb24675167 [1,1,0,0,0,0|1,1,0]=4 3210 B7R1.2 Sc1ccc(Br)[s]1 Amb24524248 [1,1,0,0,0,0|0,2,0]=4 3211 B7R1.2 Sc1ccc(Cl)[s]1 Amb24479766 [1,1,0,0,0,0|0,2,0]=4 3212 B7R1.2 [*]c1ccc([*])[s]1 Amb17933771 [1,1,0,0,0,0|1,1,0]=4 3213 B7R1.2 [13CH3]c1ccc([13CH3])o1 Amb22338842 [1,1,0,0,0,0|0,0,0]=2 3214 B7R1.2 [SiH3]c1ccc(Cl)[s]1 Amb24638420 [1,1,0,0,0,0|0,2,0]=4 3215 B7R1.4 Brc1[s]ccc1I Amb20620493 [1,1,0,0,0,0|1,1,0]=4 3216 B7R1.4 Brc1cc[s]c1I Amb20620492 [1,1,0,0,0,0|1,1,0]=4 3217 B7R1.4 Brc1cscc1C Amb2447459 [1,1,0,0,0,0|2,0,0]=4 3218 B7R1.4 Brc1csnc1C Amb10976050 [1,1,0,0,0,0|2,0,0]=4 3219 B7R1.4 Brc1nc[nH]c1C Amb10069029 [1,1,0,0,0,0|2,0,0]=4 3220 B7R1.4 Brc1oc[n]c1Br Amb25270455 [1,1,0,0,0,0|2,0,0]=4 3221 B7R1.4 Brc1sccc1Br Amb2237068 [1,1,0,0,0,0|1,1,0]=4 3222 B7R1.4 CC1=CC=CC1=O Amb24408382 [1,1,0,0,0,0|1,0,0]=3 3223 B7R1.4 CC1=CNOC1=O Amb25843682 [1,1,0,0,0,0|1,0,1]=4 3224 B7R1.4 CC1CC=CC1=O Amb25143468 [1,1,0,0,0,0|1,0,1]=4 3225 B7R1.4 CN1CC=CC1=O Amb22372248 [1,1,0,0,0,0|2,0,0]=4 3226 B7R1.4 CN1CC=CC1=S Amb25025094 [1,1,0,0,0,0|2,0,0]=4 3227 B7R1.4 CN1NC=CC1=O Amb22002214 [1,1,0,0,0,0|2,0,0]=4 3228 B7R1.4 CN1OC=CC1=O Amb25845405 [1,1,0,0,0,0|1,0,0]=3 3229 B7R1.4 CN1SC=CC1=O Amb19133167 [1,1,0,0,0,0|1,1,0]=4 3230 B7R1.4 CN1SC=CC1=O Amb20239425 [1,1,0,0,0,0|1,1,0]=4 3231 B7R1.4 CN1SC=CC1=S Amb20661435 [1,1,0,0,0,0|1,1,0]=4 3232 B7R1.4 C[C@H]1CC=CC1=O Amb24364068 [1,1,0,0,0,0|1,0,1]=4 3233 B7R1.4 C[n]1[n]ccc1Cl Amb24622347 [1,1,0,0,0,0|2,0,0]=4 3234 B7R1.4 C[n]1[n]ccc1F Amb24269140 [1,1,0,0,0,0|2,0,0]=4 3235 B7R1.4 C[n]1[n]ccc1N Amb21890197 [1,1,0,0,0,0|2,0,0]=4 3236 B7R1.4 C[n]1[n]ccc1O Amb22233838 [1,1,0,0,0,0|2,0,0]=4 3237 B7R1.4 C[n]1cccc1Br Amb18199426 [1,1,0,0,0,0|2,0,0]=4 3238 B7R1.4 C[n]1cccc1Cl Amb25212184 [1,1,0,0,0,0|2,0,0]=4 3239 B7R1.4 C[n]1cccc1I Amb24756601 [1,1,0,0,0,0|2,0,0]=4 3240 B7R1.4 C[n]1cccc1N Amb24480442 [1,1,0,0,0,0|2,0,0]=4 3241 B7R1.4 Cc1[nH][n]cc1O Amb25810995 [1,1,0,0,0,0|2,0,0]=4 3242 B7R1.4 Cc1[nH]c[n]c1Cl Amb22900048 [1,1,0,0,0,0|2,0,0]=4 3243 B7R1.4 Cc1[nH]c[n]c1F Amb24480872 [1,1,0,0,0,0|2,0,0]=4 3244 B7R1.4 Cc1[nH]c[n]c1N Amb18120727 [1,1,0,0,0,0|2,0,0]=4 3245 B7R1.4 Cc1[nH]ccc1Br Amb18199851 [1,1,0,0,0,0|1,0,0]=3 3246 B7R1.4 Cc1[nH]ccc1N Amb18198050 [1,1,0,0,0,0|1,0,0]=3 3247 B7R1.4 Cc1[nH]ccc1O Amb25214639 [1,1,0,0,0,0|1,0,0]=3 3248 B7R1.4 Cc1[nH]cnc1C Amb10975964 [1,1,0,0,0,0|2,0,0]=4 3249 B7R1.4 Cc1[n][nH]cc1C Amb22002061 [1,1,0,0,0,0|2,0,0]=4 3250 B7R1.4 Cc1[n][nH]cc1N Amb21954296 [1,1,0,0,0,0|2,0,0]=4 3251 B7R1.4 Cc1[n]c[nH]c1C Amb22728309 [1,1,0,0,0,0|2,0,0]=4 3252 B7R1.4 Cc1[n]c[nH]c1I Amb22233855 [1,1,0,0,0,0|2,0,0]=4 3253 B7R1.4 Cc1[n]c[nH]c1N Amb22754417 [1,1,0,0,0,0|2,0,0]=4 3254 B7R1.4 Cc1[n]c[nH]c1S Amb25376496 [1,1,0,0,0,0|2,0,0]=4 3255 B7R1.4 Cc1[n]c[s]c1Cl Amb24089394 [1,1,0,0,0,0|2,0,0]=4 3256 B7R1.4 Cc1[n]c[s]c1N Amb18943427 [1,1,0,0,0,0|2,0,0]=4 3257 B7R1.4 Cc1[n]c[s]c1O Amb25268351 [1,1,0,0,0,0|1,1,0]=4 3258 B7R1.4 Cc1[n]cc[n]1Br Amb25204215 [1,1,0,0,0,0|2,0,0]=4 3259 B7R1.4 Cc1[n]cc[n]1Cl Amb24615921 [1,1,0,0,0,0|2,0,0]=4 3260 B7R1.4 Cc1[n]coc1N Amb22234804 [1,1,0,0,0,0|2,0,0]=4 3261 B7R1.4 Cc1[n]coc1O Amb24536045 [1,1,0,0,0,0|1,0,0]=3 3262 B7R1.4 Cc1[n]occ1N Amb22235025 [1,1,0,0,0,0|2,0,0]=4 3263 B7R1.4 Cc1[n]occ1N Amb22494732 [1,1,0,0,0,0|2,0,0]=4 3264 B7R1.4 Cc1[s][n]cc1Br Amb24610354 [1,1,0,0,0,0|1,1,0]=4 3265 B7R1.4 Cc1[s]c[n]c1Br Amb18824935 [1,1,0,0,0,0|1,1,0]=4 3266 B7R1.4 Cc1[s]c[n]c1N Amb23504020 [1,1,0,0,0,0|1,1,0]=4 3267 B7R1.4 Cc1[s]c[n]c1O Amb24099829 [1,1,0,0,0,0|1,1,0]=4 3268 B7R1.4 Cc1[s]ccc1N Amb18833056 [1,1,0,0,0,0|0,1,0]=3 3269 B7R1.4 Cc1[s]ccc1N Amb22276099 [1,1,0,0,0,0|0,1,0]=3 3270 B7R1.4 Cc1c[nH]cc1Br Amb24419899 [1,1,0,0,0,0|2,0,0]=4 3271 B7R1.4 Cc1c[nH]cc1C Amb17938703 [1,1,0,0,0,0|2,0,0]=4 3272 B7R1.4 Cc1c[nH]cc1N Amb25682874 [1,1,0,0,0,0|2,0,0]=4 3273 B7R1.4 Cc1c[nH]nc1O Amb17622020 [1,1,0,0,0,0|2,0,0]=4 3274 B7R1.4 Cc1c[n]c[n]1C Amb22044022 [1,1,0,0,0,0|2,0,0]=4 3275 B7R1.4 Cc1c[n]oc1N Amb18943767 [1,1,0,0,0,0|2,0,0]=4 3276 B7R1.4 Cc1c[n]oc1O Amb25064746 [1,1,0,0,0,0|1,0,0]=3 3277 B7R1.4 Cc1c[s]cc1Cl Amb24751006 [1,1,0,0,0,0|2,0,0]=4 3278 B7R1.4 Cc1c[s]cc1F Amb24620444 [1,1,0,0,0,0|2,0,0]=4 3279 B7R1.4 Cc1c[s]cc1N Amb18833058 [1,1,0,0,0,0|2,0,0]=4 3280 B7R1.4 Cc1c[s]cc1N Amb20667756 [1,1,0,0,0,0|2,0,0]=4 3281 B7R1.4 Cc1c[s]cc1N Amb22234035 [1,1,0,0,0,0|2,0,0]=4 3282 B7R1.4 Cc1cc[nH]c1C Amb17938702 [1,1,0,0,0,0|1,0,0]=3 3283 B7R1.4 Cc1cc[s]c1I Amb22898804 [1,1,0,0,0,0|1,1,0]=4 3284 B7R1.4 Cc1cc[s]c1N Amb18679496 [1,1,0,0,0,0|1,1,0]=4 3285 B7R1.4 Cc1cc[s]c1N Amb22496058 [1,1,0,0,0,0|1,1,0]=4 3286 B7R1.4 Cc1cc[s]c1N Amb22498571 [1,1,0,0,0,0|1,1,0]=4 3287 B7R1.4 Cc1cc[s]c1O Amb24639732 [1,1,0,0,0,0|0,1,0]=3 3288 B7R1.4 Cc1cc[s]c1S Amb25747282 [1,1,0,0,0,0|0,2,0]=4 3289 B7R1.4 Cc1ccc[n]1N Amb25774373 [1,1,0,0,0,0|1,0,0]=3 3290 B7R1.4 Cc1ccoc1Br Amb22276939 [1,1,0,0,0,0|1,0,0]=3 3291 B7R1.4 Cc1ccsc1Br Amb2236394 [1,1,0,0,0,0|1,1,0]=4 3292 B7R1.4 Cc1cocc1Br Amb24056370 [1,1,0,0,0,0|2,0,0]=4 3293 B7R1.4 Cc1cocc1C Amb17613311 [1,1,0,0,0,0|2,0,0]=4 3294 B7R1.4 Cc1cocc1I Amb24630674 [1,1,0,0,0,0|2,0,0]=4 3295 B7R1.4 Cc1cocc1O Amb24411637 [1,1,0,0,0,0|2,0,0]=4 3296 B7R1.4 Cc1n[nH]cc1C Amb17613373 [1,1,0,0,0,0|2,0,0]=4 3297 B7R1.4 Cc1ncsc1Br Amb10067879 [1,1,0,0,0,0|2,0,0]=4 3298 B7R1.4 Cc1o[n][n]c1N Amb18202618 [1,1,0,0,0,0|2,0,0]=4 3299 B7R1.4 Cc1o[n]cc1Br Amb18199818 [1,1,0,0,0,0|1,0,0]=3 3300 B7R1.4 Cc1o[n]cc1N Amb18119789 [1,1,0,0,0,0|1,0,0]=3 3301 B7R1.4 Cc1o[n]cc1N Amb20668399 [1,1,0,0,0,0|1,0,0]=3 3302 B7R1.4 Cc1oc[n]c1Br Amb24357642 [1,1,0,0,0,0|1,0,0]=3 3303 B7R1.4 Cc1oc[n]c1C Amb22396059 [1,1,0,0,0,0|1,0,0]=3 3304 B7R1.4 Cc1occc1N Amb18203072 [1,1,0,0,0,0|0,0,0]=2 3305 B7R1.4 Cc1occc1O Amb25178728 [1,1,0,0,0,0|0,0,0]=2 3306 B7R1.4 Cc1sccc1C Amb2447413 [1,1,0,0,0,0|0,1,0]=3 3307 B7R1.4 Clc1c[nH]nc1C Amb19134484 [1,1,0,0,0,0|2,0,0]=4 3308 B7R1.4 Clc1cc[nH]c1Br Amb25315179 [1,1,0,0,0,0|2,0,0]=4 3309 B7R1.4 Clc1cc[nH]c1Cl Amb24359419 [1,1,0,0,0,0|2,0,0]=4 3310 B7R1.4 Clc1cc[s]c1I Amb25169530 [1,1,0,0,0,0|1,1,0]=4 3311 B7R1.4 Clc1ccoc1Cl Amb25208816 [1,1,0,0,0,0|1,0,0]=3 3312 B7R1.4 Clc1occc1Br Amb24443259 [1,1,0,0,0,0|1,0,0]=3 3313 B7R1.4 Cn1cccc1C Amb2447020 [1,1,0,0,0,0|1,0,0]=3 3314 B7R1.4 Cn1ccnc1C Amb2455761 [1,1,0,0,0,0|2,0,0]=4 3315 B7R1.4 Cn1nccc1Br Amb10603813 [1,1,0,0,0,0|2,0,0]=4 3316 B7R1.4 Cn1nccc1C Amb1945868 [1,1,0,0,0,0|2,0,0]=4 3317 B7R1.4 Cn1nccc1O Amb13883681 [1,1,0,0,0,0|2,0,0]=4 3318 B7R1.4 Fc1[s]ccc1Br Amb25802858 [1,1,0,0,0,0|1,1,0]=4 3319 B7R1.4 Fc1cc[nH]c1Br Amb18199773 [1,1,0,0,0,0|2,0,0]=4 3320 B7R1.4 Fc1cc[s]c1Br Amb18522293 [1,1,0,0,0,0|1,1,0]=4 3321 B7R1.4 Fc1cc[s]c1Cl Amb25662800 [1,1,0,0,0,0|1,1,0]=4 3322 B7R1.4 Fc1cc[s]c1F Amb24562839 [1,1,0,0,0,0|1,1,0]=4 3323 B7R1.4 Fc1ccoc1Br Amb18199675 [1,1,0,0,0,0|1,0,0]=3 3324 B7R1.4 Fc1occc1Br Amb24638170 [1,1,0,0,0,0|1,0,0]=3 3325 B7R1.4 Ic1c[nH]nc1C Amb10068427 [1,1,0,0,0,0|2,0,0]=4 3326 B7R1.4 Ic1cc[s]c1I Amb25270694 [1,1,0,0,0,0|1,1,0]=4 3327 B7R1.4 Ic1cn[nH]c1C Amb16186676 [1,1,0,0,0,0|2,0,0]=4 3328 B7R1.4 NC1=CCOC1=O Amb22234102 [1,1,0,0,0,0|0,0,2]=4 3329 B7R1.4 NN1C=COC1=O Amb24626105 [1,1,0,0,0,0|1,0,1]=4 3330 B7R1.4 N[C@H]1C=COC1=O Amb25259750 [1,1,0,0,0,0|0,0,2]=4 3331 B7R1.4 Nc1[nH]ccc1Br Amb18199832 [1,1,0,0,0,0|2,0,0]=4 3332 B7R1.4 Nc1[nH]ccc1S Amb25364973 [1,1,0,0,0,0|2,0,0]=4 3333 B7R1.4 Nc1[n]coc1O Amb24594151 [1,1,0,0,0,0|1,0,0]=3 3334 B7R1.4 Nc1[s]ccc1Br Amb18190889 [1,1,0,0,0,0|1,1,0]=4 3335 B7R1.4 Nc1[s]ccc1Cl Amb23400220 [1,1,0,0,0,0|1,1,0]=4 3336 B7R1.4 Nc1[s]ccc1Cl Amb23401705 [1,1,0,0,0,0|1,1,0]=4 3337 B7R1.4 Nc1[s]ccc1F Amb24679180 [1,1,0,0,0,0|1,1,0]=4 3338 B7R1.4 Nc1[s]ccc1I Amb25822246 [1,1,0,0,0,0|1,1,0]=4 3339 B7R1.4 Nc1c[nH]nc1C Amb1090858 [1,1,0,0,0,0|2,0,0]=4 3340 B7R1.4 Nc1c[nH]nc1C Amb19134403 [1,1,0,0,0,0|2,0,0]=4 3341 B7R1.4 Nc1c[n]oc1Cl Amb25025558 [1,1,0,0,0,0|2,0,0]=4 3342 B7R1.4 Nc1cc[nH]c1Br Amb18199645 [1,1,0,0,0,0|2,0,0]=4 3343 B7R1.4 Nc1cc[nH]c1N Amb18200118 [1,1,0,0,0,0|2,0,0]=4 3344 B7R1.4 Nc1cc[s]c1Br Amb22757373 [1,1,0,0,0,0|1,1,0]=4 3345 B7R1.4 Nc1cc[s]c1Cl Amb24054287 [1,1,0,0,0,0|1,1,0]=4 3346 B7R1.4 Nc1cc[s]c1Cl Amb25077005 [1,1,0,0,0,0|1,1,0]=4 3347 B7R1.4 Nc1cc[s]c1N Amb18203359 [1,1,0,0,0,0|1,1,0]=4 3348 B7R1.4 Nc1ccoc1Br Amb13884558 [1,1,0,0,0,0|1,0,0]=3 3349 B7R1.4 Nc1ccoc1N Amb18832360 [1,1,0,0,0,0|1,0,0]=3 3350 B7R1.4 Nc1ccsc1Br Amb13884557 [1,1,0,0,0,0|1,1,0]=4 3351 B7R1.4 Nc1cn[nH]c1C Amb10608291 [1,1,0,0,0,0|2,0,0]=4 3352 B7R1.4 Nc1cocc1O Amb24078810 [1,1,0,0,0,0|2,0,0]=4 3353 B7R1.4 Nc1csnc1C Amb10604431 [1,1,0,0,0,0|2,0,0]=4 3354 B7R1.4 Nc1o[n]cc1Cl Amb24385964 [1,1,0,0,0,0|2,0,0]=4 3355 B7R1.4 Nc1occc1O Amb25327034 [1,1,0,0,0,0|1,0,0]=3 3356 B7R1.4 O=C1C=COC1=O Amb24706925 [1,1,0,0,0,0|0,0,1]=3 3357 B7R1.4 O=C1C=COC1Br Amb24061538 [1,1,0,0,0,0|1,0,1]=4 3358 B7R1.4 O=C1OC=CC1Br Amb22015332 [1,1,0,0,0,0|0,0,2]=4 3359 B7R1.4 O=C1OC=CC1I Amb24679050 [1,1,0,0,0,0|0,0,2]=4 3360 B7R1.4 O=C1OCC=C1Br Amb10067498 [1,1,0,0,0,0|0,0,2]=4 3361 B7R1.4 O=C1OCC=C1C Amb16231256 [1,1,0,0,0,0|0,0,2]=4 3362 B7R1.4 O=C1OCC=C1Cl Amb23571857 [1,1,0,0,0,0|0,0,2]=4 3363 B7R1.4 O=C1OCC=C1I Amb24679080 [1,1,0,0,0,0|0,0,2]=4 3364 B7R1.4 O=C1ON=CC1=O Amb25319011 [1,1,0,0,0,0|1,0,1]=4 3365 B7R1.4 OC1=CCOC1=O Amb25147525 [1,1,0,0,0,0|0,0,2]=4 3366 B7R1.4 OC1C=COC1=O Amb25296159 [1,1,0,0,0,0|0,0,2]=4 3367 B7R1.4 O[C@@H]1CC=CC1=O Amb24571805 [1,1,0,0,0,0|1,0,1]=4 3368 B7R1.4 O[C@H]1CC=CC1=O Amb25745808 [1,1,0,0,0,0|1,0,1]=4 3369 B7R1.4 Oc1[nH]ccc1Br Amb18819118 [1,1,0,0,0,0|1,0,0]=3 3370 B7R1.4 Oc1[n][s]cc1Cl Amb25292896 [1,1,0,0,0,0|2,0,0]=4 3371 B7R1.4 Oc1[n]c[s]c1Br Amb24638356 [1,1,0,0,0,0|2,0,0]=4 3372 B7R1.4 Oc1[s]ccc1Br Amb22492529 [1,1,0,0,0,0|0,1,0]=3 3373 B7R1.4 Oc1[s]ccc1Cl Amb25296805 [1,1,0,0,0,0|0,1,0]=3 3374 B7R1.4 Oc1[s]ccc1F Amb25177194 [1,1,0,0,0,0|0,1,0]=3 3375 B7R1.4 Oc1c[s]cc1O Amb21964108 [1,1,0,0,0,0|2,0,0]=4 3376 B7R1.4 Oc1cc[nH]c1S Amb25025393 [1,1,0,0,0,0|1,1,0]=4 3377 B7R1.4 Oc1ccoc1Br Amb24078809 [1,1,0,0,0,0|1,0,0]=3 3378 B7R1.4 Oc1ccoc1O Amb24060949 [1,1,0,0,0,0|0,0,0]=2 3379 B7R1.4 Oc1cocc1Cl Amb25375956 [1,1,0,0,0,0|2,0,0]=4 3380 B7R1.4 Oc1cocc1F Amb24638363 [1,1,0,0,0,0|2,0,0]=4 3381 B7R1.4 Oc1occc1Br Amb18199810 [1,1,0,0,0,0|0,0,0]=2 3382 B7R1.4 SC1=C(C)OCC1 Amb16232456 [1,1,0,0,0,0|0,0,2]=4 3383 B7R1.4 Sc1ccoc1C Amb16232454 [1,1,0,0,0,0|0,0,0]=2 3384 B7R1.4 Sc1ccsc1C Amb16232447 [1,1,0,0,0,0|0,1,0]=3 3385 B7R1.14 CC1(C)C=CC=C1 Amb24560211 [1,1,0,0,0,0|1,0,1]=4 3386 B7R1.14 CP1(=O)C=CCO1 Amb25345454 [1,1,0,0,0,0|1,0,1]=4 3387 B7R1.6 OCCC1CC=C1 Amb25271839 [0,1,0,0,1,0|0,0,2]=4 3388 B7R1.10 OCC1CC(=O)O1 Amb25706008 [0,1,0,0,1,0|0,0,2]=4 3389 B7R1.10 OC[C@H]1CC(=O)O1 Amb25769462 [0,1,0,0,1,0|0,0,2]=4 3390 B9R1.1 Bc1ccc(CBr)cc1 Amb25690199 [0,1,0,0,0,1|2,0,0]=4 3391 B9R1.1 Bc1ccc(CCl)cc1 Amb24589247 [0,1,0,0,0,1|2,0,0]=4 3392 B9R1.1 BrCc1ccc(cc1)O Amb10603714 [0,1,0,0,0,1|2,0,0]=4 3393 B9R1.1 BrCc1ccc(cn1)F Amb10606379 [0,1,0,0,0,1|2,0,0]=4 3394 B9R1.1 BrCc1ccc(nc1)C Amb15694777 [0,1,0,0,0,1|2,0,0]=4 3395 B9R1.1 BrCc1ccc(nc1)Cl Amb10602791 [0,1,0,0,0,1|2,0,0]=4 3396 B9R1.1 BrCc1ccc(nc1)F Amb10840577 [0,1,0,0,0,1|2,0,0]=4 3397 B9R1.1 Brc1c[n]c(CBr)[n]c1 Amb22500673 [0,1,0,0,0,1|2,0,0]=4 3398 B9R1.1 Brc1c[n]c(CBr)c[n]1 Amb24457796 [0,1,0,0,0,1|2,0,0]=4 3399 B9R1.1 Brc1ccc(CBr)[n][n]1 Amb22233983 [0,1,0,0,0,1|2,0,0]=4 3400 B9R1.1 Brc1ccc(CBr)[n][n]1 Amb22753676 [0,1,0,0,0,1|2,0,0]=4 3401 B9R1.1 Brc1ccc(CBr)[n]c1 Amb22497644 [0,1,0,0,0,1|2,0,0]=4 3402 B9R1.1 Brc1ccc(CBr)[n]c1 Amb22831138 [0,1,0,0,0,1|2,0,0]=4 3403 B9R1.1 Brc1ccc(CBr)c[n]1 Amb20617927 [0,1,0,0,0,1|2,0,0]=4 3404 B9R1.1 Brc1ccc(CBr)c[n]1 Amb22273996 [0,1,0,0,0,1|2,0,0]=4 3405 B9R1.1 Brc1ccc(CI)c[n]1 Amb25178810 [0,1,0,0,0,1|2,0,0]=4 3406 B9R1.1 Brc1ccc(CI)cc1 Amb23590685 [0,1,0,0,0,1|2,0,0]=4 3407 B9R1.1 C=C1C=CC(C=C1)=CO Amb25344008 [0,1,0,0,0,1|1,0,1]=4 3408 B9R1.1 CC1C=CC(CO)C=C1 Amb22364742 [0,1,0,0,0,1|1,0,1]=4 3409 B9R1.1 CC=1C=N\C(\NC1)=N\O Amb24105682 [0,1,0,0,0,1|2,0,0]=4 3410 B9R1.1 CCC=1C=CC(=O)NC1 Amb19889888 [0,1,0,0,0,1|2,0,0]=4 3411 B9R1.1 CCc1cc[n+](F)cc1 Amb19894508 [0,1,0,0,0,1|2,0,0]=4 3412 B9R1.1 CCc1ccc(Br)c[n]1 Amb19957826 [0,1,0,0,0,1|2,0,0]=4 3413 B9R1.1 CCc1ccc(Cl)[n][n]1 Amb22754020 [0,1,0,0,0,1|2,0,0]=4 3414 B9R1.1 CCc1ccc(Cl)[n]c1 Amb19516432 [0,1,0,0,0,1|2,0,0]=4 3415 B9R1.1 CCc1ccc(Cl)[n]c1 Amb21857632 [0,1,0,0,0,1|2,0,0]=4 3416 B9R1.1 CCc1ccc(Cl)cc1 Amb17674113 [0,1,0,0,0,1|2,0,0]=4 3417 B9R1.1 CCc1ccc(F)c[n]1 Amb23402698 [0,1,0,0,0,1|2,0,0]=4 3418 B9R1.1 CCc1ccc(I)[n]c1 Amb24436572 [0,1,0,0,0,1|2,0,0]=4 3419 B9R1.1 CCc1ccc(I)c[n]1 Amb25246776 [0,1,0,0,0,1|2,0,0]=4 3420 B9R1.1 CCc1ccc(cc1)O Amb2227602 [0,1,0,0,0,1|2,0,0]=4 3421 B9R1.1 CCc1ccc(cn1)Cl Amb10600804 [0,1,0,0,0,1|2,0,0]=4 3422 B9R1.1 CCc1ccc(cn1)N Amb10600806 [0,1,0,0,0,1|2,0,0]=4 3423 B9R1.1 CCc1ccc(cn1)O Amb10573735 [0,1,0,0,0,1|2,0,0]=4 3424 B9R1.1 CCc1ccc(nc1)Br Amb10600529 [0,1,0,0,0,1|2,0,0]=4 3425 B9R1.1 CCc1ccc(nc1)N Amb10600531 [0,1,0,0,0,1|2,0,0]=4 3426 B9R1.1 CCc1ccc(nc1)O Amb10600532 [0,1,0,0,0,1|2,0,0]=4 3427 B9R1.1 CCc1ccc(nn1)Br Amb10599692 [0,1,0,0,0,1|2,0,0]=4 3428 B9R1.1 CCc1ccc(nn1)N Amb10599694 [0,1,0,0,0,1|2,0,0]=4 3429 B9R1.1 CCc1cnc(cn1)Br Amb10599458 [0,1,0,0,0,1|2,0,0]=4 3430 B9R1.1 CCc1cnc(cn1)C Amb15691842 [0,1,0,0,0,1|2,0,0]=4 3431 B9R1.1 CCc1cnc(cn1)N Amb13884056 [0,1,0,0,0,1|2,0,0]=4 3432 B9R1.1 CCc1cnc(cn1)O Amb10599460 [0,1,0,0,0,1|2,0,0]=4 3433 B9R1.1 CCc1ncc(cn1)Br Amb13884461 [0,1,0,0,0,1|2,0,0]=4 3434 B9R1.1 CCc1ncc(cn1)O Amb13884796 [0,1,0,0,0,1|2,0,0]=4 3435 B9R1.1 C[n+]1ccc(CN)cc1 Amb24113135 [0,1,0,0,0,1|2,0,0]=4 3436 B9R1.1 Cc1c[n]c(CBr)[n]c1 Amb22500619 [0,1,0,0,0,1|2,0,0]=4 3437 B9R1.1 Cc1c[n]c(CBr)[n]c1 Amb22500863 [0,1,0,0,0,1|2,0,0]=4 3438 B9R1.1 Cc1c[n]c(CBr)c[n]1 Amb18327371 [0,1,0,0,0,1|2,0,0]=4 3439 B9R1.1 Cc1c[n]c(CCl)[n]c1 Amb19958446 [0,1,0,0,0,1|2,0,0]=4 3440 B9R1.1 Cc1c[n]c(CCl)[n]c1 Amb21963303 [0,1,0,0,0,1|2,0,0]=4 3441 B9R1.1 Cc1c[n]c(CCl)c[n]1 Amb19373213 [0,1,0,0,0,1|2,0,0]=4 3442 B9R1.1 Cc1c[n]c(CN)[n]c1 Amb21858992 [0,1,0,0,0,1|2,0,0]=4 3443 B9R1.1 Cc1c[n]c(CN)[n]c1 Amb22500687 [0,1,0,0,0,1|2,0,0]=4 3444 B9R1.1 Cc1c[n]c(CN)[n]c1 Amb22747292 [0,1,0,0,0,1|2,0,0]=4 3445 B9R1.1 Cc1c[n]c(CO)[n]c1 Amb21963539 [0,1,0,0,0,1|1,0,0]=3 3446 B9R1.1 Cc1ccc(CBr)[n]c1 Amb23401204 [0,1,0,0,0,1|2,0,0]=4 3447 B9R1.1 Cc1ccc(CBr)c[n]1 Amb18326669 [0,1,0,0,0,1|2,0,0]=4 3448 B9R1.1 Cc1ccc(CC)[n]c1 Amb21963390 [0,1,0,0,0,1|2,0,0]=4 3449 B9R1.1 Cc1ccc(CC)c[n]1 Amb20242167 [0,1,0,0,0,1|2,0,0]=4 3450 B9R1.1 Cc1ccc(CC)c[n]1 Amb22731102 [0,1,0,0,0,1|2,0,0]=4 3451 B9R1.1 Cc1ccc(CCl)[n][n]1 Amb25325744 [0,1,0,0,0,1|2,0,0]=4 3452 B9R1.1 Cc1ccc(CCl)[n]c1 Amb20668491 [0,1,0,0,0,1|2,0,0]=4 3453 B9R1.1 Cc1ccc(CCl)[n]c1 Amb21856157 [0,1,0,0,0,1|2,0,0]=4 3454 B9R1.1 Cc1ccc(CCl)c[n]1 Amb22235163 [0,1,0,0,0,1|2,0,0]=4 3455 B9R1.1 Cc1ccc(CF)[n]c1 Amb25118456 [0,1,0,0,0,1|2,0,0]=4 3456 B9R1.1 Cc1ccc(CF)cc1 Amb24724496 [0,1,0,0,0,1|2,0,0]=4 3457 B9R1.1 Cc1ccc(CI)cc1 Amb25147165 [0,1,0,0,0,1|2,0,0]=4 3458 B9R1.1 Cc1ccc(CN)[n][n]1 Amb21856420 [0,1,0,0,0,1|2,0,0]=4 3459 B9R1.1 Cc1ccc(CN)[n][n]1 Amb22899636 [0,1,0,0,0,1|2,0,0]=4 3460 B9R1.1 Cc1ccc(CN)[n]c1 Amb22586821 [0,1,0,0,0,1|2,0,0]=4 3461 B9R1.1 Cc1ccc(CN)[n]c1 Amb22727965 [0,1,0,0,0,1|2,0,0]=4 3462 B9R1.1 Cc1ccc(CN)c[n]1 Amb19515888 [0,1,0,0,0,1|2,0,0]=4 3463 B9R1.1 Cc1ccc(CO)[n][n]1 Amb22002148 [0,1,0,0,0,1|1,0,0]=3 3464 B9R1.1 Cc1ccc(CO)[n]c1 Amb20248030 [0,1,0,0,0,1|1,0,0]=3 3465 B9R1.1 Cc1ccc(CO)c[n]1 Amb22495401 [0,1,0,0,0,1|1,0,0]=3 3466 B9R1.1 Cc1ccc(NO)[n]c1 Amb24333398 [0,1,0,0,0,1|2,0,0]=4 3467 B9R1.1 Cc1ccc(cc1)NO Amb21961957 [0,1,0,0,0,1|2,0,0]=4 3468 B9R1.1 ClCc1[n]cc(Br)c[n]1 Amb20241418 [0,1,0,0,0,1|2,0,0]=4 3469 B9R1.1 ClCc1ccc(Br)[n]c1 Amb22500143 [0,1,0,0,0,1|2,0,0]=4 3470 B9R1.1 ClCc1ccc(Br)[n]c1 Amb22500149 [0,1,0,0,0,1|2,0,0]=4 3471 B9R1.1 ClCc1ccc(Br)c[n]1 Amb19373716 [0,1,0,0,0,1|2,0,0]=4 3472 B9R1.1 ClCc1ccc(Br)c[n]1 Amb19515838 [0,1,0,0,0,1|2,0,0]=4 3473 B9R1.1 ClCc1ccc(I)c[n]1 Amb23399976 [0,1,0,0,0,1|2,0,0]=4 3474 B9R1.1 ClCc1ccc(cc1)N Amb17477836 [0,1,0,0,0,1|2,0,0]=4 3475 B9R1.1 ClCc1ccc(cc1)O Amb10603784 [0,1,0,0,0,1|2,0,0]=4 3476 B9R1.1 ClCc1ccc(cn1)Cl Amb13882788 [0,1,0,0,0,1|2,0,0]=4 3477 B9R1.1 ClCc1ccc(nc1)Cl Amb1928595 [0,1,0,0,0,1|2,0,0]=4 3478 B9R1.1 Clc1c[n]c(CBr)[n]c1 Amb22001848 [0,1,0,0,0,1|2,0,0]=4 3479 B9R1.1 Clc1c[n]c(CCl)[n]c1 Amb20671225 [0,1,0,0,0,1|2,0,0]=4 3480 B9R1.1 Clc1c[n]c(CCl)[n]c1 Amb24183454 [0,1,0,0,0,1|2,0,0]=4 3481 B9R1.1 Clc1c[n]c(CCl)c[n]1 Amb22001664 [0,1,0,0,0,1|2,0,0]=4 3482 B9R1.1 Clc1c[n]c(CI)[n]c1 Amb24071100 [0,1,0,0,0,1|2,0,0]=4 3483 B9R1.1 Clc1ccc(CBr)[n][n]1 Amb20618691 [0,1,0,0,0,1|2,0,0]=4 3484 B9R1.1 Clc1ccc(CBr)[n][n]1 Amb22274040 [0,1,0,0,0,1|2,0,0]=4 3485 B9R1.1 Clc1ccc(CBr)[n]c1 Amb22001697 [0,1,0,0,0,1|2,0,0]=4 3486 B9R1.1 Clc1ccc(CBr)[n]c1 Amb22492484 [0,1,0,0,0,1|2,0,0]=4 3487 B9R1.1 Clc1ccc(CBr)c[n]1 Amb22001671 [0,1,0,0,0,1|2,0,0]=4 3488 B9R1.1 Clc1ccc(CCl)[n][n]1 Amb20620670 [0,1,0,0,0,1|2,0,0]=4 3489 B9R1.1 Clc1ccc(CCl)[n][n]1 Amb22274064 [0,1,0,0,0,1|2,0,0]=4 3490 B9R1.1 Clc1ccc(CCl)[n]c1 Amb19895169 [0,1,0,0,0,1|2,0,0]=4 3491 B9R1.1 Clc1ccc(CCl)c[n]1 Amb22500029 [0,1,0,0,0,1|2,0,0]=4 3492 B9R1.1 Clc1ccc(CI)c[n]1 Amb25270483 [0,1,0,0,0,1|2,0,0]=4 3493 B9R1.1 FCc1ccc(Br)cc1 Amb22886704 [0,1,0,0,0,1|2,0,0]=4 3494 B9R1.1 FCc1ccc(Cl)[n]c1 Amb24104280 [0,1,0,0,0,1|2,0,0]=4 3495 B9R1.1 FCc1ccc(Cl)cc1 Amb22490701 [0,1,0,0,0,1|2,0,0]=4 3496 B9R1.1 Fc1c[n]c(CCl)[n]c1 Amb22496140 [0,1,0,0,0,1|2,0,0]=4 3497 B9R1.1 Fc1ccc(CCl)[n]c1 Amb23401203 [0,1,0,0,0,1|2,0,0]=4 3498 B9R1.1 Fc1ccc(CCl)c[n]1 Amb22406083 [0,1,0,0,0,1|2,0,0]=4 3499 B9R1.1 Fc1ccc(CF)cc1 Amb25104249 [0,1,0,0,0,1|2,0,0]=4 3500 B9R1.1 Fc1ccc(CI)cc1 Amb23571307 [0,1,0,0,0,1|2,0,0]=4 3501 B9R1.1 ICc1ccc(cc1)Cl Amb10552723 [0,1,0,0,0,1|2,0,0]=4 3502 B9R1.1 N#CC=1C=CC(=O)OC1 Amb22304830 [0,1,0,0,0,1|1,0,1]=4 3503 B9R1.1 NC1COC(CO)C=C1 Amb25252252 [0,1,0,0,0,1|0,0,2]=4 3504 B9R1.1 NCC1=CNC(=O)C=N1 Amb18251091 [0,1,0,0,0,1|2,0,0]=4 3505 B9R1.1 NCC=1C=CC(=O)NC1 Amb18024213 [0,1,0,0,0,1|2,0,0]=4 3506 B9R1.1 NCC=1C=CC(=O)NC1 Amb19929382 [0,1,0,0,0,1|2,0,0]=4 3507 B9R1.1 NCC=1C=CC(=O)NC1 Amb22490775 [0,1,0,0,0,1|2,0,0]=4 3508 B9R1.1 NCC=1C=CC(=O)NN1 Amb18848291 [0,1,0,0,0,1|2,0,0]=4 3509 B9R1.1 NCC=1C=CC(=S)NC1 Amb18251217 [0,1,0,0,0,1|2,0,0]=4 3510 B9R1.1 NC[13c]1[13cH][13cH][13c]([13cH][13cH]1)F Amb17614393 [0,1,0,0,0,1|2,0,0]=4 3511 B9R1.1 NCc1[n]cc(Br)c[n]1 Amb22001494 [0,1,0,0,0,1|2,0,0]=4 3512 B9R1.1 NCc1[n]cc(Br)c[n]1 Amb22501139 [0,1,0,0,0,1|2,0,0]=4 3513 B9R1.1 NCc1[n]cc(Br)c[n]1 Amb22757320 [0,1,0,0,0,1|2,0,0]=4 3514 B9R1.1 NCc1[n]cc(Cl)c[n]1 Amb18908379 [0,1,0,0,0,1|2,0,0]=4 3515 B9R1.1 NCc1[n]cc(Cl)c[n]1 Amb22587399 [0,1,0,0,0,1|2,0,0]=4 3516 B9R1.1 NCc1[n]cc(F)c[n]1 Amb22752864 [0,1,0,0,0,1|2,0,0]=4 3517 B9R1.1 NCc1[n]cc(F)c[n]1 Amb22899635 [0,1,0,0,0,1|2,0,0]=4 3518 B9R1.1 NCc1[n]cc(F)c[n]1 Amb23440541 [0,1,0,0,0,1|2,0,0]=4 3519 B9R1.1 NCc1c[n]c(Br)c[n]1 Amb18188881 [0,1,0,0,0,1|2,0,0]=4 3520 B9R1.1 NCc1c[n]c(Cl)c[n]1 Amb21927832 [0,1,0,0,0,1|2,0,0]=4 3521 B9R1.1 NCc1c[n]c(Cl)c[n]1 Amb22002620 [0,1,0,0,0,1|2,0,0]=4 3522 B9R1.1 NCc1c[n]c(Cl)c[n]1 Amb23412041 [0,1,0,0,0,1|2,0,0]=4 3523 B9R1.1 NCc1cc[n+]([O-])cc1 Amb25090606 [0,1,0,0,0,1|2,0,0]=4 3524 B9R1.1 NCc1ccc(Br)[n]c1 Amb21857057 [0,1,0,0,0,1|2,0,0]=4 3525 B9R1.1 NCc1ccc(Br)[n]c1 Amb22490838 [0,1,0,0,0,1|2,0,0]=4 3526 B9R1.1 NCc1ccc(Br)c[n]1 Amb22495640 [0,1,0,0,0,1|2,0,0]=4 3527 B9R1.1 NCc1ccc(Br)c[n]1 Amb22495846 [0,1,0,0,0,1|2,0,0]=4 3528 B9R1.1 NCc1ccc(Cl)[n][n]1 Amb18908381 [0,1,0,0,0,1|2,0,0]=4 3529 B9R1.1 NCc1ccc(Cl)[n][n]1 Amb22265394 [0,1,0,0,0,1|2,0,0]=4 3530 B9R1.1 NCc1ccc(Cl)[n]c1 Amb19514819 [0,1,0,0,0,1|2,0,0]=4 3531 B9R1.1 NCc1ccc(Cl)c[n]1 Amb21927707 [0,1,0,0,0,1|2,0,0]=4 3532 B9R1.1 NCc1ccc(Cl)cc1 Amb24066020 [0,1,0,0,0,1|2,0,0]=4 3533 B9R1.1 NCc1ccc(F)[n]c1 Amb20247920 [0,1,0,0,0,1|2,0,0]=4 3534 B9R1.1 NCc1ccc(F)[n]c1 Amb22738776 [0,1,0,0,0,1|2,0,0]=4 3535 B9R1.1 NCc1ccc(F)c[n]1 Amb20669476 [0,1,0,0,0,1|2,0,0]=4 3536 B9R1.1 NCc1ccc(F)c[n]1 Amb22500552 [0,1,0,0,0,1|2,0,0]=4 3537 B9R1.1 NCc1ccc(F)c[n]1 Amb22585859 [0,1,0,0,0,1|2,0,0]=4 3538 B9R1.1 NCc1ccc(I)[n]c1 Amb23446975 [0,1,0,0,0,1|2,0,0]=4 3539 B9R1.1 NCc1ccc(I)c[n]1 Amb25365536 [0,1,0,0,0,1|2,0,0]=4 3540 B9R1.1 NCc1ccc(O)[n]c1 Amb19432844 [0,1,0,0,0,1|2,0,0]=4 3541 B9R1.1 NCc1ccc(O)c[n]1 Amb19895109 [0,1,0,0,0,1|2,0,0]=4 3542 B9R1.1 NCc1ccc(O)c[n]1 Amb25733596 [0,1,0,0,0,1|2,0,0]=4 3543 B9R1.1 NCc1ccc(cc1)Br Amb1113965 [0,1,0,0,0,1|2,0,0]=4 3544 B9R1.1 NCc1ccc(cc1)Cl Amb1672014 [0,1,0,0,0,1|2,0,0]=4 3545 B9R1.1 NCc1ccc(cc1)N Amb19143935 [0,1,0,0,0,1|2,0,0]=4 3546 B9R1.1 NCc1ccc(cc1)O Amb1117538 [0,1,0,0,0,1|2,0,0]=4 3547 B9R1.1 NCc1ccc(cn1)Br Amb13890450 [0,1,0,0,0,1|2,0,0]=4 3548 B9R1.1 NCc1ccc(cn1)C Amb1138473 [0,1,0,0,0,1|2,0,0]=4 3549 B9R1.1 NCc1ccc(cn1)Cl Amb13890636 [0,1,0,0,0,1|2,0,0]=4 3550 B9R1.1 NCc1ccc(cn1)Cl Amb16185837 [0,1,0,0,0,1|2,0,0]=4 3551 B9R1.1 NCc1ccc(nc1)Br Amb13890447 [0,1,0,0,0,1|2,0,0]=4 3552 B9R1.1 Nc1c[n]c(CN)[n]c1 Amb23412491 [0,1,0,0,0,1|2,0,0]=4 3553 B9R1.1 Nc1c[n]c(CN)c[n]1 Amb24606536 [0,1,0,0,0,1|2,0,0]=4 3554 B9R1.1 Nc1c[n]c(CO)[n]c1 Amb23412490 [0,1,0,0,0,1|1,0,0]=3 3555 B9R1.1 Nc1c[n]c(CO)c[n]1 Amb20668964 [0,1,0,0,0,1|1,0,0]=3 3556 B9R1.1 Nc1ccc(CBr)[n]c1 Amb20248321 [0,1,0,0,0,1|2,0,0]=4 3557 B9R1.1 Nc1ccc(CBr)c[n]1 Amb20247808 [0,1,0,0,0,1|2,0,0]=4 3558 B9R1.1 Nc1ccc(CBr)cc1 Amb18649220 [0,1,0,0,0,1|2,0,0]=4 3559 B9R1.1 Nc1ccc(CBr)cc1 Amb24102928 [0,1,0,0,0,1|2,0,0]=4 3560 B9R1.1 Nc1ccc(CCl)[n][n]1 Amb25146048 [0,1,0,0,0,1|2,0,0]=4 3561 B9R1.1 Nc1ccc(CCl)[n]c1 Amb20242740 [0,1,0,0,0,1|2,0,0]=4 3562 B9R1.1 Nc1ccc(CCl)c[n]1 Amb20247806 [0,1,0,0,0,1|2,0,0]=4 3563 B9R1.1 Nc1ccc(CF)c[n]1 Amb24448743 [0,1,0,0,0,1|2,0,0]=4 3564 B9R1.1 Nc1ccc(CF)cc1 Amb25766212 [0,1,0,0,0,1|2,0,0]=4 3565 B9R1.1 Nc1ccc(CN)[n][n]1 Amb25297900 [0,1,0,0,0,1|2,0,0]=4 3566 B9R1.1 Nc1ccc(CN)[n]c1 Amb23401800 [0,1,0,0,0,1|2,0,0]=4 3567 B9R1.1 Nc1ccc(CN)c[n]1 Amb23401797 [0,1,0,0,0,1|2,0,0]=4 3568 B9R1.1 Nc1ccc(CS)c[n]1 Amb24062514 [0,1,0,0,0,1|1,1,0]=4 3569 B9R1.1 O=C1C=CC(=CO1)C=O Amb18124299 [0,1,0,0,0,1|0,0,2]=4 3570 B9R1.1 O=C1C=CC(CBr)=NN1 Amb18848283 [0,1,0,0,0,1|2,0,0]=4 3571 B9R1.1 O=C1C=CC(CCl)=NN1 Amb18848120 [0,1,0,0,0,1|2,0,0]=4 3572 B9R1.1 OC=C1C=CC(=O)C=N1 Amb19316321 [0,1,0,0,0,1|1,0,1]=4 3573 B9R1.1 OCC=1C=CC(=O)NC1 Amb20243253 [0,1,0,0,0,1|1,0,0]=3 3574 B9R1.1 OCC=1C=CC(=O)NN1 Amb18848567 [0,1,0,0,0,1|1,0,0]=3 3575 B9R1.1 OCC=1C=CC(=O)OC1 Amb25835811 [0,1,0,0,0,1|0,0,0]=2 3576 B9R1.1 OCC=1C=NC(=O)NC1 Amb24533261 [0,1,0,0,0,1|2,0,0]=4 3577 B9R1.1 OCN1C=CC(=O)C=C1 Amb25032170 [0,1,0,0,0,1|2,0,0]=4 3578 B9R1.1 OCc1[n]cc(Br)c[n]1 Amb21963588 [0,1,0,0,0,1|1,0,0]=3 3579 B9R1.1 OCc1[n]cc(Cl)c[n]1 Amb22388585 [0,1,0,0,0,1|1,0,0]=3 3580 B9R1.1 OCc1[n]cc(F)c[n]1 Amb22898963 [0,1,0,0,0,1|1,0,0]=3 3581 B9R1.1 OCc1c[n]c(Br)[n]c1 Amb24678339 [0,1,0,0,0,1|2,0,0]=4 3582 B9R1.1 OCc1c[n]c(Br)c[n]1 Amb18190294 [0,1,0,0,0,1|1,0,0]=3 3583 B9R1.1 OCc1c[n]c(Cl)[n]c1 Amb21963487 [0,1,0,0,0,1|2,0,0]=4 3584 B9R1.1 OCc1c[n]c(F)[n]c1 Amb24610830 [0,1,0,0,0,1|2,0,0]=4 3585 B9R1.1 OCc1c[n]c(F)c[n]1 Amb25220632 [0,1,0,0,0,1|1,0,0]=3 3586 B9R1.1 OCc1ccc(Br)c[n]1 Amb20241980 [0,1,0,0,0,1|1,0,0]=3 3587 B9R1.1 OCc1ccc(Br)c[n]1 Amb22500246 [0,1,0,0,0,1|1,0,0]=3 3588 B9R1.1 OCc1ccc(Cl)[n][n]1 Amb21857536 [0,1,0,0,0,1|1,0,0]=3 3589 B9R1.1 OCc1ccc(F)c[n]1 Amb21857091 [0,1,0,0,0,1|1,0,0]=3 3590 B9R1.1 OCc1ccc(I)[n]c1 Amb23446974 [0,1,0,0,0,1|1,0,0]=3 3591 B9R1.1 OCc1ccc(I)c[n]1 Amb23441249 [0,1,0,0,0,1|1,0,0]=3 3592 B9R1.1 OCc1ccc(S)[n]c1 Amb23446718 [0,1,0,0,0,1|1,0,0]=3 3593 B9R1.1 OCc1ccc(cc1)S Amb16192940 [0,1,0,0,0,1|1,0,0]=3 3594 B9R1.1 OCc1ccc(cn1)Cl Amb10975423 [0,1,0,0,0,1|1,0,0]=3 3595 B9R1.1 OCc1cnc(cn1)Cl Amb10067216 [0,1,0,0,0,1|1,0,0]=3 3596 B9R1.1 ON=C1C=CC(=O)C=C1 Amb17608819 [0,1,0,0,0,1|2,0,0]=4 3597 B9R1.1 ONc1ccc(Br)c[n]1 Amb24481950 [0,1,0,0,0,1|2,0,0]=4 3598 B9R1.1 ONc1ccc(Cl)cc1 Amb17939339 [0,1,0,0,0,1|2,0,0]=4 3599 B9R1.1 O\C=C/1\C=CC(=O)C=N1 Amb24647679 [0,1,0,0,0,1|1,0,1]=4 3600 B9R1.1 Oc1c[n]c(CBr)c[n]1 Amb24700186 [0,1,0,0,0,1|2,0,0]=4 3601 B9R1.1 Oc1c[n]c(CCl)c[n]1 Amb24444112 [0,1,0,0,0,1|2,0,0]=4 3602 B9R1.1 Oc1c[n]c(CF)[n]c1 Amb22886934 [0,1,0,0,0,1|2,0,0]=4 3603 B9R1.1 Oc1c[n]c(CO)[n]c1 Amb22886800 [0,1,0,0,0,1|1,0,0]=3 3604 B9R1.1 Oc1ccc(CBr)[n]c1 Amb22751419 [0,1,0,0,0,1|2,0,0]=4 3605 B9R1.1 Oc1ccc(CBr)c[n]1 Amb24400551 [0,1,0,0,0,1|2,0,0]=4 3606 B9R1.1 Oc1ccc(CCl)[n]c1 Amb25295363 [0,1,0,0,0,1|2,0,0]=4 3607 B9R1.1 Oc1ccc(CF)cc1 Amb25318920 [0,1,0,0,0,1|2,0,0]=4 3608 B9R1.1 Oc1ccc(CI)[n]c1 Amb24657574 [0,1,0,0,0,1|2,0,0]=4 3609 B9R1.1 Oc1ccc(CI)cc1 Amb24400412 [0,1,0,0,0,1|2,0,0]=4 3610 B9R1.1 Oc1ccc(CO)[n]c1 Amb18642263 [0,1,0,0,0,1|1,0,0]=3 3611 B9R1.1 Oc1ccc(CS)cc1 Amb25782030 [0,1,0,0,0,1|1,1,0]=4 3612 B9R1.1 S=C1C=CC(CCl)=CN1 Amb23446832 [0,1,0,0,0,1|2,0,0]=4 3613 B9R1.1 SCc1c[n]c(Cl)c[n]1 Amb24718995 [0,1,0,0,0,1|1,1,0]=4 3614 B9R1.1 SCc1ccc(Cl)[n]c1 Amb21984719 [0,1,0,0,0,1|1,1,0]=4 3615 B9R1.1 SCc1ccc(cc1)N Amb17498635 [0,1,0,0,0,1|1,1,0]=4 3616 B9R1.1 Sc1ccc(CBr)cc1 Amb25844972 [0,1,0,0,0,1|2,0,0]=4 3617 B9R1.1 [NH3+]Cc1ccc(Br)cc1 Amb24113883 [0,1,0,0,0,1|2,0,0]=4 3618 B9R1.1 [NH3+]Cc1ccc(O)cc1 Amb17943004 [0,1,0,0,0,1|2,0,0]=4 3619 B9R1.1 [Zn+]Cc1ccc(Br)cc1 Amb22337122 [0,1,0,0,0,1|2,0,0]=4 3620 B9R1.1 [Zn+]Cc1ccc(I)cc1 Amb22367204 [0,1,0,0,0,1|2,0,0]=4 3621 B9R1.2 BrCc1cccc(I)[n]1 Amb25178809 [0,1,0,0,0,1|2,0,0]=4 3622 B9R1.2 BrCc1cccc(c1)Cl Amb1651063 [0,1,0,0,0,1|2,0,0]=4 3623 B9R1.2 BrCc1ccnc(n1)Cl Amb10603713 [0,1,0,0,0,1|2,0,0]=4 3624 B9R1.2 Brc1c[n]cc(CBr)c1 Amb24085867 [0,1,0,0,0,1|2,0,0]=4 3625 B9R1.2 Brc1cc(CBr)[n]c[n]1 Amb25350945 [0,1,0,0,0,1|2,0,0]=4 3626 B9R1.2 Brc1cc(CBr)cc[n]1 Amb20618622 [0,1,0,0,0,1|2,0,0]=4 3627 B9R1.2 Brc1cc(CBr)cc[n]1 Amb22233776 [0,1,0,0,0,1|2,0,0]=4 3628 B9R1.2 Brc1cc(CBr)cc[n]1 Amb22497616 [0,1,0,0,0,1|2,0,0]=4 3629 B9R1.2 Brc1cc(CI)c[n]c1 Amb24085869 [0,1,0,0,0,1|2,0,0]=4 3630 B9R1.2 Brc1cc(CI)ccc1 Amb25756457 [0,1,0,0,0,1|2,0,0]=4 3631 B9R1.2 Brc1cc[n]c(CBr)c1 Amb24082990 [0,1,0,0,0,1|2,0,0]=4 3632 B9R1.2 Brc1cccc(CBr)[n]1 Amb23437267 [0,1,0,0,0,1|2,0,0]=4 3633 B9R1.2 Brc1cccc(CI)[n]1 Amb20248558 [0,1,0,0,0,1|2,0,0]=4 3634 B9R1.2 C=C1CC(CO)=CCC1 Amb25381301 [0,1,0,0,0,1|1,0,1]=4 3635 B9R1.2 CCC1=CC(=O)NC=N1 Amb22058903 [0,1,0,0,0,1|2,0,0]=4 3636 B9R1.2 CCC=1CC=CN(C)C1 Amb24102067 [0,1,0,0,0,1|2,0,0]=4 3637 B9R1.2 CCC=1NC(=O)C=CN1 Amb22829910 [0,1,0,0,0,1|2,0,0]=4 3638 B9R1.2 CCc1c[n+]([O-])ccc1 Amb21963682 [0,1,0,0,0,1|2,0,0]=4 3639 B9R1.2 CCc1c[n]cc(Cl)c1 Amb24644636 [0,1,0,0,0,1|2,0,0]=4 3640 B9R1.2 CCc1c[n]cc(N)c1 Amb18832981 [0,1,0,0,0,1|2,0,0]=4 3641 B9R1.2 CCc1c[n]cc(O)c1 Amb20617462 [0,1,0,0,0,1|2,0,0]=4 3642 B9R1.2 CCc1cc(Br)ccn1 Amb10599855 [0,1,0,0,0,1|2,0,0]=4 3643 B9R1.2 CCc1cc(Br)cnc1 Amb16230979 [0,1,0,0,0,1|2,0,0]=4 3644 B9R1.2 CCc1cc(Br)ncn1 Amb10600009 [0,1,0,0,0,1|2,0,0]=4 3645 B9R1.2 CCc1cc(Cl)ccn1 Amb10599875 [0,1,0,0,0,1|2,0,0]=4 3646 B9R1.2 CCc1cc(F)cc[n]1 Amb24319236 [0,1,0,0,0,1|2,0,0]=4 3647 B9R1.2 CCc1cc(I)[n]c[n]1 Amb25720063 [0,1,0,0,0,1|2,0,0]=4 3648 B9R1.2 CCc1cc(N)ccn1 Amb10599877 [0,1,0,0,0,1|2,0,0]=4 3649 B9R1.2 CCc1cc(N)ncn1 Amb10600010 [0,1,0,0,0,1|2,0,0]=4 3650 B9R1.2 CCc1cc(O)ccn1 Amb10599878 [0,1,0,0,0,1|2,0,0]=4 3651 B9R1.2 CCc1cc(S)[n]c[n]1 Amb25291321 [0,1,0,0,0,1|2,0,0]=4 3652 B9R1.2 CCc1cc(S)cc[n]1 Amb24334345 [0,1,0,0,0,1|2,0,0]=4 3653 B9R1.2 CCc1cc[n]c(F)c1 Amb24091530 [0,1,0,0,0,1|2,0,0]=4 3654 B9R1.2 CCc1cc[n]c(N)[n]1 Amb21960001 [0,1,0,0,0,1|2,0,0]=4 3655 B9R1.2 CCc1cc[n]c(N)c1 Amb22494639 [0,1,0,0,0,1|2,0,0]=4 3656 B9R1.2 CCc1cc[n]c(O)[n]1 Amb21960000 [0,1,0,0,0,1|2,0,0]=4 3657 B9R1.2 CCc1cc[n]c(S)[n]1 Amb24648960 [0,1,0,0,0,1|2,0,0]=4 3658 B9R1.2 CCc1cccc(Cl)[n]1 Amb24104166 [0,1,0,0,0,1|2,0,0]=4 3659 B9R1.2 CCc1cccc(Cl)c1 Amb20620699 [0,1,0,0,0,1|2,0,0]=4 3660 B9R1.2 CCc1cccc(F)[n]1 Amb24319184 [0,1,0,0,0,1|2,0,0]=4 3661 B9R1.2 CCc1cccc(F)c1 Amb22235099 [0,1,0,0,0,1|2,0,0]=4 3662 B9R1.2 CCc1cccc(I)[n]1 Amb24656501 [0,1,0,0,0,1|2,0,0]=4 3663 B9R1.2 CCc1cccc(n1)Br Amb10599852 [0,1,0,0,0,1|2,0,0]=4 3664 B9R1.2 CCc1cccc(n1)O Amb10599854 [0,1,0,0,0,1|2,0,0]=4 3665 B9R1.2 CCc1ccnc(c1)Cl Amb17610909 [0,1,0,0,0,1|2,0,0]=4 3666 B9R1.2 CCc1ccnc(c1)O Amb10600168 [0,1,0,0,0,1|2,0,0]=4 3667 B9R1.2 CCc1ccnc(n1)Br Amb13884145 [0,1,0,0,0,1|2,0,0]=4 3668 B9R1.2 CCc1ccnc(n1)Cl Amb13884430 [0,1,0,0,0,1|2,0,0]=4 3669 B9R1.2 CCc1ccnc(n1)N Amb13884389 [0,1,0,0,0,1|2,0,0]=4 3670 B9R1.2 CCc1ccnc(n1)O Amb13884390 [0,1,0,0,0,1|2,0,0]=4 3671 B9R1.2 CCc1cncc(c1)C Amb10573710 [0,1,0,0,0,1|2,0,0]=4 3672 B9R1.2 CCc1cncc(n1)Br Amb10600309 [0,1,0,0,0,1|2,0,0]=4 3673 B9R1.2 CCc1cncc(n1)N Amb10600311 [0,1,0,0,0,1|2,0,0]=4 3674 B9R1.2 CCc1cncc(n1)O Amb10600312 [0,1,0,0,0,1|2,0,0]=4 3675 B9R1.2 CCc1nc(Br)ccn1 Amb10599359 [0,1,0,0,0,1|2,0,0]=4 3676 B9R1.2 CCc1nc(N)ccn1 Amb10599361 [0,1,0,0,0,1|2,0,0]=4 3677 B9R1.2 CCc1nc(O)ccn1 Amb10599362 [0,1,0,0,0,1|2,0,0]=4 3678 B9R1.2 Cc1[n]c(CC)cc[n]1 Amb24091539 [0,1,0,0,0,1|2,0,0]=4 3679 B9R1.2 Cc1[n]c(CCl)cc[n]1 Amb19516065 [0,1,0,0,0,1|2,0,0]=4 3680 B9R1.2 Cc1[n]c(CO)cc[n]1 Amb19516975 [0,1,0,0,0,1|1,0,0]=3 3681 B9R1.2 Cc1[n]c(CS)cc[n]1 Amb25858020 [0,1,0,0,0,1|1,1,0]=4 3682 B9R1.2 Cc1c[n]cc(CC)[n]1 Amb22353573 [0,1,0,0,0,1|2,0,0]=4 3683 B9R1.2 Cc1c[n]cc(CCl)[n]1 Amb22002196 [0,1,0,0,0,1|2,0,0]=4 3684 B9R1.2 Cc1c[n]cc(CCl)[n]1 Amb22491419 [0,1,0,0,0,1|2,0,0]=4 3685 B9R1.2 Cc1c[n]cc(CN)[n]1 Amb18832951 [0,1,0,0,0,1|2,0,0]=4 3686 B9R1.2 Cc1c[n]cc(CO)[n]1 Amb22235691 [0,1,0,0,0,1|1,0,0]=3 3687 B9R1.2 Cc1cc(CBr)[n]cc1 Amb22298607 [0,1,0,0,0,1|2,0,0]=4 3688 B9R1.2 Cc1cc(CBr)[n]cc1 Amb22498570 [0,1,0,0,0,1|2,0,0]=4 3689 B9R1.2 Cc1cc(CBr)c[n]c1 Amb22498080 [0,1,0,0,0,1|2,0,0]=4 3690 B9R1.2 Cc1cc(CBr)cc[n]1 Amb20671017 [0,1,0,0,0,1|2,0,0]=4 3691 B9R1.2 Cc1cc(CBr)cc[n]1 Amb22386862 [0,1,0,0,0,1|2,0,0]=4 3692 B9R1.2 Cc1cc(CBr)cnc1 Amb15694776 [0,1,0,0,0,1|2,0,0]=4 3693 B9R1.2 Cc1cc(CC)[n]c[n]1 Amb24091527 [0,1,0,0,0,1|2,0,0]=4 3694 B9R1.2 Cc1cc(CC)cc[n]1 Amb22732125 [0,1,0,0,0,1|2,0,0]=4 3695 B9R1.2 Cc1cc(CCl)[n]c[n]1 Amb23437194 [0,1,0,0,0,1|2,0,0]=4 3696 B9R1.2 Cc1cc(CCl)[n]cc1 Amb19958924 [0,1,0,0,0,1|2,0,0]=4 3697 B9R1.2 Cc1cc(CCl)cc[n]1 Amb22304816 [0,1,0,0,0,1|2,0,0]=4 3698 B9R1.2 Cc1cc(CCl)cc[n]1 Amb22587514 [0,1,0,0,0,1|2,0,0]=4 3699 B9R1.2 Cc1cc(CCl)cnc1 Amb10068351 [0,1,0,0,0,1|2,0,0]=4 3700 B9R1.2 Cc1cc(CCl)cnc1 Amb16234123 [0,1,0,0,0,1|2,0,0]=4 3701 B9R1.2 Cc1cc(CF)ccc1 Amb22232791 [0,1,0,0,0,1|2,0,0]=4 3702 B9R1.2 Cc1cc(CI)ccc1 Amb23590687 [0,1,0,0,0,1|2,0,0]=4 3703 B9R1.2 Cc1cc(CN)[n][n]c1 Amb24183559 [0,1,0,0,0,1|2,0,0]=4 3704 B9R1.2 Cc1cc(CN)[n][n]c1 Amb24684021 [0,1,0,0,0,1|2,0,0]=4 3705 B9R1.2 Cc1cc(CN)[n]cc1 Amb22587020 [0,1,0,0,0,1|2,0,0]=4 3706 B9R1.2 Cc1cc(CN)c[n]c1 Amb20247922 [0,1,0,0,0,1|2,0,0]=4 3707 B9R1.2 Cc1cc(CN)c[n]c1 Amb22747284 [0,1,0,0,0,1|2,0,0]=4 3708 B9R1.2 Cc1cc(CN)c[n]c1 Amb22886409 [0,1,0,0,0,1|2,0,0]=4 3709 B9R1.2 Cc1cc(CN)cc[n]1 Amb22235873 [0,1,0,0,0,1|2,0,0]=4 3710 B9R1.2 Cc1cc(CN)ncc1 Amb16185808 [0,1,0,0,0,1|2,0,0]=4 3711 B9R1.2 Cc1cc(CN)ncn1 Amb17072861 [0,1,0,0,0,1|2,0,0]=4 3712 B9R1.2 Cc1cc(CO)[n][n]c1 Amb24183285 [0,1,0,0,0,1|1,0,0]=3 3713 B9R1.2 Cc1cc(CO)[n]c[n]1 Amb22059114 [0,1,0,0,0,1|1,0,0]=3 3714 B9R1.2 Cc1cc(CO)[n]cc1 Amb22495046 [0,1,0,0,0,1|1,0,0]=3 3715 B9R1.2 Cc1cc(CO)cnc1 Amb16231977 [0,1,0,0,0,1|1,0,0]=3 3716 B9R1.2 Cc1cc(NO)[n][n]c1 Amb25345180 [0,1,0,0,0,1|2,0,0]=4 3717 B9R1.2 Cc1cc(NO)[n]cc1 Amb25687290 [0,1,0,0,0,1|2,0,0]=4 3718 B9R1.2 Cc1cc(cc[n]1)NO Amb25763920 [0,1,0,0,0,1|2,0,0]=4 3719 B9R1.2 Cc1cc[n]c(CBr)[n]1 Amb24524220 [0,1,0,0,0,1|2,0,0]=4 3720 B9R1.2 Cc1cc[n]c(CC)[n]1 Amb24104316 [0,1,0,0,0,1|2,0,0]=4 3721 B9R1.2 Cc1cc[n]c(CC)c1 Amb24096954 [0,1,0,0,0,1|2,0,0]=4 3722 B9R1.2 Cc1cc[n]c(CCl)[n]1 Amb21856106 [0,1,0,0,0,1|2,0,0]=4 3723 B9R1.2 Cc1cc[n]c(CN)[n]1 Amb22587683 [0,1,0,0,0,1|2,0,0]=4 3724 B9R1.2 Cc1cc[n]c(CN)[n]1 Amb22886407 [0,1,0,0,0,1|2,0,0]=4 3725 B9R1.2 Cc1cc[n]c(CO)[n]1 Amb22276544 [0,1,0,0,0,1|1,0,0]=3 3726 B9R1.2 Cc1cccc(CBr)[n]1 Amb21857068 [0,1,0,0,0,1|2,0,0]=4 3727 B9R1.2 Cc1cccc(CI)[n]1 Amb24703691 [0,1,0,0,0,1|2,0,0]=4 3728 B9R1.2 Cc1cccc(CN)[n]1 Amb20669074 [0,1,0,0,0,1|2,0,0]=4 3729 B9R1.2 Cc1cccc(CN)[n]1 Amb21857709 [0,1,0,0,0,1|2,0,0]=4 3730 B9R1.2 Cc1cccc(CO)[n]1 Amb24063802 [0,1,0,0,0,1|1,0,0]=3 3731 B9R1.2 Cc1cccc(CS)[n]1 Amb25140122 [0,1,0,0,0,1|1,1,0]=4 3732 B9R1.2 Cc1cccc(NO)[n]1 Amb25136389 [0,1,0,0,0,1|2,0,0]=4 3733 B9R1.2 ClCc1c[n]cc(Br)[n]1 Amb24728307 [0,1,0,0,0,1|2,0,0]=4 3734 B9R1.2 ClCc1cc(Br)cc[n]1 Amb22490723 [0,1,0,0,0,1|2,0,0]=4 3735 B9R1.2 ClCc1cc(Br)cc[n]1 Amb22490744 [0,1,0,0,0,1|2,0,0]=4 3736 B9R1.2 ClCc1cc[n]c(Br)c1 Amb22495176 [0,1,0,0,0,1|2,0,0]=4 3737 B9R1.2 ClCc1cc[n]c(Br)c1 Amb22497641 [0,1,0,0,0,1|2,0,0]=4 3738 B9R1.2 ClCc1cccc(Br)[n]1 Amb20247745 [0,1,0,0,0,1|2,0,0]=4 3739 B9R1.2 ClCc1cccc(Br)[n]1 Amb23437266 [0,1,0,0,0,1|2,0,0]=4 3740 B9R1.2 ClCc1cccc(I)c1 Amb21964340 [0,1,0,0,0,1|2,0,0]=4 3741 B9R1.2 ClCc1cccc(c1)N Amb17477837 [0,1,0,0,0,1|2,0,0]=4 3742 B9R1.2 ClCc1cccc(n1)C Amb16234122 [0,1,0,0,0,1|2,0,0]=4 3743 B9R1.2 ClCc1ccnc(c1)N Amb16233763 [0,1,0,0,0,1|2,0,0]=4 3744 B9R1.2 Clc1[n]c(CBr)cc[n]1 Amb22899490 [0,1,0,0,0,1|2,0,0]=4 3745 B9R1.2 Clc1[n]c(CCl)cc[n]1 Amb19516431 [0,1,0,0,0,1|2,0,0]=4 3746 B9R1.2 Clc1c[n]cc(CCl)[n]1 Amb25102489 [0,1,0,0,0,1|2,0,0]=4 3747 B9R1.2 Clc1c[n]cc(CCl)c1 Amb19895015 [0,1,0,0,0,1|2,0,0]=4 3748 B9R1.2 Clc1c[n]cc(CCl)c1 Amb22295968 [0,1,0,0,0,1|2,0,0]=4 3749 B9R1.2 Clc1cc(CBr)c[n]c1 Amb24085331 [0,1,0,0,0,1|2,0,0]=4 3750 B9R1.2 Clc1cc(CBr)cc[n]1 Amb20620505 [0,1,0,0,0,1|2,0,0]=4 3751 B9R1.2 Clc1cc(CBr)cc[n]1 Amb22757508 [0,1,0,0,0,1|2,0,0]=4 3752 B9R1.2 Clc1cc(CCl)[n]c[n]1 Amb22295978 [0,1,0,0,0,1|2,0,0]=4 3753 B9R1.2 Clc1cc(CCl)cc[n]1 Amb19375413 [0,1,0,0,0,1|2,0,0]=4 3754 B9R1.2 Clc1cc(CI)ccc1 Amb23571284 [0,1,0,0,0,1|2,0,0]=4 3755 B9R1.2 Clc1cc[n]c(CCl)[n]1 Amb20620671 [0,1,0,0,0,1|2,0,0]=4 3756 B9R1.2 Clc1cc[n]c(CCl)c1 Amb21864843 [0,1,0,0,0,1|2,0,0]=4 3757 B9R1.2 Clc1cccc(CBr)[n]1 Amb24101199 [0,1,0,0,0,1|2,0,0]=4 3758 B9R1.2 FCc1[n]c(Cl)cc[n]1 Amb24407262 [0,1,0,0,0,1|2,0,0]=4 3759 B9R1.2 FCc1cccc(Cl)c1 Amb24092695 [0,1,0,0,0,1|2,0,0]=4 3760 B9R1.2 Fc1cc(CBr)[n]cc1 Amb24726125 [0,1,0,0,0,1|2,0,0]=4 3761 B9R1.2 Fc1cc(CBr)c[n]c1 Amb24085333 [0,1,0,0,0,1|2,0,0]=4 3762 B9R1.2 Fc1cc(CBr)cc[n]1 Amb20248119 [0,1,0,0,0,1|2,0,0]=4 3763 B9R1.2 Fc1cc(CCl)[n]cc1 Amb25060143 [0,1,0,0,0,1|2,0,0]=4 3764 B9R1.2 Fc1cc(CCl)c[n]c1 Amb19894486 [0,1,0,0,0,1|2,0,0]=4 3765 B9R1.2 Fc1cc(CCl)cc[n]1 Amb24102944 [0,1,0,0,0,1|2,0,0]=4 3766 B9R1.2 Fc1cc(CI)cc[n]1 Amb24084187 [0,1,0,0,0,1|2,0,0]=4 3767 B9R1.2 Fc1cc(CI)ccc1 Amb23590695 [0,1,0,0,0,1|2,0,0]=4 3768 B9R1.2 Fc1cccc(CBr)[n]1 Amb21964613 [0,1,0,0,0,1|2,0,0]=4 3769 B9R1.2 Fc1cccc(CBr)[n]1 Amb22494875 [0,1,0,0,0,1|2,0,0]=4 3770 B9R1.2 Fc1cccc(CCl)[n]1 Amb22494876 [0,1,0,0,0,1|2,0,0]=4 3771 B9R1.2 Fc1cccc(CF)c1 Amb22232792 [0,1,0,0,0,1|2,0,0]=4 3772 B9R1.2 NC=1C=CN\C(\N1)=N\O Amb24637013 [0,1,0,0,0,1|2,0,0]=4 3773 B9R1.2 NCC1=CC(=O)N=CN1 Amb21960707 [0,1,0,0,0,1|2,0,0]=4 3774 B9R1.2 NCC1=CC(=O)NC=N1 Amb18203323 [0,1,0,0,0,1|2,0,0]=4 3775 B9R1.2 NCC1=CC=CC(=O)N1 Amb18642192 [0,1,0,0,0,1|2,0,0]=4 3776 B9R1.2 NCC1=CC=CC(=O)N1 Amb22490648 [0,1,0,0,0,1|2,0,0]=4 3777 B9R1.2 NCC1=CN=CC(=O)N1 Amb18832818 [0,1,0,0,0,1|2,0,0]=4 3778 B9R1.2 NCC=1C=CNC(=O)C1 Amb21963528 [0,1,0,0,0,1|2,0,0]=4 3779 B9R1.2 NCC=1C=CNC(=O)C1 Amb21963542 [0,1,0,0,0,1|2,0,0]=4 3780 B9R1.2 NCc1[n]c(Cl)cc[n]1 Amb22396325 [0,1,0,0,0,1|2,0,0]=4 3781 B9R1.2 NCc1[n]c(Cl)cc[n]1 Amb22899229 [0,1,0,0,0,1|2,0,0]=4 3782 B9R1.2 NCc1[n]c(O)cc[n]1 Amb18222083 [0,1,0,0,0,1|2,0,0]=4 3783 B9R1.2 NCc1c[n](=O)ccc1 Amb20620295 [0,1,0,0,0,1|2,0,0]=4 3784 B9R1.2 NCc1c[n]cc(Br)c1 Amb22497484 [0,1,0,0,0,1|2,0,0]=4 3785 B9R1.2 NCc1c[n]cc(Cl)[n]1 Amb21964434 [0,1,0,0,0,1|2,0,0]=4 3786 B9R1.2 NCc1c[n]cc(Cl)[n]1 Amb22235862 [0,1,0,0,0,1|2,0,0]=4 3787 B9R1.2 NCc1c[n]cc(Cl)c1 Amb20247915 [0,1,0,0,0,1|2,0,0]=4 3788 B9R1.2 NCc1c[n]cc(Cl)c1 Amb22737042 [0,1,0,0,0,1|2,0,0]=4 3789 B9R1.2 NCc1c[n]cc(Cl)c1 Amb22899434 [0,1,0,0,0,1|2,0,0]=4 3790 B9R1.2 NCc1c[n]cc(F)c1 Amb22755436 [0,1,0,0,0,1|2,0,0]=4 3791 B9R1.2 NCc1c[n]cc(I)c1 Amb24329335 [0,1,0,0,0,1|2,0,0]=4 3792 B9R1.2 NCc1c[n]cc(O)c1 Amb22899436 [0,1,0,0,0,1|2,0,0]=4 3793 B9R1.2 NCc1cc(Br)cc[n]1 Amb18251919 [0,1,0,0,0,1|2,0,0]=4 3794 B9R1.2 NCc1cc(Br)cc[n]1 Amb21858993 [0,1,0,0,0,1|2,0,0]=4 3795 B9R1.2 NCc1cc(Br)cc[n]1 Amb24117549 [0,1,0,0,0,1|2,0,0]=4 3796 B9R1.2 NCc1cc(Cl)[n]c[n]1 Amb21960785 [0,1,0,0,0,1|2,0,0]=4 3797 B9R1.2 NCc1cc(Cl)cc[n]1 Amb19515814 [0,1,0,0,0,1|2,0,0]=4 3798 B9R1.2 NCc1cc(Cl)cc[n]1 Amb22899206 [0,1,0,0,0,1|2,0,0]=4 3799 B9R1.2 NCc1cc(Cl)ccn1 Amb16233762 [0,1,0,0,0,1|2,0,0]=4 3800 B9R1.2 NCc1cc(F)cc[n]1 Amb22304300 [0,1,0,0,0,1|2,0,0]=4 3801 B9R1.2 NCc1cc(F)cc[n]1 Amb22388476 [0,1,0,0,0,1|2,0,0]=4 3802 B9R1.2 NCc1cc(F)ccn1 Amb13890627 [0,1,0,0,0,1|2,0,0]=4 3803 B9R1.2 NCc1cc(F)cnc1 Amb13890643 [0,1,0,0,0,1|2,0,0]=4 3804 B9R1.2 NCc1cc(I)cc[n]1 Amb25689125 [0,1,0,0,0,1|2,0,0]=4 3805 B9R1.2 NCc1cc(O)cc[n]1 Amb23399915 [0,1,0,0,0,1|2,0,0]=4 3806 B9R1.2 NCc1cc(O)ncn1 Amb10608377 [0,1,0,0,0,1|2,0,0]=4 3807 B9R1.2 NCc1cc(S)cc[n]1 Amb18251215 [0,1,0,0,0,1|2,0,0]=4 3808 B9R1.2 NCc1cc[n]c(Br)[n]1 Amb25268367 [0,1,0,0,0,1|2,0,0]=4 3809 B9R1.2 NCc1cc[n]c(Br)c1 Amb22265353 [0,1,0,0,0,1|2,0,0]=4 3810 B9R1.2 NCc1cc[n]c(Cl)[n]1 Amb22011784 [0,1,0,0,0,1|2,0,0]=4 3811 B9R1.2 NCc1cc[n]c(Cl)[n]1 Amb24087436 [0,1,0,0,0,1|2,0,0]=4 3812 B9R1.2 NCc1cc[n]c(Cl)c1 Amb19959306 [0,1,0,0,0,1|2,0,0]=4 3813 B9R1.2 NCc1cc[n]c(F)c1 Amb20247883 [0,1,0,0,0,1|2,0,0]=4 3814 B9R1.2 NCc1cc[n]c(O)[n]1 Amb18832833 [0,1,0,0,0,1|2,0,0]=4 3815 B9R1.2 NCc1cc[n]c(O)c1 Amb20247895 [0,1,0,0,0,1|2,0,0]=4 3816 B9R1.2 NCc1cc[n]c(S)[n]1 Amb18202713 [0,1,0,0,0,1|2,0,0]=4 3817 B9R1.2 NCc1cccc(Br)[n]1 Amb22899554 [0,1,0,0,0,1|2,0,0]=4 3818 B9R1.2 NCc1cccc(Cl)[n]1 Amb20621543 [0,1,0,0,0,1|2,0,0]=4 3819 B9R1.2 NCc1cccc(Cl)[n]1 Amb21964888 [0,1,0,0,0,1|2,0,0]=4 3820 B9R1.2 NCc1cccc(Cl)[n]1 Amb23437268 [0,1,0,0,0,1|2,0,0]=4 3821 B9R1.2 NCc1cccc(F)[n]1 Amb22491793 [0,1,0,0,0,1|2,0,0]=4 3822 B9R1.2 NCc1cccc(O)[n]1 Amb19895192 [0,1,0,0,0,1|2,0,0]=4 3823 B9R1.2 NCc1cccc(O)[n]1 Amb22059467 [0,1,0,0,0,1|2,0,0]=4 3824 B9R1.2 NCc1cccc(S)c1 Amb25825627 [0,1,0,0,0,1|2,0,0]=4 3825 B9R1.2 NCc1cccc(c1)Br Amb1114593 [0,1,0,0,0,1|2,0,0]=4 3826 B9R1.2 NCc1cccc(c1)C Amb1116222 [0,1,0,0,0,1|2,0,0]=4 3827 B9R1.2 NCc1cccc(c1)F Amb1119747 [0,1,0,0,0,1|2,0,0]=4 3828 B9R1.2 NCc1cccc(c1)O Amb10609577 [0,1,0,0,0,1|2,0,0]=4 3829 B9R1.2 NCc1cccc(c1)O Amb1133156 [0,1,0,0,0,1|2,0,0]=4 3830 B9R1.2 NCc1cccc(n1)Br Amb10603185 [0,1,0,0,0,1|2,0,0]=4 3831 B9R1.2 NCc1cccc(n1)F Amb13890637 [0,1,0,0,0,1|2,0,0]=4 3832 B9R1.2 NCc1cccc(n1)F Amb16186029 [0,1,0,0,0,1|2,0,0]=4 3833 B9R1.2 NCc1cccc(n1)N Amb13951384 [0,1,0,0,0,1|2,0,0]=4 3834 B9R1.2 NCc1cccn(=O)c1 Amb17771581 [0,1,0,0,0,1|2,0,0]=4 3835 B9R1.2 NCc1ccnc(c1)C Amb10573552 [0,1,0,0,0,1|2,0,0]=4 3836 B9R1.2 NCc1ccnc(c1)Cl Amb10608317 [0,1,0,0,0,1|2,0,0]=4 3837 B9R1.2 NCc1ccnc(c1)F Amb13890639 [0,1,0,0,0,1|2,0,0]=4 3838 B9R1.2 NCc1ccnc(c1)F Amb16186028 [0,1,0,0,0,1|2,0,0]=4 3839 B9R1.2 NCc1ccnc(c1)O Amb13952113 [0,1,0,0,0,1|2,0,0]=4 3840 B9R1.2 NCc1ccnc(n1)N Amb2371874 [0,1,0,0,0,1|2,0,0]=4 3841 B9R1.2 NCc1nccc(c1)F Amb16186031 [0,1,0,0,0,1|2,0,0]=4 3842 B9R1.2 NCc1ncnc(c1)O Amb17622204 [0,1,0,0,0,1|2,0,0]=4 3843 B9R1.2 Nc1[n]c(CF)cc[n]1 Amb25840416 [0,1,0,0,0,1|2,0,0]=4 3844 B9R1.2 Nc1[n]c(CN)cc[n]1 Amb19372589 [0,1,0,0,0,1|2,0,0]=4 3845 B9R1.2 Nc1[n]c(CO)cc[n]1 Amb20248683 [0,1,0,0,0,1|1,0,0]=3 3846 B9R1.2 Nc1c[n]cc(CN)c1 Amb23401799 [0,1,0,0,0,1|2,0,0]=4 3847 B9R1.2 Nc1cc(CBr)[n]cc1 Amb20247769 [0,1,0,0,0,1|2,0,0]=4 3848 B9R1.2 Nc1cc(CBr)c[n]c1 Amb20247636 [0,1,0,0,0,1|2,0,0]=4 3849 B9R1.2 Nc1cc(CBr)ccc1 Amb22235890 [0,1,0,0,0,1|2,0,0]=4 3850 B9R1.2 Nc1cc(CBr)ccc1 Amb22728096 [0,1,0,0,0,1|2,0,0]=4 3851 B9R1.2 Nc1cc(CCl)[n]c[n]1 Amb24696784 [0,1,0,0,0,1|2,0,0]=4 3852 B9R1.2 Nc1cc(CCl)c[n]c1 Amb24425769 [0,1,0,0,0,1|2,0,0]=4 3853 B9R1.2 Nc1cc(CCl)ccn1 Amb17739840 [0,1,0,0,0,1|2,0,0]=4 3854 B9R1.2 Nc1cc(CF)[n]c[n]1 Amb24538560 [0,1,0,0,0,1|2,0,0]=4 3855 B9R1.2 Nc1cc(CF)[n]cc1 Amb25092860 [0,1,0,0,0,1|2,0,0]=4 3856 B9R1.2 Nc1cc(CF)c[n]c1 Amb24719831 [0,1,0,0,0,1|2,0,0]=4 3857 B9R1.2 Nc1cc(CF)ccc1 Amb23556448 [0,1,0,0,0,1|2,0,0]=4 3858 B9R1.2 Nc1cc(CI)cc[n]1 Amb20247701 [0,1,0,0,0,1|2,0,0]=4 3859 B9R1.2 Nc1cc(CN)[n]c[n]1 Amb21960760 [0,1,0,0,0,1|2,0,0]=4 3860 B9R1.2 Nc1cc(CN)[n]c[n]1 Amb24183939 [0,1,0,0,0,1|2,0,0]=4 3861 B9R1.2 Nc1cc(CN)cc[n]1 Amb22490576 [0,1,0,0,0,1|2,0,0]=4 3862 B9R1.2 Nc1cc(CO)[n]c[n]1 Amb22728448 [0,1,0,0,0,1|1,0,0]=3 3863 B9R1.2 Nc1cc(CO)[n]c[n]1 Amb22755340 [0,1,0,0,0,1|1,0,0]=3 3864 B9R1.2 Nc1cc(CO)[n]cc1 Amb20247768 [0,1,0,0,0,1|1,0,0]=3 3865 B9R1.2 Nc1cc(CO)[n]cc1 Amb22899638 [0,1,0,0,0,1|1,0,0]=3 3866 B9R1.2 Nc1cc(CO)c[n]c1 Amb24102573 [0,1,0,0,0,1|1,0,0]=3 3867 B9R1.2 Nc1cc(CS)cc[n]1 Amb24099586 [0,1,0,0,0,1|1,1,0]=4 3868 B9R1.2 Nc1cc(ccc1)SO Amb25732860 [0,1,0,0,0,1|2,0,0]=4 3869 B9R1.2 Nc1cc[n]c(CF)[n]1 Amb24101300 [0,1,0,0,0,1|2,0,0]=4 3870 B9R1.2 Nc1cc[n]c(CN)[n]1 Amb18832891 [0,1,0,0,0,1|2,0,0]=4 3871 B9R1.2 Nc1cc[n]c(CN)c1 Amb18280762 [0,1,0,0,0,1|2,0,0]=4 3872 B9R1.2 Nc1cc[n]c(CN)c1 Amb24117548 [0,1,0,0,0,1|2,0,0]=4 3873 B9R1.2 Nc1cccc(CBr)[n]1 Amb25336459 [0,1,0,0,0,1|2,0,0]=4 3874 B9R1.2 Nc1cccc(CCl)[n]1 Amb24478618 [0,1,0,0,0,1|2,0,0]=4 3875 B9R1.2 Nc1cccc(CN)[n]1 Amb23401798 [0,1,0,0,0,1|2,0,0]=4 3876 B9R1.2 Nc1cccc(CO)[n]1 Amb21857102 [0,1,0,0,0,1|1,0,0]=3 3877 B9R1.2 Nc1ccnc(n1)CCl Amb16233767 [0,1,0,0,0,1|2,0,0]=4 3878 B9R1.2 O=C1C=C(CBr)C=CN1 Amb25130534 [0,1,0,0,0,1|2,0,0]=4 3879 B9R1.2 O=C1C=C(CBr)NC=C1 Amb24369351 [0,1,0,0,0,1|2,0,0]=4 3880 B9R1.2 O=C1C=C(CCl)C=CO1 Amb25713812 [0,1,0,0,0,1|2,0,0]=4 3881 B9R1.2 O=C1C=C(CF)N=CN1 Amb24628286 [0,1,0,0,0,1|2,0,0]=4 3882 B9R1.2 O=C1C=CC=C(CCl)N1 Amb25692765 [0,1,0,0,0,1|2,0,0]=4 3883 B9R1.2 O=C1C=CCC(CCl)O1 Amb24432531 [0,1,0,0,0,1|1,0,1]=4 3884 B9R1.2 O=C1C=CC[C@@H](CCl)O1 Amb22226720 [0,1,0,0,0,1|1,0,1]=4 3885 B9R1.2 O=C1C=CN=C(CCl)N1 Amb20242252 [0,1,0,0,0,1|2,0,0]=4 3886 B9R1.2 O=C1C=COC(=C1)C=O Amb24636661 [0,1,0,0,0,1|0,0,2]=4 3887 B9R1.2 O=C1CCC=C(CCl)O1 Amb25032240 [0,1,0,0,0,1|1,0,1]=4 3888 B9R1.2 OCC1=CC=CC(=S)N1 Amb25178558 [0,1,0,0,0,1|1,0,0]=3 3889 B9R1.2 OCC1C=CCC(=O)O1 Amb25802959 [0,1,0,0,0,1|0,0,1]=3 3890 B9R1.2 OCC1CC(=O)CC=C1 Amb24524209 [0,1,0,0,0,1|1,0,1]=4 3891 B9R1.2 OCC1CC=CC(=S)N1 Amb24577817 [0,1,0,0,0,1|1,0,1]=4 3892 B9R1.2 OCC=1C=CNC(=O)C1 Amb21960732 [0,1,0,0,0,1|1,0,0]=3 3893 B9R1.2 OCC=1C=COC(=O)C1 Amb24747519 [0,1,0,0,0,1|1,0,0]=3 3894 B9R1.2 OC[C@@H]1C=CCC(=O)O1 Amb24388493 [0,1,0,0,0,1|0,0,1]=3 3895 B9R1.2 OC[C@@H]1CC=CC(=O)C1 Amb24658579 [0,1,0,0,0,1|1,0,1]=4 3896 B9R1.2 OC[C@@H]1CC=CC(=O)N1 Amb24581594 [0,1,0,0,0,1|1,0,1]=4 3897 B9R1.2 OCc1[n]c(Cl)cc[n]1 Amb22235687 [0,1,0,0,0,1|1,0,0]=3 3898 B9R1.2 OCc1c[n]cc(Br)[n]1 Amb21964568 [0,1,0,0,0,1|1,0,0]=3 3899 B9R1.2 OCc1c[n]cc(Cl)[n]1 Amb21856133 [0,1,0,0,0,1|1,0,0]=3 3900 B9R1.2 OCc1cc(Br)[n]c[n]1 Amb25255522 [0,1,0,0,0,1|1,0,0]=3 3901 B9R1.2 OCc1cc(Cl)[n]c[n]1 Amb23399657 [0,1,0,0,0,1|1,0,0]=3 3902 B9R1.2 OCc1cc(Cl)cnc1 Amb10975945 [0,1,0,0,0,1|1,0,0]=3 3903 B9R1.2 OCc1cc(F)cnc1 Amb10603180 [0,1,0,0,0,1|1,0,0]=3 3904 B9R1.2 OCc1cc(I)cc[n]1 Amb24439513 [0,1,0,0,0,1|1,0,0]=3 3905 B9R1.2 OCc1cc[n]c(Br)[n]1 Amb25320419 [0,1,0,0,0,1|1,0,0]=3 3906 B9R1.2 OCc1cc[n]c(Cl)[n]1 Amb24099659 [0,1,0,0,0,1|1,0,0]=3 3907 B9R1.2 OCc1cc[n]c(F)c1 Amb20247913 [0,1,0,0,0,1|1,0,0]=3 3908 B9R1.2 OCc1ccc[n+](c1)C Amb10573217 [0,1,0,0,0,1|1,0,0]=3 3909 B9R1.2 OCc1ccc[n+](c1)[O-] Amb10552691 [0,1,0,0,0,1|1,0,0]=3 3910 B9R1.2 OCc1cccc(c1)Cl Amb1232082 [0,1,0,0,0,1|1,0,0]=3 3911 B9R1.2 OCc1cccc(c1)N Amb2099649 [0,1,0,0,0,1|1,0,0]=3 3912 B9R1.2 OCc1cccc(c1)S Amb16231056 [0,1,0,0,0,1|1,0,0]=3 3913 B9R1.2 OCc1ccnc(c1)C Amb10067646 [0,1,0,0,0,1|1,0,0]=3 3914 B9R1.2 OCc1ccnc(c1)O Amb10600384 [0,1,0,0,0,1|1,0,0]=3 3915 B9R1.2 ONC1=CC(=O)NC=N1 Amb24675661 [0,1,0,0,0,1|2,0,0]=4 3916 B9R1.2 ONC=1NC(=O)C=CN1 Amb24580355 [0,1,0,0,0,1|2,0,0]=4 3917 B9R1.2 ONc1c[n]cc(Cl)[n]1 Amb24696194 [0,1,0,0,0,1|2,0,0]=4 3918 B9R1.2 ONc1cc[n]c(Cl)c1 Amb24433783 [0,1,0,0,0,1|2,0,0]=4 3919 B9R1.2 ONc1cc[n]c(I)c1 Amb25223525 [0,1,0,0,0,1|2,0,0]=4 3920 B9R1.2 ONc1cccc(Cl)c1 Amb24078712 [0,1,0,0,0,1|2,0,0]=4 3921 B9R1.2 OSC=1C=CNC(=O)N1 Amb24099662 [0,1,0,0,0,1|2,0,0]=4 3922 B9R1.2 O[C@H]1C[C@@H](CO)OC=C1 Amb24759137 [0,1,0,0,0,1|0,0,2]=4 3923 B9R1.2 O\N=C/1\C=CNC(=O)N1 Amb25062604 [0,1,0,0,0,1|2,0,0]=4 3924 B9R1.2 Oc1c[n]cc(CO)c1 Amb23401211 [0,1,0,0,0,1|1,0,0]=3 3925 B9R1.2 Oc1cc(CBr)[n]c[n]1 Amb22494518 [0,1,0,0,0,1|2,0,0]=4 3926 B9R1.2 Oc1cc(CCl)[n]cc1 Amb25064757 [0,1,0,0,0,1|2,0,0]=4 3927 B9R1.2 Oc1cc(CCl)c[n]c1 Amb25336303 [0,1,0,0,0,1|2,0,0]=4 3928 B9R1.2 Oc1cc(CF)[n]cc1 Amb25247027 [0,1,0,0,0,1|2,0,0]=4 3929 B9R1.2 Oc1cc(CF)ccc1 Amb24733630 [0,1,0,0,0,1|2,0,0]=4 3930 B9R1.2 Oc1cc(CS)ccc1 Amb18643580 [0,1,0,0,0,1|1,1,0]=4 3931 B9R1.2 Oc1cc[n]c(CO)[n]1 Amb22737475 [0,1,0,0,0,1|1,0,0]=3 3932 B9R1.2 Oc1cc[n]c(CO)c1 Amb22292446 [0,1,0,0,0,1|1,0,0]=3 3933 B9R1.2 Oc1cc[n]c(CS)[n]1 Amb24553855 [0,1,0,0,0,1|1,1,0]=4 3934 B9R1.2 Oc1cccc(CF)[n]1 Amb25195006 [0,1,0,0,0,1|2,0,0]=4 3935 B9R1.2 SCc1[n]c(I)cc[n]1 Amb25234281 [0,1,0,0,0,1|1,1,0]=4 3936 B9R1.2 SCc1cc[n]c(Cl)[n]1 Amb25135837 [0,1,0,0,0,1|1,1,0]=4 3937 B9R1.2 SCc1cc[n]c(Cl)c1 Amb22396233 [0,1,0,0,0,1|1,1,0]=4 3938 B9R1.2 SCc1cccc(Br)[n]1 Amb25212807 [0,1,0,0,0,1|1,1,0]=4 3939 B9R1.2 SCc1cccc(Cl)[n]1 Amb24726180 [0,1,0,0,0,1|1,1,0]=4 3940 B9R1.2 Sc1cc(CBr)ccc1 Amb25729904 [0,1,0,0,0,1|2,0,0]=4 3941 B9R1.2 Sc1cc(CCl)ccc1 Amb25793601 [0,1,0,0,0,1|2,0,0]=4 3942 B9R1.2 [NH3+]Cc1cccc(Br)c1 Amb24113872 [0,1,0,0,0,1|2,0,0]=4 3943 B9R1.2 [NH3+]Cc1cccc(Cl)c1 Amb22641594 [0,1,0,0,0,1|2,0,0]=4 3944 B9R1.2 [NH3+]Cc1cccc(O)c1 Amb22547663 [0,1,0,0,0,1|2,0,0]=4 3945 B9R1.2 [Zn+]Cc1cccc(I)c1 Amb22337135 [0,1,0,0,0,1|2,0,0]=4 3946 B9R1.6 BrC(Br)c1c[n]ccc1 Amb24747660 [0,1,0,0,0,1|2,0,0]=4 3947 B9R1.6 CC(Br)c1c[n]cc[n]1 Amb21862010 [0,1,0,0,0,1|2,0,0]=4 3948 B9R1.6 CC(Br)c1cc[n]c[n]1 Amb24480125 [0,1,0,0,0,1|2,0,0]=4 3949 B9R1.6 CC(C)C1=CCC=CN1 Amb25146142 [0,1,0,0,0,1|2,0,0]=4 3950 B9R1.6 CC(C)c1[n]ccc[n]1 Amb24084521 [0,1,0,0,0,1|2,0,0]=4 3951 B9R1.6 CC(C)c1c[n]ccc1 Amb24320774 [0,1,0,0,0,1|2,0,0]=4 3952 B9R1.6 CC(C)c1cc[n]c[n]1 Amb24070425 [0,1,0,0,0,1|2,0,0]=4 3953 B9R1.6 CC(C)c1ccccc1 Amb24052959 [0,1,0,0,0,1|2,0,0]=4 3954 B9R1.6 CC(Cl)c1c[n]cc[n]1 Amb20618636 [0,1,0,0,0,1|2,0,0]=4 3955 B9R1.6 CC(Cl)c1cc[n]cc1 Amb19514972 [0,1,0,0,0,1|2,0,0]=4 3956 B9R1.6 CC(F)c1ccccc1 Amb24555504 [0,1,0,0,0,1|2,0,0]=4 3957 B9R1.6 CC(I)c1ccccc1 Amb24064714 [0,1,0,0,0,1|2,0,0]=4 3958 B9R1.6 CC(N)C=1C=CCC=C1 Amb24480325 [0,1,0,0,0,1|2,0,0]=4 3959 B9R1.6 CC(N)c1[n]ccc[n]1 Amb22757229 [0,1,0,0,0,1|2,0,0]=4 3960 B9R1.6 CC(N)c1c[n]cc[n]1 Amb18278310 [0,1,0,0,0,1|2,0,0]=4 3961 B9R1.6 CC(N)c1c[n]ccc1 Amb22754521 [0,1,0,0,0,1|2,0,0]=4 3962 B9R1.6 CC(N)c1cc[n]c[n]1 Amb22587681 [0,1,0,0,0,1|2,0,0]=4 3963 B9R1.6 CC(N)c1cc[n]cc1 Amb19958395 [0,1,0,0,0,1|2,0,0]=4 3964 B9R1.6 CC(N)c1cccc[n]1 Amb22265614 [0,1,0,0,0,1|2,0,0]=4 3965 B9R1.6 CC(N)c1cccc[n]1 Amb24064899 [0,1,0,0,0,1|2,0,0]=4 3966 B9R1.6 CC(O)C1=CCCCO1 Amb25349292 [0,1,0,0,0,1|0,0,2]=4 3967 B9R1.6 CC(O)c1[n]ccc[n]1 Amb22284841 [0,1,0,0,0,1|1,0,0]=3 3968 B9R1.6 CC(O)c1c[n]c[n]c1 Amb22055840 [0,1,0,0,0,1|2,0,0]=4 3969 B9R1.6 CC(O)c1cc[n]c[n]1 Amb24477841 [0,1,0,0,0,1|1,0,0]=3 3970 B9R1.6 CC(S)c1c[n]cc[n]1 Amb22267831 [0,1,0,0,0,1|1,1,0]=4 3971 B9R1.6 CC(c1ccccc1)[NH3+] Amb10560245 [0,1,0,0,0,1|2,0,0]=4 3972 B9R1.6 CC(c1ccccn1)Cl Amb10610197 [0,1,0,0,0,1|2,0,0]=4 3973 B9R1.6 CC(c1ccccn1)N Amb1102610 [0,1,0,0,0,1|2,0,0]=4 3974 B9R1.6 CC(c1cccnc1)Br Amb10610142 [0,1,0,0,0,1|2,0,0]=4 3975 B9R1.6 CC(c1cccnc1)Cl Amb13952205 [0,1,0,0,0,1|2,0,0]=4 3976 B9R1.6 CC(c1cccnc1)N Amb1214297 [0,1,0,0,0,1|2,0,0]=4 3977 B9R1.6 CC(c1ccncc1)Br Amb10610143 [0,1,0,0,0,1|2,0,0]=4 3978 B9R1.6 CC(c1ccncc1)N Amb1152976 [0,1,0,0,0,1|2,0,0]=4 3979 B9R1.6 CC(c1ccncn1)N Amb10608543 [0,1,0,0,0,1|2,0,0]=4 3980 B9R1.6 CC(c1cnccn1)O Amb13952214 [0,1,0,0,0,1|1,0,0]=3 3981 B9R1.6 CN(O)c1[n]ccc[n]1 Amb24478644 [0,1,0,0,0,1|2,0,0]=4 3982 B9R1.6 CN(O)c1cc[n]cc1 Amb22522442 [0,1,0,0,0,1|2,0,0]=4 3983 B9R1.6 C[C@@H](Br)c1cccc[n]1 Amb25725731 [0,1,0,0,0,1|2,0,0]=4 3984 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [0,1,0,0,0,1|2,0,0]=4 3985 B9R1.6 C[C@@H](Cl)c1ccccc1 Amb25772789 [0,1,0,0,0,1|2,0,0]=4 3986 B9R1.6 C[C@@H](N)c1c[n]cc[n]1 Amb22747093 [0,1,0,0,0,1|2,0,0]=4 3987 B9R1.6 C[C@@H](N)c1cc[n]c[n]1 Amb18832953 [0,1,0,0,0,1|2,0,0]=4 3988 B9R1.6 C[C@@H](N)c1cccc[n]1 Amb19514583 [0,1,0,0,0,1|2,0,0]=4 3989 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [0,1,0,0,0,1|2,0,0]=4 3990 B9R1.6 C[C@@H](O)c1[n]ccc[n]1 Amb25313724 [0,1,0,0,0,1|1,0,0]=3 3991 B9R1.6 C[C@@H](O)c1c[n]cc[n]1 Amb19514758 [0,1,0,0,0,1|1,0,0]=3 3992 B9R1.6 C[C@@H](O)c1cccc[n]1 Amb24087444 [0,1,0,0,0,1|1,0,0]=3 3993 B9R1.6 C[C@@H](S)c1cccc[n]1 Amb25346958 [0,1,0,0,0,1|1,1,0]=4 3994 B9R1.6 C[C@@H](c1ccccn1)O Amb13951167 [0,1,0,0,0,1|1,0,0]=3 3995 B9R1.6 C[C@H](Br)c1ccccc1 Amb24355307 [0,1,0,0,0,1|2,0,0]=4 3996 B9R1.6 C[C@H](Cl)c1ccccc1 Amb24391406 [0,1,0,0,0,1|2,0,0]=4 3997 B9R1.6 C[C@H](N)c1cc[n]c[n]1 Amb24099656 [0,1,0,0,0,1|2,0,0]=4 3998 B9R1.6 C[C@H](O)c1[n]ccc[n]1 Amb24428544 [0,1,0,0,0,1|1,0,0]=3 3999 B9R1.6 C[C@H](O)c1c[n]c[n]c1 Amb25259575 [0,1,0,0,0,1|2,0,0]=4 4000 B9R1.6 C[C@H](c1cccnc1)N Amb13951181 [0,1,0,0,0,1|2,0,0]=4 4001 B9R1.6 C[C@H](c1ccncc1)N Amb13952719 [0,1,0,0,0,1|2,0,0]=4 4002 B9R1.6 ClC(Cl)c1[n]ccc[n]1 Amb25201031 [0,1,0,0,0,1|2,0,0]=4 4003 B9R1.6 ClC(Cl)c1cc[n]c[n]1 Amb25765741 [0,1,0,0,0,1|2,0,0]=4 4004 B9R1.6 ClC(Cl)c1cc[n]cc1 Amb25231961 [0,1,0,0,0,1|2,0,0]=4 4005 B9R1.6 ClC(Cl)c1cccc[n]1 Amb22295832 [0,1,0,0,0,1|2,0,0]=4 4006 B9R1.6 FC(F)c1c[n]cc[n]1 Amb24552356 [0,1,0,0,0,1|2,0,0]=4 4007 B9R1.6 FC(F)c1cc[n]cc1 Amb19894457 [0,1,0,0,0,1|2,0,0]=4 4008 B9R1.6 FC(F)c1cccc[n]1 Amb19894454 [0,1,0,0,0,1|2,0,0]=4 4009 B9R1.6 FC(c1ccccc1)Cl Amb10838337 [0,1,0,0,0,1|2,0,0]=4 4010 B9R1.6 FC(c1ccccc1)F Amb10606272 [0,1,0,0,0,1|2,0,0]=4 4011 B9R1.6 FC(c1cccnc1)F Amb10605994 [0,1,0,0,0,1|2,0,0]=4 4012 B9R1.6 N=C(O)c1c[n]cc[n]1 Amb22166847 [0,1,0,0,0,1|1,0,1]=4 4013 B9R1.6 NC(F)c1ccccc1 Amb25059400 [0,1,0,0,0,1|2,0,0]=4 4014 B9R1.6 NC(N)c1[n]ccc[n]1 Amb24516896 [0,1,0,0,0,1|2,0,0]=4 4015 B9R1.6 NC(N)c1cc[n]cc1 Amb24079161 [0,1,0,0,0,1|2,0,0]=4 4016 B9R1.6 NC(N)c1cccc[n]1 Amb24430144 [0,1,0,0,0,1|2,0,0]=4 4017 B9R1.6 NC(O)c1c[n]ccc1 Amb25251813 [0,1,0,0,0,1|1,0,0]=3 4018 B9R1.6 NC(O)c1cc[n]cc1 Amb25744601 [0,1,0,0,0,1|1,0,0]=3 4019 B9R1.6 OB(O)c1c[n]cc[n]1 Amb22000964 [0,1,0,0,0,1|2,0,0]=4 4020 B9R1.6 OB(O)c1c[n]ccc1 Amb21954295 [0,1,0,0,0,1|2,0,0]=4 4021 B9R1.6 OB(O)c1ccc[n][n]1 Amb23403685 [0,1,0,0,0,1|2,0,0]=4 4022 B9R1.6 OB(O)c1ccccc1 Amb22587706 [0,1,0,0,0,1|2,0,0]=4 4023 B9R1.6 OB(c1ccccn1)O Amb2383498 [0,1,0,0,0,1|2,0,0]=4 4024 B9R1.6 OB(c1cccnc1)O Amb1353193 [0,1,0,0,0,1|2,0,0]=4 4025 B9R1.6 OB(c1ccncc1)O Amb13887063 [0,1,0,0,0,1|2,0,0]=4 4026 B9R1.6 OB(c1ccncc1)O Amb2383497 [0,1,0,0,0,1|2,0,0]=4 4027 B9R1.6 OC(=O)C1=CC=CCS1 Amb22831443 [0,1,0,0,0,1|0,1,1]=4 4028 B9R1.6 OC(=O)C1=COC=CO1 Amb25305603 [0,1,0,0,0,1|0,0,1]=3 4029 B9R1.6 OC(=O)C1C=CC=CO1 Amb18642363 [0,1,0,0,0,1|0,0,2]=4 4030 B9R1.6 OC(=O)C=1CC=CNC1 Amb25293556 [0,1,0,0,0,1|1,0,1]=4 4031 B9R1.6 OC(=O)C=1CNC=CC1 Amb25823057 [0,1,0,0,0,1|1,0,1]=4 4032 B9R1.6 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054405 [0,1,0,0,0,1|1,0,1]=4 4033 B9R1.6 OC(=O)[13c]1ccccc1 Amb22353371 [0,1,0,0,0,1|1,0,1]=4 4034 B9R1.6 OC(=O)c1[n]ccc[n]1 Amb19330380 [0,1,0,0,0,1|1,0,1]=4 4035 B9R1.6 OC(=O)c1cc[13cH]cc1 Amb22367544 [0,1,0,0,0,1|1,0,1]=4 4036 B9R1.6 OC(=O)c1ccccc1 Amb16232256 [0,1,0,0,0,1|1,0,1]=4 4037 B9R1.6 OC(=O)c1ccccc1 Amb1935196 [0,1,0,0,0,1|1,0,1]=4 4038 B9R1.6 OC(=O)c1ccccc1 Amb22002523 [0,1,0,0,0,1|1,0,1]=4 4039 B9R1.6 OC(=O)c1ccccc1 Amb22279605 [0,1,0,0,0,1|1,0,1]=4 4040 B9R1.6 OC(=O)c1ccccc1 Amb22336602 [0,1,0,0,0,1|1,0,1]=4 4041 B9R1.6 OC(=O)c1ccccc1 Amb22338105 [0,1,0,0,0,1|1,0,1]=4 4042 B9R1.6 OC(=O)c1ccccc1 Amb22351742 [0,1,0,0,0,1|1,0,1]=4 4043 B9R1.6 OC(=O)c1ccccc1 Amb22472602 [0,1,0,0,0,1|1,0,1]=4 4044 B9R1.6 OC(=O)c1ccccc1 Amb22491636 [0,1,0,0,0,1|1,0,1]=4 4045 B9R1.6 OC(=O)c1ccccn1 Amb1227737 [0,1,0,0,0,1|1,0,1]=4 4046 B9R1.6 OC(=O)c1cccnc1 Amb1195995 [0,1,0,0,0,1|1,0,1]=4 4047 B9R1.6 OC(=O)c1ccncn1 Amb1102414 [0,1,0,0,0,1|1,0,1]=4 4048 B9R1.6 OC(=O)c1cnccn1 Amb2455963 [0,1,0,0,0,1|1,0,1]=4 4049 B9R1.6 OC(=S)c1ccc[n]c1 Amb22731908 [0,1,0,0,0,1|1,0,1]=4 4050 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [0,1,0,0,0,1|1,0,1]=4 4051 B9R1.6 OC(Br)c1ccccc1 Amb24693764 [0,1,0,0,0,1|1,0,0]=3 4052 B9R1.6 OC(Cl)c1ccccc1 Amb24480238 [0,1,0,0,0,1|1,0,0]=3 4053 B9R1.6 OC(O)c1c[n]ccc1 Amb24102578 [0,1,0,0,0,1|1,0,0]=3 4054 B9R1.6 OC(O)c1cc[n]c[n]1 Amb24099652 [0,1,0,0,0,1|1,0,0]=3 4055 B9R1.6 OC(O)c1cc[n]cc1 Amb24070648 [0,1,0,0,0,1|1,0,0]=3 4056 B9R1.6 OC(O)c1cccc[n]1 Amb24085037 [0,1,0,0,0,1|1,0,0]=3 4057 B9R1.6 OC(P)c1ccccc1 Amb24448419 [0,1,0,0,0,1|1,0,0]=3 4058 B9R1.6 ON(O)c1cc[n]cc1 Amb24572621 [0,1,0,0,0,1|2,0,0]=4 4059 B9R1.6 OP(=O)c1ccccc1 Amb10571098 [0,1,0,0,0,1|2,0,0]=4 4060 B9R1.6 OS(=O)c1[n]ccc[n]1 Amb24061346 [0,1,0,0,0,1|2,0,0]=4 4061 B9R1.6 OS(=O)c1c[n]ccc1 Amb24062548 [0,1,0,0,0,1|2,0,0]=4 4062 B9R1.6 OS(=O)c1cc[n]cc1 Amb24099594 [0,1,0,0,0,1|2,0,0]=4 4063 B9R1.6 OS(=O)c1ccccc1 Amb17939345 [0,1,0,0,0,1|2,0,0]=4 4064 B9R1.6 O[12C](=O)[12c]1[12cH][12cH][12cH][12cH][12cH]1 Amb22338193 [0,1,0,0,0,1|1,0,1]=4 4065 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367547 [0,1,0,0,0,1|1,0,1]=4 4066 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1 Amb17618353 [0,1,0,0,0,1|1,0,1]=4 4067 B9R1.6 O[13C](=O)c1ccccc1 Amb22338753 [0,1,0,0,0,1|1,0,1]=4 4068 B9R1.6 O[14C](=O)c1ccccc1 Amb22352700 [0,1,0,0,0,1|1,0,1]=4 4069 B9R1.6 O[C@H](Br)c1ccccc1 Amb25114797 [0,1,0,0,0,1|1,0,0]=3 4070 B9R1.6 SC(S)c1ccccc1 Amb25716873 [0,1,0,0,0,1|1,1,0]=4 4071 B9R1.6 [13CH3][13CH](O)c1ccccc1 Amb22363197 [0,1,0,0,0,1|1,0,0]=3 4072 B9R1.8 BOCc1cccc[n]1 Amb24406683 [0,1,0,0,0,1|1,0,0]=3 4073 B9R1.8 BrCCc1c[n]cc[n]1 Amb24652166 [0,1,0,0,0,1|2,0,0]=4 4074 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [0,1,0,0,0,1|2,0,0]=4 4075 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [0,1,0,0,0,1|2,0,0]=4 4076 B9R1.8 BrCCc1cc[n]c[n]1 Amb25681855 [0,1,0,0,0,1|2,0,0]=4 4077 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [0,1,0,0,0,1|2,0,0]=4 4078 B9R1.8 BrCCc1ccccn1 Amb1102303 [0,1,0,0,0,1|2,0,0]=4 4079 B9R1.8 BrCCc1ccccn1 Amb17935743 [0,1,0,0,0,1|2,0,0]=4 4080 B9R1.8 BrCNc1ccccc1 Amb25758335 [0,1,0,0,0,1|2,0,0]=4 4081 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [0,1,0,0,0,1|2,0,0]=4 4082 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [0,1,0,0,0,1|2,0,0]=4 4083 B9R1.8 C#CCc1cc[n]cc1 Amb24478677 [0,1,0,0,0,1|2,0,0]=4 4084 B9R1.8 C#CCc1cccc[n]1 Amb25759001 [0,1,0,0,0,1|2,0,0]=4 4085 B9R1.8 C(c1cnccn1)C#N Amb17106784 [0,1,0,0,0,1|2,0,0]=4 4086 B9R1.8 C=CCc1c[n]cc[n]1 Amb24365743 [0,1,0,0,0,1|2,0,0]=4 4087 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [0,1,0,0,0,1|2,0,0]=4 4088 B9R1.8 C=CCc1cc[n]c[n]1 Amb24091172 [0,1,0,0,0,1|2,0,0]=4 4089 B9R1.8 C=NCc1c[n]ccc1 Amb24062506 [0,1,0,0,0,1|2,0,0]=4 4090 B9R1.8 CCCc1[n]ccc[n]1 Amb24084965 [0,1,0,0,0,1|2,0,0]=4 4091 B9R1.8 CCCc1cc[n]c[n]1 Amb24070638 [0,1,0,0,0,1|2,0,0]=4 4092 B9R1.8 CCCc1ccc[n][n]1 Amb24447402 [0,1,0,0,0,1|2,0,0]=4 4093 B9R1.8 CCCc1ccccc1 Amb2447143 [0,1,0,0,0,1|2,0,0]=4 4094 B9R1.8 CCNc1cc[n]c[n]1 Amb18282107 [0,1,0,0,0,1|2,0,0]=4 4095 B9R1.8 CCNc1ccc[n][n]1 Amb18286130 [0,1,0,0,0,1|2,0,0]=4 4096 B9R1.8 CCNc1ccccc1 Amb22731692 [0,1,0,0,0,1|2,0,0]=4 4097 B9R1.8 CCOc1[n]ccc[n]1 Amb22498694 [0,1,0,0,0,1|2,0,0]=4 4098 B9R1.8 CCOc1cc[n]c[n]1 Amb24091512 [0,1,0,0,0,1|2,0,0]=4 4099 B9R1.8 CCOc1ccc[n][n]1 Amb19958352 [0,1,0,0,0,1|2,0,0]=4 4100 B9R1.8 CCOc1cccnc1 Amb10573342 [0,1,0,0,0,1|2,0,0]=4 4101 B9R1.8 CCSc1cc[n]c[n]1 Amb24102978 [0,1,0,0,0,1|2,0,0]=4 4102 B9R1.8 CCSc1ccc[n][n]1 Amb24462843 [0,1,0,0,0,1|2,0,0]=4 4103 B9R1.8 CNCc1[n]ccc[n]1 Amb22886406 [0,1,0,0,0,1|2,0,0]=4 4104 B9R1.8 CNCc1c[n]cc[n]1 Amb21959600 [0,1,0,0,0,1|2,0,0]=4 4105 B9R1.8 CNCc1c[n]cc[n]1 Amb22498352 [0,1,0,0,0,1|2,0,0]=4 4106 B9R1.8 CNCc1cc[n]c[n]1 Amb21962059 [0,1,0,0,0,1|2,0,0]=4 4107 B9R1.8 CNCc1cc[n]c[n]1 Amb22587684 [0,1,0,0,0,1|2,0,0]=4 4108 B9R1.8 CNCc1ccccn1 Amb10068750 [0,1,0,0,0,1|2,0,0]=4 4109 B9R1.8 CNCc1ccccn1 Amb10576408 [0,1,0,0,0,1|2,0,0]=4 4110 B9R1.8 CNCc1cccnc1 Amb10066918 [0,1,0,0,0,1|2,0,0]=4 4111 B9R1.8 CNCc1cccnc1 Amb10576409 [0,1,0,0,0,1|2,0,0]=4 4112 B9R1.8 CNCc1cccnc1 Amb1648828 [0,1,0,0,0,1|2,0,0]=4 4113 B9R1.8 CNCc1ccncc1 Amb10068773 [0,1,0,0,0,1|2,0,0]=4 4114 B9R1.8 CNCc1ccncc1 Amb10576211 [0,1,0,0,0,1|2,0,0]=4 4115 B9R1.8 CNCc1ccncc1 Amb1115812 [0,1,0,0,0,1|2,0,0]=4 4116 B9R1.8 CNCc1cnccn1 Amb1094140 [0,1,0,0,0,1|2,0,0]=4 4117 B9R1.8 COC[n+]1ccccc1 Amb25309455 [0,1,0,0,0,1|2,0,0]=4 4118 B9R1.8 COCc1c[n]cc[n]1 Amb24656513 [0,1,0,0,0,1|1,0,0]=3 4119 B9R1.8 COCc1c[n]ccc1 Amb24106446 [0,1,0,0,0,1|1,0,0]=3 4120 B9R1.8 COCc1cc[n]cc1 Amb24075931 [0,1,0,0,0,1|1,0,0]=3 4121 B9R1.8 COCc1ccc[n][n]1 Amb25178748 [0,1,0,0,0,1|1,0,0]=3 4122 B9R1.8 CONc1[n]ccc[n]1 Amb24672173 [0,1,0,0,0,1|2,0,0]=4 4123 B9R1.8 CONc1c[n]ccc1 Amb25347084 [0,1,0,0,0,1|2,0,0]=4 4124 B9R1.8 COPc1ccccc1 Amb22729661 [0,1,0,0,0,1|2,0,0]=4 4125 B9R1.8 CSCc1[n]ccc[n]1 Amb24476755 [0,1,0,0,0,1|1,1,0]=4 4126 B9R1.8 CSCc1c[n]cc[n]1 Amb22490462 [0,1,0,0,0,1|1,1,0]=4 4127 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [0,1,0,0,0,1|1,1,0]=4 4128 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [0,1,0,0,0,1|2,0,0]=4 4129 B9R1.8 ClCCc1[n]ccc[n]1 Amb25845186 [0,1,0,0,0,1|2,0,0]=4 4130 B9R1.8 ClCCc1c[n]cc[n]1 Amb24477833 [0,1,0,0,0,1|2,0,0]=4 4131 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [0,1,0,0,0,1|2,0,0]=4 4132 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [0,1,0,0,0,1|2,0,0]=4 4133 B9R1.8 ClCCc1cc[n]c[n]1 Amb25100826 [0,1,0,0,0,1|2,0,0]=4 4134 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [0,1,0,0,0,1|2,0,0]=4 4135 B9R1.8 ClCCc1ccc[n][n]1 Amb25373976 [0,1,0,0,0,1|2,0,0]=4 4136 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [0,1,0,0,0,1|2,0,0]=4 4137 B9R1.8 ClCCc1ccccn1 Amb1102254 [0,1,0,0,0,1|2,0,0]=4 4138 B9R1.8 ClCNc1ccccc1 Amb25836772 [0,1,0,0,0,1|2,0,0]=4 4139 B9R1.8 ClCOc1c[n]ccc1 Amb25780203 [0,1,0,0,0,1|2,0,0]=4 4140 B9R1.8 ClCOc1ccccc1 Amb22059503 [0,1,0,0,0,1|2,0,0]=4 4141 B9R1.8 ClCPc1ccccc1 Amb25294535 [0,1,0,0,0,1|2,0,0]=4 4142 B9R1.8 ClCSc1c[n]ccc1 Amb25837457 [0,1,0,0,0,1|2,0,0]=4 4143 B9R1.8 ClCSc1cc[n]c[n]1 Amb24764038 [0,1,0,0,0,1|2,0,0]=4 4144 B9R1.8 ClCSc1ncccn1 Amb2459898 [0,1,0,0,0,1|2,0,0]=4 4145 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [0,1,0,0,0,1|2,0,0]=4 4146 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [0,1,0,0,0,1|2,0,0]=4 4147 B9R1.8 Cl[Zn]Cc1cccc[n]1 Amb22000362 [0,1,0,0,0,1|2,0,0]=4 4148 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [0,1,0,0,0,1|2,0,0]=4 4149 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [0,1,0,0,0,1|2,0,0]=4 4150 B9R1.8 FCCc1cccc[n]1 Amb24070130 [0,1,0,0,0,1|2,0,0]=4 4151 B9R1.8 FCOc1ccccc1 Amb24099991 [0,1,0,0,0,1|2,0,0]=4 4152 B9R1.8 FCSc1[n]ccc[n]1 Amb24106750 [0,1,0,0,0,1|2,0,0]=4 4153 B9R1.8 FCSc1cccc[n]1 Amb24106749 [0,1,0,0,0,1|2,0,0]=4 4154 B9R1.8 ICCc1cccc[n]1 Amb24573930 [0,1,0,0,0,1|2,0,0]=4 4155 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [0,1,0,0,0,1|2,0,0]=4 4156 B9R1.8 N#CCc1[n]ccc[n]1 Amb19929361 [0,1,0,0,0,1|2,0,0]=4 4157 B9R1.8 N#CCc1cc[n]c[n]1 Amb22001990 [0,1,0,0,0,1|2,0,0]=4 4158 B9R1.8 N#CCc1ccc[n][n]1 Amb22264435 [0,1,0,0,0,1|2,0,0]=4 4159 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [0,1,0,0,0,1|2,0,0]=4 4160 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [0,1,0,0,0,1|2,0,0]=4 4161 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [0,1,0,0,0,1|2,0,0]=4 4162 B9R1.8 NCCc1[n]ccc[n]1 Amb18199432 [0,1,0,0,0,1|2,0,0]=4 4163 B9R1.8 NCCc1[n]ccc[n]1 Amb23399636 [0,1,0,0,0,1|2,0,0]=4 4164 B9R1.8 NCCc1[n]ccc[n]1 Amb24066982 [0,1,0,0,0,1|2,0,0]=4 4165 B9R1.8 NCCc1c[n]cc[n]1 Amb22756001 [0,1,0,0,0,1|2,0,0]=4 4166 B9R1.8 NCCc1c[n]cc[n]1 Amb24066949 [0,1,0,0,0,1|2,0,0]=4 4167 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [0,1,0,0,0,1|2,0,0]=4 4168 B9R1.8 NCCc1cc[n]c[n]1 Amb22899210 [0,1,0,0,0,1|2,0,0]=4 4169 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [0,1,0,0,0,1|2,0,0]=4 4170 B9R1.8 NCCc1ccc[n][n]1 Amb23592188 [0,1,0,0,0,1|2,0,0]=4 4171 B9R1.8 NCCc1cccc[n]1 Amb24065228 [0,1,0,0,0,1|2,0,0]=4 4172 B9R1.8 NCCc1cccc[n]1 Amb24066975 [0,1,0,0,0,1|2,0,0]=4 4173 B9R1.8 NCCc1ccccc1 Amb17772283 [0,1,0,0,0,1|2,0,0]=4 4174 B9R1.8 NCCc1ccccc1 Amb17843439 [0,1,0,0,0,1|2,0,0]=4 4175 B9R1.8 NCCc1ccccc1 Amb22360716 [0,1,0,0,0,1|2,0,0]=4 4176 B9R1.8 NCCc1ccccc1 Amb24325112 [0,1,0,0,0,1|2,0,0]=4 4177 B9R1.8 NCCc1ccccc1 Amb24325408 [0,1,0,0,0,1|2,0,0]=4 4178 B9R1.8 NCCc1ccccn1 Amb1156071 [0,1,0,0,0,1|2,0,0]=4 4179 B9R1.8 NCCc1cccnc1 Amb1134784 [0,1,0,0,0,1|2,0,0]=4 4180 B9R1.8 NCCc1cccnc1 Amb16230500 [0,1,0,0,0,1|2,0,0]=4 4181 B9R1.8 NCCc1ccncc1 Amb1102164 [0,1,0,0,0,1|2,0,0]=4 4182 B9R1.8 NCCc1cnccn1 Amb10067912 [0,1,0,0,0,1|2,0,0]=4 4183 B9R1.8 NCCc1cnccn1 Amb1995199 [0,1,0,0,0,1|2,0,0]=4 4184 B9R1.8 NCCc1ncccn1 Amb17074351 [0,1,0,0,0,1|2,0,0]=4 4185 B9R1.8 NCNc1ccccc1 Amb17117015 [0,1,0,0,0,1|2,0,0]=4 4186 B9R1.8 NCOc1ccccc1 Amb25128781 [0,1,0,0,0,1|2,0,0]=4 4187 B9R1.8 NCSc1ccccc1 Amb25128061 [0,1,0,0,0,1|2,0,0]=4 4188 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [0,1,0,0,0,1|2,0,0]=4 4189 B9R1.8 NNCc1[n]ccc[n]1 Amb23439061 [0,1,0,0,0,1|2,0,0]=4 4190 B9R1.8 NNCc1c[n]cc[n]1 Amb21964577 [0,1,0,0,0,1|2,0,0]=4 4191 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [0,1,0,0,0,1|2,0,0]=4 4192 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [0,1,0,0,0,1|2,0,0]=4 4193 B9R1.8 NNCc1cc[n]c[n]1 Amb23586399 [0,1,0,0,0,1|2,0,0]=4 4194 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [0,1,0,0,0,1|2,0,0]=4 4195 B9R1.8 NNCc1ccc[n][n]1 Amb23586393 [0,1,0,0,0,1|2,0,0]=4 4196 B9R1.8 NNCc1cccc[n]1 Amb19893254 [0,1,0,0,0,1|2,0,0]=4 4197 B9R1.8 NNCc1ccccc1 Amb1105200 [0,1,0,0,0,1|2,0,0]=4 4198 B9R1.8 NNCc1ccccc1 Amb16231890 [0,1,0,0,0,1|2,0,0]=4 4199 B9R1.8 NNCc1ccccc1 Amb22492438 [0,1,0,0,0,1|2,0,0]=4 4200 B9R1.8 NNCc1ccccn1 Amb1117330 [0,1,0,0,0,1|2,0,0]=4 4201 B9R1.8 NNCc1cccnc1 Amb1121062 [0,1,0,0,0,1|2,0,0]=4 4202 B9R1.8 NNCc1ccncc1 Amb1118337 [0,1,0,0,0,1|2,0,0]=4 4203 B9R1.8 NOCc1[n]ccc[n]1 Amb25702287 [0,1,0,0,0,1|1,0,0]=3 4204 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [0,1,0,0,0,1|1,0,0]=3 4205 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [0,1,0,0,0,1|1,0,0]=3 4206 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [0,1,0,0,0,1|1,0,0]=3 4207 B9R1.8 NOCc1cccc[n]1 Amb18642195 [0,1,0,0,0,1|1,0,0]=3 4208 B9R1.8 NOCc1ccccc1 Amb1154307 [0,1,0,0,0,1|1,0,0]=3 4209 B9R1.8 NOCc1ccccc1 Amb16204809 [0,1,0,0,0,1|1,0,0]=3 4210 B9R1.8 NOCc1ccccc1 Amb22489499 [0,1,0,0,0,1|1,0,0]=3 4211 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [0,1,0,0,0,1|2,0,0]=4 4212 B9R1.8 O/N=N/c1ccccn1 Amb17940654 [0,1,0,0,0,1|2,0,0]=4 4213 B9R1.8 O=CCc1[n]ccc[n]1 Amb24061341 [0,1,0,0,0,1|1,0,1]=4 4214 B9R1.8 O=CCc1c[n]cc[n]1 Amb25124492 [0,1,0,0,0,1|1,0,1]=4 4215 B9R1.8 O=CCc1cc[n]c[n]1 Amb24099612 [0,1,0,0,0,1|1,0,1]=4 4216 B9R1.8 O=CCc1ccc[n][n]1 Amb24682971 [0,1,0,0,0,1|1,0,1]=4 4217 B9R1.8 O=CCc1ccccn1 Amb17089528 [0,1,0,0,0,1|1,0,1]=4 4218 B9R1.8 O=CCc1ccncc1 Amb17089529 [0,1,0,0,0,1|1,0,1]=4 4219 B9R1.8 OCCC1=CCCCO1 Amb25266822 [0,1,0,0,0,1|0,0,2]=4 4220 B9R1.8 OCCC1C=CCCO1 Amb24423433 [0,1,0,0,0,1|0,0,2]=4 4221 B9R1.8 OCCC1CCC=CO1 Amb24481996 [0,1,0,0,0,1|0,0,2]=4 4222 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [0,1,0,0,0,1|2,0,0]=4 4223 B9R1.8 OCCc1[n]ccc[n]1 Amb22896758 [0,1,0,0,0,1|1,0,0]=3 4224 B9R1.8 OCCc1c[n][n]cc1 Amb23559765 [0,1,0,0,0,1|2,0,0]=4 4225 B9R1.8 OCCc1c[n]c[n]c1 Amb20240921 [0,1,0,0,0,1|2,0,0]=4 4226 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [0,1,0,0,0,1|1,0,0]=3 4227 B9R1.8 OCCc1ccc[n][n]1 Amb25086060 [0,1,0,0,0,1|1,0,0]=3 4228 B9R1.8 OCCc1ccncn1 Amb17593271 [0,1,0,0,0,1|1,0,0]=3 4229 B9R1.8 OCNc1[n][n]cc[n]1 Amb25293654 [0,1,0,0,0,1|2,0,0]=4 4230 B9R1.8 OCNc1[n]ccc[n]1 Amb24068196 [0,1,0,0,0,1|1,0,0]=3 4231 B9R1.8 OCNc1cccc[n]1 Amb25066721 [0,1,0,0,0,1|1,0,0]=3 4232 B9R1.8 OCOc1ccccc1 Amb25847006 [0,1,0,0,0,1|1,0,0]=3 4233 B9R1.8 ON=Cc1cc[n]c[n]1 Amb20668794 [0,1,0,0,0,1|1,0,1]=4 4234 B9R1.8 ON=Cc1ccccn1 Amb10573542 [0,1,0,0,0,1|1,0,1]=4 4235 B9R1.8 ON=Cc1ccncc1 Amb10075320 [0,1,0,0,0,1|1,0,1]=4 4236 B9R1.8 ONCC1CCC=CO1 Amb24715148 [0,1,0,0,0,1|0,0,2]=4 4237 B9R1.8 ONCC=1COCCC1 Amb24552508 [0,1,0,0,0,1|0,0,2]=4 4238 B9R1.8 ONCc1[n]ccc[n]1 Amb23586395 [0,1,0,0,0,1|1,0,0]=3 4239 B9R1.8 ONCc1c[n][n]cc1 Amb23586390 [0,1,0,0,0,1|2,0,0]=4 4240 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [0,1,0,0,0,1|1,0,0]=3 4241 B9R1.8 ONCc1cc[n]c[n]1 Amb23586394 [0,1,0,0,0,1|1,0,0]=3 4242 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [0,1,0,0,0,1|1,0,0]=3 4243 B9R1.8 ONCc1ccc[n][n]1 Amb23586391 [0,1,0,0,0,1|1,0,0]=3 4244 B9R1.8 ONCc1ccccc1 Amb22001943 [0,1,0,0,0,1|1,0,0]=3 4245 B9R1.8 O\N=C/c1c[n]ccc1 Amb24611619 [0,1,0,0,0,1|1,0,1]=4 4246 B9R1.8 O\N=C/c1ccccn1 Amb10069892 [0,1,0,0,0,1|1,0,1]=4 4247 B9R1.8 O\N=C\C=1CC=CNC1 Amb24668003 [0,1,0,0,0,1|1,0,1]=4 4248 B9R1.8 O\N=C\c1cc[n]c[n]1 Amb22292199 [0,1,0,0,0,1|1,0,1]=4 4249 B9R1.8 O\N=C\c1ccc[n][n]1 Amb23539035 [0,1,0,0,0,1|1,0,1]=4 4250 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [0,1,0,0,0,1|1,0,1]=4 4251 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [0,1,0,0,0,1|1,0,1]=4 4252 B9R1.8 O\N=N\c1c[n]cc[n]1 Amb24744897 [0,1,0,0,0,1|2,0,0]=4 4253 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [0,1,0,0,0,1|1,1,0]=4 4254 B9R1.8 SCCc1ccccn1 Amb17619707 [0,1,0,0,0,1|1,1,0]=4 4255 B9R1.8 SCCc1ccncc1 Amb10552830 [0,1,0,0,0,1|1,1,0]=4 4256 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [0,1,0,0,0,1|2,0,0]=4 4257 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [0,1,0,0,0,1|2,0,0]=4 4258 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [0,1,0,0,0,1|2,0,0]=4 4259 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [0,1,0,0,0,1|2,0,0]=4 4260 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [0,1,0,0,0,1|2,0,0]=4 4261 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [0,1,0,0,0,1|2,0,0]=4 4262 B9R1.15 BrCc1ccc[n]c1I Amb25178811 [0,1,0,0,0,1|2,0,0]=4 4263 B9R1.15 BrCc1ccccc1Br Amb1152530 [0,1,0,0,0,1|2,0,0]=4 4264 B9R1.15 BrCc1cccnc1Br Amb10071486 [0,1,0,0,0,1|2,0,0]=4 4265 B9R1.15 BrCc1cccnc1Br Amb10608824 [0,1,0,0,0,1|2,0,0]=4 4266 B9R1.15 BrCc1ncccc1C Amb1935083 [0,1,0,0,0,1|2,0,0]=4 4267 B9R1.15 Brc1c[n]ccc1CBr Amb22898756 [0,1,0,0,0,1|2,0,0]=4 4268 B9R1.15 Brc1ccc[n]c1CBr Amb22728103 [0,1,0,0,0,1|2,0,0]=4 4269 B9R1.15 Brc1ccc[n]c1CI Amb24386676 [0,1,0,0,0,1|2,0,0]=4 4270 B9R1.15 Brc1ccccc1CI Amb24474244 [0,1,0,0,0,1|2,0,0]=4 4271 B9R1.15 C=C/1C=CC=C\C1=C\O Amb25052188 [0,1,0,0,0,1|1,0,1]=4 4272 B9R1.15 CCC1=CNC=CC1=N Amb22126003 [0,1,0,0,0,1|2,0,0]=4 4273 B9R1.15 CCC1=CNC=CC1=O Amb24062648 [0,1,0,0,0,1|2,0,0]=4 4274 B9R1.15 CCC1=NC=CNC1=O Amb21912469 [0,1,0,0,0,1|2,0,0]=4 4275 B9R1.15 CCc1[n]c[n]cc1Cl Amb24071186 [0,1,0,0,0,1|2,0,0]=4 4276 B9R1.15 CCc1[n]c[n]cc1F Amb22055218 [0,1,0,0,0,1|2,0,0]=4 4277 B9R1.15 CCc1[n]c[n]cc1N Amb18677215 [0,1,0,0,0,1|2,0,0]=4 4278 B9R1.15 CCc1[n]cc[n]c1Br Amb25704152 [0,1,0,0,0,1|2,0,0]=4 4279 B9R1.15 CCc1[n]cc[n]c1F Amb24715100 [0,1,0,0,0,1|2,0,0]=4 4280 B9R1.15 CCc1[n]cc[n]c1I Amb24481658 [0,1,0,0,0,1|2,0,0]=4 4281 B9R1.15 CCc1[n]cc[n]c1N Amb22234764 [0,1,0,0,0,1|2,0,0]=4 4282 B9R1.15 CCc1[n]cccc1Br Amb22233901 [0,1,0,0,0,1|2,0,0]=4 4283 B9R1.15 CCc1[n]cccc1Cl Amb22497670 [0,1,0,0,0,1|2,0,0]=4 4284 B9R1.15 CCc1[n]cccc1N Amb18832982 [0,1,0,0,0,1|2,0,0]=4 4285 B9R1.15 CCc1[n]cccc1S Amb25369508 [0,1,0,0,0,1|2,0,0]=4 4286 B9R1.15 CCc1c[n]ccc1Br Amb20617488 [0,1,0,0,0,1|2,0,0]=4 4287 B9R1.15 CCc1c[n]ccc1Cl Amb25188972 [0,1,0,0,0,1|2,0,0]=4 4288 B9R1.15 CCc1c[n]ccc1N Amb19514793 [0,1,0,0,0,1|2,0,0]=4 4289 B9R1.15 CCc1c[n]ccc1N Amb22059068 [0,1,0,0,0,1|2,0,0]=4 4290 B9R1.15 CCc1c[n]ccc1S Amb24099598 [0,1,0,0,0,1|2,0,0]=4 4291 B9R1.15 CCc1cc[n]cc1Br Amb21857366 [0,1,0,0,0,1|2,0,0]=4 4292 B9R1.15 CCc1cc[n]cc1Cl Amb22748741 [0,1,0,0,0,1|2,0,0]=4 4293 B9R1.15 CCc1cc[n]cc1F Amb19959241 [0,1,0,0,0,1|2,0,0]=4 4294 B9R1.15 CCc1cc[n]cc1N Amb18832983 [0,1,0,0,0,1|2,0,0]=4 4295 B9R1.15 CCc1cc[n]cc1O Amb18642098 [0,1,0,0,0,1|2,0,0]=4 4296 B9R1.15 CCc1cc[n]cc1S Amb24062437 [0,1,0,0,0,1|2,0,0]=4 4297 B9R1.15 CCc1ccc[n]c1Br Amb24319268 [0,1,0,0,0,1|2,0,0]=4 4298 B9R1.15 CCc1ccc[n]c1Cl Amb19516800 [0,1,0,0,0,1|2,0,0]=4 4299 B9R1.15 CCc1ccc[n]c1O Amb21864629 [0,1,0,0,0,1|2,0,0]=4 4300 B9R1.15 CCc1cccc[n+]1C Amb25742957 [0,1,0,0,0,1|2,0,0]=4 4301 B9R1.15 CCc1ccccc1F Amb10840487 [0,1,0,0,0,1|2,0,0]=4 4302 B9R1.15 CCc1ccncc1C Amb10565932 [0,1,0,0,0,1|2,0,0]=4 4303 B9R1.15 CCc1ncncc1Br Amb10068158 [0,1,0,0,0,1|2,0,0]=4 4304 B9R1.15 COC1=CC=COC1=O Amb25174071 [0,1,0,0,0,1|2,0,0]=4 4305 B9R1.15 COC1=COC=CC1=O Amb25735758 [0,1,0,0,0,1|2,0,0]=4 4306 B9R1.15 C[C@H]1CC=CO[C@@H]1CO Amb24723035 [0,1,0,0,0,1|0,0,2]=4 4307 B9R1.15 C[n+]1ccccc1CO Amb22445974 [0,1,0,0,0,1|1,0,0]=3 4308 B9R1.15 C[n+]1ccccc1CO Amb24543885 [0,1,0,0,0,1|1,0,0]=3 4309 B9R1.15 Cc1[n]c[n]cc1CO Amb23401791 [0,1,0,0,0,1|2,0,0]=4 4310 B9R1.15 Cc1[n]cc[n]c1CBr Amb22751199 [0,1,0,0,0,1|2,0,0]=4 4311 B9R1.15 Cc1[n]cc[n]c1CCl Amb19516783 [0,1,0,0,0,1|2,0,0]=4 4312 B9R1.15 Cc1[n]cc[n]c1CCl Amb22587268 [0,1,0,0,0,1|2,0,0]=4 4313 B9R1.15 Cc1[n]cc[n]c1CI Amb22751201 [0,1,0,0,0,1|2,0,0]=4 4314 B9R1.15 Cc1[n]cc[n]c1CN Amb22899640 [0,1,0,0,0,1|2,0,0]=4 4315 B9R1.15 Cc1[n]cc[n]c1CO Amb19516781 [0,1,0,0,0,1|1,0,0]=3 4316 B9R1.15 Cc1[n]cccc1CBr Amb18850480 [0,1,0,0,0,1|2,0,0]=4 4317 B9R1.15 Cc1[n]cccc1CBr Amb20671009 [0,1,0,0,0,1|2,0,0]=4 4318 B9R1.15 Cc1[n]cccc1CC Amb22169849 [0,1,0,0,0,1|2,0,0]=4 4319 B9R1.15 Cc1[n]cccc1CCl Amb18851725 [0,1,0,0,0,1|2,0,0]=4 4320 B9R1.15 Cc1[n]cccc1CCl Amb20171422 [0,1,0,0,0,1|2,0,0]=4 4321 B9R1.15 Cc1[n]cccc1CI Amb24494725 [0,1,0,0,0,1|2,0,0]=4 4322 B9R1.15 Cc1[n]cccc1CN Amb22747289 [0,1,0,0,0,1|2,0,0]=4 4323 B9R1.15 Cc1[n]cccc1CS Amb18852312 [0,1,0,0,0,1|1,1,0]=4 4324 B9R1.15 Cc1[n]cccc1NO Amb24062319 [0,1,0,0,0,1|2,0,0]=4 4325 B9R1.15 Cc1c[n]c[n]c1CC Amb24091553 [0,1,0,0,0,1|2,0,0]=4 4326 B9R1.15 Cc1c[n]c[n]c1CCl Amb23403013 [0,1,0,0,0,1|2,0,0]=4 4327 B9R1.15 Cc1c[n]c[n]c1CN Amb22055828 [0,1,0,0,0,1|2,0,0]=4 4328 B9R1.15 Cc1c[n]ccc1CBr Amb24752357 [0,1,0,0,0,1|2,0,0]=4 4329 B9R1.15 Cc1c[n]ccc1CCl Amb19516653 [0,1,0,0,0,1|2,0,0]=4 4330 B9R1.15 Cc1cc[n]cc1CBr Amb21964366 [0,1,0,0,0,1|2,0,0]=4 4331 B9R1.15 Cc1cc[n]cc1CBr Amb22436775 [0,1,0,0,0,1|2,0,0]=4 4332 B9R1.15 Cc1cc[n]cc1CCl Amb20668411 [0,1,0,0,0,1|2,0,0]=4 4333 B9R1.15 Cc1cc[n]cc1CCl Amb22059444 [0,1,0,0,0,1|2,0,0]=4 4334 B9R1.15 Cc1cc[n]cc1CN Amb22500751 [0,1,0,0,0,1|2,0,0]=4 4335 B9R1.15 Cc1cc[n]cc1CN Amb22747290 [0,1,0,0,0,1|2,0,0]=4 4336 B9R1.15 Cc1cc[n]cc1CO Amb19892286 [0,1,0,0,0,1|1,0,0]=3 4337 B9R1.15 Cc1cc[n]cc1CS Amb25839891 [0,1,0,0,0,1|1,1,0]=4 4338 B9R1.15 Cc1ccc[n]c1CCl Amb21964607 [0,1,0,0,0,1|2,0,0]=4 4339 B9R1.15 Cc1ccc[n]c1CI Amb25198271 [0,1,0,0,0,1|2,0,0]=4 4340 B9R1.15 Cc1ccc[n]c1CN Amb22233790 [0,1,0,0,0,1|2,0,0]=4 4341 B9R1.15 Cc1ccc[n]c1CN Amb22494638 [0,1,0,0,0,1|2,0,0]=4 4342 B9R1.15 Cc1ccc[n]c1CO Amb22233995 [0,1,0,0,0,1|1,0,0]=3 4343 B9R1.15 Cc1ccc[n]c1CS Amb25284674 [0,1,0,0,0,1|1,1,0]=4 4344 B9R1.15 Cc1ccc[n]c1NO Amb24675427 [0,1,0,0,0,1|2,0,0]=4 4345 B9R1.15 Cc1ccccc1CI Amb25147167 [0,1,0,0,0,1|2,0,0]=4 4346 B9R1.15 Cc1ccccc1CN Amb24065797 [0,1,0,0,0,1|2,0,0]=4 4347 B9R1.15 Cc1ccccc1NO Amb21961958 [0,1,0,0,0,1|2,0,0]=4 4348 B9R1.15 Cc1ccccc1[NH2+]O Amb23529777 [0,1,0,0,0,1|2,0,0]=4 4349 B9R1.15 Cc1ccccc1[NH2+]O Amb24113085 [0,1,0,0,0,1|2,0,0]=4 4350 B9R1.15 ClCc1[n]cccc1Br Amb21926821 [0,1,0,0,0,1|2,0,0]=4 4351 B9R1.15 ClCc1ccc[n]c1Br Amb22044048 [0,1,0,0,0,1|2,0,0]=4 4352 B9R1.15 ClCc1ccccc1Cl Amb1691713 [0,1,0,0,0,1|2,0,0]=4 4353 B9R1.15 ClCc1ccccc1O Amb17477840 [0,1,0,0,0,1|2,0,0]=4 4354 B9R1.15 ClCc1cccnc1Cl Amb13952360 [0,1,0,0,0,1|2,0,0]=4 4355 B9R1.15 ClCc1cccnc1Cl Amb13953079 [0,1,0,0,0,1|2,0,0]=4 4356 B9R1.15 ClCc1nccc[n+]1[O-] Amb13951662 [0,1,0,0,0,1|2,0,0]=4 4357 B9R1.15 Clc1[n]cc[n]c1CBr Amb20617926 [0,1,0,0,0,1|2,0,0]=4 4358 B9R1.15 Clc1[n]cc[n]c1CBr Amb22288908 [0,1,0,0,0,1|2,0,0]=4 4359 B9R1.15 Clc1[n]cc[n]c1CCl Amb19957845 [0,1,0,0,0,1|2,0,0]=4 4360 B9R1.15 Clc1[n]cc[n]c1CCl Amb21857838 [0,1,0,0,0,1|2,0,0]=4 4361 B9R1.15 Clc1[n]cccc1CBr Amb22753739 [0,1,0,0,0,1|2,0,0]=4 4362 B9R1.15 Clc1[n]cccc1CI Amb25376929 [0,1,0,0,0,1|2,0,0]=4 4363 B9R1.15 Clc1c[n]ccc1CBr Amb25032117 [0,1,0,0,0,1|2,0,0]=4 4364 B9R1.15 Clc1c[n]ccc1CCl Amb19148857 [0,1,0,0,0,1|2,0,0]=4 4365 B9R1.15 Clc1c[n]ccc1CCl Amb22011576 [0,1,0,0,0,1|2,0,0]=4 4366 B9R1.15 Clc1cc[n]cc1CCl Amb24091385 [0,1,0,0,0,1|2,0,0]=4 4367 B9R1.15 Clc1ccc[n]c1CBr Amb22494738 [0,1,0,0,0,1|2,0,0]=4 4368 B9R1.15 Clc1ccc[n]c1CBr Amb22494872 [0,1,0,0,0,1|2,0,0]=4 4369 B9R1.15 Clc1ccc[n]c1CCl Amb20671208 [0,1,0,0,0,1|2,0,0]=4 4370 B9R1.15 Clc1ccc[n]c1CCl Amb22494746 [0,1,0,0,0,1|2,0,0]=4 4371 B9R1.15 Clc1ccccc1CI Amb23571255 [0,1,0,0,0,1|2,0,0]=4 4372 B9R1.15 FCc1c[n]ccc1Cl Amb25369306 [0,1,0,0,0,1|2,0,0]=4 4373 B9R1.15 FCc1ccc[n]c1Cl Amb20620708 [0,1,0,0,0,1|2,0,0]=4 4374 B9R1.15 FCc1ccccc1Br Amb25762101 [0,1,0,0,0,1|2,0,0]=4 4375 B9R1.15 Fc1[n]cccc1CBr Amb22490568 [0,1,0,0,0,1|2,0,0]=4 4376 B9R1.15 Fc1[n]cccc1CCl Amb22490533 [0,1,0,0,0,1|2,0,0]=4 4377 B9R1.15 Fc1[n]cccc1CCl Amb22490569 [0,1,0,0,0,1|2,0,0]=4 4378 B9R1.15 Fc1c[n]ccc1CBr Amb22011572 [0,1,0,0,0,1|2,0,0]=4 4379 B9R1.15 Fc1c[n]ccc1CCl Amb22886714 [0,1,0,0,0,1|2,0,0]=4 4380 B9R1.15 Fc1c[n]ccc1CCl Amb25147215 [0,1,0,0,0,1|2,0,0]=4 4381 B9R1.15 Fc1cc[n]cc1CCl Amb24417206 [0,1,0,0,0,1|2,0,0]=4 4382 B9R1.15 Fc1ccc[n]c1CBr Amb21964584 [0,1,0,0,0,1|2,0,0]=4 4383 B9R1.15 Fc1ccc[n]c1CBr Amb22491310 [0,1,0,0,0,1|2,0,0]=4 4384 B9R1.15 Fc1ccc[n]c1CCl Amb19515818 [0,1,0,0,0,1|2,0,0]=4 4385 B9R1.15 Fc1ccc[n]c1CCl Amb21963959 [0,1,0,0,0,1|2,0,0]=4 4386 B9R1.15 Fc1ccccc1CI Amb23571315 [0,1,0,0,0,1|2,0,0]=4 4387 B9R1.15 Ic1[n]cccc1CI Amb24078630 [0,1,0,0,0,1|2,0,0]=4 4388 B9R1.15 Ic1ccc[n]c1CI Amb24060885 [0,1,0,0,0,1|2,0,0]=4 4389 B9R1.15 NC/1=CNC=N\C1=N\O Amb25053312 [0,1,0,0,0,1|2,0,0]=4 4390 B9R1.15 NCC1=CC=CNC1=O Amb18043158 [0,1,0,0,0,1|2,0,0]=4 4391 B9R1.15 NCC1=CC=CNC1=O Amb22054312 [0,1,0,0,0,1|2,0,0]=4 4392 B9R1.15 NC[13c]1[13cH][13cH][13cH][13cH][13c]1Br Amb22367385 [0,1,0,0,0,1|2,0,0]=4 4393 B9R1.15 NCc1[n]c[n]cc1Br Amb18523223 [0,1,0,0,0,1|2,0,0]=4 4394 B9R1.15 NCc1[n]c[n]cc1Cl Amb18908380 [0,1,0,0,0,1|2,0,0]=4 4395 B9R1.15 NCc1[n]cc[n]c1Br Amb24685176 [0,1,0,0,0,1|2,0,0]=4 4396 B9R1.15 NCc1[n]cc[n]c1O Amb18279588 [0,1,0,0,0,1|2,0,0]=4 4397 B9R1.15 NCc1[n]cccc1Br Amb22501100 [0,1,0,0,0,1|2,0,0]=4 4398 B9R1.15 NCc1[n]cccc1Br Amb22756452 [0,1,0,0,0,1|2,0,0]=4 4399 B9R1.15 NCc1[n]cccc1Cl Amb19929608 [0,1,0,0,0,1|2,0,0]=4 4400 B9R1.15 NCc1[n]cccc1Cl Amb21857817 [0,1,0,0,0,1|2,0,0]=4 4401 B9R1.15 NCc1[n]cccc1Cl Amb22756434 [0,1,0,0,0,1|2,0,0]=4 4402 B9R1.15 NCc1[n]cccc1F Amb21962659 [0,1,0,0,0,1|2,0,0]=4 4403 B9R1.15 NCc1[n]cccc1F Amb22754755 [0,1,0,0,0,1|2,0,0]=4 4404 B9R1.15 NCc1[n]cccc1I Amb24061085 [0,1,0,0,0,1|2,0,0]=4 4405 B9R1.15 NCc1[n]cccc1O Amb22501146 [0,1,0,0,0,1|2,0,0]=4 4406 B9R1.15 NCc1[n]cccc1S Amb24427279 [0,1,0,0,0,1|2,0,0]=4 4407 B9R1.15 NCc1c[n]ccc1Br Amb22292211 [0,1,0,0,0,1|2,0,0]=4 4408 B9R1.15 NCc1c[n]ccc1Br Amb24068528 [0,1,0,0,0,1|2,0,0]=4 4409 B9R1.15 NCc1c[n]ccc1Cl Amb18831607 [0,1,0,0,0,1|2,0,0]=4 4410 B9R1.15 NCc1c[n]ccc1Cl Amb22886403 [0,1,0,0,0,1|2,0,0]=4 4411 B9R1.15 NCc1c[n]ccc1F Amb25320760 [0,1,0,0,0,1|2,0,0]=4 4412 B9R1.15 NCc1c[n]ccc1O Amb18908274 [0,1,0,0,0,1|2,0,0]=4 4413 B9R1.15 NCc1cc[n]cc1Br Amb18252030 [0,1,0,0,0,1|2,0,0]=4 4414 B9R1.15 NCc1cc[n]cc1Br Amb22500955 [0,1,0,0,0,1|2,0,0]=4 4415 B9R1.15 NCc1cc[n]cc1Cl Amb18831608 [0,1,0,0,0,1|2,0,0]=4 4416 B9R1.15 NCc1cc[n]cc1Cl Amb21927836 [0,1,0,0,0,1|2,0,0]=4 4417 B9R1.15 NCc1cc[n]cc1I Amb24554252 [0,1,0,0,0,1|2,0,0]=4 4418 B9R1.15 NCc1cc[n]cc1O Amb20247896 [0,1,0,0,0,1|2,0,0]=4 4419 B9R1.15 NCc1ccc[n]c1Br Amb20247921 [0,1,0,0,0,1|2,0,0]=4 4420 B9R1.15 NCc1ccc[n]c1Br Amb22831651 [0,1,0,0,0,1|2,0,0]=4 4421 B9R1.15 NCc1ccc[n]c1Cl Amb19929364 [0,1,0,0,0,1|2,0,0]=4 4422 B9R1.15 NCc1ccc[n]c1Cl Amb22498734 [0,1,0,0,0,1|2,0,0]=4 4423 B9R1.15 NCc1ccc[n]c1F Amb21857815 [0,1,0,0,0,1|2,0,0]=4 4424 B9R1.15 NCc1ccccc1C Amb1651810 [0,1,0,0,0,1|2,0,0]=4 4425 B9R1.15 NCc1ccccc1Cl Amb19958655 [0,1,0,0,0,1|2,0,0]=4 4426 B9R1.15 NCc1ccccc1I Amb16193175 [0,1,0,0,0,1|2,0,0]=4 4427 B9R1.15 NCc1ccccc1O Amb1111172 [0,1,0,0,0,1|2,0,0]=4 4428 B9R1.15 NCc1ccccc1O Amb13951900 [0,1,0,0,0,1|2,0,0]=4 4429 B9R1.15 NCc1cccnc1F Amb10603597 [0,1,0,0,0,1|2,0,0]=4 4430 B9R1.15 NCc1cccnc1N Amb15701368 [0,1,0,0,0,1|2,0,0]=4 4431 B9R1.15 NCc1cccnc1O Amb16233816 [0,1,0,0,0,1|2,0,0]=4 4432 B9R1.15 NCc1ccncc1F Amb13890638 [0,1,0,0,0,1|2,0,0]=4 4433 B9R1.15 NCc1ccncc1F Amb16186030 [0,1,0,0,0,1|2,0,0]=4 4434 B9R1.15 NCc1ccncc1N Amb16230501 [0,1,0,0,0,1|2,0,0]=4 4435 B9R1.15 NCc1cnccc1N Amb10602159 [0,1,0,0,0,1|2,0,0]=4 4436 B9R1.15 NCc1nccnc1Cl Amb16234022 [0,1,0,0,0,1|2,0,0]=4 4437 B9R1.15 Nc1[n][n]ccc1CO Amb24637273 [0,1,0,0,0,1|2,0,0]=4 4438 B9R1.15 Nc1[n]c[n]cc1CO Amb20668186 [0,1,0,0,0,1|2,0,0]=4 4439 B9R1.15 Nc1[n]cc[n]c1CN Amb18947969 [0,1,0,0,0,1|2,0,0]=4 4440 B9R1.15 Nc1[n]cc[n]c1CO Amb20622522 [0,1,0,0,0,1|1,0,0]=3 4441 B9R1.15 Nc1[n]cccc1CBr Amb20247764 [0,1,0,0,0,1|2,0,0]=4 4442 B9R1.15 Nc1[n]cccc1CCl Amb22500055 [0,1,0,0,0,1|2,0,0]=4 4443 B9R1.15 Nc1[n]cccc1CI Amb20247770 [0,1,0,0,0,1|2,0,0]=4 4444 B9R1.15 Nc1[n]cccc1CN Amb22274044 [0,1,0,0,0,1|2,0,0]=4 4445 B9R1.15 Nc1[n]cccc1CN Amb23401796 [0,1,0,0,0,1|2,0,0]=4 4446 B9R1.15 Nc1[n]cccc1CS Amb24062512 [0,1,0,0,0,1|1,1,0]=4 4447 B9R1.15 Nc1c[n]c[n]c1CO Amb22755330 [0,1,0,0,0,1|1,0,0]=3 4448 B9R1.15 Nc1c[n]ccc1CBr Amb22750984 [0,1,0,0,0,1|2,0,0]=4 4449 B9R1.15 Nc1c[n]ccc1CN Amb22755075 [0,1,0,0,0,1|2,0,0]=4 4450 B9R1.15 Nc1cc[n]cc1CF Amb24621221 [0,1,0,0,0,1|2,0,0]=4 4451 B9R1.15 Nc1cc[n]cc1CN Amb22491462 [0,1,0,0,0,1|2,0,0]=4 4452 B9R1.15 Nc1cc[n]cc1CS Amb24062513 [0,1,0,0,0,1|1,1,0]=4 4453 B9R1.15 Nc1ccc[n]c1CF Amb24581688 [0,1,0,0,0,1|2,0,0]=4 4454 B9R1.15 Nc1ccc[n]c1CN Amb18908273 [0,1,0,0,0,1|2,0,0]=4 4455 B9R1.15 Nc1ccc[n]c1CN Amb23401213 [0,1,0,0,0,1|2,0,0]=4 4456 B9R1.15 Nc1ccccc1CBr Amb18649219 [0,1,0,0,0,1|2,0,0]=4 4457 B9R1.15 Nc1ccccc1CF Amb19515970 [0,1,0,0,0,1|2,0,0]=4 4458 B9R1.15 Nc1ccccc1NO Amb25371431 [0,1,0,0,0,1|2,0,0]=4 4459 B9R1.15 O=C1NC=CC=C1CBr Amb18925116 [0,1,0,0,0,1|2,0,0]=4 4460 B9R1.15 O=C1NC=CC=C1CCl Amb18261403 [0,1,0,0,0,1|2,0,0]=4 4461 B9R1.15 O=C1NC=CC=C1CS Amb18923200 [0,1,0,0,0,1|1,1,0]=4 4462 B9R1.15 O=C1OC=CC=C1CCl Amb24460780 [0,1,0,0,0,1|1,0,0]=3 4463 B9R1.15 O=CC=1COC=CC1Cl Amb24357235 [0,1,0,0,0,1|0,0,2]=4 4464 B9R1.15 OC1C=CCOC1CO Amb25702117 [0,1,0,0,0,1|0,0,2]=4 4465 B9R1.15 OC1CC=COC1CO Amb24482017 [0,1,0,0,0,1|0,0,2]=4 4466 B9R1.15 OC=1C=COCC1C=O Amb24440922 [0,1,0,0,0,1|0,0,2]=4 4467 B9R1.15 OCC1=CC=CNC1=O Amb18922455 [0,1,0,0,0,1|1,0,0]=3 4468 B9R1.15 OCC1=CC=CNC1=S Amb25210908 [0,1,0,0,0,1|1,0,0]=3 4469 B9R1.15 OCC1=CC=NNC1=O Amb23455762 [0,1,0,0,0,1|2,0,0]=4 4470 B9R1.15 OCC1C=CC=NC1=O Amb24085377 [0,1,0,0,0,1|1,0,1]=4 4471 B9R1.15 OCC1CCC=CC1=O Amb25086884 [0,1,0,0,0,1|1,0,1]=4 4472 B9R1.15 OCN1C=CC=NC1=O Amb24403912 [0,1,0,0,0,1|2,0,0]=4 4473 B9R1.15 OC[C@H]1OC=CCC1=O Amb25807504 [0,1,0,0,0,1|0,0,1]=3 4474 B9R1.15 OCc1[n]c[n]cc1Br Amb22497742 [0,1,0,0,0,1|1,0,0]=3 4475 B9R1.15 OCc1[n]c[n]cc1Cl Amb25188981 [0,1,0,0,0,1|1,0,0]=3 4476 B9R1.15 OCc1[n]cccc1I Amb23447033 [0,1,0,0,0,1|1,0,0]=3 4477 B9R1.15 OCc1[n]cccc1S Amb25306650 [0,1,0,0,0,1|1,0,0]=3 4478 B9R1.15 OCc1c[n]c[n]c1Cl Amb22236141 [0,1,0,0,0,1|2,0,0]=4 4479 B9R1.15 OCc1c[n]ccc1Br Amb19958695 [0,1,0,0,0,1|1,0,0]=3 4480 B9R1.15 OCc1c[n]ccc1Br Amb20671165 [0,1,0,0,0,1|1,0,0]=3 4481 B9R1.15 OCc1c[n]ccc1Cl Amb22233797 [0,1,0,0,0,1|1,0,0]=3 4482 B9R1.15 OCc1c[n]ccc1F Amb25147035 [0,1,0,0,0,1|1,0,0]=3 4483 B9R1.15 OCc1cc[n][n]c1Cl Amb24478732 [0,1,0,0,0,1|2,0,0]=4 4484 B9R1.15 OCc1cc[n]cc1Br Amb19958216 [0,1,0,0,0,1|1,0,0]=3 4485 B9R1.15 OCc1cc[n]cc1I Amb23447040 [0,1,0,0,0,1|1,0,0]=3 4486 B9R1.15 OCc1cc[n]cc1S Amb24099590 [0,1,0,0,0,1|1,0,0]=3 4487 B9R1.15 OCc1cccc[n+]1[O-] Amb17615558 [0,1,0,0,0,1|1,0,0]=3 4488 B9R1.15 OCc1ccccc1N Amb1808337 [0,1,0,0,0,1|1,0,0]=3 4489 B9R1.15 OCc1cccnc1F Amb10603593 [0,1,0,0,0,1|1,0,0]=3 4490 B9R1.15 OCc1ccncc1F Amb13887027 [0,1,0,0,0,1|1,0,0]=3 4491 B9R1.15 OCc1cnccc1Cl Amb10068416 [0,1,0,0,0,1|1,0,0]=3 4492 B9R1.15 OCc1ncccc1Br Amb13882830 [0,1,0,0,0,1|1,0,0]=3 4493 B9R1.15 OCc1ncccc1Cl Amb15695291 [0,1,0,0,0,1|1,0,0]=3 4494 B9R1.15 OCc1nccnc1Cl Amb16233469 [0,1,0,0,0,1|1,0,0]=3 4495 B9R1.15 ONC1=NC=CNC1=O Amb24481951 [0,1,0,0,0,1|2,0,0]=4 4496 B9R1.15 ONc1[n]cccc1Br Amb25221060 [0,1,0,0,0,1|2,0,0]=4 4497 B9R1.15 ONc1[n]cccc1Cl Amb24481952 [0,1,0,0,0,1|2,0,0]=4 4498 B9R1.15 ONc1cc[n]cc1Cl Amb24354730 [0,1,0,0,0,1|2,0,0]=4 4499 B9R1.15 ONc1ccc[n]c1I Amb24096630 [0,1,0,0,0,1|2,0,0]=4 4500 B9R1.15 ONc1ccccc1Cl Amb24093632 [0,1,0,0,0,1|2,0,0]=4 4501 B9R1.15 ONc1ccccc1I Amb22230990 [0,1,0,0,0,1|2,0,0]=4 4502 B9R1.15 O[C@H]1CC=CO[C@@H]1CO Amb25303086 [0,1,0,0,0,1|0,0,2]=4 4503 B9R1.15 O\C=C/1\C=CN=CC1=O Amb25132276 [0,1,0,0,0,1|1,0,1]=4 4504 B9R1.15 O\C=C/1\CCC=CC1=O Amb24562020 [0,1,0,0,0,1|1,0,1]=4 4505 B9R1.15 O\C=C/1\N=CC=CC1=O Amb25265487 [0,1,0,0,0,1|1,0,1]=4 4506 B9R1.15 O\N=C/1\C=CC=CC1=O Amb25348202 [0,1,0,0,0,1|2,0,0]=4 4507 B9R1.15 Oc1[n]cccc1CO Amb20247914 [0,1,0,0,0,1|1,0,0]=3 4508 B9R1.15 Oc1c[n]ccc1CBr Amb25697071 [0,1,0,0,0,1|2,0,0]=4 4509 B9R1.15 Oc1c[n]ccc1CO Amb19958756 [0,1,0,0,0,1|1,0,0]=3 4510 B9R1.15 Oc1cc[n]cc1CO Amb20247881 [0,1,0,0,0,1|1,0,0]=3 4511 B9R1.15 Oc1ccc[n]c1CBr Amb24062574 [0,1,0,0,0,1|2,0,0]=4 4512 B9R1.15 Oc1ccc[n]c1CCl Amb24062575 [0,1,0,0,0,1|2,0,0]=4 4513 B9R1.15 Oc1ccccc1CBr Amb18129657 [0,1,0,0,0,1|2,0,0]=4 4514 B9R1.15 Oc1ccccc1CF Amb24645490 [0,1,0,0,0,1|2,0,0]=4 4515 B9R1.15 Oc1ccccc1CI Amb25275415 [0,1,0,0,0,1|2,0,0]=4 4516 B9R1.15 Oc1ccccc1CS Amb25188976 [0,1,0,0,0,1|1,1,0]=4 4517 B9R1.15 Oc1ccccc1NO Amb24476488 [0,1,0,0,0,1|2,0,0]=4 4518 B9R1.15 SCc1[n]cccc1Br Amb24528797 [0,1,0,0,0,1|1,1,0]=4 4519 B9R1.15 SCc1cc[n]cc1Cl Amb24465690 [0,1,0,0,0,1|1,1,0]=4 4520 B9R1.15 SCc1ccc[n]c1Cl Amb22396091 [0,1,0,0,0,1|1,1,0]=4 4521 B9R1.118 CC1(CO)CC=CCO1 Amb24661081 [0,1,0,0,0,1|0,0,2]=4 4522 B9R1.118 CC1(CO)CCC=CO1 Amb25226631 [0,1,0,0,0,1|0,0,2]=4 4523 B9R1.118 C[C@]1(CO)C=CCCO1 Amb24587977 [0,1,0,0,0,1|0,0,2]=4 4524 B9R1.118 OCC1(Br)C=CC=CN1 Amb24065442 [0,1,0,0,0,1|1,0,1]=4 4525 B9R1.7 Brc1c[s]c(CCBr)c1 Amb18231829 [0,2,0,0,0,0|1,1,0]=4 4526 B9R1.7 Brc1cc(sc1)CC#N Amb10070334 [0,2,0,0,0,0|1,1,0]=4 4527 B9R1.7 Brc1ccc(CCBr)[s]1 Amb18232370 [0,2,0,0,0,0|1,1,0]=4 4528 B9R1.7 C=CCC1=CCC(=O)O1 Amb24583267 [0,2,0,0,0,0|1,0,1]=4 4529 B9R1.7 C=NCc1ccc(Cl)[s]1 Amb24511846 [0,2,0,0,0,0|1,1,0]=4 4530 B9R1.7 CCCC1=CC(=O)NO1 Amb24481719 [0,2,0,0,0,0|2,0,0]=4 4531 B9R1.7 CCCC1C=CC(=O)O1 Amb25793308 [0,2,0,0,0,0|1,0,1]=4 4532 B9R1.7 CCCc1c[n]c(S)o1 Amb24580745 [0,2,0,0,0,0|2,0,0]=4 4533 B9R1.7 CCCc1cc(Br)c[s]1 Amb24079077 [0,2,0,0,0,0|1,1,0]=4 4534 B9R1.7 CCCc1cc(C)c[nH]1 Amb17666652 [0,2,0,0,0,0|2,0,0]=4 4535 B9R1.7 CCCc1cc(N)[n]o1 Amb18642428 [0,2,0,0,0,0|2,0,0]=4 4536 B9R1.7 CCCc1cc(N)c[s]1 Amb18671245 [0,2,0,0,0,0|1,1,0]=4 4537 B9R1.7 CCCc1ccc(Br)[s]1 Amb20617246 [0,2,0,0,0,0|1,1,0]=4 4538 B9R1.7 CCCc1ccc(Br)o1 Amb24318772 [0,2,0,0,0,0|1,0,0]=3 4539 B9R1.7 CCCc1ccc(I)[s]1 Amb25270488 [0,2,0,0,0,0|1,1,0]=4 4540 B9R1.7 CCCc1ccc(N)[s]1 Amb20617247 [0,2,0,0,0,0|1,1,0]=4 4541 B9R1.7 CCCc1ccc(S)o1 Amb24541239 [0,2,0,0,0,0|1,0,0]=3 4542 B9R1.7 CCNc1ccc(Br)[s]1 Amb18055074 [0,2,0,0,0,0|1,1,0]=4 4543 B9R1.7 CCNc1ccc(Cl)[s]1 Amb18055067 [0,2,0,0,0,0|1,1,0]=4 4544 B9R1.7 CCOC1=CCC(=O)O1 Amb22001902 [0,2,0,0,0,0|1,0,1]=4 4545 B9R1.7 CCO[C@@H]1C=CC(=O)O1 Amb25060479 [0,2,0,0,0,0|1,0,1]=4 4546 B9R1.7 CCOc1[n]c(Br)co1 Amb25704186 [0,2,0,0,0,0|2,0,0]=4 4547 B9R1.7 CCOc1cc(N)no1 Amb17935873 [0,2,0,0,0,0|2,0,0]=4 4548 B9R1.7 CCOc1cnc(o1)C Amb10554426 [0,2,0,0,0,0|2,0,0]=4 4549 B9R1.7 CCSc1cc(Br)co1 Amb25351967 [0,2,0,0,0,0|1,0,0]=3 4550 B9R1.7 CCSc1ccc(Cl)[s]1 Amb25836878 [0,2,0,0,0,0|1,1,0]=4 4551 B9R1.7 CCSc1ccc(O)o1 Amb25234153 [0,2,0,0,0,0|1,0,0]=3 4552 B9R1.7 CCSc1ccc(s1)N Amb17109263 [0,2,0,0,0,0|1,1,0]=4 4553 B9R1.7 CCSc1ccc(s1)O Amb17201915 [0,2,0,0,0,0|1,1,0]=4 4554 B9R1.7 CC\C=C/1\C=CC(=O)O1 Amb25359381 [0,2,0,0,0,0|1,0,0]=3 4555 B9R1.7 CC\N=C\1/C=CC(=O)O1 Amb25274141 [0,2,0,0,0,0|1,0,0]=3 4556 B9R1.7 CNCC1=CC(=O)NO1 Amb24694968 [0,2,0,0,0,0|2,0,0]=4 4557 B9R1.7 CNCc1c[n]c(Cl)o1 Amb24743890 [0,2,0,0,0,0|2,0,0]=4 4558 B9R1.7 CNCc1c[n]c(N)o1 Amb24502374 [0,2,0,0,0,0|2,0,0]=4 4559 B9R1.7 CNCc1cc(Cl)c[nH]1 Amb20669048 [0,2,0,0,0,0|2,0,0]=4 4560 B9R1.7 CNCc1cc(Cl)c[s]1 Amb23441688 [0,2,0,0,0,0|1,1,0]=4 4561 B9R1.7 CNCc1cc(Cl)co1 Amb23537708 [0,2,0,0,0,0|1,0,0]=3 4562 B9R1.7 CNCc1ccc(Br)o1 Amb25280004 [0,2,0,0,0,0|1,0,0]=3 4563 B9R1.7 CNCc1ccc(Cl)o1 Amb18523734 [0,2,0,0,0,0|1,0,0]=3 4564 B9R1.7 CNCc1ccc(F)[s]1 Amb24269266 [0,2,0,0,0,0|1,1,0]=4 4565 B9R1.7 CNCc1ccc(F)[s]1 Amb25247421 [0,2,0,0,0,0|1,1,0]=4 4566 B9R1.7 CNCc1ccc(N)o1 Amb18101397 [0,2,0,0,0,0|1,0,0]=3 4567 B9R1.7 CNCc1ccc(o1)Br Amb1131647 [0,2,0,0,0,0|1,0,0]=3 4568 B9R1.7 CNCc1ccc(o1)C Amb1105046 [0,2,0,0,0,0|1,0,0]=3 4569 B9R1.7 CNCc1ccc(s1)Br Amb2311980 [0,2,0,0,0,0|1,1,0]=4 4570 B9R1.7 CNCc1cnc(o1)C Amb10071349 [0,2,0,0,0,0|2,0,0]=4 4571 B9R1.7 COCC1=NNC(=O)O1 Amb20668827 [0,2,0,0,0,0|2,0,0]=4 4572 B9R1.7 COC[C@@H]1C=CC(=O)O1 Amb24726034 [0,2,0,0,0,0|0,0,1]=3 4573 B9R1.7 COC[n]1cc(Br)c[n]1 Amb23401118 [0,2,0,0,0,0|2,0,0]=4 4574 B9R1.7 COC[n]1cc(C)c[n]1 Amb24615530 [0,2,0,0,0,0|2,0,0]=4 4575 B9R1.7 COC[n]1cc(I)c[n]1 Amb23401115 [0,2,0,0,0,0|2,0,0]=4 4576 B9R1.7 COC[n]1ccc(C)[n]1 Amb25744150 [0,2,0,0,0,0|2,0,0]=4 4577 B9R1.7 COCc1[n][n]c(Br)o1 Amb24377561 [0,2,0,0,0,0|2,0,0]=4 4578 B9R1.7 COCc1[n][n]c(I)o1 Amb24481878 [0,2,0,0,0,0|2,0,0]=4 4579 B9R1.7 COCc1[n]c(Br)[n]o1 Amb24502344 [0,2,0,0,0,0|2,0,0]=4 4580 B9R1.7 COCc1c[nH]c(N)[n]1 Amb24582718 [0,2,0,0,0,0|2,0,0]=4 4581 B9R1.7 COCc1c[n]c(Br)[s]1 Amb25694265 [0,2,0,0,0,0|1,1,0]=4 4582 B9R1.7 COCc1c[n]c(Cl)[s]1 Amb20618687 [0,2,0,0,0,0|1,1,0]=4 4583 B9R1.7 COCc1c[n]c(N)[s]1 Amb25189073 [0,2,0,0,0,0|1,1,0]=4 4584 B9R1.7 COCc1c[s]c(Cl)[n]1 Amb25359939 [0,2,0,0,0,0|2,0,0]=4 4585 B9R1.7 COCc1c[s]c(O)[n]1 Amb24364821 [0,2,0,0,0,0|2,0,0]=4 4586 B9R1.7 COCc1cc(Br)co1 Amb25178576 [0,2,0,0,0,0|0,0,0]=2 4587 B9R1.7 COCc1cc(Cl)o[n]1 Amb25095952 [0,2,0,0,0,0|2,0,0]=4 4588 B9R1.7 COCc1cc(N)[nH][n]1 Amb23005834 [0,2,0,0,0,0|2,0,0]=4 4589 B9R1.7 COCc1cc(N)[n]o1 Amb18642587 [0,2,0,0,0,0|1,0,0]=3 4590 B9R1.7 COCc1cc(N)o[n]1 Amb23504005 [0,2,0,0,0,0|2,0,0]=4 4591 B9R1.7 COCc1cc(O)o[n]1 Amb25112983 [0,2,0,0,0,0|2,0,0]=4 4592 B9R1.7 COCc1cc[n](C)[n]1 Amb24269384 [0,2,0,0,0,0|2,0,0]=4 4593 B9R1.7 COCc1ccc(Br)[s]1 Amb25116824 [0,2,0,0,0,0|0,1,0]=3 4594 B9R1.7 COCc1ccc(Br)o1 Amb25837821 [0,2,0,0,0,0|0,0,0]=2 4595 B9R1.7 COCc1ccc(Cl)[s]1 Amb25365290 [0,2,0,0,0,0|0,1,0]=3 4596 B9R1.7 COCc1ccc(I)[s]1 Amb24638308 [0,2,0,0,0,0|0,1,0]=3 4597 B9R1.7 COCc1ccc(I)o1 Amb23538044 [0,2,0,0,0,0|0,0,0]=2 4598 B9R1.7 COCc1coc(Br)c1 Amb25185389 [0,2,0,0,0,0|2,0,0]=4 4599 B9R1.7 COCc1coc(I)[n]1 Amb24603043 [0,2,0,0,0,0|2,0,0]=4 4600 B9R1.7 COCc1csc(n1)C Amb2422078 [0,2,0,0,0,0|2,0,0]=4 4601 B9R1.7 COCc1nc(no1)N Amb15701418 [0,2,0,0,0,0|2,0,0]=4 4602 B9R1.7 COCn1cc(cn1)N Amb1946508 [0,2,0,0,0,0|2,0,0]=4 4603 B9R1.7 CSCc1cc(Br)c[s]1 Amb24340088 [0,2,0,0,0,0|0,2,0]=4 4604 B9R1.7 CSCc1ccc(Br)[s]1 Amb25830767 [0,2,0,0,0,0|0,2,0]=4 4605 B9R1.7 CSCc1ccc(S)o1 Amb24476599 [0,2,0,0,0,0|0,1,0]=3 4606 B9R1.7 C[n]1c[n]c(CNO)c1 Amb25317733 [0,2,0,0,0,0|2,0,0]=4 4607 B9R1.7 C[n]1cc(CCO)cc1 Amb18860516 [0,2,0,0,0,0|2,0,0]=4 4608 B9R1.7 C[n]1cc(CNO)cc1 Amb24395952 [0,2,0,0,0,0|2,0,0]=4 4609 B9R1.7 C[n]1ccc(CCO)[n]1 Amb25308759 [0,2,0,0,0,0|2,0,0]=4 4610 B9R1.7 C[n]1ccc(CNO)[n]1 Amb24636195 [0,2,0,0,0,0|2,0,0]=4 4611 B9R1.7 C[n]1ccc(CON)[n]1 Amb18642510 [0,2,0,0,0,0|2,0,0]=4 4612 B9R1.7 C\N=C\c1ccc(Cl)o1 Amb24679384 [0,2,0,0,0,0|1,0,1]=4 4613 B9R1.7 Cc1[n]c(CON)c[s]1 Amb24103233 [0,2,0,0,0,0|2,0,0]=4 4614 B9R1.7 Cc1[n]cc(CCC)o1 Amb25374470 [0,2,0,0,0,0|2,0,0]=4 4615 B9R1.7 Cc1[n]cc(CCCl)o1 Amb24413860 [0,2,0,0,0,0|2,0,0]=4 4616 B9R1.7 Cc1[n]cc(CCO)[s]1 Amb23536232 [0,2,0,0,0,0|1,1,0]=4 4617 B9R1.7 Cc1[n]cc(CON)[s]1 Amb25092356 [0,2,0,0,0,0|1,1,0]=4 4618 B9R1.7 Cc1[n]oc(COC)[n]1 Amb25855012 [0,2,0,0,0,0|2,0,0]=4 4619 B9R1.7 Cc1c[n][n](CCO)c1 Amb22587123 [0,2,0,0,0,0|2,0,0]=4 4620 B9R1.7 Cc1c[n]c(CNC)o1 Amb18860649 [0,2,0,0,0,0|2,0,0]=4 4621 B9R1.7 Cc1c[n]c(CSC)o1 Amb24689356 [0,2,0,0,0,0|1,1,0]=4 4622 B9R1.7 Cc1c[s]c(CCO)[n]1 Amb24417243 [0,2,0,0,0,0|1,1,0]=4 4623 B9R1.7 Cc1c[s]c(NCO)[n]1 Amb24068942 [0,2,0,0,0,0|1,1,0]=4 4624 B9R1.7 Cc1cc(C=NO)[nH]c1 Amb25268477 [0,2,0,0,0,0|1,0,1]=4 4625 B9R1.7 Cc1cc(C=NO)oc1 Amb25211029 [0,2,0,0,0,0|0,0,1]=3 4626 B9R1.7 Cc1cc(CC#N)[s]c1 Amb24645305 [0,2,0,0,0,0|1,1,0]=4 4627 B9R1.7 Cc1cc(CC=C)o[n]1 Amb24557641 [0,2,0,0,0,0|2,0,0]=4 4628 B9R1.7 Cc1cc(CCCl)o[n]1 Amb24376595 [0,2,0,0,0,0|2,0,0]=4 4629 B9R1.7 Cc1cc(CCN)[nH]c1 Amb18832865 [0,2,0,0,0,0|2,0,0]=4 4630 B9R1.7 Cc1cc(CCN)[s]c1 Amb18831670 [0,2,0,0,0,0|1,1,0]=4 4631 B9R1.7 Cc1cc(CCN)oc1 Amb18832812 [0,2,0,0,0,0|1,0,0]=3 4632 B9R1.7 Cc1cc(CCO)[nH][n]1 Amb24372058 [0,2,0,0,0,0|2,0,0]=4 4633 B9R1.7 Cc1cc(CCO)c[s]1 Amb24672867 [0,2,0,0,0,0|2,0,0]=4 4634 B9R1.7 Cc1cc(CCO)co1 Amb25058458 [0,2,0,0,0,0|2,0,0]=4 4635 B9R1.7 Cc1cc(CCO)o[n]1 Amb21936274 [0,2,0,0,0,0|1,0,0]=3 4636 B9R1.7 Cc1cc(CNN)[s]c1 Amb24689793 [0,2,0,0,0,0|1,1,0]=4 4637 B9R1.7 Cc1cc(CNO)o[n]1 Amb24637557 [0,2,0,0,0,0|1,0,0]=3 4638 B9R1.7 Cc1cc(COC)[n][nH]1 Amb19737371 [0,2,0,0,0,0|2,0,0]=4 4639 B9R1.7 Cc1cc(COC)[n]o1 Amb25197675 [0,2,0,0,0,0|2,0,0]=4 4640 B9R1.7 Cc1cc(N=C=O)oc1 Amb24665949 [0,2,0,0,0,0|0,0,2]=4 4641 B9R1.7 Cc1cc(on1)CC#N Amb15701569 [0,2,0,0,0,0|2,0,0]=4 4642 B9R1.7 Cc1cc(sc1)CCO Amb17593605 [0,2,0,0,0,0|0,1,0]=3 4643 B9R1.7 Cc1ccc(C=[N+]=[N-])o1 Amb24638381 [0,2,0,0,0,0|1,0,1]=4 4644 B9R1.7 Cc1ccc(CC#C)[s]1 Amb25218039 [0,2,0,0,0,0|1,1,0]=4 4645 B9R1.7 Cc1ccc(CC#N)[s]1 Amb23005966 [0,2,0,0,0,0|1,1,0]=4 4646 B9R1.7 Cc1ccc(CC=O)[s]1 Amb24679545 [0,2,0,0,0,0|0,1,1]=4 4647 B9R1.7 Cc1ccc(CCBr)[s]1 Amb25741696 [0,2,0,0,0,0|1,1,0]=4 4648 B9R1.7 Cc1ccc(CCC)o1 Amb22339463 [0,2,0,0,0,0|1,0,0]=3 4649 B9R1.7 Cc1ccc(CCN)[nH]1 Amb21971484 [0,2,0,0,0,0|2,0,0]=4 4650 B9R1.7 Cc1ccc(CCN)[s]1 Amb22749482 [0,2,0,0,0,0|1,1,0]=4 4651 B9R1.7 Cc1ccc(CCO)o1 Amb24496246 [0,2,0,0,0,0|0,0,0]=2 4652 B9R1.7 Cc1ccc(CNC)[nH]1 Amb23153430 [0,2,0,0,0,0|2,0,0]=4 4653 B9R1.7 Cc1ccc(CON)o1 Amb24679622 [0,2,0,0,0,0|0,0,0]=2 4654 B9R1.7 Cc1ccc(CSC)o1 Amb24696980 [0,2,0,0,0,0|0,1,0]=3 4655 B9R1.7 Cc1ccc(\C=N/O)o1 Amb25147225 [0,2,0,0,0,0|0,0,1]=3 4656 B9R1.7 Cc1ccc(\C=N\N)o1 Amb25788831 [0,2,0,0,0,0|1,0,1]=4 4657 B9R1.7 Cc1ccc(o1)OCC Amb25238828 [0,2,0,0,0,0|1,0,0]=3 4658 B9R1.7 Cc1ccc(o1)SCC Amb25174134 [0,2,0,0,0,0|1,0,0]=3 4659 B9R1.7 Cc1coc(CCN)[n]1 Amb18832751 [0,2,0,0,0,0|2,0,0]=4 4660 B9R1.7 Cc1coc(CCO)[n]1 Amb25765513 [0,2,0,0,0,0|1,0,0]=3 4661 B9R1.7 Cc1coc(CNC)[n]1 Amb18832730 [0,2,0,0,0,0|2,0,0]=4 4662 B9R1.7 Cc1coc([n]1)SCC Amb25721089 [0,2,0,0,0,0|2,0,0]=4 4663 B9R1.7 Cc1ncc(o1)CC#N Amb10071204 [0,2,0,0,0,0|2,0,0]=4 4664 B9R1.7 Cc1ncc(o1)CCN Amb17399806 [0,2,0,0,0,0|2,0,0]=4 4665 B9R1.7 ClCCc1cc(Br)c[s]1 Amb18861068 [0,2,0,0,0,0|1,1,0]=4 4666 B9R1.7 ClCCc1ccc(Br)[s]1 Amb18225218 [0,2,0,0,0,0|1,1,0]=4 4667 B9R1.7 ClCCc1ccc(Br)o1 Amb25147196 [0,2,0,0,0,0|1,0,0]=3 4668 B9R1.7 Clc1c[s]c(CCCl)c1 Amb25340889 [0,2,0,0,0,0|1,1,0]=4 4669 B9R1.7 Clc1ccc(CCBr)[s]1 Amb18225213 [0,2,0,0,0,0|1,1,0]=4 4670 B9R1.7 Clc1ccc(CCCl)[s]1 Amb18862991 [0,2,0,0,0,0|1,1,0]=4 4671 B9R1.7 N#CCC1C=CC(=O)O1 Amb18124291 [0,2,0,0,0,0|1,0,1]=4 4672 B9R1.7 N#CCc1cc(Br)[n]o1 Amb24596327 [0,2,0,0,0,0|2,0,0]=4 4673 B9R1.7 N#CCc1cc(Br)co1 Amb18129572 [0,2,0,0,0,0|1,0,0]=3 4674 B9R1.7 N#CCc1ccc(F)[s]1 Amb24192737 [0,2,0,0,0,0|1,1,0]=4 4675 B9R1.7 NCCC1=CC(=O)NO1 Amb18832645 [0,2,0,0,0,0|2,0,0]=4 4676 B9R1.7 NCCc1cc(Cl)c[s]1 Amb23441690 [0,2,0,0,0,0|1,1,0]=4 4677 B9R1.7 NCCc1cc(Cl)co1 Amb18831465 [0,2,0,0,0,0|1,0,0]=3 4678 B9R1.7 NCCc1cc(cs1)Br Amb10067274 [0,2,0,0,0,0|1,1,0]=4 4679 B9R1.7 NCCc1ccc(Br)[s]1 Amb22754157 [0,2,0,0,0,0|1,1,0]=4 4680 B9R1.7 NCCc1ccc(Br)o1 Amb20626078 [0,2,0,0,0,0|1,0,0]=3 4681 B9R1.7 NCCc1ccc(Cl)o1 Amb18963970 [0,2,0,0,0,0|1,0,0]=3 4682 B9R1.7 NCCc1ccc(F)[s]1 Amb24054158 [0,2,0,0,0,0|1,1,0]=4 4683 B9R1.7 NCCc1ccc(s1)Br Amb1107706 [0,2,0,0,0,0|1,1,0]=4 4684 B9R1.7 NCCc1ccc(s1)Br Amb143881 [0,2,0,0,0,0|1,1,0]=4 4685 B9R1.7 NCCc1ccc(s1)Cl Amb10205375 [0,2,0,0,0,0|1,1,0]=4 4686 B9R1.7 NCCc1ccc(s1)I Amb1109579 [0,2,0,0,0,0|1,1,0]=4 4687 B9R1.7 NCCc1ccc(s1)I Amb13952820 [0,2,0,0,0,0|1,1,0]=4 4688 B9R1.7 NN=Cc1cc(Br)co1 Amb25180611 [0,2,0,0,0,0|1,0,1]=4 4689 B9R1.7 NOCc1c[s]c(Cl)c1 Amb24752908 [0,2,0,0,0,0|2,0,0]=4 4690 B9R1.7 NOCc1cc(Br)c[s]1 Amb24627588 [0,2,0,0,0,0|0,1,0]=3 4691 B9R1.7 NOCc1ccc(Br)o1 Amb25032146 [0,2,0,0,0,0|0,0,0]=2 4692 B9R1.7 NOCc1ccc(Cl)[s]1 Amb18126398 [0,2,0,0,0,0|0,1,0]=3 4693 B9R1.7 N\N=C\c1ccc(Br)o1 Amb24415450 [0,2,0,0,0,0|1,0,1]=4 4694 B9R1.7 N\N=C\c1ccc(Cl)o1 Amb25296773 [0,2,0,0,0,0|1,0,1]=4 4695 B9R1.7 Nc1[nH]c(CCO)c[n]1 Amb25146126 [0,2,0,0,0,0|2,0,0]=4 4696 B9R1.7 Nc1[n]c(CCO)c[s]1 Amb22587080 [0,2,0,0,0,0|2,0,0]=4 4697 B9R1.7 Nc1[n]c(CCO)co1 Amb24574214 [0,2,0,0,0,0|2,0,0]=4 4698 B9R1.7 Nc1[n]cc(CCO)[s]1 Amb18644160 [0,2,0,0,0,0|1,1,0]=4 4699 B9R1.7 Nc1[n]cc(CCO)o1 Amb24400923 [0,2,0,0,0,0|1,0,0]=3 4700 B9R1.7 Nc1c[n](CCO)cc1 Amb25188974 [0,2,0,0,0,0|2,0,0]=4 4701 B9R1.7 Nc1cc(CC#N)o[n]1 Amb18832969 [0,2,0,0,0,0|2,0,0]=4 4702 B9R1.7 Nc1cc(CCO)[n][nH]1 Amb25311393 [0,2,0,0,0,0|2,0,0]=4 4703 B9R1.7 Nc1cc[n](CCO)[n]1 Amb22282177 [0,2,0,0,0,0|2,0,0]=4 4704 B9R1.7 Nc1ccn(n1)CCO Amb16229863 [0,2,0,0,0,0|2,0,0]=4 4705 B9R1.7 Nc1cn(nc1)CCO Amb10609894 [0,2,0,0,0,0|2,0,0]=4 4706 B9R1.7 Nc1nc(cs1)CCO Amb10607935 [0,2,0,0,0,0|2,0,0]=4 4707 B9R1.7 O=C1C=C\C(=C/C=O)\O1 Amb24334582 [0,2,0,0,0,0|0,0,2]=4 4708 B9R1.7 O=C1C=C\C(=C/CBr)\O1 Amb25211667 [0,2,0,0,0,0|1,0,0]=3 4709 B9R1.7 O=C1C=C\C(=C\C=O)\O1 Amb24668983 [0,2,0,0,0,0|0,0,2]=4 4710 B9R1.7 O=C=Nc1ccc(Cl)o1 Amb25780963 [0,2,0,0,0,0|0,0,2]=4 4711 B9R1.7 O=CCc1cc(Br)co1 Amb25249614 [0,2,0,0,0,0|0,0,1]=3 4712 B9R1.7 O=CCc1ccc(Br)[s]1 Amb24433759 [0,2,0,0,0,0|0,1,1]=4 4713 B9R1.7 O=CCc1ccc(Cl)o1 Amb25174639 [0,2,0,0,0,0|0,0,1]=3 4714 B9R1.7 O=CCc1ccc(F)[s]1 Amb24648364 [0,2,0,0,0,0|0,1,1]=4 4715 B9R1.7 OCCC1=CC(=O)NN1 Amb25253756 [0,2,0,0,0,0|2,0,0]=4 4716 B9R1.7 OCCC1=CC(=O)ON1 Amb25174383 [0,2,0,0,0,0|2,0,0]=4 4717 B9R1.7 OCCC1=CCC(=O)O1 Amb20171600 [0,2,0,0,0,0|0,0,1]=3 4718 B9R1.7 OCCC1C=CC(=O)O1 Amb18832646 [0,2,0,0,0,0|0,0,1]=3 4719 B9R1.7 OCCC=1CCC(=O)C1 Amb25773413 [0,2,0,0,0,0|1,0,1]=4 4720 B9R1.7 OCC[n]1cc(F)c[n]1 Amb23402170 [0,2,0,0,0,0|2,0,0]=4 4721 B9R1.7 OCC[n]1cc(I)c[n]1 Amb22498613 [0,2,0,0,0,0|2,0,0]=4 4722 B9R1.7 OCC[n]1cc(O)c[n]1 Amb18832639 [0,2,0,0,0,0|2,0,0]=4 4723 B9R1.7 OCC[n]1ccc(Br)[n]1 Amb23541422 [0,2,0,0,0,0|2,0,0]=4 4724 B9R1.7 OCCc1[n][n]c(Cl)o1 Amb24628213 [0,2,0,0,0,0|2,0,0]=4 4725 B9R1.7 OCCc1[n]c(Br)c[s]1 Amb24719543 [0,2,0,0,0,0|1,1,0]=4 4726 B9R1.7 OCCc1c[nH]c(S)[n]1 Amb25774042 [0,2,0,0,0,0|2,0,0]=4 4727 B9R1.7 OCCc1c[n]c(Br)[s]1 Amb22495409 [0,2,0,0,0,0|1,1,0]=4 4728 B9R1.7 OCCc1c[n]c(Cl)[s]1 Amb22495215 [0,2,0,0,0,0|1,1,0]=4 4729 B9R1.7 OCCc1c[n]c(Cl)o1 Amb24708365 [0,2,0,0,0,0|1,0,0]=3 4730 B9R1.7 OCCc1c[n]c(F)[s]1 Amb25364417 [0,2,0,0,0,0|1,1,0]=4 4731 B9R1.7 OCCc1c[s]c(=S)[nH]1 Amb24094335 [0,2,0,0,0,0|2,0,0]=4 4732 B9R1.7 OCCc1c[s]c(Br)[n]1 Amb22495406 [0,2,0,0,0,0|2,0,0]=4 4733 B9R1.7 OCCc1c[s]c(F)[n]1 Amb25723849 [0,2,0,0,0,0|2,0,0]=4 4734 B9R1.7 OCCc1cc(Br)c[s]1 Amb18224933 [0,2,0,0,0,0|0,1,0]=3 4735 B9R1.7 OCCc1cc(Cl)c[s]1 Amb25682063 [0,2,0,0,0,0|0,1,0]=3 4736 B9R1.7 OCCc1cc(no1)Br Amb2455856 [0,2,0,0,0,0|1,0,0]=3 4737 B9R1.7 OCCc1ccc(F)o1 Amb24527495 [0,2,0,0,0,0|0,0,0]=2 4738 B9R1.7 OCCc1ccc(S)[s]1 Amb24627821 [0,2,0,0,0,0|0,1,0]=3 4739 B9R1.7 OCCc1ccc(s1)Br Amb17239160 [0,2,0,0,0,0|0,1,0]=3 4740 B9R1.7 OCCc1ccc(s1)Cl Amb17232423 [0,2,0,0,0,0|0,1,0]=3 4741 B9R1.7 OCCn1cc(cn1)Br Amb1102317 [0,2,0,0,0,0|2,0,0]=4 4742 B9R1.7 OC\C=C\1/C=CC(=O)O1 Amb25801971 [0,2,0,0,0,0|0,0,0]=2 4743 B9R1.7 ONCc1[nH]cc(Br)[n]1 Amb25105362 [0,2,0,0,0,0|2,0,0]=4 4744 B9R1.7 ONCc1[n]cc(Cl)[s]1 Amb25721340 [0,2,0,0,0,0|1,1,0]=4 4745 B9R1.7 ONCc1[n]cc(I)[s]1 Amb25032190 [0,2,0,0,0,0|1,1,0]=4 4746 B9R1.7 ONCc1cc(Cl)c[s]1 Amb25786956 [0,2,0,0,0,0|0,1,0]=3 4747 B9R1.7 ONCc1ccc(Cl)o1 Amb24449836 [0,2,0,0,0,0|0,0,0]=2 4748 B9R1.7 O\N=C/c1ccc(Br)[s]1 Amb21811533 [0,2,0,0,0,0|0,1,1]=4 4749 B9R1.7 O\N=C\c1cc(Cl)co1 Amb24192789 [0,2,0,0,0,0|0,0,1]=3 4750 B9R1.7 O\N=C\c1ccc(F)[s]1 Amb19892823 [0,2,0,0,0,0|0,1,1]=4 4751 B9R1.7 O\N=C\c1ccc(I)[s]1 Amb24335180 [0,2,0,0,0,0|0,1,1]=4 4752 B9R1.7 O\N=C\c1ccc(o1)Br Amb2387512 [0,2,0,0,0,0|0,0,1]=3 4753 B9R1.7 O\N=C\c1ccc(o1)I Amb16239327 [0,2,0,0,0,0|0,0,1]=3 4754 B9R1.7 Oc1[n]c(CCO)c[s]1 Amb24544782 [0,2,0,0,0,0|2,0,0]=4 4755 B9R1.7 SCCc1cc(Br)c[s]1 Amb18570897 [0,2,0,0,0,0|0,2,0]=4 4756 B9R1.7 SCCc1ccc(s1)Br Amb17471938 [0,2,0,0,0,0|0,2,0]=4 4757 B9R1.7 SCCc1ccc(s1)Cl Amb17470585 [0,2,0,0,0,0|0,2,0]=4 4758 B9R1.7 [C-]#[N+]Cc1ccc(o1)C Amb1981057 [0,2,0,0,0,0|1,0,0]=3 4759 B9R1.7 [N-]=[N+]=Cc1ccc(Cl)o1 Amb25325284 [0,2,0,0,0,0|1,0,1]=4 4760 B9R1.7 [O-][N+]#Cc1ccc(Cl)o1 Amb25257856 [0,2,0,0,0,0|0,0,2]=4 4761 B9R1.21 BrCc1c[n]c(CBr)o1 Amb25092737 [0,2,0,0,0,0|2,0,0]=4 4762 B9R1.21 C#Cc1[n]c(CO)c[s]1 Amb24099808 [0,2,0,0,0,0|2,0,0]=4 4763 B9R1.21 C#Cc1ccc(CO)o1 Amb25306139 [0,2,0,0,0,0|0,0,0]=2 4764 B9R1.21 C=Cc1cc(C=O)oc1 Amb24395954 [0,2,0,0,0,0|0,0,2]=4 4765 B9R1.21 C=Cc1cc(CN)co1 Amb25042025 [0,2,0,0,0,0|1,0,1]=4 4766 B9R1.21 C=Cc1ccc(C=O)o1 Amb18124289 [0,2,0,0,0,0|0,0,2]=4 4767 B9R1.21 CCC=1C[C@@H](CO)OC1 Amb25284402 [0,2,0,0,0,0|0,0,2]=4 4768 B9R1.21 CC[n]1c[n]c(CO)c1 Amb23585668 [0,2,0,0,0,0|2,0,0]=4 4769 B9R1.21 CC[n]1c[n]c(CO)c1 Amb24079797 [0,2,0,0,0,0|2,0,0]=4 4770 B9R1.21 CCc1[n]c(C=O)co1 Amb25679095 [0,2,0,0,0,0|2,0,0]=4 4771 B9R1.21 CCc1[n]c(CO)c[s]1 Amb22587132 [0,2,0,0,0,0|2,0,0]=4 4772 B9R1.21 CCc1[n]cc(C#N)o1 Amb25703706 [0,2,0,0,0,0|2,0,0]=4 4773 B9R1.21 CCc1[n]cc(CBr)o1 Amb24669190 [0,2,0,0,0,0|2,0,0]=4 4774 B9R1.21 CCc1c[nH]c(CC)c1 Amb17672334 [0,2,0,0,0,0|2,0,0]=4 4775 B9R1.21 CCc1c[n]c(CCl)o1 Amb19148906 [0,2,0,0,0,0|2,0,0]=4 4776 B9R1.21 CCc1c[n]c(CN)o1 Amb18832750 [0,2,0,0,0,0|2,0,0]=4 4777 B9R1.21 CCc1c[n]c(CO)[s]1 Amb24271105 [0,2,0,0,0,0|1,1,0]=4 4778 B9R1.21 CCc1c[s]c(CN)c1 Amb25377400 [0,2,0,0,0,0|1,1,0]=4 4779 B9R1.21 CCc1cc(C=O)[n]o1 Amb18832855 [0,2,0,0,0,0|2,0,0]=4 4780 B9R1.21 CCc1cc(C=O)c[nH]1 Amb18142592 [0,2,0,0,0,0|2,0,0]=4 4781 B9R1.21 CCc1cc(C=O)c[s]1 Amb18643619 [0,2,0,0,0,0|1,1,0]=4 4782 B9R1.21 CCc1cc(C=O)co1 Amb18678528 [0,2,0,0,0,0|1,0,0]=3 4783 B9R1.21 CCc1cc(C=O)oc1 Amb18673932 [0,2,0,0,0,0|0,0,2]=4 4784 B9R1.21 CCc1cc(CBr)[n]o1 Amb24480212 [0,2,0,0,0,0|2,0,0]=4 4785 B9R1.21 CCc1cc(CC)c[s]1 Amb25250020 [0,2,0,0,0,0|1,1,0]=4 4786 B9R1.21 CCc1cc(CCl)[n]o1 Amb24581244 [0,2,0,0,0,0|2,0,0]=4 4787 B9R1.21 CCc1cc(CN)[n]o1 Amb21955823 [0,2,0,0,0,0|2,0,0]=4 4788 B9R1.21 CCc1cc(CN)c[s]1 Amb18908358 [0,2,0,0,0,0|1,1,0]=4 4789 B9R1.21 CCc1cc(CN)o[n]1 Amb21955501 [0,2,0,0,0,0|2,0,0]=4 4790 B9R1.21 CCc1cc(CO)[n][nH]1 Amb23447174 [0,2,0,0,0,0|2,0,0]=4 4791 B9R1.21 CCc1cc(CO)[n]o1 Amb24074422 [0,2,0,0,0,0|2,0,0]=4 4792 B9R1.21 CCc1cc(NC)[n]o1 Amb22270816 [0,2,0,0,0,0|2,0,0]=4 4793 B9R1.21 CCc1cc(c[s]1)C#C Amb25234236 [0,2,0,0,0,0|1,1,0]=4 4794 B9R1.21 CCc1cc(c[s]1)C#N Amb25224363 [0,2,0,0,0,0|1,1,0]=4 4795 B9R1.21 CCc1ccc(C#C)[s]1 Amb25789529 [0,2,0,0,0,0|1,1,0]=4 4796 B9R1.21 CCc1ccc(C#N)[nH]1 Amb19517007 [0,2,0,0,0,0|2,0,0]=4 4797 B9R1.21 CCc1ccc(C=C)[s]1 Amb24478629 [0,2,0,0,0,0|1,1,0]=4 4798 B9R1.21 CCc1ccc(CC)[nH]1 Amb17672335 [0,2,0,0,0,0|2,0,0]=4 4799 B9R1.21 CCc1ccc(CCl)[s]1 Amb18797933 [0,2,0,0,0,0|1,1,0]=4 4800 B9R1.21 CCc1ccc(CCl)o1 Amb25140995 [0,2,0,0,0,0|1,0,0]=3 4801 B9R1.21 CCc1ccc(CN)[nH]1 Amb18832866 [0,2,0,0,0,0|2,0,0]=4 4802 B9R1.21 CCc1ccc(CN)o1 Amb18960153 [0,2,0,0,0,0|1,0,0]=3 4803 B9R1.21 CCc1ccc(CO)[nH]1 Amb23153700 [0,2,0,0,0,0|1,0,0]=3 4804 B9R1.21 CCc1ccc(CO)o1 Amb23512583 [0,2,0,0,0,0|0,0,0]=2 4805 B9R1.21 CCc1ccc(CS)o1 Amb24367663 [0,2,0,0,0,0|0,1,0]=3 4806 B9R1.21 CCc1ccc(OC)[s]1 Amb25380674 [0,2,0,0,0,0|1,1,0]=4 4807 B9R1.21 CCc1ccc([nH]1)C=O Amb17593257 [0,2,0,0,0,0|2,0,0]=4 4808 B9R1.21 CCc1ccc(o1)C#N Amb10574576 [0,2,0,0,0,0|1,0,0]=3 4809 B9R1.21 CCc1ccc(o1)SC Amb25178741 [0,2,0,0,0,0|1,0,0]=3 4810 B9R1.21 CCc1ccc(s1)CC Amb15691671 [0,2,0,0,0,0|1,1,0]=4 4811 B9R1.21 CCc1ccc(s1)NN Amb17207565 [0,2,0,0,0,0|1,1,0]=4 4812 B9R1.21 CCc1coc(CC)[n]1 Amb25351946 [0,2,0,0,0,0|2,0,0]=4 4813 B9R1.21 CCc1ncc(o1)C=O Amb17399800 [0,2,0,0,0,0|2,0,0]=4 4814 B9R1.21 CCc1ncc(o1)CC Amb10554427 [0,2,0,0,0,0|2,0,0]=4 4815 B9R1.21 CCc1ncc(o1)CN Amb17231843 [0,2,0,0,0,0|2,0,0]=4 4816 B9R1.21 CCc1ncc(s1)CO Amb17514230 [0,2,0,0,0,0|1,1,0]=4 4817 B9R1.21 CCc1occ(n1)CCl Amb17399896 [0,2,0,0,0,0|2,0,0]=4 4818 B9R1.21 CCc1occ(n1)CN Amb17399807 [0,2,0,0,0,0|2,0,0]=4 4819 B9R1.21 CCc1scc(c1)CCl Amb17093914 [0,2,0,0,0,0|1,1,0]=4 4820 B9R1.21 CCc1scc(c1)CO Amb17093897 [0,2,0,0,0,0|1,1,0]=4 4821 B9R1.21 CNc1[n]c(CO)co1 Amb24661772 [0,2,0,0,0,0|2,0,0]=4 4822 B9R1.21 CNc1[n]cc(CO)[s]1 Amb25266898 [0,2,0,0,0,0|1,1,0]=4 4823 B9R1.21 CNc1cc(CO)[n]o1 Amb24383081 [0,2,0,0,0,0|2,0,0]=4 4824 B9R1.21 COc1[n]c(CO)c[s]1 Amb24099810 [0,2,0,0,0,0|2,0,0]=4 4825 B9R1.21 COc1[n]c(CO)co1 Amb25792763 [0,2,0,0,0,0|2,0,0]=4 4826 B9R1.21 COc1c[n]c(CN)o1 Amb24656785 [0,2,0,0,0,0|2,0,0]=4 4827 B9R1.21 COc1c[s]c(CN)c1 Amb23450213 [0,2,0,0,0,0|1,1,0]=4 4828 B9R1.21 COc1c[s]c(CO)c1 Amb23450202 [0,2,0,0,0,0|0,1,0]=3 4829 B9R1.21 COc1cc(CBr)o[n]1 Amb24331429 [0,2,0,0,0,0|2,0,0]=4 4830 B9R1.21 COc1cc(CCl)o[n]1 Amb25188912 [0,2,0,0,0,0|2,0,0]=4 4831 B9R1.21 COc1cc(CN)o[n]1 Amb18642595 [0,2,0,0,0,0|2,0,0]=4 4832 B9R1.21 COc1cc(CO)[n]o1 Amb24532916 [0,2,0,0,0,0|2,0,0]=4 4833 B9R1.21 COc1cc(CO)[s][n]1 Amb24598092 [0,2,0,0,0,0|1,1,0]=4 4834 B9R1.21 COc1cc(CO)o[n]1 Amb23571226 [0,2,0,0,0,0|1,0,0]=3 4835 B9R1.21 COc1ccc(C=O)o1 Amb18832781 [0,2,0,0,0,0|0,0,2]=4 4836 B9R1.21 COc1ccc(CC)o1 Amb25229999 [0,2,0,0,0,0|1,0,0]=3 4837 B9R1.21 COc1ccc(CCl)[s]1 Amb24518054 [0,2,0,0,0,0|1,1,0]=4 4838 B9R1.21 COc1ccc(o1)OC Amb22295890 [0,2,0,0,0,0|2,0,0]=4 4839 B9R1.21 COc1coc(CS)c1 Amb24402337 [0,2,0,0,0,0|0,1,0]=3 4840 B9R1.21 COc1coc(c1)C=O Amb18832782 [0,2,0,0,0,0|0,0,2]=4 4841 B9R1.21 CSc1[n][n]c(CO)o1 Amb20248838 [0,2,0,0,0,0|2,0,0]=4 4842 B9R1.21 CSc1cc(CO)co1 Amb24696963 [0,2,0,0,0,0|2,0,0]=4 4843 B9R1.21 CSc1ccc(C#N)o1 Amb18643423 [0,2,0,0,0,0|1,0,1]=4 4844 B9R1.21 CSc1ccc(C=O)o1 Amb18643872 [0,2,0,0,0,0|0,0,2]=4 4845 B9R1.21 CSc1ccc(CBr)o1 Amb25758931 [0,2,0,0,0,0|1,0,0]=3 4846 B9R1.21 CSc1ccc(CCl)o1 Amb25830387 [0,2,0,0,0,0|1,0,0]=3 4847 B9R1.21 CSc1ccc(CN)o1 Amb18908342 [0,2,0,0,0,0|1,0,0]=3 4848 B9R1.21 CSc1ccc(CO)[s]1 Amb24364786 [0,2,0,0,0,0|0,1,0]=3 4849 B9R1.21 CSc1ccc(CO)o1 Amb24087433 [0,2,0,0,0,0|0,0,0]=2 4850 B9R1.21 CSc1coc(C=O)c1 Amb25072714 [0,2,0,0,0,0|0,0,2]=4 4851 B9R1.21 CSc1coc(CO)c1 Amb24616081 [0,2,0,0,0,0|0,0,0]=2 4852 B9R1.21 ClCc1cc(CBr)o[n]1 Amb25163388 [0,2,0,0,0,0|2,0,0]=4 4853 B9R1.21 ClCc1cc(CCl)co1 Amb24421085 [0,2,0,0,0,0|1,0,0]=3 4854 B9R1.21 ClCc1ccc(CCl)[nH]1 Amb24524160 [0,2,0,0,0,0|2,0,0]=4 4855 B9R1.21 ClCc1ccc(CCl)[s]1 Amb22235042 [0,2,0,0,0,0|1,1,0]=4 4856 B9R1.21 ClCc1coc(CCl)[n]1 Amb24644647 [0,2,0,0,0,0|2,0,0]=4 4857 B9R1.21 Cl[Hg]c1ccc([Hg]Cl)o1 Amb17672749 [0,2,0,0,0,0|2,0,0]=4 4858 B9R1.21 N#CC=1CC(CBr)=CC1 Amb22229513 [0,2,0,0,0,0|2,0,0]=4 4859 B9R1.21 N#Cc1[nH]cc(CO)[n]1 Amb25263988 [0,2,0,0,0,0|2,0,0]=4 4860 B9R1.21 N#Cc1[n]cc(CO)o1 Amb25686410 [0,2,0,0,0,0|1,0,0]=3 4861 B9R1.21 N#Cc1c[n][n](CO)c1 Amb24698622 [0,2,0,0,0,0|2,0,0]=4 4862 B9R1.21 N#Cc1c[s]c(CBr)c1 Amb24629118 [0,2,0,0,0,0|1,1,0]=4 4863 B9R1.21 N#Cc1c[s]c(CCl)c1 Amb18644976 [0,2,0,0,0,0|1,1,0]=4 4864 B9R1.21 N#Cc1c[s]c(CO)c1 Amb18643426 [0,2,0,0,0,0|0,1,0]=3 4865 B9R1.21 N#Cc1cc(C=O)co1 Amb18833001 [0,2,0,0,0,0|1,0,1]=4 4866 B9R1.21 N#Cc1cc(CBr)co1 Amb25116122 [0,2,0,0,0,0|1,0,1]=4 4867 B9R1.21 N#Cc1cc(CBr)o[n]1 Amb24677621 [0,2,0,0,0,0|2,0,0]=4 4868 B9R1.21 N#Cc1cc(CO)c[s]1 Amb25265950 [0,2,0,0,0,0|2,0,0]=4 4869 B9R1.21 N#Cc1cc(co1)C#N Amb25180704 [0,2,0,0,0,0|1,0,1]=4 4870 B9R1.21 N#Cc1cc[n](CO)[n]1 Amb22494065 [0,2,0,0,0,0|2,0,0]=4 4871 B9R1.21 N#Cc1ccc(C#N)o1 Amb22734014 [0,2,0,0,0,0|1,0,1]=4 4872 B9R1.21 N#Cc1ccc(C=O)o1 Amb18124285 [0,2,0,0,0,0|0,0,2]=4 4873 B9R1.21 N#Cc1ccc(CCl)[s]1 Amb25830479 [0,2,0,0,0,0|1,1,0]=4 4874 B9R1.21 N#Cc1ccc(CCl)o1 Amb18643781 [0,2,0,0,0,0|1,0,0]=3 4875 B9R1.21 N#Cc1ccc(CO)[nH]1 Amb23402530 [0,2,0,0,0,0|1,0,0]=3 4876 B9R1.21 N#Cc1ccc(CO)[s]1 Amb22233914 [0,2,0,0,0,0|0,1,0]=3 4877 B9R1.21 N#Cc1ccc(CO)o1 Amb18642081 [0,2,0,0,0,0|0,0,0]=2 4878 B9R1.21 N#Cc1coc(C=O)c1 Amb18833002 [0,2,0,0,0,0|0,0,2]=4 4879 B9R1.21 N#Cc1coc(CBr)c1 Amb25141016 [0,2,0,0,0,0|1,0,0]=3 4880 B9R1.21 N#Cc1coc(CCl)c1 Amb18124601 [0,2,0,0,0,0|1,0,0]=3 4881 B9R1.21 N#Cc1coc(CO)c1 Amb18642087 [0,2,0,0,0,0|0,0,0]=2 4882 B9R1.21 NCC=1CC(=CC1)C#N Amb22229497 [0,2,0,0,0,0|2,0,0]=4 4883 B9R1.21 NCc1[nH]cc(CO)[n]1 Amb24680932 [0,2,0,0,0,0|2,0,0]=4 4884 B9R1.21 NCc1[n]c(CF)co1 Amb24653990 [0,2,0,0,0,0|2,0,0]=4 4885 B9R1.21 NCc1[n]c(CO)c[s]1 Amb18908383 [0,2,0,0,0,0|2,0,0]=4 4886 B9R1.21 NCc1[n]c(CO)c[s]1 Amb24271112 [0,2,0,0,0,0|2,0,0]=4 4887 B9R1.21 NCc1[n]oc(CO)[n]1 Amb25075107 [0,2,0,0,0,0|2,0,0]=4 4888 B9R1.21 NCc1c[n]c(CF)o1 Amb25247310 [0,2,0,0,0,0|2,0,0]=4 4889 B9R1.21 NCc1c[n]c(CO)[s]1 Amb25067807 [0,2,0,0,0,0|1,1,0]=4 4890 B9R1.21 NCc1c[s]c(CO)[n]1 Amb25744387 [0,2,0,0,0,0|1,1,0]=4 4891 B9R1.21 NCc1c[s]c(CO)c1 Amb18202474 [0,2,0,0,0,0|0,1,0]=3 4892 B9R1.21 NCc1cc(CO)c[nH]1 Amb24638075 [0,2,0,0,0,0|2,0,0]=4 4893 B9R1.21 NCc1cc(CO)c[s]1 Amb18202473 [0,2,0,0,0,0|1,1,0]=4 4894 B9R1.21 NCc1cc(CO)co1 Amb24065086 [0,2,0,0,0,0|1,0,0]=3 4895 B9R1.21 NCc1cc(c[s]1)C#N Amb20241078 [0,2,0,0,0,0|1,1,0]=4 4896 B9R1.21 NCc1cc(c[s]1)C#N Amb20241199 [0,2,0,0,0,0|1,1,0]=4 4897 B9R1.21 NCc1cc(co1)C#N Amb20241076 [0,2,0,0,0,0|1,0,0]=3 4898 B9R1.21 NCc1cc(co1)C#N Amb20241197 [0,2,0,0,0,0|1,0,0]=3 4899 B9R1.21 NCc1ccc(C#N)[s]1 Amb22233811 [0,2,0,0,0,0|1,1,0]=4 4900 B9R1.21 NCc1ccc(C#N)o1 Amb18251086 [0,2,0,0,0,0|1,0,0]=3 4901 B9R1.21 NCc1ccc(C#N)o1 Amb20241075 [0,2,0,0,0,0|1,0,0]=3 4902 B9R1.21 NCc1ccc(C=O)o1 Amb24581084 [0,2,0,0,0,0|1,0,0]=3 4903 B9R1.21 NCc1ccc(CCl)o1 Amb24511708 [0,2,0,0,0,0|1,0,0]=3 4904 B9R1.21 NCc1ccc(CN)[s]1 Amb24545865 [0,2,0,0,0,0|1,1,0]=4 4905 B9R1.21 NCc1ccc(CO)o1 Amb18251107 [0,2,0,0,0,0|0,0,0]=2 4906 B9R1.21 NCc1ccc(o1)CN Amb17609504 [0,2,0,0,0,0|1,0,0]=3 4907 B9R1.21 NCc1ccc(s1)C#N Amb17506858 [0,2,0,0,0,0|1,1,0]=4 4908 B9R1.21 NCc1coc(CF)[n]1 Amb24578645 [0,2,0,0,0,0|2,0,0]=4 4909 B9R1.21 NNc1[n]c(CO)c[s]1 Amb25236742 [0,2,0,0,0,0|2,0,0]=4 4910 B9R1.21 O=Cc1[n]cc(CBr)o1 Amb24689353 [0,2,0,0,0,0|2,0,0]=4 4911 B9R1.21 O=Cc1cc(CCl)co1 Amb25714786 [0,2,0,0,0,0|0,0,2]=4 4912 B9R1.21 O=Cc1cc(co1)C=O Amb22170483 [0,2,0,0,0,0|0,0,2]=4 4913 B9R1.21 O=Cc1ccc(CBr)[s]1 Amb24426974 [0,2,0,0,0,0|1,1,0]=4 4914 B9R1.21 O=Cc1ccc(CBr)o1 Amb18129279 [0,2,0,0,0,0|1,0,0]=3 4915 B9R1.21 O=Cc1ccc(CCl)[s]1 Amb24532845 [0,2,0,0,0,0|1,1,0]=4 4916 B9R1.21 O=Cc1ccc(CI)o1 Amb24094652 [0,2,0,0,0,0|1,0,0]=3 4917 B9R1.21 O=Cc1ccc(CS)o1 Amb24519070 [0,2,0,0,0,0|0,1,0]=3 4918 B9R1.21 O=Cc1ccc(o1)C#C Amb16192466 [0,2,0,0,0,0|0,0,2]=4 4919 B9R1.21 OCC1CC=C(C=O)O1 Amb24418450 [0,2,0,0,0,0|0,0,2]=4 4920 B9R1.21 OC[n]1ccc(C=O)[n]1 Amb25162833 [0,2,0,0,0,0|2,0,0]=4 4921 B9R1.21 OCc1[n]c(CCl)c[s]1 Amb24545928 [0,2,0,0,0,0|1,1,0]=4 4922 B9R1.21 OCc1[n]c(CF)c[s]1 Amb24727772 [0,2,0,0,0,0|1,1,0]=4 4923 B9R1.21 OCc1[n]cc(C=O)[s]1 Amb24502349 [0,2,0,0,0,0|1,1,0]=4 4924 B9R1.21 OCc1[n]cc(CBr)[s]1 Amb24752359 [0,2,0,0,0,0|1,1,0]=4 4925 B9R1.21 OCc1c[n]c(CO)[nH]1 Amb25216265 [0,2,0,0,0,0|2,0,0]=4 4926 B9R1.21 OCc1c[n]c(CO)[s]1 Amb24093512 [0,2,0,0,0,0|1,1,0]=4 4927 B9R1.21 OCc1c[s]c(C=O)[n]1 Amb25684695 [0,2,0,0,0,0|2,0,0]=4 4928 B9R1.21 OCc1c[s]c(CO)[n]1 Amb25074137 [0,2,0,0,0,0|1,1,0]=4 4929 B9R1.21 OCc1cc(C=O)co1 Amb25045602 [0,2,0,0,0,0|0,0,0]=2 4930 B9R1.21 OCc1cc(C=O)oc1 Amb20248337 [0,2,0,0,0,0|0,0,2]=4 4931 B9R1.21 OCc1cc(CO)[n][nH]1 Amb22363378 [0,2,0,0,0,0|2,0,0]=4 4932 B9R1.21 OCc1cc(CO)co1 Amb20248338 [0,2,0,0,0,0|0,0,0]=2 4933 B9R1.21 OCc1ccc(C=O)[nH]1 Amb18642272 [0,2,0,0,0,0|1,0,0]=3 4934 B9R1.21 OCc1ccc(C=O)[s]1 Amb18643874 [0,2,0,0,0,0|0,1,0]=3 4935 B9R1.21 OCc1ccc(CBr)o1 Amb25082040 [0,2,0,0,0,0|0,0,0]=2 4936 B9R1.21 OCc1ccc(CO)[s]1 Amb22387630 [0,2,0,0,0,0|0,1,0]=3 4937 B9R1.21 OCc1ccc([nH]1)CO Amb17593331 [0,2,0,0,0,0|1,0,0]=3 4938 B9R1.21 OCc1coc(CCl)[n]1 Amb25743310 [0,2,0,0,0,0|2,0,0]=4 4939 B9R1.21 OCc1coc(CO)[n]1 Amb23590972 [0,2,0,0,0,0|1,0,0]=3 4940 B9R1.21 O[13CH2][13c]1[13cH][13cH][13c](o1)[13CH]=O Amb17615531 [0,2,0,0,0,0|0,0,0]=2 4941 B9R1.22 CC1=CC(=O)C(CC)O1 Amb25143499 [0,2,0,0,0,0|1,0,1]=4 4942 B9R1.22 CC1=CC(=O)C=C1CC Amb24553152 [0,2,0,0,0,0|2,0,0]=4 4943 B9R1.22 CC1=CC(=O)N(CCl)O1 Amb25743893 [0,2,0,0,0,0|2,0,0]=4 4944 B9R1.22 CC1=CC(=O)N(CO)O1 Amb24735156 [0,2,0,0,0,0|1,0,0]=3 4945 B9R1.22 CC1=CC(=O)OC1=CBr Amb25259288 [0,2,0,0,0,0|1,0,1]=4 4946 B9R1.22 CC1=CC(=O)OC1CO Amb25116791 [0,2,0,0,0,0|0,0,1]=3 4947 B9R1.22 CC1=CC(=O)O[C@@H]1CO Amb25830656 [0,2,0,0,0,0|0,0,1]=3 4948 B9R1.22 CC=1NC(=S)NC1CO Amb25724070 [0,2,0,0,0,0|2,0,0]=4 4949 B9R1.22 CC=1OC(=O)NC1CO Amb25708677 [0,2,0,0,0,0|2,0,0]=4 4950 B9R1.22 CC=1OC(=O)OC1CBr Amb19894710 [0,2,0,0,0,0|2,0,0]=4 4951 B9R1.22 CC=1OC(=O)OC1CCl Amb19957854 [0,2,0,0,0,0|2,0,0]=4 4952 B9R1.22 CC=1OC(=O)OC1CO Amb21962117 [0,2,0,0,0,0|1,0,0]=3 4953 B9R1.22 CC[n+]1oc(C)cc1C Amb22440681 [0,2,0,0,0,0|2,0,0]=4 4954 B9R1.22 CCc1[nH]c(C)cc1C Amb17938709 [0,2,0,0,0,0|2,0,0]=4 4955 B9R1.22 CCc1[s]c(N)cc1Br Amb18140453 [0,2,0,0,0,0|1,1,0]=4 4956 B9R1.22 C[n]1[n]c(Br)cc1CO Amb25267921 [0,2,0,0,0,0|2,0,0]=4 4957 B9R1.22 C[n]1[n]c(N)cc1CO Amb20619775 [0,2,0,0,0,0|2,0,0]=4 4958 B9R1.22 C[n]1[n]c(O)cc1CO Amb24682383 [0,2,0,0,0,0|2,0,0]=4 4959 B9R1.22 C[n]1cc(Br)cc1CN Amb18253004 [0,2,0,0,0,0|2,0,0]=4 4960 B9R1.22 C[n]1cc(Cl)c(CO)[n]1 Amb20619732 [0,2,0,0,0,0|2,0,0]=4 4961 B9R1.22 C[n]1cc(Cl)cc1CN Amb18251280 [0,2,0,0,0,0|2,0,0]=4 4962 B9R1.22 C[n]1cc(N)cc1CN Amb18251094 [0,2,0,0,0,0|2,0,0]=4 4963 B9R1.22 C[n]1cc(N)cc1CO Amb18642430 [0,2,0,0,0,0|1,0,0]=3 4964 B9R1.22 C\C=C\1/OC(=O)C=C1N Amb24426967 [0,2,0,0,0,0|1,0,1]=4 4965 B9R1.22 Cc1[nH]c(C)cc1CO Amb18893298 [0,2,0,0,0,0|2,0,0]=4 4966 B9R1.22 Cc1[nH]c(Cl)c(CO)[n]1 Amb24624106 [0,2,0,0,0,0|2,0,0]=4 4967 B9R1.22 Cc1[n]c(C)[nH]c1CO Amb25104861 [0,2,0,0,0,0|2,0,0]=4 4968 B9R1.22 Cc1[n]c(C)oc1CBr Amb25321781 [0,2,0,0,0,0|2,0,0]=4 4969 B9R1.22 Cc1[n]c(C)oc1CCl Amb22235325 [0,2,0,0,0,0|2,0,0]=4 4970 B9R1.22 Cc1[n]c(C)oc1CN Amb18251097 [0,2,0,0,0,0|2,0,0]=4 4971 B9R1.22 Cc1[n]c(CO)c(Br)[s]1 Amb24481932 [0,2,0,0,0,0|2,0,0]=4 4972 B9R1.22 Cc1[n]c(Cl)[s]c1CO Amb19649017 [0,2,0,0,0,0|1,1,0]=4 4973 B9R1.22 Cc1[n]c(Cl)oc1CCl Amb25837430 [0,2,0,0,0,0|2,0,0]=4 4974 B9R1.22 Cc1[n]c(I)oc1CC Amb24733561 [0,2,0,0,0,0|2,0,0]=4 4975 B9R1.22 Cc1[n]c(N)[s]c1CO Amb24071678 [0,2,0,0,0,0|1,1,0]=4 4976 B9R1.22 Cc1[n]c(N)oc1CC Amb18642431 [0,2,0,0,0,0|2,0,0]=4 4977 B9R1.22 Cc1[n]c(S)c(CO)[s]1 Amb24405518 [0,2,0,0,0,0|1,1,0]=4 4978 B9R1.22 Cc1[s]c(Br)[n]c1CO Amb22500774 [0,2,0,0,0,0|2,0,0]=4 4979 B9R1.22 Cc1[s]c(C)[n]c1CO Amb23438059 [0,2,0,0,0,0|2,0,0]=4 4980 B9R1.22 Cc1[s]c(Cl)[n]c1CO Amb22500779 [0,2,0,0,0,0|2,0,0]=4 4981 B9R1.22 Cc1[s]c(N)[n]c1CO Amb22500860 [0,2,0,0,0,0|2,0,0]=4 4982 B9R1.22 Cc1c[n](C)[n]c1CO Amb24502186 [0,2,0,0,0,0|2,0,0]=4 4983 B9R1.22 Cc1c[n](C)c(CO)[n]1 Amb24269254 [0,2,0,0,0,0|2,0,0]=4 4984 B9R1.22 Cc1cc(Br)[s]c1CN Amb25212404 [0,2,0,0,0,0|1,1,0]=4 4985 B9R1.22 Cc1cc(Br)[s]c1CO Amb24397099 [0,2,0,0,0,0|0,1,0]=3 4986 B9R1.22 Cc1cc(Br)c(C=O)o1 Amb18190707 [0,2,0,0,0,0|0,0,2]=4 4987 B9R1.22 Cc1cc(Br)c(CN)[s]1 Amb24379485 [0,2,0,0,0,0|1,1,0]=4 4988 B9R1.22 Cc1cc(Br)c(CO)[s]1 Amb24408933 [0,2,0,0,0,0|0,1,0]=3 4989 B9R1.22 Cc1cc(C)[nH]c1CN Amb18908276 [0,2,0,0,0,0|2,0,0]=4 4990 B9R1.22 Cc1cc(C)[s]c1CO Amb25791006 [0,2,0,0,0,0|0,1,0]=3 4991 B9R1.22 Cc1cc(C)oc1C=O Amb18642172 [0,2,0,0,0,0|0,0,2]=4 4992 B9R1.22 Cc1cc(C)oc1CN Amb18642317 [0,2,0,0,0,0|1,0,0]=3 4993 B9R1.22 Cc1cc(Cl)c(C=O)o1 Amb18202379 [0,2,0,0,0,0|0,0,2]=4 4994 B9R1.22 Cc1cc(Cl)c(CO)[s]1 Amb25178264 [0,2,0,0,0,0|0,1,0]=3 4995 B9R1.22 Cc1cc(N)[s]c1CC Amb18143528 [0,2,0,0,0,0|1,1,0]=4 4996 B9R1.22 Cc1cc(N)c(C=O)o1 Amb18832843 [0,2,0,0,0,0|0,0,2]=4 4997 B9R1.22 Cc1cc(N)c(CBr)[s]1 Amb25742731 [0,2,0,0,0,0|1,1,0]=4 4998 B9R1.22 Cc1cc(N)c(CO)[s]1 Amb25726201 [0,2,0,0,0,0|0,1,0]=3 4999 B9R1.22 Cc1cc(N)oc1CC Amb18832815 [0,2,0,0,0,0|1,0,0]=3 5000 B9R1.22 Cc1oc(=O)oc1CO Amb22270084 [0,2,0,0,0,0|1,0,0]=3 5001 B9R1.22 ClCc1[s]c(Cl)cc1Cl Amb24408338 [0,2,0,0,0,0|1,1,0]=4 5002 B9R1.22 NCc1[s]c(Br)cc1F Amb24550521 [0,2,0,0,0,0|1,1,0]=4 5003 B9R1.22 Nc1[n]c(CO)c(I)[s]1 Amb24661055 [0,2,0,0,0,0|2,0,0]=4 5004 B9R1.22 Nc1[s]c(Br)cc1CO Amb25848205 [0,2,0,0,0,0|2,0,0]=4 5005 B9R1.22 Nc1[s]c(Cl)cc1CO Amb24423337 [0,2,0,0,0,0|2,0,0]=4 5006 B9R1.22 Nc1cc(Cl)oc1C#N Amb24518925 [0,2,0,0,0,0|1,0,1]=4 5007 B9R1.22 O=C1C=C(Br)\C(=C/Br)\O1 Amb24478650 [0,2,0,0,0,0|1,0,1]=4 5008 B9R1.22 O=C1C=C(Cl)\C(=C/Cl)\O1 Amb25210550 [0,2,0,0,0,0|1,0,1]=4 5009 B9R1.22 O=Cc1oc(Cl)cc1Cl Amb25072805 [0,2,0,0,0,0|0,0,2]=4 5010 B9R1.22 OCC1=CC(=O)OC1O Amb25687821 [0,2,0,0,0,0|2,0,0]=4 5011 B9R1.22 OCc1[nH]c(Cl)[n]c1Cl Amb25695311 [0,2,0,0,0,0|2,0,0]=4 5012 B9R1.22 OCc1[n]c(Cl)[s]c1Cl Amb22495231 [0,2,0,0,0,0|2,0,0]=4 5013 B9R1.22 OCc1[s]c(Br)cc1F Amb25341396 [0,2,0,0,0,0|0,1,0]=3 5014 B9R1.22 OCc1[s]c(Cl)cc1Cl Amb24395139 [0,2,0,0,0,0|0,1,0]=3 5015 B9R1.22 OCc1cc(Br)[s]c1Br Amb22498112 [0,2,0,0,0,0|2,0,0]=4 5016 B9R1.22 OCc1cc(Cl)[s]c1Cl Amb25742638 [0,2,0,0,0,0|2,0,0]=4 5017 B9R1.22 OCc1nc(sc1Br)Br Amb2455945 [0,2,0,0,0,0|2,0,0]=4 5018 B9R1.22 OCc1oc(nc1C)C Amb10608521 [0,2,0,0,0,0|1,0,0]=3 5019 B9R1.22 OCc1sc(nc1Br)Br Amb10602532 [0,2,0,0,0,0|1,1,0]=4 5020 B9R1.22 OCc1sc(nc1Cl)Cl Amb10602534 [0,2,0,0,0,0|1,1,0]=4 5021 B9R1.23 BrCc1cc(Br)c(Br)[s]1 Amb24414109 [0,2,0,0,0,0|1,1,0]=4 5022 B9R1.23 C#Cc1cc(Br)c(Br)o1 Amb25104410 [0,2,0,0,0,0|1,0,1]=4 5023 B9R1.23 C=C1CC(CO)OC1=O Amb24524234 [0,2,0,0,0,0|0,0,2]=4 5024 B9R1.23 C=C1C[C@H](CO)OC1=O Amb24733132 [0,2,0,0,0,0|0,0,2]=4 5025 B9R1.23 C=Cc1cc(Br)c(Br)o1 Amb25340894 [0,2,0,0,0,0|1,0,1]=4 5026 B9R1.23 CC1=CC(CCl)OC1=O Amb24340254 [0,2,0,0,0,0|1,0,1]=4 5027 B9R1.23 CC1=CC(CO)NC1=O Amb25799453 [0,2,0,0,0,0|1,0,1]=4 5028 B9R1.23 CC1=CC(NC1=O)=NO Amb25332437 [0,2,0,0,0,0|2,0,0]=4 5029 B9R1.23 CC1=C[C@H](CO)NC1=O Amb24685779 [0,2,0,0,0,0|1,0,1]=4 5030 B9R1.23 CC1=C[C@H](CO)OC1=O Amb25357559 [0,2,0,0,0,0|0,0,1]=3 5031 B9R1.23 CC1=C\C(=C\Br)\OC1=O Amb25800206 [0,2,0,0,0,0|1,0,1]=4 5032 B9R1.23 CCc1[n]c(C)c(C)o1 Amb22047354 [0,2,0,0,0,0|2,0,0]=4 5033 B9R1.23 CCc1cc(Br)c(N)[s]1 Amb18176525 [0,2,0,0,0,0|1,1,0]=4 5034 B9R1.23 CCc1cc(C)c(C)[nH]1 Amb17938708 [0,2,0,0,0,0|2,0,0]=4 5035 B9R1.23 CCc1cc(N)c(Br)[nH]1 Amb18820652 [0,2,0,0,0,0|2,0,0]=4 5036 B9R1.23 CCc1cc(N)c(Br)[s]1 Amb25851701 [0,2,0,0,0,0|1,1,0]=4 5037 B9R1.23 CN1C=C(CO)SC1=O Amb24312656 [0,2,0,0,0,0|1,1,0]=4 5038 B9R1.23 CN1OC(CCl)=CC1=O Amb24674143 [0,2,0,0,0,0|2,0,0]=4 5039 B9R1.23 C[n]1[n]c(CO)cc1N Amb22803050 [0,2,0,0,0,0|2,0,0]=4 5040 B9R1.23 C[n]1[n]c(CO)cc1N Amb24269046 [0,2,0,0,0,0|2,0,0]=4 5041 B9R1.23 C[n]1cc(CO)[n]c1S Amb21927944 [0,2,0,0,0,0|2,0,0]=4 5042 B9R1.23 C[n]1cc(CO)cc1Cl Amb25377217 [0,2,0,0,0,0|2,0,0]=4 5043 B9R1.23 Cc1[nH]c(CO)[n]c1N Amb24633191 [0,2,0,0,0,0|2,0,0]=4 5044 B9R1.23 Cc1[n][n](CO)cc1Cl Amb25080488 [0,2,0,0,0,0|2,0,0]=4 5045 B9R1.23 Cc1[n]c(CN)oc1Br Amb25773780 [0,2,0,0,0,0|2,0,0]=4 5046 B9R1.23 Cc1[n]c(CO)[nH]c1C Amb18832738 [0,2,0,0,0,0|2,0,0]=4 5047 B9R1.23 Cc1[n]c(CO)[s]c1Br Amb24478774 [0,2,0,0,0,0|1,1,0]=4 5048 B9R1.23 Cc1[s]c(CBr)cc1C Amb25053700 [0,2,0,0,0,0|1,1,0]=4 5049 B9R1.23 Cc1[s]c(CCl)cc1Br Amb24432950 [0,2,0,0,0,0|1,1,0]=4 5050 B9R1.23 Cc1[s]c(CN)cc1Br Amb23589259 [0,2,0,0,0,0|1,1,0]=4 5051 B9R1.23 Cc1[s]c(CN)cc1C Amb18118450 [0,2,0,0,0,0|1,1,0]=4 5052 B9R1.23 Cc1[s]c(CN)cc1C Amb19335293 [0,2,0,0,0,0|1,1,0]=4 5053 B9R1.23 Cc1[s]c(CO)[n]c1C Amb22587195 [0,2,0,0,0,0|1,1,0]=4 5054 B9R1.23 Cc1[s]c(CO)cc1Br Amb25100585 [0,2,0,0,0,0|0,1,0]=3 5055 B9R1.23 Cc1cc(C=O)oc1Br Amb18187323 [0,2,0,0,0,0|0,0,2]=4 5056 B9R1.23 Cc1cc(C=O)oc1N Amb18832858 [0,2,0,0,0,0|0,0,2]=4 5057 B9R1.23 Cc1cc(CBr)[s]c1Br Amb24675120 [0,2,0,0,0,0|1,1,0]=4 5058 B9R1.23 Cc1cc(CBr)[s]c1Cl Amb24532905 [0,2,0,0,0,0|1,1,0]=4 5059 B9R1.23 Cc1cc(CCl)[s]c1Br Amb25832421 [0,2,0,0,0,0|1,1,0]=4 5060 B9R1.23 Cc1cc(CO)[s]c1Cl Amb24364822 [0,2,0,0,0,0|0,1,0]=3 5061 B9R1.23 Cc1cc(CO)nn1C Amb17913658 [0,2,0,0,0,0|2,0,0]=4 5062 B9R1.23 Cc1oc(C=O)cc1Br Amb18129294 [0,2,0,0,0,0|0,0,2]=4 5063 B9R1.23 Cc1oc(C=O)cc1F Amb18832650 [0,2,0,0,0,0|0,0,2]=4 5064 B9R1.23 Cc1oc(C=O)cc1N Amb18832845 [0,2,0,0,0,0|0,0,2]=4 5065 B9R1.23 Cc1oc(CBr)[n]c1C Amb24340169 [0,2,0,0,0,0|2,0,0]=4 5066 B9R1.23 Cc1oc(CC)[n]c1Br Amb25099063 [0,2,0,0,0,0|2,0,0]=4 5067 B9R1.23 Cc1oc(CI)[n]c1C Amb24729189 [0,2,0,0,0,0|2,0,0]=4 5068 B9R1.23 Cc1oc(CN)[n]c1N Amb25187203 [0,2,0,0,0,0|2,0,0]=4 5069 B9R1.23 Cc1oc(CN)cc1Br Amb23537726 [0,2,0,0,0,0|1,0,0]=3 5070 B9R1.23 Cc1oc(CN)cc1C Amb18642316 [0,2,0,0,0,0|1,0,0]=3 5071 B9R1.23 Cc1oc(CN)cc1N Amb18832726 [0,2,0,0,0,0|1,0,0]=3 5072 B9R1.23 Cc1oc(CO)[n]c1C Amb20667780 [0,2,0,0,0,0|1,0,0]=3 5073 B9R1.23 Cc1oc(CO)cc1Br Amb23537832 [0,2,0,0,0,0|0,0,0]=2 5074 B9R1.23 Cc1oc(cc1Br)C#N Amb23537727 [0,2,0,0,0,0|1,0,1]=4 5075 B9R1.23 ClCc1cc(Br)c(Br)[s]1 Amb24524199 [0,2,0,0,0,0|1,1,0]=4 5076 B9R1.23 ClCc1cc(Br)c(Br)o1 Amb25082917 [0,2,0,0,0,0|1,0,0]=3 5077 B9R1.23 ClCc1oc(c(n1)C)C Amb10609632 [0,2,0,0,0,0|2,0,0]=4 5078 B9R1.23 Cl[Hg]c1cc(Br)c(Br)o1 Amb22366199 [0,2,0,0,0,0|2,0,0]=4 5079 B9R1.23 Clc1cc(CBr)[s]c1Br Amb24416120 [0,2,0,0,0,0|1,1,0]=4 5080 B9R1.23 N#Cc1cc(Br)c(Br)o1 Amb23537581 [0,2,0,0,0,0|1,0,1]=4 5081 B9R1.23 N#Cc1cc(Br)c(Cl)o1 Amb23539105 [0,2,0,0,0,0|1,0,1]=4 5082 B9R1.23 N#Cc1cc(Cl)c(Cl)o1 Amb23538069 [0,2,0,0,0,0|1,0,1]=4 5083 B9R1.23 NC1=CC(CO)OC1=O Amb25275545 [0,2,0,0,0,0|0,0,1]=3 5084 B9R1.23 NCC1C=C(O)C(=O)O1 Amb25204300 [0,2,0,0,0,0|1,0,1]=4 5085 B9R1.23 NCc1cc(Br)c(Br)o1 Amb23535608 [0,2,0,0,0,0|1,0,0]=3 5086 B9R1.23 NCc1oc(c(n1)C)C Amb10609816 [0,2,0,0,0,0|2,0,0]=4 5087 B9R1.23 Nc1cc(C=O)oc1Br Amb18189507 [0,2,0,0,0,0|0,0,2]=4 5088 B9R1.23 O=Cc1cc(Br)c(Cl)o1 Amb18131113 [0,2,0,0,0,0|0,0,2]=4 5089 B9R1.23 O=Cc1cc(Cl)c(Cl)o1 Amb25366256 [0,2,0,0,0,0|0,0,2]=4 5090 B9R1.23 O=Cc1oc(c(c1)Br)Br Amb1799053 [0,2,0,0,0,0|0,0,2]=4 5091 B9R1.23 OC[C@@H]1C=C(Br)C(=O)O1 Amb25782292 [0,2,0,0,0,0|0,0,1]=3 5092 B9R1.23 OC[C@@H]1C=C(Cl)C(=O)O1 Amb25296371 [0,2,0,0,0,0|0,0,1]=3 5093 B9R1.23 OCc1[nH]c(Cl)c(Cl)[n]1 Amb22500915 [0,2,0,0,0,0|2,0,0]=4 5094 B9R1.23 OCc1cc(Br)c(Cl)o1 Amb23539104 [0,2,0,0,0,0|0,0,0]=2 5095 B9R1.23 OCc1cc(Cl)c(Br)[s]1 Amb25263178 [0,2,0,0,0,0|0,1,0]=3 5096 B9R1.23 OCc1cc(Cl)c(Cl)[nH]1 Amb22495087 [0,2,0,0,0,0|1,0,0]=3 5097 B9R1.23 OCc1cc(Cl)c(Cl)[s]1 Amb23560505 [0,2,0,0,0,0|0,1,0]=3 5098 B9R1.23 OCc1sc(c(n1)C)C Amb10608242 [0,2,0,0,0,0|1,1,0]=4 5099 B9R1.35 BrC(=O)c1ccc(Br)o1 Amb17939056 [0,2,0,0,0,0|0,0,2]=4 5100 B9R1.35 CC(=C)c1cc(Br)co1 Amb24596524 [0,2,0,0,0,0|1,0,1]=4 5101 B9R1.35 CC(=O)c1cc(Br)co1 Amb25780956 [0,2,0,0,0,0|0,0,2]=4 5102 B9R1.35 CC(=O)c1ccc(Br)o1 Amb18678443 [0,2,0,0,0,0|0,0,2]=4 5103 B9R1.35 CC(=O)c1ccc(Cl)o1 Amb24476595 [0,2,0,0,0,0|0,0,2]=4 5104 B9R1.35 CC(=O)c1ccc(F)o1 Amb24569531 [0,2,0,0,0,0|0,0,2]=4 5105 B9R1.35 CC(=O)c1ccc(I)o1 Amb24678169 [0,2,0,0,0,0|0,0,2]=4 5106 B9R1.35 CC(=O)c1ccc(N)o1 Amb18642262 [0,2,0,0,0,0|0,0,2]=4 5107 B9R1.35 CC(=O)c1ccc(S)o1 Amb25376412 [0,2,0,0,0,0|0,0,2]=4 5108 B9R1.35 CC(Br)c1ccc(Br)o1 Amb24444085 [0,2,0,0,0,0|1,0,0]=3 5109 B9R1.35 CC(C)=C1C=CC(=O)O1 Amb25663354 [0,2,0,0,0,0|1,0,1]=4 5110 B9R1.35 CC(C)c1[n]cc(Br)o1 Amb24368755 [0,2,0,0,0,0|2,0,0]=4 5111 B9R1.35 CC(C)c1[n]cc(N)o1 Amb18062956 [0,2,0,0,0,0|2,0,0]=4 5112 B9R1.35 CC(C)c1cc(Br)[n]o1 Amb24759090 [0,2,0,0,0,0|2,0,0]=4 5113 B9R1.35 CC(C)c1cc(Br)c[s]1 Amb18783656 [0,2,0,0,0,0|1,1,0]=4 5114 B9R1.35 CC(C)c1cc(Cl)[n]o1 Amb25220072 [0,2,0,0,0,0|2,0,0]=4 5115 B9R1.35 CC(C)c1cc(N)[n]o1 Amb18642427 [0,2,0,0,0,0|2,0,0]=4 5116 B9R1.35 CC(C)c1cc(N)c[nH]1 Amb18832880 [0,2,0,0,0,0|2,0,0]=4 5117 B9R1.35 CC(C)c1ccc(C)[nH]1 Amb17666653 [0,2,0,0,0,0|2,0,0]=4 5118 B9R1.35 CC(C)c1ccc(O)[s]1 Amb20617566 [0,2,0,0,0,0|1,1,0]=4 5119 B9R1.35 CC(Cl)c1ccc(Cl)[s]1 Amb18181045 [0,2,0,0,0,0|1,1,0]=4 5120 B9R1.35 CC(N)c1cc(Br)c[nH]1 Amb24349727 [0,2,0,0,0,0|2,0,0]=4 5121 B9R1.35 CC(N)c1cc(Br)c[s]1 Amb18244132 [0,2,0,0,0,0|1,1,0]=4 5122 B9R1.35 CC(N)c1cc(Br)co1 Amb24746809 [0,2,0,0,0,0|1,0,0]=3 5123 B9R1.35 CC(N)c1cc(Cl)c[s]1 Amb25185371 [0,2,0,0,0,0|1,1,0]=4 5124 B9R1.35 CC(N)c1cc(F)c[nH]1 Amb25695366 [0,2,0,0,0,0|2,0,0]=4 5125 B9R1.35 CC(N)c1cc(F)c[s]1 Amb25276824 [0,2,0,0,0,0|1,1,0]=4 5126 B9R1.35 CC(N)c1cc(F)co1 Amb24480319 [0,2,0,0,0,0|1,0,0]=3 5127 B9R1.35 CC(N)c1cc(I)c[nH]1 Amb25263920 [0,2,0,0,0,0|2,0,0]=4 5128 B9R1.35 CC(N)c1cc(N)c[s]1 Amb24693602 [0,2,0,0,0,0|1,1,0]=4 5129 B9R1.35 CC(N)c1cc(O)[n]o1 Amb18642593 [0,2,0,0,0,0|2,0,0]=4 5130 B9R1.35 CC(N)c1cc(O)c[nH]1 Amb25758722 [0,2,0,0,0,0|2,0,0]=4 5131 B9R1.35 CC(N)c1ccc(Br)[nH]1 Amb25311209 [0,2,0,0,0,0|2,0,0]=4 5132 B9R1.35 CC(N)c1ccc(F)[nH]1 Amb25139437 [0,2,0,0,0,0|2,0,0]=4 5133 B9R1.35 CC(N)c1ccc(F)[s]1 Amb24054157 [0,2,0,0,0,0|1,1,0]=4 5134 B9R1.35 CC(N)c1ccc(N)[nH]1 Amb24480318 [0,2,0,0,0,0|2,0,0]=4 5135 B9R1.35 CC(N)c1ccc(N)[s]1 Amb24425151 [0,2,0,0,0,0|1,1,0]=4 5136 B9R1.35 CC(O)C1=CCC(=O)O1 Amb24756799 [0,2,0,0,0,0|0,0,1]=3 5137 B9R1.35 CC(O)C1=CSC(=S)S1 Amb25332365 [0,2,0,0,0,0|1,1,0]=4 5138 B9R1.35 CC(O)c1[n][n]c(N)o1 Amb25829847 [0,2,0,0,0,0|2,0,0]=4 5139 B9R1.35 CC(O)c1[n]c(Br)c[s]1 Amb24446899 [0,2,0,0,0,0|1,1,0]=4 5140 B9R1.35 CC(O)c1c[n](C)c[n]1 Amb23439449 [0,2,0,0,0,0|2,0,0]=4 5141 B9R1.35 CC(O)c1c[n]c(Br)[s]1 Amb24690205 [0,2,0,0,0,0|1,1,0]=4 5142 B9R1.35 CC(O)c1c[n]c(Cl)[s]1 Amb25317218 [0,2,0,0,0,0|1,1,0]=4 5143 B9R1.35 CC(O)c1c[n]c(N)[s]1 Amb18280271 [0,2,0,0,0,0|1,1,0]=4 5144 B9R1.35 CC(O)c1c[n]c(O)[s]1 Amb24475958 [0,2,0,0,0,0|1,1,0]=4 5145 B9R1.35 CC(O)c1c[s]c(Cl)c1 Amb23440017 [0,2,0,0,0,0|2,0,0]=4 5146 B9R1.35 CC(O)c1c[s]c(I)c1 Amb24712968 [0,2,0,0,0,0|2,0,0]=4 5147 B9R1.35 CC(O)c1cc(Br)[n][nH]1 Amb25025446 [0,2,0,0,0,0|2,0,0]=4 5148 B9R1.35 CC(O)c1cc(Br)[n]o1 Amb24478601 [0,2,0,0,0,0|1,0,0]=3 5149 B9R1.35 CC(O)c1cc(Cl)[n]o1 Amb24532878 [0,2,0,0,0,0|1,0,0]=3 5150 B9R1.35 CC(O)c1cc(Cl)c[s]1 Amb25840149 [0,2,0,0,0,0|0,1,0]=3 5151 B9R1.35 CC(O)c1cc(O)[n][nH]1 Amb25676645 [0,2,0,0,0,0|2,0,0]=4 5152 B9R1.35 CC(O)c1ccc(Cl)o1 Amb24554790 [0,2,0,0,0,0|0,0,0]=2 5153 B9R1.35 CC(O)c1ccc(F)[s]1 Amb19892826 [0,2,0,0,0,0|0,1,0]=3 5154 B9R1.35 CC(O)c1coc(Br)c1 Amb25834179 [0,2,0,0,0,0|2,0,0]=4 5155 B9R1.35 CC(S)c1cc(Br)c[s]1 Amb24387948 [0,2,0,0,0,0|0,2,0]=4 5156 B9R1.35 CC(c1ccc(o1)Br)C Amb10600622 [0,2,0,0,0,0|1,0,0]=3 5157 B9R1.35 CC(c1ccc(o1)N)C Amb10600623 [0,2,0,0,0,0|1,0,0]=3 5158 B9R1.35 CC(c1ccc(s1)Br)C Amb10600620 [0,2,0,0,0,0|1,1,0]=4 5159 B9R1.35 CC(c1ccc(s1)Br)O Amb17194985 [0,2,0,0,0,0|0,1,0]=3 5160 B9R1.35 CC(c1ccc(s1)Cl)N Amb1107924 [0,2,0,0,0,0|1,1,0]=4 5161 B9R1.35 CC(c1ccc(s1)Cl)O Amb1111325 [0,2,0,0,0,0|0,1,0]=3 5162 B9R1.35 CC(c1ccc(s1)N)C Amb10600621 [0,2,0,0,0,0|1,1,0]=4 5163 B9R1.35 CN(C)c1ccc(Br)o1 Amb24317621 [0,2,0,0,0,0|2,0,0]=4 5164 B9R1.35 CN(C)c1ccc(O)o1 Amb25830511 [0,2,0,0,0,0|2,0,0]=4 5165 B9R1.35 C[C@@H](Br)[C@@H]1C=CC(=O)O1 Amb24552862 [0,2,0,0,0,0|1,0,1]=4 5166 B9R1.35 C[C@@H](N)C1=CC(=O)NO1 Amb18832644 [0,2,0,0,0,0|2,0,0]=4 5167 B9R1.35 C[C@@H](N)c1cc(Cl)c[s]1 Amb24436871 [0,2,0,0,0,0|1,1,0]=4 5168 B9R1.35 C[C@@H](N)c1cc(Cl)co1 Amb24611768 [0,2,0,0,0,0|1,0,0]=3 5169 B9R1.35 C[C@@H](N)c1cc(F)c[s]1 Amb25809065 [0,2,0,0,0,0|1,1,0]=4 5170 B9R1.35 C[C@@H](N)c1cc(I)c[nH]1 Amb24432646 [0,2,0,0,0,0|2,0,0]=4 5171 B9R1.35 C[C@@H](N)c1cc(O)co1 Amb24605618 [0,2,0,0,0,0|1,0,0]=3 5172 B9R1.35 C[C@@H](N)c1ccc(Br)[nH]1 Amb25104295 [0,2,0,0,0,0|2,0,0]=4 5173 B9R1.35 C[C@@H](N)c1ccc(Cl)[nH]1 Amb24714574 [0,2,0,0,0,0|2,0,0]=4 5174 B9R1.35 C[C@@H](N)c1ccc(F)[s]1 Amb25211709 [0,2,0,0,0,0|1,1,0]=4 5175 B9R1.35 C[C@@H](N)c1ccc(F)o1 Amb24572823 [0,2,0,0,0,0|1,0,0]=3 5176 B9R1.35 C[C@@H](N)c1ccc(N)o1 Amb25121513 [0,2,0,0,0,0|1,0,0]=3 5177 B9R1.35 C[C@@H](N)c1ccc(O)[nH]1 Amb24677930 [0,2,0,0,0,0|2,0,0]=4 5178 B9R1.35 C[C@@H](N)c1ccc(O)[s]1 Amb25350227 [0,2,0,0,0,0|1,1,0]=4 5179 B9R1.35 C[C@@H](O)C=1CCC(=O)C1 Amb25093670 [0,2,0,0,0,0|1,0,1]=4 5180 B9R1.35 C[C@@H](O)[C@@H]1C=CC(=O)O1 Amb25373835 [0,2,0,0,0,0|0,0,1]=3 5181 B9R1.35 C[C@@H](O)[C@H]1C=CC(=O)O1 Amb24691316 [0,2,0,0,0,0|0,0,1]=3 5182 B9R1.35 C[C@@H](O)c1cc(Br)[n]o1 Amb25091959 [0,2,0,0,0,0|1,0,0]=3 5183 B9R1.35 C[C@@H](O)c1cc(Br)c[s]1 Amb23439873 [0,2,0,0,0,0|0,1,0]=3 5184 B9R1.35 C[C@@H](O)c1cc[n](C)[n]1 Amb24691637 [0,2,0,0,0,0|2,0,0]=4 5185 B9R1.35 C[C@@H](c1ccc(s1)Br)N Amb13953006 [0,2,0,0,0,0|1,1,0]=4 5186 B9R1.35 C[C@@H](c1ccc(s1)Br)O Amb13953004 [0,2,0,0,0,0|0,1,0]=3 5187 B9R1.35 C[C@@H](c1ccc(s1)Cl)N Amb13953001 [0,2,0,0,0,0|1,1,0]=4 5188 B9R1.35 C[C@@H](c1ccc(s1)Cl)O Amb13953000 [0,2,0,0,0,0|0,1,0]=3 5189 B9R1.35 C[C@H](N)c1cc(Br)c[s]1 Amb25075759 [0,2,0,0,0,0|1,1,0]=4 5190 B9R1.35 C[C@H](N)c1cc(N)c[s]1 Amb24670079 [0,2,0,0,0,0|1,1,0]=4 5191 B9R1.35 C[C@H](N)c1cc(N)co1 Amb25300413 [0,2,0,0,0,0|1,0,0]=3 5192 B9R1.35 C[C@H](N)c1cc(O)co1 Amb25327387 [0,2,0,0,0,0|1,0,0]=3 5193 B9R1.35 C[C@H](N)c1ccc(F)[s]1 Amb25140799 [0,2,0,0,0,0|1,1,0]=4 5194 B9R1.35 C[C@H](N)c1ccc(I)[s]1 Amb24478743 [0,2,0,0,0,0|1,1,0]=4 5195 B9R1.35 C[C@H](N)c1ccc(N)[nH]1 Amb24757771 [0,2,0,0,0,0|2,0,0]=4 5196 B9R1.35 C[C@H](N)c1ccc(N)o1 Amb25185372 [0,2,0,0,0,0|1,0,0]=3 5197 B9R1.35 C[C@H](N)c1ccc(O)[nH]1 Amb25760309 [0,2,0,0,0,0|2,0,0]=4 5198 B9R1.35 C[C@H](N)c1ccc(O)[s]1 Amb25121515 [0,2,0,0,0,0|1,1,0]=4 5199 B9R1.35 C[C@H](O)C=1CCC(=O)C1 Amb24722795 [0,2,0,0,0,0|1,0,1]=4 5200 B9R1.35 C[C@H](O)c1c[s]c(Cl)c1 Amb25360387 [0,2,0,0,0,0|2,0,0]=4 5201 B9R1.35 C[C@H](O)c1cc(O)[n][nH]1 Amb24363601 [0,2,0,0,0,0|2,0,0]=4 5202 B9R1.35 C[C@H](O)c1cc[n](C)[n]1 Amb24545879 [0,2,0,0,0,0|2,0,0]=4 5203 B9R1.35 C[C@H](c1ccc(s1)Br)N Amb13953005 [0,2,0,0,0,0|1,1,0]=4 5204 B9R1.35 C[C@H](c1ccc(s1)Br)O Amb13953003 [0,2,0,0,0,0|0,1,0]=3 5205 B9R1.35 C[C@H](c1ccc(s1)Cl)N Amb13953002 [0,2,0,0,0,0|1,1,0]=4 5206 B9R1.35 C[C@H](c1ccc(s1)Cl)O Amb13952999 [0,2,0,0,0,0|0,1,0]=3 5207 B9R1.35 Cc1[n][n]c(o1)C(C)O Amb19330390 [0,2,0,0,0,0|2,0,0]=4 5208 B9R1.35 Cc1[n][n]c(o1)[C@@H](C)O Amb19373046 [0,2,0,0,0,0|2,0,0]=4 5209 B9R1.35 Cc1[n][n]c(o1)[C@H](C)O Amb24505031 [0,2,0,0,0,0|2,0,0]=4 5210 B9R1.35 Cc1[n]c(c[s]1)C(C)O Amb25307878 [0,2,0,0,0,0|2,0,0]=4 5211 B9R1.35 Cc1[n]c(c[s]1)[C@H](C)O Amb24747372 [0,2,0,0,0,0|2,0,0]=4 5212 B9R1.35 Cc1[n]c(co1)[C@@H](C)O Amb24366160 [0,2,0,0,0,0|2,0,0]=4 5213 B9R1.35 Cc1[n]c(co1)[C@H](C)O Amb24710550 [0,2,0,0,0,0|2,0,0]=4 5214 B9R1.35 Cc1[n]cc([s]1)C(C)O Amb25137666 [0,2,0,0,0,0|1,1,0]=4 5215 B9R1.35 Cc1[n]oc([n]1)C(C)O Amb19322011 [0,2,0,0,0,0|2,0,0]=4 5216 B9R1.35 Cc1[n]oc([n]1)[C@H](C)O Amb24456188 [0,2,0,0,0,0|2,0,0]=4 5217 B9R1.35 Cc1c[nH]c([n]1)C(C)O Amb21984112 [0,2,0,0,0,0|2,0,0]=4 5218 B9R1.35 Cc1c[nH]c(c1)C(C)N Amb25188943 [0,2,0,0,0,0|2,0,0]=4 5219 B9R1.35 Cc1c[nH]c(c1)[C@H](C)N Amb25805622 [0,2,0,0,0,0|2,0,0]=4 5220 B9R1.35 Cc1c[n]c([s]1)C(C)O Amb19649411 [0,2,0,0,0,0|1,1,0]=4 5221 B9R1.35 Cc1c[n]c(o1)C(C)C Amb23456251 [0,2,0,0,0,0|2,0,0]=4 5222 B9R1.35 Cc1c[n]c(o1)C(C)Cl Amb22059657 [0,2,0,0,0,0|2,0,0]=4 5223 B9R1.35 Cc1c[n]c(o1)C(C)O Amb25801402 [0,2,0,0,0,0|1,0,0]=3 5224 B9R1.35 Cc1c[n]c(o1)C(O)=O Amb18832708 [0,2,0,0,0,0|1,0,1]=4 5225 B9R1.35 Cc1c[n]c(o1)[C@@H](C)N Amb19373386 [0,2,0,0,0,0|2,0,0]=4 5226 B9R1.35 Cc1c[n]c(o1)[C@H](C)N Amb24649719 [0,2,0,0,0,0|2,0,0]=4 5227 B9R1.35 Cc1c[s]c([n]1)C(C)O Amb19649410 [0,2,0,0,0,0|1,1,0]=4 5228 B9R1.35 Cc1c[s]c(c1)C(C)C Amb25352144 [0,2,0,0,0,0|1,1,0]=4 5229 B9R1.35 Cc1c[s]c(c1)C(C)N Amb24505034 [0,2,0,0,0,0|1,1,0]=4 5230 B9R1.35 Cc1c[s]c(c1)C(C)O Amb24631377 [0,2,0,0,0,0|0,1,0]=3 5231 B9R1.35 Cc1cc([nH]c1)B(O)O Amb25265380 [0,2,0,0,0,0|2,0,0]=4 5232 B9R1.35 Cc1cc([n][nH]1)C(C)O Amb24352299 [0,2,0,0,0,0|2,0,0]=4 5233 B9R1.35 Cc1cc([n][s]1)C(C)O Amb25318018 [0,2,0,0,0,0|2,0,0]=4 5234 B9R1.35 Cc1cc([n]o1)C(C)O Amb23440963 [0,2,0,0,0,0|2,0,0]=4 5235 B9R1.35 Cc1cc([n]o1)[C@@H](C)O Amb24340083 [0,2,0,0,0,0|2,0,0]=4 5236 B9R1.35 Cc1cc(c[s]1)[C@@H](C)O Amb25372866 [0,2,0,0,0,0|2,0,0]=4 5237 B9R1.35 Cc1cc(o[n]1)B(O)O Amb25075534 [0,2,0,0,0,0|2,0,0]=4 5238 B9R1.35 Cc1cc(o[n]1)C(C)Cl Amb25188934 [0,2,0,0,0,0|2,0,0]=4 5239 B9R1.35 Cc1cc(o[n]1)C(C)O Amb19958726 [0,2,0,0,0,0|1,0,0]=3 5240 B9R1.35 Cc1cc(o[n]1)C(F)F Amb23571755 [0,2,0,0,0,0|2,0,0]=4 5241 B9R1.35 Cc1cc(o[n]1)[C@H](C)O Amb24675526 [0,2,0,0,0,0|1,0,0]=3 5242 B9R1.35 Cc1cc(oc1)C(O)=O Amb18642368 [0,2,0,0,0,0|0,0,1]=3 5243 B9R1.35 Cc1ccc([nH]1)C(C)Br Amb25138989 [0,2,0,0,0,0|2,0,0]=4 5244 B9R1.35 Cc1ccc([nH]1)[C@H](C)N Amb25162727 [0,2,0,0,0,0|2,0,0]=4 5245 B9R1.35 Cc1ccc([s]1)C(C)Cl Amb18175475 [0,2,0,0,0,0|1,1,0]=4 5246 B9R1.35 Cc1ccc([s]1)[C@@H](C)O Amb24625882 [0,2,0,0,0,0|0,1,0]=3 5247 B9R1.35 Cc1ccc([s]1)[C@H](C)N Amb24555329 [0,2,0,0,0,0|1,1,0]=4 5248 B9R1.35 Cc1ccc(o1)B(C)C Amb25239116 [0,2,0,0,0,0|2,0,0]=4 5249 B9R1.35 Cc1ccc(o1)B(O)O Amb22586674 [0,2,0,0,0,0|1,0,0]=3 5250 B9R1.35 Cc1ccc(o1)C(=O)C Amb1154368 [0,2,0,0,0,0|0,0,2]=4 5251 B9R1.35 Cc1ccc(o1)C(C)=C Amb24716757 [0,2,0,0,0,0|1,0,1]=4 5252 B9R1.35 Cc1ccc(o1)C(C)C Amb22749543 [0,2,0,0,0,0|1,0,0]=3 5253 B9R1.35 Cc1ccc(o1)C(N)=N Amb21959999 [0,2,0,0,0,0|1,0,1]=4 5254 B9R1.35 Cc1ccc(o1)C(O)O Amb24679355 [0,2,0,0,0,0|0,0,0]=2 5255 B9R1.35 Cc1ccc(o1)[C@@H](N)C Amb13952995 [0,2,0,0,0,0|1,0,0]=3 5256 B9R1.35 Cc1ccc(o1)[C@@H](O)C Amb13952992 [0,2,0,0,0,0|0,0,0]=2 5257 B9R1.35 Cc1ccc(o1)[C@H](N)C Amb13952993 [0,2,0,0,0,0|1,0,0]=3 5258 B9R1.35 Cc1ccc(o1)[C@H](O)C Amb13952991 [0,2,0,0,0,0|0,0,0]=2 5259 B9R1.35 Cc1ccc(s1)C(=O)O Amb1157149 [0,2,0,0,0,0|0,1,1]=4 5260 B9R1.35 Cc1ccc(s1)C(N)C Amb10610116 [0,2,0,0,0,0|1,1,0]=4 5261 B9R1.35 Cc1ccc(s1)C(N)C Amb1108677 [0,2,0,0,0,0|1,1,0]=4 5262 B9R1.35 Cc1ccc(s1)C(O)C Amb2237071 [0,2,0,0,0,0|0,1,0]=3 5263 B9R1.35 Cc1coc([n]1)C(C)N Amb25786164 [0,2,0,0,0,0|2,0,0]=4 5264 B9R1.35 Cc1coc([n]1)C(O)=O Amb18832706 [0,2,0,0,0,0|1,0,1]=4 5265 B9R1.35 Cc1coc([n]1)[C@@H](C)N Amb18832748 [0,2,0,0,0,0|2,0,0]=4 5266 B9R1.35 Cc1coc(c1)C(C)C Amb25223545 [0,2,0,0,0,0|1,0,0]=3 5267 B9R1.35 Cc1coc(c1)C(C)N Amb18203314 [0,2,0,0,0,0|1,0,0]=3 5268 B9R1.35 Cc1ncc(o1)C(=O)O Amb17399815 [0,2,0,0,0,0|1,0,1]=4 5269 B9R1.35 Clc1ccc([s]1)C(Br)Br Amb25352134 [0,2,0,0,0,0|1,1,0]=4 5270 B9R1.35 Cn1ccc(n1)C(O)C Amb10068438 [0,2,0,0,0,0|2,0,0]=4 5271 B9R1.35 FC(F)c1[n]c(Br)co1 Amb24517353 [0,2,0,0,0,0|2,0,0]=4 5272 B9R1.35 FC(F)c1c[n]c(Br)o1 Amb24517352 [0,2,0,0,0,0|2,0,0]=4 5273 B9R1.35 FC(F)c1cc(Cl)c[s]1 Amb24355104 [0,2,0,0,0,0|1,1,0]=4 5274 B9R1.35 FC(F)c1ccc(Br)[s]1 Amb19894510 [0,2,0,0,0,0|1,1,0]=4 5275 B9R1.35 FC(F)c1ccc(I)o1 Amb22008359 [0,2,0,0,0,0|1,0,0]=3 5276 B9R1.35 NC(=N)c1ccc(o1)I Amb16240317 [0,2,0,0,0,0|1,0,1]=4 5277 B9R1.35 NC(=N)c1ccc(o1)I Amb17601640 [0,2,0,0,0,0|1,0,1]=4 5278 B9R1.35 NC(=O)c1cc(Br)co1 Amb22044254 [0,2,0,0,0,0|0,0,2]=4 5279 B9R1.35 NC(=O)c1ccc(S)o1 Amb24093660 [0,2,0,0,0,0|0,0,2]=4 5280 B9R1.35 NC(=S)c1ccc(o1)Br Amb1117160 [0,2,0,0,0,0|0,1,1]=4 5281 B9R1.35 Nc1[n]cc(o1)C(O)=O Amb19959202 [0,2,0,0,0,0|1,0,1]=4 5282 B9R1.35 Nc1cc([nH]c1)C(O)=O Amb18945036 [0,2,0,0,0,0|1,0,1]=4 5283 B9R1.35 Nc1cc([s]c1)C(O)=O Amb18124637 [0,2,0,0,0,0|0,1,1]=4 5284 B9R1.35 Nc1cc(o[n]1)C(O)=O Amb18832657 [0,2,0,0,0,0|1,0,1]=4 5285 B9R1.35 Nc1cc(oc1)C(O)=O Amb24428249 [0,2,0,0,0,0|0,0,1]=3 5286 B9R1.35 Nc1cc(sc1)C(=O)O Amb10602581 [0,2,0,0,0,0|0,1,1]=4 5287 B9R1.35 Nc1ccc([nH]1)C(O)=O Amb21963287 [0,2,0,0,0,0|1,0,1]=4 5288 B9R1.35 Nc1ccc([nH]1)C(O)=O Amb22899764 [0,2,0,0,0,0|1,0,1]=4 5289 B9R1.35 Nc1ccc([s]1)B(O)O Amb25217925 [0,2,0,0,0,0|1,1,0]=4 5290 B9R1.35 Nc1ccc([s]1)C(O)=O Amb18831593 [0,2,0,0,0,0|0,1,1]=4 5291 B9R1.35 Nc1ccc(o1)C(N)=O Amb18107255 [0,2,0,0,0,0|0,0,2]=4 5292 B9R1.35 Nc1ccc(o1)C(O)=O Amb18946756 [0,2,0,0,0,0|0,0,1]=3 5293 B9R1.35 Nc1ccc(o1)[N+]([O-])=O Amb18832656 [0,2,0,0,0,0|1,0,1]=4 5294 B9R1.35 O=C(I)c1ccc(Br)o1 Amb25180066 [0,2,0,0,0,0|0,0,2]=4 5295 B9R1.35 OB(O)c1cc(Br)co1 Amb24312747 [0,2,0,0,0,0|1,0,0]=3 5296 B9R1.35 OB(O)c1cc(Cl)c[s]1 Amb24073885 [0,2,0,0,0,0|1,1,0]=4 5297 B9R1.35 OB(O)c1cc(Cl)co1 Amb24433254 [0,2,0,0,0,0|1,0,0]=3 5298 B9R1.35 OB(O)c1cc(F)c[s]1 Amb22001864 [0,2,0,0,0,0|1,1,0]=4 5299 B9R1.35 OB(O)c1cc(F)co1 Amb25066867 [0,2,0,0,0,0|1,0,0]=3 5300 B9R1.35 OB(O)c1ccc(Br)o1 Amb24312807 [0,2,0,0,0,0|1,0,0]=3 5301 B9R1.35 OB(O)c1ccc(Cl)o1 Amb25072410 [0,2,0,0,0,0|1,0,0]=3 5302 B9R1.35 OB(O)c1ccc(F)[s]1 Amb19892583 [0,2,0,0,0,0|1,1,0]=4 5303 B9R1.35 OB(c1ccc(s1)Br)O Amb2455658 [0,2,0,0,0,0|1,1,0]=4 5304 B9R1.35 OB(c1occ(c1)C)O Amb10597554 [0,2,0,0,0,0|1,0,0]=3 5305 B9R1.35 OB(c1scc(c1)C)O Amb2456033 [0,2,0,0,0,0|1,1,0]=4 5306 B9R1.35 OC(=O)C1=CC(=O)NO1 Amb19889163 [0,2,0,0,0,0|1,0,1]=4 5307 B9R1.35 OC(=O)c1[n]c(Br)co1 Amb22754333 [0,2,0,0,0,0|1,0,1]=4 5308 B9R1.35 OC(=O)c1[n]cc(Cl)o1 Amb25208596 [0,2,0,0,0,0|1,0,1]=4 5309 B9R1.35 OC(=O)c1c[n]c(Br)o1 Amb19958445 [0,2,0,0,0,0|1,0,1]=4 5310 B9R1.35 OC(=O)c1c[n]c(Br)o1 Amb22432570 [0,2,0,0,0,0|1,0,1]=4 5311 B9R1.35 OC(=O)c1cc(Br)co1 Amb18129829 [0,2,0,0,0,0|0,0,1]=3 5312 B9R1.35 OC(=O)c1cc(Cl)co1 Amb18644297 [0,2,0,0,0,0|0,0,1]=3 5313 B9R1.35 OC(=O)c1cc(F)c[nH]1 Amb22887025 [0,2,0,0,0,0|1,0,1]=4 5314 B9R1.35 OC(=O)c1cc(S)c[s]1 Amb24478659 [0,2,0,0,0,0|0,1,1]=4 5315 B9R1.35 OC(=O)c1cc(c[nH]1)Br Amb1154606 [0,2,0,0,0,0|1,0,1]=4 5316 B9R1.35 OC(=O)c1cc(c[nH]1)Cl Amb1106125 [0,2,0,0,0,0|1,0,1]=4 5317 B9R1.35 OC(=O)c1cc(cs1)Br Amb1935172 [0,2,0,0,0,0|0,1,1]=4 5318 B9R1.35 OC(=O)c1cc(cs1)Cl Amb16185757 [0,2,0,0,0,0|0,1,1]=4 5319 B9R1.35 OC(=O)c1cc(cs1)F Amb10602731 [0,2,0,0,0,0|0,1,1]=4 5320 B9R1.35 OC(=O)c1cc(no1)Br Amb10603676 [0,2,0,0,0,0|1,0,1]=4 5321 B9R1.35 OC(=O)c1cc(no1)Cl Amb15701317 [0,2,0,0,0,0|1,0,1]=4 5322 B9R1.35 OC(=O)c1ccc(Br)[nH]1 Amb21857063 [0,2,0,0,0,0|1,0,1]=4 5323 B9R1.35 OC(=O)c1ccc(F)o1 Amb23538033 [0,2,0,0,0,0|0,0,1]=3 5324 B9R1.35 OC(=O)c1ccc(I)[nH]1 Amb22498191 [0,2,0,0,0,0|1,0,1]=4 5325 B9R1.35 OC(=O)c1ccc(I)[s]1 Amb22002319 [0,2,0,0,0,0|0,1,1]=4 5326 B9R1.35 OC(=O)c1ccc(S)o1 Amb18279728 [0,2,0,0,0,0|0,0,1]=3 5327 B9R1.35 OC(=O)c1ccc(o1)Cl Amb1107530 [0,2,0,0,0,0|0,0,1]=3 5328 B9R1.35 OC(=O)c1ccc(o1)I Amb2459665 [0,2,0,0,0,0|0,0,1]=3 5329 B9R1.35 OC(=O)c1ccc(s1)Cl Amb1152956 [0,2,0,0,0,0|0,1,1]=4 5330 B9R1.35 OS(=O)c1cc(Br)c[s]1 Amb18867802 [0,2,0,0,0,0|1,1,0]=4 5331 B9R1.35 OS(=O)c1ccc(Br)[s]1 Amb18571234 [0,2,0,0,0,0|1,1,0]=4 5332 B9R1.35 OS(=O)c1ccc(Cl)[s]1 Amb18560136 [0,2,0,0,0,0|1,1,0]=4 5333 B9R1.35 Oc1[n]cc(o1)C(O)=O Amb25178101 [0,2,0,0,0,0|1,0,1]=4 5334 B9R1.35 Oc1c[nH]c(c1)C(O)=O Amb24649356 [0,2,0,0,0,0|1,0,1]=4 5335 B9R1.35 Oc1c[n]c(o1)C(F)F Amb24564221 [0,2,0,0,0,0|2,0,0]=4 5336 B9R1.35 Oc1c[n]c(o1)C(O)=O Amb25145621 [0,2,0,0,0,0|1,0,1]=4 5337 B9R1.35 Oc1cc([s]c1)C(F)F Amb25365330 [0,2,0,0,0,0|1,1,0]=4 5338 B9R1.35 Oc1ccc(o1)C(O)=O Amb18946939 [0,2,0,0,0,0|0,0,1]=3 5339 B9R1.35 Oc1coc([n]1)C(O)=O Amb25243276 [0,2,0,0,0,0|1,0,1]=4 5340 B9R1.35 [O-]C(=O)c1ccc(o1)I Amb2459790 [0,2,0,0,0,0|0,0,2]=4 5341 B9R1.35 [O-][N+](=O)c1ccc(O)o1 Amb25025913 [0,2,0,0,0,0|1,0,1]=4 5342 B9R1.125 C[C@]1(CO)C=CC(=O)O1 Amb24404816 [0,2,0,0,0,0|0,0,1]=3 5343 B9R1.125 O=C1C=CP(=O)(CCl)O1 Amb24401494 [0,2,0,0,0,0|2,0,0]=4 5344 B9R1.132 BrCc1[s]cc(Br)c1Br Amb22753861 [0,2,0,0,0,0|1,1,0]=4 5345 B9R1.132 CC1=C(CO)COC1=O Amb24398034 [0,2,0,0,0,0|2,0,0]=4 5346 B9R1.132 CC=1C(=O)NOC1CC Amb24481691 [0,2,0,0,0,0|2,0,0]=4 5347 B9R1.132 CC=1C(=O)NOC1CN Amb18832638 [0,2,0,0,0,0|2,0,0]=4 5348 B9R1.132 CCc1[nH]cc(C)c1C Amb17938711 [0,2,0,0,0,0|2,0,0]=4 5349 B9R1.132 CCc1o[n]c(N)c1Br Amb25842122 [0,2,0,0,0,0|2,0,0]=4 5350 B9R1.132 CCc1o[n]c(O)c1F Amb25071409 [0,2,0,0,0,0|2,0,0]=4 5351 B9R1.132 CN1C(=S)NC=C1CO Amb20637276 [0,2,0,0,0,0|2,0,0]=4 5352 B9R1.132 C[n]1c(Br)[n]cc1CO Amb22495979 [0,2,0,0,0,0|2,0,0]=4 5353 B9R1.132 C[n]1c(Cl)[n]cc1CO Amb25809022 [0,2,0,0,0,0|2,0,0]=4 5354 B9R1.132 C[n]1c(F)ccc1CC Amb24373276 [0,2,0,0,0,0|2,0,0]=4 5355 B9R1.132 C[n]1c(N)c[n]c1CO Amb23585169 [0,2,0,0,0,0|2,0,0]=4 5356 B9R1.132 Cc1[nH][n]c(CO)c1Cl Amb24546764 [0,2,0,0,0,0|2,0,0]=4 5357 B9R1.132 Cc1[nH][n]c(CO)c1F Amb24564597 [0,2,0,0,0,0|2,0,0]=4 5358 B9R1.132 Cc1[n][nH]c(CO)c1Br Amb24564648 [0,2,0,0,0,0|2,0,0]=4 5359 B9R1.132 Cc1[n]cc(CO)[n]1C Amb22009457 [0,2,0,0,0,0|2,0,0]=4 5360 B9R1.132 Cc1[n]oc(CBr)c1Br Amb22748950 [0,2,0,0,0,0|2,0,0]=4 5361 B9R1.132 Cc1[n]oc(CC)c1N Amb23440679 [0,2,0,0,0,0|2,0,0]=4 5362 B9R1.132 Cc1[n]oc(CCl)c1Cl Amb25032241 [0,2,0,0,0,0|2,0,0]=4 5363 B9R1.132 Cc1[n]oc(CN)c1Br Amb23592259 [0,2,0,0,0,0|2,0,0]=4 5364 B9R1.132 Cc1[n]oc(CO)c1Br Amb23592260 [0,2,0,0,0,0|1,0,0]=3 5365 B9R1.132 Cc1[s]cc(CO)c1N Amb25128782 [0,2,0,0,0,0|2,0,0]=4 5366 B9R1.132 Cc1c(Br)[n]oc1CO Amb24475092 [0,2,0,0,0,0|1,0,0]=3 5367 B9R1.132 Cc1c(Br)o[n]c1CO Amb22388577 [0,2,0,0,0,0|2,0,0]=4 5368 B9R1.132 Cc1c(CO)[n]c[n]1C Amb25187373 [0,2,0,0,0,0|2,0,0]=4 5369 B9R1.132 Cc1c(CO)cc[n]1C Amb24062100 [0,2,0,0,0,0|2,0,0]=4 5370 B9R1.132 Cc1c(Cl)o[n]c1CO Amb25692341 [0,2,0,0,0,0|2,0,0]=4 5371 B9R1.132 Cc1c(N)[n]oc1CC Amb18832753 [0,2,0,0,0,0|2,0,0]=4 5372 B9R1.132 Cc1c(N)c[s]c1CC Amb24471496 [0,2,0,0,0,0|1,1,0]=4 5373 B9R1.132 Cc1c(N)coc1C=O Amb18832844 [0,2,0,0,0,0|0,0,2]=4 5374 B9R1.132 Cc1c[n]c(CO)[n]1C Amb24192760 [0,2,0,0,0,0|2,0,0]=4 5375 B9R1.132 Cc1c[s]c(CBr)c1Cl Amb24554516 [0,2,0,0,0,0|1,1,0]=4 5376 B9R1.132 Cc1c[s]c(CC)c1N Amb24084032 [0,2,0,0,0,0|1,1,0]=4 5377 B9R1.132 Cc1c[s]c(CCl)c1Cl Amb24479936 [0,2,0,0,0,0|1,1,0]=4 5378 B9R1.132 Cc1ccc(CO)[n]1C Amb23149160 [0,2,0,0,0,0|1,0,0]=3 5379 B9R1.132 Cc1coc(C=O)c1Br Amb18187328 [0,2,0,0,0,0|0,0,2]=4 5380 B9R1.132 Cn1c(CN)ccc1C Amb10531650 [0,2,0,0,0,0|2,0,0]=4 5381 B9R1.132 Cn1c(CN)ccc1C Amb1090454 [0,2,0,0,0,0|2,0,0]=4 5382 B9R1.132 Cn1c(CO)cnc1S Amb2424532 [0,2,0,0,0,0|2,0,0]=4 5383 B9R1.132 Cn1c(CO)ncc1Cl Amb13951698 [0,2,0,0,0,0|2,0,0]=4 5384 B9R1.132 N#Cc1occ(Cl)c1Cl Amb23538002 [0,2,0,0,0,0|1,0,1]=4 5385 B9R1.132 NCc1[s]cc(Br)c1Br Amb23537865 [0,2,0,0,0,0|1,1,0]=4 5386 B9R1.132 NCc1o[n]c(O)c1Br Amb24532842 [0,2,0,0,0,0|2,0,0]=4 5387 B9R1.132 Nc1c(Br)coc1C#N Amb25825107 [0,2,0,0,0,0|1,0,1]=4 5388 B9R1.132 Nc1c(Cl)[nH][n]c1CO Amb25836858 [0,2,0,0,0,0|2,0,0]=4 5389 B9R1.132 Nc1c(N)c[n][n]1CO Amb24460346 [0,2,0,0,0,0|2,0,0]=4 5390 B9R1.132 O=C1NOC(CCl)=C1Br Amb24379118 [0,2,0,0,0,0|2,0,0]=4 5391 B9R1.132 OCc1[s][n]c(Cl)c1Cl Amb25675466 [0,2,0,0,0,0|1,1,0]=4 5392 B9R1.132 OCc1c[s]c(Br)c1Br Amb22498289 [0,2,0,0,0,0|2,0,0]=4 5393 B9R1.132 OCc1c[s]c(Br)c1F Amb24651243 [0,2,0,0,0,0|2,0,0]=4 5394 B9R1.132 OCc1c[s]c(Cl)c1Cl Amb24569963 [0,2,0,0,0,0|2,0,0]=4 5395 B9R1.132 OCc1coc(Br)c1F Amb24651242 [0,2,0,0,0,0|2,0,0]=4 5396 B9R1.132 OCc1occ(Cl)c1Cl Amb25760097 [0,2,0,0,0,0|0,0,0]=2 5397 B9R1.132 Oc1[n]oc(CCl)c1Cl Amb25180893 [0,2,0,0,0,0|2,0,0]=4 5398 B9R1.133 CC1(O)C=CC(CO)O1 Amb24718495 [0,2,0,0,0,0|0,0,2]=4 5399 B9R1.11 BrCC(c1cccs1)C Amb17238292 [0,2,0,0,0,0|1,1,0]=4 5400 B9R1.11 BrCC(c1cccs1)O Amb17206127 [0,2,0,0,0,0|0,1,0]=3 5401 B9R1.11 C#CC(Br)c1ccc[s]1 Amb24541130 [0,2,0,0,0,0|1,1,0]=4 5402 B9R1.11 C#CC(N)c1ccc[s]1 Amb23448720 [0,2,0,0,0,0|1,1,0]=4 5403 B9R1.11 C#CC(N)c1ccco1 Amb23448719 [0,2,0,0,0,0|1,0,0]=3 5404 B9R1.11 C#CC(O)c1[n]cc[s]1 Amb24481643 [0,2,0,0,0,0|1,1,0]=4 5405 B9R1.11 C#CC(O)c1ccco1 Amb25188923 [0,2,0,0,0,0|0,0,0]=2 5406 B9R1.11 C#CC(O)c1cocc1 Amb25147214 [0,2,0,0,0,0|2,0,0]=4 5407 B9R1.11 C#CC(S)c1ccc[s]1 Amb24511591 [0,2,0,0,0,0|0,2,0]=4 5408 B9R1.11 C#C[C@@H](O)c1c[s]cc1 Amb25691185 [0,2,0,0,0,0|2,0,0]=4 5409 B9R1.11 C#C[C@@H](O)c1ccc[s]1 Amb25105984 [0,2,0,0,0,0|0,1,0]=3 5410 B9R1.11 C#C[C@@H](O)c1ccco1 Amb25842614 [0,2,0,0,0,0|0,0,0]=2 5411 B9R1.11 C=C(C#N)c1ccco1 Amb24645340 [0,2,0,0,0,0|1,0,1]=4 5412 B9R1.11 C=C(CCl)c1ccc[s]1 Amb25349350 [0,2,0,0,0,0|1,1,0]=4 5413 B9R1.11 C=C(CN)c1ccc[s]1 Amb18908327 [0,2,0,0,0,0|1,1,0]=4 5414 B9R1.11 C=CC(=O)c1ccco1 Amb16232452 [0,2,0,0,0,0|0,0,2]=4 5415 B9R1.11 C=CC(N)c1ccc[nH]1 Amb24477837 [0,2,0,0,0,0|2,0,0]=4 5416 B9R1.11 C=CC(O)C1=CCCO1 Amb25284316 [0,2,0,0,0,0|0,0,2]=4 5417 B9R1.11 C=CC(O)c1[n]cc[s]1 Amb24481644 [0,2,0,0,0,0|1,1,0]=4 5418 B9R1.11 C=CC(O)c1c[nH]cc1 Amb25767547 [0,2,0,0,0,0|2,0,0]=4 5419 B9R1.11 C=CC(O)c1c[s]cc1 Amb24427764 [0,2,0,0,0,0|2,0,0]=4 5420 B9R1.11 C=CC(O)c1ccc[s]1 Amb25123773 [0,2,0,0,0,0|0,1,0]=3 5421 B9R1.11 C=CC(O)c1ccco1 Amb24332569 [0,2,0,0,0,0|0,0,0]=2 5422 B9R1.11 C=CC(O)c1cocc1 Amb25794051 [0,2,0,0,0,0|2,0,0]=4 5423 B9R1.11 C=C[C@@H](O)c1ccco1 Amb25074343 [0,2,0,0,0,0|0,0,0]=2 5424 B9R1.11 C=C[C@H](N)c1ccc[s]1 Amb24693080 [0,2,0,0,0,0|1,1,0]=4 5425 B9R1.11 C=C[C@H](O)c1ccc[s]1 Amb25084312 [0,2,0,0,0,0|0,1,0]=3 5426 B9R1.11 C=C[C@H](O)c1ccco1 Amb25056767 [0,2,0,0,0,0|0,0,0]=2 5427 B9R1.11 C=C[C@H](O)c1cocc1 Amb24732477 [0,2,0,0,0,0|2,0,0]=4 5428 B9R1.11 CC(=NO)c1ccc[nH]1 Amb24059875 [0,2,0,0,0,0|1,0,1]=4 5429 B9R1.11 CC(=NO)c1ccc[s]1 Amb24060087 [0,2,0,0,0,0|0,1,1]=4 5430 B9R1.11 CC(C#N)c1ccc[nH]1 Amb18124279 [0,2,0,0,0,0|2,0,0]=4 5431 B9R1.11 CC(C=O)c1ccc[nH]1 Amb24349735 [0,2,0,0,0,0|1,0,1]=4 5432 B9R1.11 CC(C=O)c1ccco1 Amb18642174 [0,2,0,0,0,0|0,0,1]=3 5433 B9R1.11 CC(CCl)=C1C=CC=C1 Amb25705321 [0,2,0,0,0,0|2,0,0]=4 5434 B9R1.11 CC(CN)c1[n]cco1 Amb25808994 [0,2,0,0,0,0|2,0,0]=4 5435 B9R1.11 CC(CN)c1cc[n]o1 Amb24559475 [0,2,0,0,0,0|2,0,0]=4 5436 B9R1.11 CC(CO)c1[nH]cc[n]1 Amb22585594 [0,2,0,0,0,0|2,0,0]=4 5437 B9R1.11 CC(NO)c1c[n]c[s]1 Amb25074444 [0,2,0,0,0,0|1,1,0]=4 5438 B9R1.11 CC(NO)c1c[s]c[n]1 Amb24481713 [0,2,0,0,0,0|2,0,0]=4 5439 B9R1.11 CC(NO)c1c[s]cc1 Amb24529065 [0,2,0,0,0,0|2,0,0]=4 5440 B9R1.11 CC(NO)c1cocc1 Amb24756333 [0,2,0,0,0,0|2,0,0]=4 5441 B9R1.11 CCC(C)c1cc[n]o1 Amb25061708 [0,2,0,0,0,0|2,0,0]=4 5442 B9R1.11 CCC(C)c1ccc[nH]1 Amb24376687 [0,2,0,0,0,0|2,0,0]=4 5443 B9R1.11 CCC(N)c1cc[n]o1 Amb18832755 [0,2,0,0,0,0|2,0,0]=4 5444 B9R1.11 CCC(N)c1ccc[nH]1 Amb18832877 [0,2,0,0,0,0|2,0,0]=4 5445 B9R1.11 CCC(O)C1=CCCO1 Amb25844889 [0,2,0,0,0,0|0,0,2]=4 5446 B9R1.11 CCC(O)[n]1ccc[n]1 Amb25090876 [0,2,0,0,0,0|2,0,0]=4 5447 B9R1.11 CCC(O)c1[n]cc[s]1 Amb19649356 [0,2,0,0,0,0|1,1,0]=4 5448 B9R1.11 CCC(O)c1c[nH]c[n]1 Amb24612300 [0,2,0,0,0,0|2,0,0]=4 5449 B9R1.11 CCC(O)c1c[n]c[s]1 Amb24382275 [0,2,0,0,0,0|1,1,0]=4 5450 B9R1.11 CCC(O)c1c[s]cc1 Amb25070368 [0,2,0,0,0,0|2,0,0]=4 5451 B9R1.11 CCC(O)c1cc[s][n]1 Amb25341019 [0,2,0,0,0,0|2,0,0]=4 5452 B9R1.11 CCC(O)c1ccc[nH]1 Amb25781453 [0,2,0,0,0,0|1,0,0]=3 5453 B9R1.11 CCC(S)c1ccc[s]1 Amb18787791 [0,2,0,0,0,0|0,2,0]=4 5454 B9R1.11 CCC(c1ccco1)Cl Amb17138399 [0,2,0,0,0,0|1,0,0]=3 5455 B9R1.11 CCC(c1ccco1)N Amb17061211 [0,2,0,0,0,0|1,0,0]=3 5456 B9R1.11 CCC(c1ccco1)O Amb17138369 [0,2,0,0,0,0|0,0,0]=2 5457 B9R1.11 CCC(c1cccs1)Cl Amb17138515 [0,2,0,0,0,0|1,1,0]=4 5458 B9R1.11 CCC(c1cccs1)N Amb10609665 [0,2,0,0,0,0|1,1,0]=4 5459 B9R1.11 CCC(c1cccs1)N Amb1102446 [0,2,0,0,0,0|1,1,0]=4 5460 B9R1.11 CCS(=O)c1[n]cco1 Amb24679306 [0,2,0,0,0,0|2,0,0]=4 5461 B9R1.11 CC[C@@H](N)c1c[n]co1 Amb25266886 [0,2,0,0,0,0|2,0,0]=4 5462 B9R1.11 CC[C@@H](N)c1ccc[s]1 Amb24666373 [0,2,0,0,0,0|1,1,0]=4 5463 B9R1.11 CC[C@@H](N)c1ccco1 Amb25246133 [0,2,0,0,0,0|1,0,0]=3 5464 B9R1.11 CC[C@@H](O)[n]1cccc1 Amb24644142 [0,2,0,0,0,0|2,0,0]=4 5465 B9R1.11 CC[C@@H](O)c1c[nH]cc1 Amb25032173 [0,2,0,0,0,0|2,0,0]=4 5466 B9R1.11 CC[C@@H](O)c1c[s]cc1 Amb24441265 [0,2,0,0,0,0|2,0,0]=4 5467 B9R1.11 CC[C@@H](O)c1ccc[s]1 Amb25162319 [0,2,0,0,0,0|0,1,0]=3 5468 B9R1.11 CC[C@H](N)c1c[n]co1 Amb25043145 [0,2,0,0,0,0|2,0,0]=4 5469 B9R1.11 CC[C@H](O)c1[n]cc[s]1 Amb24386906 [0,2,0,0,0,0|1,1,0]=4 5470 B9R1.11 CC[C@H](O)c1c[s]c[n]1 Amb25276018 [0,2,0,0,0,0|2,0,0]=4 5471 B9R1.11 CNC(=N)c1ccco1 Amb24539020 [0,2,0,0,0,0|1,0,1]=4 5472 B9R1.11 CNC(=S)c1ccco1 Amb25146108 [0,2,0,0,0,0|0,1,1]=4 5473 B9R1.11 CNC(C)c1[n]cco1 Amb25106029 [0,2,0,0,0,0|2,0,0]=4 5474 B9R1.11 CNC(C)c1ccco1 Amb19888104 [0,2,0,0,0,0|1,0,0]=3 5475 B9R1.11 CNC(c1ccco1)C Amb1127360 [0,2,0,0,0,0|1,0,0]=3 5476 B9R1.11 CNC(c1cccs1)C Amb1799863 [0,2,0,0,0,0|1,1,0]=4 5477 B9R1.11 CN[C@@H](C)c1ccc[s]1 Amb24364654 [0,2,0,0,0,0|1,1,0]=4 5478 B9R1.11 CN[C@H](C)c1ccc[s]1 Amb24635445 [0,2,0,0,0,0|1,1,0]=4 5479 B9R1.11 CN[C@H](C)c1ccco1 Amb24434234 [0,2,0,0,0,0|1,0,0]=3 5480 B9R1.11 COC(=N)c1ccc[nH]1 Amb24669587 [0,2,0,0,0,0|1,0,1]=4 5481 B9R1.11 COC(=N)c1ccco1 Amb22263727 [0,2,0,0,0,0|0,0,1]=3 5482 B9R1.11 COC(=N)c1cccs1 Amb17621680 [0,2,0,0,0,0|0,1,1]=4 5483 B9R1.11 COC(=O)c1[n]cco1 Amb22001762 [0,2,0,0,0,0|1,0,1]=4 5484 B9R1.11 COC(=O)c1c[n]co1 Amb21520455 [0,2,0,0,0,0|1,0,1]=4 5485 B9R1.11 COC(=O)c1ccc[nH]1 Amb1088973 [0,2,0,0,0,0|1,0,1]=4 5486 B9R1.11 COC(=O)c1cccs1 Amb1911537 [0,2,0,0,0,0|0,1,1]=4 5487 B9R1.11 COC(=S)c1ccco1 Amb22232675 [0,2,0,0,0,0|0,0,1]=3 5488 B9R1.11 COC(C)c1[n]cc[s]1 Amb24676177 [0,2,0,0,0,0|1,1,0]=4 5489 B9R1.11 COC(C)c1ccc[s]1 Amb25026642 [0,2,0,0,0,0|0,1,0]=3 5490 B9R1.11 COC(C)c1ccco1 Amb25220078 [0,2,0,0,0,0|0,0,0]=2 5491 B9R1.11 COC(O)c1ccc[s]1 Amb24429952 [0,2,0,0,0,0|0,1,0]=3 5492 B9R1.11 COS(=O)c1ccc[s]1 Amb25254375 [0,2,0,0,0,0|1,1,0]=4 5493 B9R1.11 CSC(C)c1ccc[s]1 Amb24476743 [0,2,0,0,0,0|0,2,0]=4 5494 B9R1.11 C[C@@H](C=O)c1ccc[s]1 Amb24602792 [0,2,0,0,0,0|0,1,1]=4 5495 B9R1.11 C[C@@H](C=O)c1ccco1 Amb25830685 [0,2,0,0,0,0|0,0,1]=3 5496 B9R1.11 C[C@@H](CO)[n]1cccc1 Amb24417094 [0,2,0,0,0,0|2,0,0]=4 5497 B9R1.11 C[C@@H](CO)c1c[s]cc1 Amb24734195 [0,2,0,0,0,0|2,0,0]=4 5498 B9R1.11 C[C@@H](CO)c1ccc[s]1 Amb24619184 [0,2,0,0,0,0|0,1,0]=3 5499 B9R1.11 C[C@@H](CO)c1ccco1 Amb24340224 [0,2,0,0,0,0|0,0,0]=2 5500 B9R1.11 C[C@@H](NO)c1ccc[s]1 Amb24445194 [0,2,0,0,0,0|0,1,0]=3 5501 B9R1.11 C[C@H](C=O)c1ccco1 Amb25735791 [0,2,0,0,0,0|0,0,1]=3 5502 B9R1.11 C[C@H](CO)C1=CCC=C1 Amb25745076 [0,2,0,0,0,0|1,0,1]=4 5503 B9R1.11 C[C@H](CO)[C@@H]1C=CCO1 Amb24588337 [0,2,0,0,0,0|0,0,2]=4 5504 B9R1.11 C[C@H](CO)[n]1cccc1 Amb24481818 [0,2,0,0,0,0|2,0,0]=4 5505 B9R1.11 C[C@H](NO)c1ccco1 Amb25354707 [0,2,0,0,0,0|0,0,0]=2 5506 B9R1.11 C\C(=N/N)\c1ccco1 Amb24407173 [0,2,0,0,0,0|1,0,1]=4 5507 B9R1.11 C\C(=N\N)\c1ccco1 Amb25272224 [0,2,0,0,0,0|1,0,1]=4 5508 B9R1.11 C\C(=N\O)\c1ccc[nH]1 Amb19894730 [0,2,0,0,0,0|1,0,1]=4 5509 B9R1.11 C\N=C(/c1ccco1)\Cl Amb2371268 [0,2,0,0,0,0|1,0,1]=4 5510 B9R1.11 ClCC(=O)c1ccco1 Amb17138398 [0,2,0,0,0,0|1,0,0]=3 5511 B9R1.11 ClCC(c1cccs1)C Amb17232346 [0,2,0,0,0,0|1,1,0]=4 5512 B9R1.11 ClCC(c1cccs1)O Amb17194470 [0,2,0,0,0,0|0,1,0]=3 5513 B9R1.11 N#CC(=O)c1ccco1 Amb17231835 [0,2,0,0,0,0|0,0,2]=4 5514 B9R1.11 N#CC(Br)c1ccc[s]1 Amb24383298 [0,2,0,0,0,0|1,1,0]=4 5515 B9R1.11 N#CC(Cl)c1ccc[s]1 Amb18177577 [0,2,0,0,0,0|1,1,0]=4 5516 B9R1.11 N#CC(Cl)c1ccco1 Amb24726526 [0,2,0,0,0,0|1,0,0]=3 5517 B9R1.11 N#CC(O)c1[n]cc[s]1 Amb24441662 [0,2,0,0,0,0|1,1,0]=4 5518 B9R1.11 N#CC(O)c1c[nH]c[n]1 Amb24599970 [0,2,0,0,0,0|2,0,0]=4 5519 B9R1.11 N#CC(O)c1c[s]c[n]1 Amb25115145 [0,2,0,0,0,0|2,0,0]=4 5520 B9R1.11 N#CC(O)c1ccc[nH]1 Amb24545917 [0,2,0,0,0,0|1,0,0]=3 5521 B9R1.11 N#CC(O)c1cocc1 Amb24712254 [0,2,0,0,0,0|2,0,0]=4 5522 B9R1.11 N#CC(c1ccco1)N Amb1108460 [0,2,0,0,0,0|1,0,0]=3 5523 B9R1.11 N#CC(c1cccs1)C Amb17089237 [0,2,0,0,0,0|1,1,0]=4 5524 B9R1.11 N#CC(c1cccs1)N Amb1108134 [0,2,0,0,0,0|1,1,0]=4 5525 B9R1.11 N#C[C@@H](O)c1c[n]co1 Amb25846979 [0,2,0,0,0,0|1,0,0]=3 5526 B9R1.11 N#C[C@@H](O)c1ccc[s]1 Amb24658057 [0,2,0,0,0,0|0,1,0]=3 5527 B9R1.11 N#C[C@H](O)c1c[s]cc1 Amb25064191 [0,2,0,0,0,0|2,0,0]=4 5528 B9R1.11 N#C[C@H](O)c1ccco1 Amb24502187 [0,2,0,0,0,0|0,0,0]=2 5529 B9R1.11 NC(C#N)c1c[n]co1 Amb24511765 [0,2,0,0,0,0|2,0,0]=4 5530 B9R1.11 NC(CF)c1ccc[nH]1 Amb24682195 [0,2,0,0,0,0|2,0,0]=4 5531 B9R1.11 NC(CO)C1C=CCO1 Amb24332335 [0,2,0,0,0,0|0,0,2]=4 5532 B9R1.11 NC(CO)C=1CC=CN1 Amb25139570 [0,2,0,0,0,0|1,0,1]=4 5533 B9R1.11 NC(CO)c1[nH]cc[n]1 Amb24480322 [0,2,0,0,0,0|2,0,0]=4 5534 B9R1.11 NC(CO)c1[n]c[n]o1 Amb18949306 [0,2,0,0,0,0|2,0,0]=4 5535 B9R1.11 NC(CO)c1[n]cc[s]1 Amb25188940 [0,2,0,0,0,0|1,1,0]=4 5536 B9R1.11 NC(CO)c1c[nH]cc1 Amb18560625 [0,2,0,0,0,0|2,0,0]=4 5537 B9R1.11 NC(CO)c1c[n]c[s]1 Amb18831492 [0,2,0,0,0,0|1,1,0]=4 5538 B9R1.11 NC(CO)c1c[n]co1 Amb22713444 [0,2,0,0,0,0|1,0,0]=3 5539 B9R1.11 NC(CO)c1c[s]c[n]1 Amb18831491 [0,2,0,0,0,0|2,0,0]=4 5540 B9R1.11 NC(CO)c1c[s]cc1 Amb18281700 [0,2,0,0,0,0|2,0,0]=4 5541 B9R1.11 NC(CO)c1cc[n][nH]1 Amb25083520 [0,2,0,0,0,0|2,0,0]=4 5542 B9R1.11 NC(CO)c1ccc[nH]1 Amb24564289 [0,2,0,0,0,0|1,0,0]=3 5543 B9R1.11 NC(CO)c1cocc1 Amb25779755 [0,2,0,0,0,0|2,0,0]=4 5544 B9R1.11 NCC(=O)c1ccc[nH]1 Amb17593270 [0,2,0,0,0,0|2,0,0]=4 5545 B9R1.11 NCC(=O)c1ccco1 Amb18642269 [0,2,0,0,0,0|1,0,0]=3 5546 B9R1.11 NCC(=O)c1ccco1 Amb19373982 [0,2,0,0,0,0|1,0,0]=3 5547 B9R1.11 NCC(=O)c1cccs1 Amb1286169 [0,2,0,0,0,0|1,1,0]=4 5548 B9R1.11 NCC(F)c1ccc[s]1 Amb25842892 [0,2,0,0,0,0|1,1,0]=4 5549 B9R1.11 NCC(F)c1ccco1 Amb24573586 [0,2,0,0,0,0|1,0,0]=3 5550 B9R1.11 NCC(O)c1c[nH]c[n]1 Amb18832691 [0,2,0,0,0,0|2,0,0]=4 5551 B9R1.11 NCC(O)c1c[nH]cc1 Amb18062992 [0,2,0,0,0,0|2,0,0]=4 5552 B9R1.11 NCC(O)c1c[s]c[n]1 Amb18831493 [0,2,0,0,0,0|2,0,0]=4 5553 B9R1.11 NCC(O)c1cc[nH][n]1 Amb18203268 [0,2,0,0,0,0|2,0,0]=4 5554 B9R1.11 NCC(O)c1cocc1 Amb22642021 [0,2,0,0,0,0|2,0,0]=4 5555 B9R1.11 NCC(O)c1cocc1 Amb24656205 [0,2,0,0,0,0|2,0,0]=4 5556 B9R1.11 NCC(c1ccc[nH]1)O Amb1108226 [0,2,0,0,0,0|1,0,0]=3 5557 B9R1.11 NCC(c1ccco1)O Amb1108638 [0,2,0,0,0,0|0,0,0]=2 5558 B9R1.11 NCC(c1cccs1)O Amb1108252 [0,2,0,0,0,0|0,1,0]=3 5559 B9R1.11 NCC(c1cscc1)O Amb1108450 [0,2,0,0,0,0|2,0,0]=4 5560 B9R1.11 NC[C@@H](N)c1ccc[nH]1 Amb24534316 [0,2,0,0,0,0|2,0,0]=4 5561 B9R1.11 NC[C@@H](O)c1ccc[nH]1 Amb24117030 [0,2,0,0,0,0|1,0,0]=3 5562 B9R1.11 NC[C@@H](O)c1ccc[s]1 Amb25804883 [0,2,0,0,0,0|0,1,0]=3 5563 B9R1.11 NC[C@@H](O)c1ccco1 Amb22747769 [0,2,0,0,0,0|0,0,0]=2 5564 B9R1.11 NC[C@H](N)c1ccc[nH]1 Amb25680046 [0,2,0,0,0,0|2,0,0]=4 5565 B9R1.11 NC[C@H](N)c1ccco1 Amb24467396 [0,2,0,0,0,0|1,0,0]=3 5566 B9R1.11 NC[C@H](O)[C@@H]1C=CCO1 Amb24618153 [0,2,0,0,0,0|0,0,2]=4 5567 B9R1.11 NC[C@H](O)c1c[s]cc1 Amb25828147 [0,2,0,0,0,0|2,0,0]=4 5568 B9R1.11 NNC(=S)c1ccco1 Amb25042393 [0,2,0,0,0,0|0,1,1]=4 5569 B9R1.11 NOC(=O)c1ccc[s]1 Amb25268305 [0,2,0,0,0,0|0,1,1]=4 5570 B9R1.11 NOC(c1cccs1)C Amb17089184 [0,2,0,0,0,0|0,1,0]=3 5571 B9R1.11 N[C@@H](C#N)c1ccc[s]1 Amb24455695 [0,2,0,0,0,0|1,1,0]=4 5572 B9R1.11 N[C@@H](C#N)c1ccco1 Amb25078710 [0,2,0,0,0,0|1,0,0]=3 5573 B9R1.11 N[C@@H](CF)c1ccco1 Amb25133807 [0,2,0,0,0,0|1,0,0]=3 5574 B9R1.11 N[C@@H](CO)C=1CC=CN1 Amb25082519 [0,2,0,0,0,0|1,0,1]=4 5575 B9R1.11 N[C@@H](CO)[C@@H]1C=CCO1 Amb24515429 [0,2,0,0,0,0|0,0,2]=4 5576 B9R1.11 N[C@@H](CO)c1[n]cc[s]1 Amb25224968 [0,2,0,0,0,0|1,1,0]=4 5577 B9R1.11 N[C@@H](CO)c1c[s]cc1 Amb25254855 [0,2,0,0,0,0|2,0,0]=4 5578 B9R1.11 N[C@@H](CO)c1ccc[nH]1 Amb24692347 [0,2,0,0,0,0|1,0,0]=3 5579 B9R1.11 N[C@@H](CO)c1cocc1 Amb24680984 [0,2,0,0,0,0|2,0,0]=4 5580 B9R1.11 N[C@H](C#N)c1ccc[s]1 Amb25354974 [0,2,0,0,0,0|1,1,0]=4 5581 B9R1.11 N[C@H](CF)c1ccc[s]1 Amb24481880 [0,2,0,0,0,0|1,1,0]=4 5582 B9R1.11 N[C@H](CO)c1[nH]cc[n]1 Amb25117345 [0,2,0,0,0,0|2,0,0]=4 5583 B9R1.11 N[C@H](CO)c1[n]cc[s]1 Amb24727007 [0,2,0,0,0,0|1,1,0]=4 5584 B9R1.11 N[C@H](CO)c1c[nH]cc1 Amb24641548 [0,2,0,0,0,0|2,0,0]=4 5585 B9R1.11 N[C@H](CO)c1ccc[nH]1 Amb25696955 [0,2,0,0,0,0|1,0,0]=3 5586 B9R1.11 N\C(=C\O)\c1ccc[s]1 Amb25305790 [0,2,0,0,0,0|0,1,1]=4 5587 B9R1.11 N\C(=N/O)\c1ccc[nH]1 Amb19869356 [0,2,0,0,0,0|1,0,1]=4 5588 B9R1.11 N\C(=N/O)\c1ccco1 Amb22587188 [0,2,0,0,0,0|0,0,1]=3 5589 B9R1.11 N\C(=N\N)\c1ccco1 Amb25330067 [0,2,0,0,0,0|1,0,1]=4 5590 B9R1.11 N\C(=N\O)\c1cc[n]o1 Amb22292334 [0,2,0,0,0,0|1,0,1]=4 5591 B9R1.11 O([2H])C(=O)c1cccs1 Amb10573503 [0,2,0,0,0,0|0,1,1]=4 5592 B9R1.11 O=C(CBr)c1cc[n]o1 Amb24106246 [0,2,0,0,0,0|2,0,0]=4 5593 B9R1.11 O=C(CBr)c1ccc[s]1 Amb22491221 [0,2,0,0,0,0|1,1,0]=4 5594 B9R1.11 O=C(CCl)c1[n]cco1 Amb22904306 [0,2,0,0,0,0|2,0,0]=4 5595 B9R1.11 O=C(CF)c1ccc[s]1 Amb21964939 [0,2,0,0,0,0|1,1,0]=4 5596 B9R1.11 O=C(CI)c1ccco1 Amb25365425 [0,2,0,0,0,0|1,0,0]=3 5597 B9R1.11 O=C(OCl)c1ccc[nH]1 Amb24518091 [0,2,0,0,0,0|1,0,1]=4 5598 B9R1.11 O=CC(=O)c1ccco1 Amb17593264 [0,2,0,0,0,0|0,0,2]=4 5599 B9R1.11 O=CC(c1cccs1)C Amb17138391 [0,2,0,0,0,0|0,1,1]=4 5600 B9R1.11 OC(C=O)c1c[s]cc1 Amb24466343 [0,2,0,0,0,0|2,0,0]=4 5601 B9R1.11 OC(C=O)c1ccco1 Amb25769824 [0,2,0,0,0,0|0,0,0]=2 5602 B9R1.11 OC(C=O)c1cocc1 Amb25334420 [0,2,0,0,0,0|2,0,0]=4 5603 B9R1.11 OC(CCl)c1[n]cc[s]1 Amb24415239 [0,2,0,0,0,0|1,1,0]=4 5604 B9R1.11 OCC(=O)[n]1cccc1 Amb25107623 [0,2,0,0,0,0|2,0,0]=4 5605 B9R1.11 OCC(=O)c1cc[nH]c1 Amb18560595 [0,2,0,0,0,0|2,0,0]=4 5606 B9R1.11 OCC(=O)c1cc[s]c1 Amb25348480 [0,2,0,0,0,0|2,0,0]=4 5607 B9R1.11 OCC(=O)c1ccc[s]1 Amb25742219 [0,2,0,0,0,0|0,1,0]=3 5608 B9R1.11 OCC(=O)c1ccco1 Amb17689139 [0,2,0,0,0,0|0,0,0]=2 5609 B9R1.11 OCC(F)c1ccco1 Amb25365029 [0,2,0,0,0,0|0,0,0]=2 5610 B9R1.11 OCC(O)c1[nH]cc[n]1 Amb25258511 [0,2,0,0,0,0|2,0,0]=4 5611 B9R1.11 OCC(O)c1c[nH]cc1 Amb18560626 [0,2,0,0,0,0|2,0,0]=4 5612 B9R1.11 OCC(O)c1c[n]co1 Amb24354332 [0,2,0,0,0,0|1,0,0]=3 5613 B9R1.11 OCC(O)c1ccc[s]1 Amb18063817 [0,2,0,0,0,0|0,1,0]=3 5614 B9R1.11 OCC(O)c1cocc1 Amb25122533 [0,2,0,0,0,0|2,0,0]=4 5615 B9R1.11 OCC(c1ccco1)N Amb17231846 [0,2,0,0,0,0|0,0,0]=2 5616 B9R1.11 OCC(c1cccs1)C Amb17231948 [0,2,0,0,0,0|0,1,0]=3 5617 B9R1.11 OCC(c1cccs1)N Amb17231970 [0,2,0,0,0,0|0,1,0]=3 5618 B9R1.11 OC[C@@H](O)C1=CCCO1 Amb25788086 [0,2,0,0,0,0|0,0,2]=4 5619 B9R1.11 OC[C@@H](O)c1c[n]co1 Amb25794787 [0,2,0,0,0,0|1,0,0]=3 5620 B9R1.11 OC[C@@H](O)c1ccco1 Amb24183799 [0,2,0,0,0,0|0,0,0]=2 5621 B9R1.11 OC[C@H](O)c1c[nH]c[n]1 Amb25305173 [0,2,0,0,0,0|2,0,0]=4 5622 B9R1.11 OC[C@H](O)c1cocc1 Amb24665741 [0,2,0,0,0,0|2,0,0]=4 5623 B9R1.11 ONC(=N)c1ccco1 Amb17231841 [0,2,0,0,0,0|0,0,1]=3 5624 B9R1.11 ONC(=N)c1cccs1 Amb17231942 [0,2,0,0,0,0|0,1,1]=4 5625 B9R1.11 ONC(=O)c1c[n]co1 Amb24734821 [0,2,0,0,0,0|1,0,1]=4 5626 B9R1.11 ONC(=O)c1ccc[nH]1 Amb24451516 [0,2,0,0,0,0|1,0,1]=4 5627 B9R1.11 ONC(=O)c1cccs1 Amb1151586 [0,2,0,0,0,0|0,1,1]=4 5628 B9R1.11 ONC(c1ccco1)C Amb10605011 [0,2,0,0,0,0|0,0,0]=2 5629 B9R1.11 ONC(c1cccs1)C Amb10606933 [0,2,0,0,0,0|0,1,0]=3 5630 B9R1.11 O[C@@H](CBr)c1[n]cc[s]1 Amb25094848 [0,2,0,0,0,0|1,1,0]=4 5631 B9R1.11 O[C@@H](CBr)c1c[s]cc1 Amb25185201 [0,2,0,0,0,0|2,0,0]=4 5632 B9R1.11 O[C@@H](CCl)c1[n]cc[s]1 Amb25760086 [0,2,0,0,0,0|1,1,0]=4 5633 B9R1.11 O[C@@H](CCl)c1ccc[s]1 Amb25349338 [0,2,0,0,0,0|0,1,0]=3 5634 B9R1.11 O[C@H](CBr)c1ccco1 Amb24480070 [0,2,0,0,0,0|0,0,0]=2 5635 B9R1.11 O\N=C(/c1cccs1)\N Amb1106021 [0,2,0,0,0,0|0,1,1]=4 5636 B9R1.11 O\N=C(\Cl)/c1ccco1 Amb24398879 [0,2,0,0,0,0|0,0,1]=3 5637 B9R1.11 SCC(=O)c1cccs1 Amb17400035 [0,2,0,0,0,0|0,2,0]=4 5638 B9R1.11 [Cu]OC(=O)c1cccs1 Amb13890298 [0,2,0,0,0,0|0,1,1]=4 5639 B9R1.11 [NH3+]CC(=O)c1cccs1 Amb17848802 [0,2,0,0,0,0|1,1,0]=4 5640 B9R1.19 C([2H])(c1ccco1)(O)[2H] Amb17614665 [0,2,0,0,0,0|0,0,0]=2 5641 B9R1.19 C([2H])(c1ccco1)(S)[2H] Amb17614666 [0,2,0,0,0,0|0,1,0]=3 5642 B9R1.19 C([2H])(c1ccco1)([2H])[2H] Amb17617446 [0,2,0,0,0,0|1,0,0]=3 5643 B9R1.19 C([2H])(c1cocc1)(O)[2H] Amb17614659 [0,2,0,0,0,0|2,0,0]=4 5644 B9R1.19 CC(C)(C)C=1CC=CC1 Amb21864640 [0,2,0,0,0,0|2,0,0]=4 5645 B9R1.19 CC(C)(C)c1c[n]co1 Amb25069549 [0,2,0,0,0,0|2,0,0]=4 5646 B9R1.19 CC(C)(C)c1ccco1 Amb22360626 [0,2,0,0,0,0|1,0,0]=3 5647 B9R1.19 CC(C)(N)c1[n]cco1 Amb18832749 [0,2,0,0,0,0|2,0,0]=4 5648 B9R1.19 CC(C)(N)c1c[n]co1 Amb24420088 [0,2,0,0,0,0|2,0,0]=4 5649 B9R1.19 CC(C)(O)C1=CCCO1 Amb24641292 [0,2,0,0,0,0|0,0,2]=4 5650 B9R1.19 CC(C)(O)c1[nH]cc[n]1 Amb22546313 [0,2,0,0,0,0|2,0,0]=4 5651 B9R1.19 CC(C)(O)c1c[n]c[nH]1 Amb25239136 [0,2,0,0,0,0|2,0,0]=4 5652 B9R1.19 CC(C)(O)c1c[n]c[s]1 Amb18256917 [0,2,0,0,0,0|1,1,0]=4 5653 B9R1.19 CC(C)(O)c1cc[n][s]1 Amb22896481 [0,2,0,0,0,0|1,1,0]=4 5654 B9R1.19 CC(C)(O)c1cc[s][n]1 Amb25026887 [0,2,0,0,0,0|2,0,0]=4 5655 B9R1.19 CC(C)(O)c1ccco1 Amb22749603 [0,2,0,0,0,0|0,0,0]=2 5656 B9R1.19 CC(C)(O)c1cocc1 Amb25057878 [0,2,0,0,0,0|2,0,0]=4 5657 B9R1.19 CC(Cl)(Cl)c1ccc[s]1 Amb25308931 [0,2,0,0,0,0|1,1,0]=4 5658 B9R1.19 CC(N)(O)c1ccc[s]1 Amb25248960 [0,2,0,0,0,0|0,1,0]=3 5659 B9R1.19 CC(c1ccco1)(N)C Amb17078788 [0,2,0,0,0,0|1,0,0]=3 5660 B9R1.19 CC(c1cccs1)(N)C Amb17078777 [0,2,0,0,0,0|1,1,0]=4 5661 B9R1.19 CC(c1ncco1)(C)C Amb17399802 [0,2,0,0,0,0|2,0,0]=4 5662 B9R1.19 C[Si](C)(C)c1ccco1 Amb20671355 [0,2,0,0,0,0|1,1,0]=4 5663 B9R1.19 C[Si](C)(O)c1ccc[s]1 Amb22167028 [0,2,0,0,0,0|0,2,0]=4 5664 B9R1.19 C[Si](C)(O)c1ccco1 Amb22167043 [0,2,0,0,0,0|0,1,0]=3 5665 B9R1.19 C[Si](C)([O-])c1ccco1 Amb22047449 [0,2,0,0,0,0|0,1,1]=4 5666 B9R1.19 FC(F)(Cl)c1ccco1 Amb24743557 [0,2,0,0,0,0|1,0,0]=3 5667 B9R1.19 FC(F)(F)c1ccc[nH]1 Amb22284869 [0,2,0,0,0,0|2,0,0]=4 5668 B9R1.19 FC(c1ccno1)(Cl)F Amb10839890 [0,2,0,0,0,0|2,0,0]=4 5669 B9R1.19 FC(c1ccno1)(F)F Amb10841129 [0,2,0,0,0,0|2,0,0]=4 5670 B9R1.19 F[B-](c1ccco1)(F)F Amb13890469 [0,2,0,0,0,0|2,0,0]=4 5671 B9R1.19 NS(=O)(=O)c1ccco1 Amb24093662 [0,2,0,0,0,0|1,0,1]=4 5672 B9R1.19 OB(O)(O)c1ccco1 Amb24615100 [0,2,0,0,0,0|1,0,0]=3 5673 B9R1.19 OP(=O)(c1cccs1)O Amb10558199 [0,2,0,0,0,0|1,1,0]=4 5674 B9R1.19 OP(O)(=O)c1ccc[s]1 Amb24678119 [0,2,0,0,0,0|1,1,0]=4 5675 B9R1.19 OP(O)(=O)c1ccco1 Amb24649753 [0,2,0,0,0,0|1,0,0]=3 5676 B9R1.19 OS(=O)(=O)c1ccc[nH]1 Amb24567340 [0,2,0,0,0,0|2,0,0]=4 5677 B9R1.19 OS(=O)(=O)c1cccs1 Amb17672954 [0,2,0,0,0,0|1,1,0]=4 5678 B9R1.19 O[B-](O)(O)c1ccc[s]1 Amb22583820 [0,2,0,0,0,0|1,1,0]=4 5679 B9R1.41 CC(=O)c1occc1Br Amb19374756 [0,2,0,0,0,0|0,0,2]=4 5680 B9R1.41 CC(=O)c1occc1N Amb18832859 [0,2,0,0,0,0|0,0,2]=4 5681 B9R1.41 CC(=O)c1occc1S Amb24518707 [0,2,0,0,0,0|0,0,2]=4 5682 B9R1.41 CC(Br)c1[s]ccc1Br Amb24524200 [0,2,0,0,0,0|1,1,0]=4 5683 B9R1.41 CC(C)N1OC=CC1=O Amb24371681 [0,2,0,0,0,0|2,0,0]=4 5684 B9R1.41 CC(C)c1[nH]ccc1N Amb18832879 [0,2,0,0,0,0|2,0,0]=4 5685 B9R1.41 CC(C)c1[s]ccc1N Amb24084484 [0,2,0,0,0,0|1,1,0]=4 5686 B9R1.41 CC(C)c1ccc[n]1C Amb25337542 [0,2,0,0,0,0|2,0,0]=4 5687 B9R1.41 CC(C)c1o[n]cc1N Amb18642429 [0,2,0,0,0,0|2,0,0]=4 5688 B9R1.41 CC(C)c1occc1Br Amb18820654 [0,2,0,0,0,0|1,0,0]=3 5689 B9R1.41 CC(Cl)c1[s]ccc1Cl Amb25107252 [0,2,0,0,0,0|1,1,0]=4 5690 B9R1.41 CC(Cl)c1occc1Br Amb25769784 [0,2,0,0,0,0|1,0,0]=3 5691 B9R1.41 CC(N)c1[nH]ccc1Br Amb25032284 [0,2,0,0,0,0|2,0,0]=4 5692 B9R1.41 CC(N)c1[nH]ccc1N Amb25275110 [0,2,0,0,0,0|2,0,0]=4 5693 B9R1.41 CC(N)c1[nH]ccc1O Amb24693579 [0,2,0,0,0,0|2,0,0]=4 5694 B9R1.41 CC(N)c1[s]ccc1I Amb25377145 [0,2,0,0,0,0|1,1,0]=4 5695 B9R1.41 CC(N)c1[s]ccc1O Amb25350215 [0,2,0,0,0,0|1,1,0]=4 5696 B9R1.41 CC(N)c1occc1N Amb24358118 [0,2,0,0,0,0|1,0,0]=3 5697 B9R1.41 CC(N)c1occc1O Amb24480336 [0,2,0,0,0,0|1,0,0]=3 5698 B9R1.41 CC(O)C1CC=CC1=O Amb24646680 [0,2,0,0,0,0|1,0,1]=4 5699 B9R1.41 CC(O)c1[n]c[s]c1I Amb25106030 [0,2,0,0,0,0|2,0,0]=4 5700 B9R1.41 CC(O)c1[n]cc[n]1C Amb22267722 [0,2,0,0,0,0|2,0,0]=4 5701 B9R1.41 CC(O)c1[s][n]cc1Cl Amb25350884 [0,2,0,0,0,0|1,1,0]=4 5702 B9R1.41 CC(O)c1[s]c[n]c1Cl Amb24495478 [0,2,0,0,0,0|1,1,0]=4 5703 B9R1.41 CC(O)c1[s]ccc1F Amb24383836 [0,2,0,0,0,0|0,1,0]=3 5704 B9R1.41 CC(O)c1[s]ccc1I Amb25376020 [0,2,0,0,0,0|0,1,0]=3 5705 B9R1.41 CC(O)c1cc[s]c1Br Amb25332329 [0,2,0,0,0,0|2,0,0]=4 5706 B9R1.41 CC(O)c1ccc[n]1C Amb25348523 [0,2,0,0,0,0|1,0,0]=3 5707 B9R1.41 CC(O)c1occc1Cl Amb25136263 [0,2,0,0,0,0|0,0,0]=2 5708 B9R1.41 CC=1C=CCC1C(O)=O Amb24358734 [0,2,0,0,0,0|1,0,1]=4 5709 B9R1.41 C[C@@H](N)c1[nH]ccc1F Amb25780073 [0,2,0,0,0,0|2,0,0]=4 5710 B9R1.41 C[C@@H](N)c1[s]ccc1Br Amb24429631 [0,2,0,0,0,0|1,1,0]=4 5711 B9R1.41 C[C@@H](N)c1ccc[n]1C Amb22831455 [0,2,0,0,0,0|2,0,0]=4 5712 B9R1.41 C[C@@H](N)c1occc1F Amb24760248 [0,2,0,0,0,0|1,0,0]=3 5713 B9R1.41 C[C@@H](N)c1occc1N Amb25108222 [0,2,0,0,0,0|1,0,0]=3 5714 B9R1.41 C[C@H](N)c1[nH]ccc1Br Amb25716392 [0,2,0,0,0,0|2,0,0]=4 5715 B9R1.41 C[C@H](N)c1[nH]ccc1F Amb25103720 [0,2,0,0,0,0|2,0,0]=4 5716 B9R1.41 C[C@H](N)c1[nH]ccc1N Amb24435986 [0,2,0,0,0,0|2,0,0]=4 5717 B9R1.41 C[C@H](N)c1[s]ccc1N Amb25229931 [0,2,0,0,0,0|1,1,0]=4 5718 B9R1.41 C[C@H](N)c1occc1Cl Amb25067336 [0,2,0,0,0,0|1,0,0]=3 5719 B9R1.41 C[C@H](O)c1[s]ccc1Cl Amb24363179 [0,2,0,0,0,0|0,1,0]=3 5720 B9R1.41 C[n]1cccc1C(F)F Amb25322349 [0,2,0,0,0,0|2,0,0]=4 5721 B9R1.41 C[n]1cccc1C(N)O Amb25349340 [0,2,0,0,0,0|1,0,0]=3 5722 B9R1.41 C[n]1cccc1S(O)=O Amb25335328 [0,2,0,0,0,0|2,0,0]=4 5723 B9R1.41 C\C(\O)=C/1\OC=CC1=O Amb25686104 [0,2,0,0,0,0|0,0,1]=3 5724 B9R1.41 C\C(\O)=C/1\SC=CC1=O Amb24340198 [0,2,0,0,0,0|0,1,1]=4 5725 B9R1.41 Cc1[n]c[s]c1[C@H](C)O Amb24457287 [0,2,0,0,0,0|1,1,0]=4 5726 B9R1.41 Cc1[n]coc1C(C)Br Amb24733250 [0,2,0,0,0,0|2,0,0]=4 5727 B9R1.41 Cc1[n]coc1C(C)N Amb18832735 [0,2,0,0,0,0|2,0,0]=4 5728 B9R1.41 Cc1[s]ccc1C(C)O Amb24601249 [0,2,0,0,0,0|2,0,0]=4 5729 B9R1.41 Cc1c[n]oc1C(C)N Amb25195005 [0,2,0,0,0,0|2,0,0]=4 5730 B9R1.41 Cc1c[n]oc1C(Cl)Cl Amb25268032 [0,2,0,0,0,0|2,0,0]=4 5731 B9R1.41 Cc1c[s]cc1[C@H](C)O Amb24671755 [0,2,0,0,0,0|2,0,0]=4 5732 B9R1.41 Cc1cc[nH]c1C(C)C Amb25090111 [0,2,0,0,0,0|2,0,0]=4 5733 B9R1.41 Cc1cc[nH]c1C(C)N Amb25188942 [0,2,0,0,0,0|2,0,0]=4 5734 B9R1.41 Cc1cc[nH]c1C(O)=O Amb22491226 [0,2,0,0,0,0|1,0,1]=4 5735 B9R1.41 Cc1cc[nH]c1[C@@H](C)N Amb25857983 [0,2,0,0,0,0|2,0,0]=4 5736 B9R1.41 Cc1cc[s]c1C(C)N Amb18279251 [0,2,0,0,0,0|1,1,0]=4 5737 B9R1.41 Cc1cc[s]c1C(C)O Amb24556518 [0,2,0,0,0,0|0,1,0]=3 5738 B9R1.41 Cc1cc[s]c1C(C)S Amb24505030 [0,2,0,0,0,0|0,2,0]=4 5739 B9R1.41 Cc1cc[s]c1[C@@H](C)O Amb25842069 [0,2,0,0,0,0|0,1,0]=3 5740 B9R1.41 Cc1cc[s]c1[C@H](C)N Amb25710219 [0,2,0,0,0,0|1,1,0]=4 5741 B9R1.41 Cc1cc[s]c1[C@H](C)O Amb25088944 [0,2,0,0,0,0|0,1,0]=3 5742 B9R1.41 Cc1ccoc1B(O)O Amb25106923 [0,2,0,0,0,0|1,0,0]=3 5743 B9R1.41 Cc1ccoc1C(C)=O Amb20668258 [0,2,0,0,0,0|0,0,2]=4 5744 B9R1.41 Cc1ccoc1C(C)N Amb18203315 [0,2,0,0,0,0|1,0,0]=3 5745 B9R1.41 Cc1ccoc1C(C)O Amb25121301 [0,2,0,0,0,0|0,0,0]=2 5746 B9R1.41 Cc1ccoc1C(F)F Amb23589862 [0,2,0,0,0,0|1,0,0]=3 5747 B9R1.41 Cc1ccoc1C(N)=N Amb24368716 [0,2,0,0,0,0|1,0,1]=4 5748 B9R1.41 Cc1ccoc1C(N)=S Amb25775196 [0,2,0,0,0,0|0,1,1]=4 5749 B9R1.41 Cc1ccoc1[C@@H](C)N Amb25707081 [0,2,0,0,0,0|1,0,0]=3 5750 B9R1.41 Cc1ccoc1[N+]([O-])=O Amb24062153 [0,2,0,0,0,0|1,0,1]=4 5751 B9R1.41 Cc1cnoc1C(=O)O Amb10071410 [0,2,0,0,0,0|1,0,1]=4 5752 B9R1.41 Cc1occc1[C@H](C)O Amb24403069 [0,2,0,0,0,0|2,0,0]=4 5753 B9R1.41 FC(F)c1[s]ccc1Br Amb22008724 [0,2,0,0,0,0|1,1,0]=4 5754 B9R1.41 NC(=N)c1occc1Br Amb25350008 [0,2,0,0,0,0|1,0,1]=4 5755 B9R1.41 NC(=O)c1occc1Br Amb25757923 [0,2,0,0,0,0|0,0,2]=4 5756 B9R1.41 Nc1c[n]oc1C(F)F Amb25811363 [0,2,0,0,0,0|2,0,0]=4 5757 B9R1.41 Nc1cc[s]c1C(O)=O Amb19888389 [0,2,0,0,0,0|0,1,1]=4 5758 B9R1.41 Nc1ccoc1C(O)=O Amb18832709 [0,2,0,0,0,0|0,0,1]=3 5759 B9R1.41 O=C(Cl)c1occc1Cl Amb25147033 [0,2,0,0,0,0|0,0,2]=4 5760 B9R1.41 OB(c1cccn1C)O Amb16185674 [0,2,0,0,0,0|2,0,0]=4 5761 B9R1.41 OB(c1sccc1Cl)O Amb13890311 [0,2,0,0,0,0|1,1,0]=4 5762 B9R1.41 OC(=O)C1=CC=CS1O Amb25825290 [0,2,0,0,0,0|0,1,1]=4 5763 B9R1.41 OC(=O)c1cccn1C Amb1151288 [0,2,0,0,0,0|1,0,1]=4 5764 B9R1.41 OC(=O)c1oc[n]c1Br Amb24481767 [0,2,0,0,0,0|1,0,1]=4 5765 B9R1.41 OC(=O)c1occc1C Amb1156943 [0,2,0,0,0,0|0,0,1]=3 5766 B9R1.41 OC(=O)c1occc1Cl Amb18202245 [0,2,0,0,0,0|0,0,1]=3 5767 B9R1.41 OC(=O)c1sccc1O Amb10069920 [0,2,0,0,0,0|0,1,1]=4 5768 B9R1.41 OC(=O)c1sccc1S Amb2405731 [0,2,0,0,0,0|0,1,1]=4 5769 B9R1.41 OC(O)c1[n]cc[n]1O Amb24100198 [0,2,0,0,0,0|2,0,0]=4 5770 B9R1.41 OS(=O)c1[s]ccc1Br Amb24557305 [0,2,0,0,0,0|1,1,0]=4 5771 B9R1.41 Oc1cc[nH]c1C(O)=O Amb24387128 [0,2,0,0,0,0|1,0,1]=4 5772 B9R1.12 BrCCCc1ccco1 Amb17104550 [0,2,0,0,0,0|1,0,0]=3 5773 B9R1.12 BrCCCc1cccs1 Amb17104551 [0,2,0,0,0,0|1,1,0]=4 5774 B9R1.12 BrCCSc1[n]cco1 Amb25352471 [0,2,0,0,0,0|2,0,0]=4 5775 B9R1.12 C#CCSc1ccc[nH]1 Amb25222425 [0,2,0,0,0,0|2,0,0]=4 5776 B9R1.12 C#CCSc1ccc[s]1 Amb18522290 [0,2,0,0,0,0|1,1,0]=4 5777 B9R1.12 C#C\C=C\c1ccco1 Amb24575226 [0,2,0,0,0,0|1,0,1]=4 5778 B9R1.12 C=C/C=C/c1ccco1 Amb17939509 [0,2,0,0,0,0|1,0,1]=4 5779 B9R1.12 C=CCCc1ccc[nH]1 Amb25858739 [0,2,0,0,0,0|2,0,0]=4 5780 B9R1.12 C=CCNc1[n]cco1 Amb22586361 [0,2,0,0,0,0|2,0,0]=4 5781 B9R1.12 C=CCNc1c[n]co1 Amb25218393 [0,2,0,0,0,0|2,0,0]=4 5782 B9R1.12 C=CCNc1ncco1 Amb2382968 [0,2,0,0,0,0|2,0,0]=4 5783 B9R1.12 C=CCSc1ccc[nH]1 Amb24692500 [0,2,0,0,0,0|2,0,0]=4 5784 B9R1.12 C=CCSc1cccs1 Amb17672857 [0,2,0,0,0,0|1,1,0]=4 5785 B9R1.12 C=COCc1ccc[s]1 Amb25337439 [0,2,0,0,0,0|0,1,0]=3 5786 B9R1.12 C=COCc1ccco1 Amb24631898 [0,2,0,0,0,0|0,0,0]=2 5787 B9R1.12 C=CSCc1ccco1 Amb24757008 [0,2,0,0,0,0|0,1,0]=3 5788 B9R1.12 CCCCc1ccco1 Amb10070290 [0,2,0,0,0,0|1,0,0]=3 5789 B9R1.12 CCCSc1ccc[nH]1 Amb24453201 [0,2,0,0,0,0|2,0,0]=4 5790 B9R1.12 CCCSc1ccco1 Amb25249856 [0,2,0,0,0,0|1,0,0]=3 5791 B9R1.12 CCNCc1c[n]co1 Amb18291304 [0,2,0,0,0,0|2,0,0]=4 5792 B9R1.12 CCNCc1cc[n]o1 Amb18975194 [0,2,0,0,0,0|2,0,0]=4 5793 B9R1.12 CCNCc1ccc[nH]1 Amb17142855 [0,2,0,0,0,0|2,0,0]=4 5794 B9R1.12 CCNCc1ccc[s]1 Amb22283900 [0,2,0,0,0,0|1,1,0]=4 5795 B9R1.12 CCNCc1ccco1 Amb1137312 [0,2,0,0,0,0|1,0,0]=3 5796 B9R1.12 CCNCc1cccs1 Amb1088620 [0,2,0,0,0,0|1,1,0]=4 5797 B9R1.12 CCOCc1[nH]cc[n]1 Amb22831569 [0,2,0,0,0,0|2,0,0]=4 5798 B9R1.12 CCOCc1[n]cc[s]1 Amb24407886 [0,2,0,0,0,0|1,1,0]=4 5799 B9R1.12 CCOCc1c[s]cc1 Amb24708417 [0,2,0,0,0,0|2,0,0]=4 5800 B9R1.12 CCOCc1ccc[nH]1 Amb25190159 [0,2,0,0,0,0|1,0,0]=3 5801 B9R1.12 CCOCc1ccc[s]1 Amb25217999 [0,2,0,0,0,0|0,1,0]=3 5802 B9R1.12 CCOCc1ccco1 Amb22234292 [0,2,0,0,0,0|0,0,0]=2 5803 B9R1.12 CCSCc1ccc[s]1 Amb24478825 [0,2,0,0,0,0|0,2,0]=4 5804 B9R1.12 CC\N=C\c1ccc[s]1 Amb24518706 [0,2,0,0,0,0|1,1,0]=4 5805 B9R1.12 CN/N=C/c1ccco1 Amb17804206 [0,2,0,0,0,0|1,0,1]=4 5806 B9R1.12 CNCCC=1CC=CC1 Amb25755843 [0,2,0,0,0,0|2,0,0]=4 5807 B9R1.12 CNCCc1[n]cco1 Amb18222315 [0,2,0,0,0,0|2,0,0]=4 5808 B9R1.12 CNCCc1ccc[s]1 Amb21959880 [0,2,0,0,0,0|1,1,0]=4 5809 B9R1.12 CNCCc1ccco1 Amb17399803 [0,2,0,0,0,0|1,0,0]=3 5810 B9R1.12 COCC[n]1ccc[n]1 Amb20667698 [0,2,0,0,0,0|2,0,0]=4 5811 B9R1.12 COCCc1[nH]cc[n]1 Amb18336890 [0,2,0,0,0,0|2,0,0]=4 5812 B9R1.12 COCCc1cc[nH][n]1 Amb25854998 [0,2,0,0,0,0|2,0,0]=4 5813 B9R1.12 COCCc1ccc[s]1 Amb25147094 [0,2,0,0,0,0|0,1,0]=3 5814 B9R1.12 COCCc1ccco1 Amb25147016 [0,2,0,0,0,0|0,0,0]=2 5815 B9R1.12 COCOc1ccco1 Amb25312610 [0,2,0,0,0,0|0,0,0]=2 5816 B9R1.12 COCSc1[n]cc[s]1 Amb25084160 [0,2,0,0,0,0|1,1,0]=4 5817 B9R1.12 CONCc1[nH]cc[n]1 Amb24665547 [0,2,0,0,0,0|2,0,0]=4 5818 B9R1.12 CONCc1[n]cc[s]1 Amb24671756 [0,2,0,0,0,0|1,1,0]=4 5819 B9R1.12 CONCc1c[n]c[nH]1 Amb24417417 [0,2,0,0,0,0|2,0,0]=4 5820 B9R1.12 CONCc1c[n]c[s]1 Amb25373568 [0,2,0,0,0,0|1,1,0]=4 5821 B9R1.12 CONCc1c[n]co1 Amb24636654 [0,2,0,0,0,0|1,0,0]=3 5822 B9R1.12 CONCc1ccc[nH]1 Amb24364458 [0,2,0,0,0,0|1,0,0]=3 5823 B9R1.12 CONCc1ccc[s]1 Amb25347354 [0,2,0,0,0,0|0,1,0]=3 5824 B9R1.12 CONCc1ccco1 Amb25760018 [0,2,0,0,0,0|0,0,0]=2 5825 B9R1.12 CO\C=C\c1ccco1 Amb25208464 [0,2,0,0,0,0|0,0,1]=3 5826 B9R1.12 CO\N=C\c1ccc[nH]1 Amb25781615 [0,2,0,0,0,0|1,0,1]=4 5827 B9R1.12 CSCSc1[n]cco1 Amb24550887 [0,2,0,0,0,0|1,1,0]=4 5828 B9R1.12 C\C=C\Cc1ccc[nH]1 Amb25243730 [0,2,0,0,0,0|2,0,0]=4 5829 B9R1.12 ClCC#Cc1ccc[s]1 Amb18791793 [0,2,0,0,0,0|1,1,0]=4 5830 B9R1.12 ClCC#Cc1ccco1 Amb25215455 [0,2,0,0,0,0|1,0,0]=3 5831 B9R1.12 ClCCCc1ccc[nH]1 Amb24502221 [0,2,0,0,0,0|2,0,0]=4 5832 B9R1.12 ClCCCc1cccs1 Amb17104524 [0,2,0,0,0,0|1,1,0]=4 5833 B9R1.12 ClCCOc1ccc[s]1 Amb24674144 [0,2,0,0,0,0|1,1,0]=4 5834 B9R1.12 ClCCSc1[n]cco1 Amb24385235 [0,2,0,0,0,0|2,0,0]=4 5835 B9R1.12 ClCSCc1ccco1 Amb25265779 [0,2,0,0,0,0|0,1,0]=3 5836 B9R1.12 ClC\C=C\c1ccc[s]1 Amb25084944 [0,2,0,0,0,0|1,1,0]=4 5837 B9R1.12 N#CCCc1ccc[nH]1 Amb24424952 [0,2,0,0,0,0|2,0,0]=4 5838 B9R1.12 N#CCCc1ccco1 Amb20623925 [0,2,0,0,0,0|1,0,0]=3 5839 B9R1.12 N#CCCc1cccs1 Amb17226709 [0,2,0,0,0,0|1,1,0]=4 5840 B9R1.12 N#CCNc1ccc[s]1 Amb25318122 [0,2,0,0,0,0|1,1,0]=4 5841 B9R1.12 N#CNCc1ccc[s]1 Amb25713335 [0,2,0,0,0,0|1,1,0]=4 5842 B9R1.12 N#C\C=C\c1ccco1 Amb16233571 [0,2,0,0,0,0|1,0,1]=4 5843 B9R1.12 NCC#Cc1ccc[s]1 Amb18951280 [0,2,0,0,0,0|1,1,0]=4 5844 B9R1.12 NCCCc1[n]cco1 Amb18061835 [0,2,0,0,0,0|2,0,0]=4 5845 B9R1.12 NCCCc1cc[n]o1 Amb18832760 [0,2,0,0,0,0|2,0,0]=4 5846 B9R1.12 NCCCc1ccc[nH]1 Amb25076791 [0,2,0,0,0,0|2,0,0]=4 5847 B9R1.12 NCCCc1ccc[s]1 Amb24094214 [0,2,0,0,0,0|1,1,0]=4 5848 B9R1.12 NCCNc1ccc[s]1 Amb18299161 [0,2,0,0,0,0|1,1,0]=4 5849 B9R1.12 NC\C=C/c1ccco1 Amb25312822 [0,2,0,0,0,0|1,0,0]=3 5850 B9R1.12 NC\C=C\c1ccc[s]1 Amb18563038 [0,2,0,0,0,0|1,1,0]=4 5851 B9R1.12 NC\C=C\c1ccco1 Amb10560864 [0,2,0,0,0,0|1,0,0]=3 5852 B9R1.12 NOCCc1c[s]cc1 Amb25799465 [0,2,0,0,0,0|2,0,0]=4 5853 B9R1.12 NOCCc1ccc[nH]1 Amb25280155 [0,2,0,0,0,0|1,0,0]=3 5854 B9R1.12 NOCCc1ccc[s]1 Amb25130652 [0,2,0,0,0,0|0,1,0]=3 5855 B9R1.12 NOCCc1ccco1 Amb25208726 [0,2,0,0,0,0|0,0,0]=2 5856 B9R1.12 O=C=NCc1cc[n]o1 Amb18061876 [0,2,0,0,0,0|1,0,1]=4 5857 B9R1.12 O=CC#Cc1ccco1 Amb24546607 [0,2,0,0,0,0|0,0,2]=4 5858 B9R1.12 O=CCCc1[n]cco1 Amb24511583 [0,2,0,0,0,0|1,0,1]=4 5859 B9R1.12 O=CCCc1ccc[nH]1 Amb24760290 [0,2,0,0,0,0|1,0,1]=4 5860 B9R1.12 O=CCCc1ccco1 Amb17081672 [0,2,0,0,0,0|0,0,1]=3 5861 B9R1.12 O=CCCc1cccs1 Amb17081673 [0,2,0,0,0,0|0,1,1]=4 5862 B9R1.12 O=CCSc1[n]cco1 Amb24599824 [0,2,0,0,0,0|1,0,1]=4 5863 B9R1.12 O=CCSc1cccs1 Amb17082929 [0,2,0,0,0,0|0,1,1]=4 5864 B9R1.12 O=NSCc1ccco1 Amb25806081 [0,2,0,0,0,0|0,0,1]=3 5865 B9R1.12 OCC#Cc1c[s]cc1 Amb24709250 [0,2,0,0,0,0|2,0,0]=4 5866 B9R1.12 OCC#Cc1cc[nH][n]1 Amb24689618 [0,2,0,0,0,0|2,0,0]=4 5867 B9R1.12 OCCCC=1CC=CC1 Amb25851384 [0,2,0,0,0,0|1,0,0]=3 5868 B9R1.12 OCCCc1c[nH]c[n]1 Amb19316315 [0,2,0,0,0,0|2,0,0]=4 5869 B9R1.12 OCCCc1c[nH]cc1 Amb18222128 [0,2,0,0,0,0|2,0,0]=4 5870 B9R1.12 OCCCc1c[n]c[nH]1 Amb22899104 [0,2,0,0,0,0|2,0,0]=4 5871 B9R1.12 OCCCc1c[s]c[n]1 Amb24099813 [0,2,0,0,0,0|2,0,0]=4 5872 B9R1.12 OCCCc1cc[nH][n]1 Amb25132262 [0,2,0,0,0,0|2,0,0]=4 5873 B9R1.12 OCCCc1ccc[nH]1 Amb24428704 [0,2,0,0,0,0|1,0,0]=3 5874 B9R1.12 OCCCc1cccs1 Amb17089493 [0,2,0,0,0,0|0,1,0]=3 5875 B9R1.12 OCCCc1cscc1 Amb17605794 [0,2,0,0,0,0|2,0,0]=4 5876 B9R1.12 OCCCn1cccc1 Amb17593298 [0,2,0,0,0,0|2,0,0]=4 5877 B9R1.12 OCCN[n]1cccc1 Amb25756597 [0,2,0,0,0,0|2,0,0]=4 5878 B9R1.12 OCCNc1c[nH]c[n]1 Amb24733354 [0,2,0,0,0,0|2,0,0]=4 5879 B9R1.12 OCCNc1c[nH]cc1 Amb24472507 [0,2,0,0,0,0|2,0,0]=4 5880 B9R1.12 OCCNc1ccc[nH]1 Amb24704389 [0,2,0,0,0,0|1,0,0]=3 5881 B9R1.12 OCCOc1[n]cc[s]1 Amb24069917 [0,2,0,0,0,0|1,1,0]=4 5882 B9R1.12 OCCOc1c[nH]cc1 Amb25309374 [0,2,0,0,0,0|2,0,0]=4 5883 B9R1.12 OCOC[n]1cccc1 Amb25788107 [0,2,0,0,0,0|2,0,0]=4 5884 B9R1.12 OC\C=C/c1[nH]cc[n]1 Amb25146181 [0,2,0,0,0,0|2,0,0]=4 5885 B9R1.12 OC\C=C/c1c[n]c[nH]1 Amb24534535 [0,2,0,0,0,0|2,0,0]=4 5886 B9R1.12 OC\C=C/c1ccc[nH]1 Amb24744418 [0,2,0,0,0,0|1,0,0]=3 5887 B9R1.12 OC\C=C\c1[n]cc[s]1 Amb24683013 [0,2,0,0,0,0|1,1,0]=4 5888 B9R1.12 OC\C=C\c1c[nH]cc1 Amb24454320 [0,2,0,0,0,0|2,0,0]=4 5889 B9R1.12 OC\C=C\c1c[n]c[nH]1 Amb24621877 [0,2,0,0,0,0|2,0,0]=4 5890 B9R1.12 OC\C=C\c1c[n]c[s]1 Amb25733141 [0,2,0,0,0,0|1,1,0]=4 5891 B9R1.12 OC\C=C\c1c[s]cc1 Amb25315908 [0,2,0,0,0,0|2,0,0]=4 5892 B9R1.12 OC\C=C\c1cc[n]o1 Amb25847068 [0,2,0,0,0,0|1,0,0]=3 5893 B9R1.12 OC\C=C\c1ccc[nH]1 Amb25090739 [0,2,0,0,0,0|1,0,0]=3 5894 B9R1.12 OC\C=C\c1ccc[s]1 Amb23555588 [0,2,0,0,0,0|0,1,0]=3 5895 B9R1.12 OC\C=C\c1cocc1 Amb25177010 [0,2,0,0,0,0|2,0,0]=4 5896 B9R1.12 ON=CCc1c[n]c[nH]1 Amb25364639 [0,2,0,0,0,0|2,0,0]=4 5897 B9R1.12 ONCCc1c[n]c[nH]1 Amb25178668 [0,2,0,0,0,0|2,0,0]=4 5898 B9R1.12 S=C=NCc1cccs1 Amb1107236 [0,2,0,0,0,0|0,2,0]=4 5899 B9R1.12 S=COCc1ccco1 Amb16232453 [0,2,0,0,0,0|0,0,0]=2 5900 B9R1.12 SCCCc1ccc[nH]1 Amb24722505 [0,2,0,0,0,0|1,1,0]=4 5901 B9R1.12 SCCCc1ccco1 Amb17399874 [0,2,0,0,0,0|0,1,0]=3 5902 B9R1.12 SCCCc1cccs1 Amb17400036 [0,2,0,0,0,0|0,2,0]=4 5903 B9R1.12 SCCSc1ccc[s]1 Amb25031295 [0,2,0,0,0,0|0,2,0]=4 5904 B9R1.12 [C-]#[N+]CCc1ccco1 Amb24743086 [0,2,0,0,0,0|1,0,0]=3 5905 B9R1.12 [N-]=[N+]=NCc1ccc[s]1 Amb19148919 [0,2,0,0,0,0|1,1,0]=4 5906 B9R1.12 [N-]=[N+]=NCc1ccco1 Amb25791515 [0,2,0,0,0,0|1,0,0]=3 5907 B9R1.13 BrC(Br)=Cc1ccco1 Amb22228062 [0,2,0,0,0,0|1,0,1]=4 5908 B9R1.13 C=C(Br)Cc1ccc[s]1 Amb25185096 [0,2,0,0,0,0|1,1,0]=4 5909 B9R1.13 C=C(Br)Cc1ccco1 Amb24411253 [0,2,0,0,0,0|1,0,0]=3 5910 B9R1.13 C=C(Cl)Cc1ccc[s]1 Amb24674094 [0,2,0,0,0,0|1,1,0]=4 5911 B9R1.13 C=C(O)CC1C=CC=N1 Amb25162740 [0,2,0,0,0,0|1,0,1]=4 5912 B9R1.13 CC(=C)Cc1ccc[nH]1 Amb24477810 [0,2,0,0,0,0|2,0,0]=4 5913 B9R1.13 CC(=C)Cc1ccco1 Amb24673621 [0,2,0,0,0,0|1,0,0]=3 5914 B9R1.13 CC(=O)CC1=CC=C[SiH2]1 Amb25729101 [0,2,0,0,0,0|1,0,1]=4 5915 B9R1.13 CC(=O)Cc1cc[n]o1 Amb24425365 [0,2,0,0,0,0|1,0,1]=4 5916 B9R1.13 CC(=O)Sc1ccco1 Amb24511658 [0,2,0,0,0,0|0,0,2]=4 5917 B9R1.13 CC(Br)Cc1ccco1 Amb25074648 [0,2,0,0,0,0|1,0,0]=3 5918 B9R1.13 CC(C)Cc1ccc[s]1 Amb24061264 [0,2,0,0,0,0|1,1,0]=4 5919 B9R1.13 CC(C)Nc1ccc[s]1 Amb18679411 [0,2,0,0,0,0|1,1,0]=4 5920 B9R1.13 CC(C)Sc1[n]cco1 Amb24524241 [0,2,0,0,0,0|2,0,0]=4 5921 B9R1.13 CC(Cc1ccc[nH]1)O Amb17593297 [0,2,0,0,0,0|1,0,0]=3 5922 B9R1.13 CC(Cc1cccs1)Cl Amb17477833 [0,2,0,0,0,0|1,1,0]=4 5923 B9R1.13 CC(Cc1ncco1)C Amb17399801 [0,2,0,0,0,0|2,0,0]=4 5924 B9R1.13 CC(N)Cc1ccc[nH]1 Amb18284392 [0,2,0,0,0,0|2,0,0]=4 5925 B9R1.13 CC(N)Cc1ccc[s]1 Amb19514742 [0,2,0,0,0,0|1,1,0]=4 5926 B9R1.13 CC(Nc1ncco1)C Amb2382967 [0,2,0,0,0,0|2,0,0]=4 5927 B9R1.13 CC(O)CC=1C=CCC1 Amb24732104 [0,2,0,0,0,0|1,0,1]=4 5928 B9R1.13 CC(O)CC=1CC=CC1 Amb25832624 [0,2,0,0,0,0|1,0,0]=3 5929 B9R1.13 CC(O)C[n]1ccc[n]1 Amb21988438 [0,2,0,0,0,0|2,0,0]=4 5930 B9R1.13 CC(O)C[n]1cccc1 Amb24589643 [0,2,0,0,0,0|2,0,0]=4 5931 B9R1.13 CC(O)Cc1[nH]cc[n]1 Amb20668940 [0,2,0,0,0,0|2,0,0]=4 5932 B9R1.13 CC(O)Cc1[nH]cc[n]1 Amb22058890 [0,2,0,0,0,0|2,0,0]=4 5933 B9R1.13 CC(O)Cc1c[nH]c[n]1 Amb25259667 [0,2,0,0,0,0|2,0,0]=4 5934 B9R1.13 CC(O)Cc1c[n]c[s]1 Amb24659738 [0,2,0,0,0,0|1,1,0]=4 5935 B9R1.13 CC(O)Cc1c[s]cc1 Amb24725695 [0,2,0,0,0,0|2,0,0]=4 5936 B9R1.13 CC(O)Cc1cc[n]o1 Amb24747618 [0,2,0,0,0,0|1,0,0]=3 5937 B9R1.13 CC(O)Cc1ccco1 Amb22748663 [0,2,0,0,0,0|0,0,0]=2 5938 B9R1.13 CC(O)Nc1ccco1 Amb24392212 [0,2,0,0,0,0|0,0,0]=2 5939 B9R1.13 CC(O)Sc1c[s]cc1 Amb25234203 [0,2,0,0,0,0|2,0,0]=4 5940 B9R1.13 CC(S)Cc1ccco1 Amb25132353 [0,2,0,0,0,0|0,1,0]=3 5941 B9R1.13 CN(C)Cc1ccc[s]1 Amb21864815 [0,2,0,0,0,0|1,1,0]=4 5942 B9R1.13 CN(C)Cc1ccco1 Amb22730011 [0,2,0,0,0,0|1,0,0]=3 5943 B9R1.13 CN(Cl)Cc1ccc[s]1 Amb24639521 [0,2,0,0,0,0|1,1,0]=4 5944 B9R1.13 CN(N)Cc1ccco1 Amb25216114 [0,2,0,0,0,0|1,0,0]=3 5945 B9R1.13 CS(=O)Cc1ccc[s]1 Amb25746950 [0,2,0,0,0,0|0,1,1]=4 5946 B9R1.13 C[C@@H](N)Cc1ccc[s]1 Amb24680998 [0,2,0,0,0,0|1,1,0]=4 5947 B9R1.13 C[C@@H](O)C[n]1ccc[n]1 Amb24502208 [0,2,0,0,0,0|2,0,0]=4 5948 B9R1.13 C[C@@H](O)C[n]1cccc1 Amb25793900 [0,2,0,0,0,0|2,0,0]=4 5949 B9R1.13 C[C@@H](O)Cc1[nH]cc[n]1 Amb24675763 [0,2,0,0,0,0|2,0,0]=4 5950 B9R1.13 C[C@@H](O)Cc1c[s]cc1 Amb22896909 [0,2,0,0,0,0|2,0,0]=4 5951 B9R1.13 C[C@@H](O)Cc1ccc[s]1 Amb22896924 [0,2,0,0,0,0|0,1,0]=3 5952 B9R1.13 C[C@@H](O)Cc1ccco1 Amb24433279 [0,2,0,0,0,0|0,0,0]=2 5953 B9R1.13 C[C@H](O)C[n]1ccc[n]1 Amb25188990 [0,2,0,0,0,0|2,0,0]=4 5954 B9R1.13 C[C@H](O)Cc1[nH]cc[n]1 Amb24671075 [0,2,0,0,0,0|2,0,0]=4 5955 B9R1.13 C[C@H](O)Cc1c[s]cc1 Amb24395208 [0,2,0,0,0,0|2,0,0]=4 5956 B9R1.13 C[C@H](O)Cc1cc[n]o1 Amb25706054 [0,2,0,0,0,0|1,0,0]=3 5957 B9R1.13 C[C@H](O)Cc1ccc[s]1 Amb25354706 [0,2,0,0,0,0|0,1,0]=3 5958 B9R1.13 ClC(Cl)=Cc1ccco1 Amb24559898 [0,2,0,0,0,0|1,0,1]=4 5959 B9R1.13 ClC(Cl)Sc1[n]cco1 Amb24515085 [0,2,0,0,0,0|2,0,0]=4 5960 B9R1.13 ClC(Cl)Sc1ccc[nH]1 Amb25208501 [0,2,0,0,0,0|2,0,0]=4 5961 B9R1.13 ClC(Cl)Sc1ccc[s]1 Amb24579236 [0,2,0,0,0,0|1,1,0]=4 5962 B9R1.13 FC(Sc1cccs1)F Amb17232586 [0,2,0,0,0,0|1,1,0]=4 5963 B9R1.13 F\C(\Cl)=C\c1ccco1 Amb24665869 [0,2,0,0,0,0|1,0,1]=4 5964 B9R1.13 NC(=O)Cc1ccc[nH]1 Amb22886650 [0,2,0,0,0,0|1,0,1]=4 5965 B9R1.13 NC(=O)Cc1ccco1 Amb24534382 [0,2,0,0,0,0|0,0,1]=3 5966 B9R1.13 NC(=S)Cc1ccc[nH]1 Amb19148730 [0,2,0,0,0,0|1,1,0]=4 5967 B9R1.13 NC(=S)Cc1cccs1 Amb1092031 [0,2,0,0,0,0|0,2,0]=4 5968 B9R1.13 O=C(Cl)Cc1ccco1 Amb25124003 [0,2,0,0,0,0|0,0,1]=3 5969 B9R1.13 O=C(Cl)Oc1ccco1 Amb25258766 [0,2,0,0,0,0|0,0,2]=4 5970 B9R1.13 OB(Cc1ccco1)O Amb10576612 [0,2,0,0,0,0|0,0,0]=2 5971 B9R1.13 OC(=O)CC1=CCCO1 Amb24639240 [0,2,0,0,0,0|0,0,2]=4 5972 B9R1.13 OC(=O)Cc1[cH-]ccc1 Amb24122585 [0,2,0,0,0,0|1,0,0]=3 5973 B9R1.13 OC(=O)Cc1[nH]cc[n]1 Amb22750530 [0,2,0,0,0,0|2,0,0]=4 5974 B9R1.13 OC(=O)Cc1[n][n]co1 Amb22753920 [0,2,0,0,0,0|2,0,0]=4 5975 B9R1.13 OC(=O)Cc1c[nH]c[n]1 Amb20670251 [0,2,0,0,0,0|2,0,0]=4 5976 B9R1.13 OC(=O)Cc1cc[nH]c1 Amb18062951 [0,2,0,0,0,0|2,0,0]=4 5977 B9R1.13 OC(=O)Cc1cc[n][nH]1 Amb19243677 [0,2,0,0,0,0|2,0,0]=4 5978 B9R1.13 OC(=O)Cc1cc[n][s]1 Amb18831590 [0,2,0,0,0,0|1,1,0]=4 5979 B9R1.13 OC(=O)Cc1cc[s][n]1 Amb18831591 [0,2,0,0,0,0|2,0,0]=4 5980 B9R1.13 OC(=O)Cc1cscc1 Amb1151879 [0,2,0,0,0,0|2,0,0]=4 5981 B9R1.13 OC(=O)Cc1cscn1 Amb17039671 [0,2,0,0,0,0|2,0,0]=4 5982 B9R1.13 OC(=O)Cn1cccc1 Amb1124868 [0,2,0,0,0,0|2,0,0]=4 5983 B9R1.13 OC(=O)Cn1cccn1 Amb1157167 [0,2,0,0,0,0|2,0,0]=4 5984 B9R1.13 OC(=O)Sc1ccco1 Amb24695916 [0,2,0,0,0,0|0,0,1]=3 5985 B9R1.33 Brc1cc[s]c1CCBr Amb25804548 [0,2,0,0,0,0|1,1,0]=4 5986 B9R1.33 C#CCN1OC=CC1=O Amb25295677 [0,2,0,0,0,0|2,0,0]=4 5987 B9R1.33 C=CCc1[s]ccc1Cl Amb25709977 [0,2,0,0,0,0|1,1,0]=4 5988 B9R1.33 C=CCc1[s]ccc1S Amb24743677 [0,2,0,0,0,0|1,1,0]=4 5989 B9R1.33 C=CCc1occc1Br Amb24383548 [0,2,0,0,0,0|1,0,0]=3 5990 B9R1.33 CC=1CC=CC1CCO Amb24419603 [0,2,0,0,0,0|1,0,1]=4 5991 B9R1.33 CCCN1OC=CC1=O Amb25681048 [0,2,0,0,0,0|2,0,0]=4 5992 B9R1.33 CCCc1[s]ccc1N Amb24084960 [0,2,0,0,0,0|1,1,0]=4 5993 B9R1.33 CCNc1ccc[n]1C Amb25147232 [0,2,0,0,0,0|2,0,0]=4 5994 B9R1.33 CCOc1[s]ccc1N Amb19929914 [0,2,0,0,0,0|1,1,0]=4 5995 B9R1.33 CNCc1[s]ccc1Br Amb20623997 [0,2,0,0,0,0|1,1,0]=4 5996 B9R1.33 CNCc1ccc[n]1C Amb21954194 [0,2,0,0,0,0|2,0,0]=4 5997 B9R1.33 CNCc1ocnc1C Amb16230505 [0,2,0,0,0,0|2,0,0]=4 5998 B9R1.33 CNCc1sccc1Br Amb16230502 [0,2,0,0,0,0|1,1,0]=4 5999 B9R1.33 COCC1CC=CC1=O Amb24620076 [0,2,0,0,0,0|1,0,1]=4 6000 B9R1.33 COC[n]1[n]ccc1C Amb25737240 [0,2,0,0,0,0|2,0,0]=4 6001 B9R1.33 COCc1[n]c[s]c1N Amb24524242 [0,2,0,0,0,0|2,0,0]=4 6002 B9R1.33 COCc1[s]c[n]c1N Amb25147198 [0,2,0,0,0,0|1,1,0]=4 6003 B9R1.33 COCc1c[n]c[n]1C Amb24062960 [0,2,0,0,0,0|2,0,0]=4 6004 B9R1.33 COCc1cc[n][n]1C Amb24269821 [0,2,0,0,0,0|2,0,0]=4 6005 B9R1.33 COCc1cc[s]c1Br Amb24637857 [0,2,0,0,0,0|2,0,0]=4 6006 B9R1.33 CSCc1[s]ccc1Cl Amb24720678 [0,2,0,0,0,0|0,2,0]=4 6007 B9R1.33 C[n]1[n]ccc1CCO Amb19957348 [0,2,0,0,0,0|2,0,0]=4 6008 B9R1.33 C[n]1[n]ccc1CNO Amb25360541 [0,2,0,0,0,0|2,0,0]=4 6009 B9R1.33 C[n]1c[n]cc1CCO Amb25111555 [0,2,0,0,0,0|2,0,0]=4 6010 B9R1.33 C[n]1c[n]cc1CNO Amb24416831 [0,2,0,0,0,0|2,0,0]=4 6011 B9R1.33 C[n]1c[n]cc1CON Amb25859369 [0,2,0,0,0,0|2,0,0]=4 6012 B9R1.33 C[n]1cc[n]c1CNO Amb24339748 [0,2,0,0,0,0|2,0,0]=4 6013 B9R1.33 C[n]1cc[n]c1SCO Amb25357714 [0,2,0,0,0,0|2,0,0]=4 6014 B9R1.33 C[n]1cccc1CC#C Amb25308963 [0,2,0,0,0,0|2,0,0]=4 6015 B9R1.33 C[n]1cccc1CCCl Amb24419304 [0,2,0,0,0,0|2,0,0]=4 6016 B9R1.33 C[n]1cccc1CCO Amb19957346 [0,2,0,0,0,0|1,0,0]=3 6017 B9R1.33 C[n]1cccc1CCS Amb25282882 [0,2,0,0,0,0|1,1,0]=4 6018 B9R1.33 C[n]1cccc1CNN Amb19664698 [0,2,0,0,0,0|2,0,0]=4 6019 B9R1.33 C[n]1cccc1CON Amb25837380 [0,2,0,0,0,0|1,0,0]=3 6020 B9R1.33 Cc1[nH]c[n]c1CCO Amb25800404 [0,2,0,0,0,0|2,0,0]=4 6021 B9R1.33 Cc1[n]c[nH]c1COC Amb25727176 [0,2,0,0,0,0|2,0,0]=4 6022 B9R1.33 Cc1[n]c[s]c1CNO Amb24422983 [0,2,0,0,0,0|1,1,0]=4 6023 B9R1.33 Cc1[n]coc1CC#N Amb24413842 [0,2,0,0,0,0|2,0,0]=4 6024 B9R1.33 Cc1[n]coc1CCBr Amb24480044 [0,2,0,0,0,0|2,0,0]=4 6025 B9R1.33 Cc1[n]coc1CSC Amb24481998 [0,2,0,0,0,0|1,1,0]=4 6026 B9R1.33 Cc1[s]c[n]c1CCO Amb24670192 [0,2,0,0,0,0|2,0,0]=4 6027 B9R1.33 Cc1[s]ccc1CCO Amb24738484 [0,2,0,0,0,0|2,0,0]=4 6028 B9R1.33 Cc1[s]ccc1CNO Amb24664840 [0,2,0,0,0,0|2,0,0]=4 6029 B9R1.33 Cc1c[n]oc1CC#N Amb25213005 [0,2,0,0,0,0|2,0,0]=4 6030 B9R1.33 Cc1c[n]oc1CNC Amb24527516 [0,2,0,0,0,0|2,0,0]=4 6031 B9R1.33 Cc1cc[nH]c1CCC Amb24477791 [0,2,0,0,0,0|2,0,0]=4 6032 B9R1.33 Cc1cc[nH]c1CCN Amb25032227 [0,2,0,0,0,0|2,0,0]=4 6033 B9R1.33 Cc1cc[s]c1CCBr Amb25234538 [0,2,0,0,0,0|1,1,0]=4 6034 B9R1.33 Cc1cc[s]c1CCC Amb24679259 [0,2,0,0,0,0|1,1,0]=4 6035 B9R1.33 Cc1cc[s]c1CCCl Amb25846576 [0,2,0,0,0,0|1,1,0]=4 6036 B9R1.33 Cc1cc[s]c1CCS Amb25108739 [0,2,0,0,0,0|0,2,0]=4 6037 B9R1.33 Cc1ccoc1CC#N Amb25247026 [0,2,0,0,0,0|1,0,0]=3 6038 B9R1.33 Cc1ccoc1CCN Amb18832814 [0,2,0,0,0,0|1,0,0]=3 6039 B9R1.33 Cc1ccoc1CCO Amb25300068 [0,2,0,0,0,0|0,0,0]=2 6040 B9R1.33 Cc1ccoc1\C=N\N Amb24449093 [0,2,0,0,0,0|1,0,1]=4 6041 B9R1.33 Cc1ncoc1CCN Amb17399804 [0,2,0,0,0,0|2,0,0]=4 6042 B9R1.33 Cc1ncoc1CCO Amb17399816 [0,2,0,0,0,0|1,0,0]=3 6043 B9R1.33 Cc1oc[n]c1CCO Amb24423384 [0,2,0,0,0,0|2,0,0]=4 6044 B9R1.33 Cc1occc1CCO Amb25104148 [0,2,0,0,0,0|2,0,0]=4 6045 B9R1.33 Clc1cc[s]c1CCCl Amb25824910 [0,2,0,0,0,0|1,1,0]=4 6046 B9R1.33 N#CCc1[s]ccc1Cl Amb25147110 [0,2,0,0,0,0|1,1,0]=4 6047 B9R1.33 N#CCc1[s]ccc1F Amb24691611 [0,2,0,0,0,0|1,1,0]=4 6048 B9R1.33 NCCc1[s]ccc1Br Amb18956643 [0,2,0,0,0,0|1,1,0]=4 6049 B9R1.33 NCCc1o[n]cc1Cl Amb24616009 [0,2,0,0,0,0|2,0,0]=4 6050 B9R1.33 NCCc1occc1Br Amb18186835 [0,2,0,0,0,0|1,0,0]=3 6051 B9R1.33 NCCc1occc1Cl Amb18202348 [0,2,0,0,0,0|1,0,0]=3 6052 B9R1.33 NNCc1[s]ccc1I Amb25856657 [0,2,0,0,0,0|1,1,0]=4 6053 B9R1.33 NNCc1occc1Br Amb25307686 [0,2,0,0,0,0|1,0,0]=3 6054 B9R1.33 NOCc1[s]ccc1Br Amb24372190 [0,2,0,0,0,0|0,1,0]=3 6055 B9R1.33 NOCc1cc[s]c1Cl Amb18126393 [0,2,0,0,0,0|2,0,0]=4 6056 B9R1.33 N\N=C\c1occc1Br Amb25683319 [0,2,0,0,0,0|1,0,1]=4 6057 B9R1.33 Nc1[n]c[s]c1CCO Amb24071677 [0,2,0,0,0,0|1,1,0]=4 6058 B9R1.33 Nc1cc[s]c1CNO Amb24684747 [0,2,0,0,0,0|0,1,0]=3 6059 B9R1.33 O=CCc1[s]ccc1Br Amb24534254 [0,2,0,0,0,0|0,1,1]=4 6060 B9R1.33 OCCC1OC=CC1=O Amb25101057 [0,2,0,0,0,0|0,0,1]=3 6061 B9R1.33 OCCN1SC=CC1=O Amb23441692 [0,2,0,0,0,0|1,1,0]=4 6062 B9R1.33 OCC[n]1[n]ccc1Br Amb25123086 [0,2,0,0,0,0|2,0,0]=4 6063 B9R1.33 OCCc1[n]c[s]c1Cl Amb25208441 [0,2,0,0,0,0|2,0,0]=4 6064 B9R1.33 OCCc1cc[s]c1I Amb25364342 [0,2,0,0,0,0|2,0,0]=4 6065 B9R1.33 OCCc1nccn1C Amb17593312 [0,2,0,0,0,0|2,0,0]=4 6066 B9R1.33 OC\C=C/1\CC=CC1=O Amb25179367 [0,2,0,0,0,0|1,0,0]=3 6067 B9R1.33 ONCc1cc[s]c1Cl Amb24391031 [0,2,0,0,0,0|2,0,0]=4 6068 B9R1.33 O\N=C\c1[s]ccc1Cl Amb24532403 [0,2,0,0,0,0|0,1,1]=4 6069 B9R1.14 BrCc1[s]ccc1CBr Amb25735651 [0,2,0,0,0,0|1,1,0]=4 6070 B9R1.14 BrCc1occc1CBr Amb24656536 [0,2,0,0,0,0|1,0,0]=3 6071 B9R1.14 C=Cc1[s]c[n]c1CO Amb24423485 [0,2,0,0,0,0|2,0,0]=4 6072 B9R1.14 C=Cc1cc[s]c1CN Amb24466453 [0,2,0,0,0,0|1,1,0]=4 6073 B9R1.14 C=Cc1ccoc1C=O Amb24618362 [0,2,0,0,0,0|0,0,2]=4 6074 B9R1.14 C=Cc1ccoc1CN Amb25758246 [0,2,0,0,0,0|1,0,0]=3 6075 B9R1.14 CC[n]1cccc1CBr Amb22270986 [0,2,0,0,0,0|2,0,0]=4 6076 B9R1.14 CC[n]1cccc1CCl Amb22270988 [0,2,0,0,0,0|2,0,0]=4 6077 B9R1.14 CC[n]1cccc1CI Amb22270989 [0,2,0,0,0,0|2,0,0]=4 6078 B9R1.14 CC[n]1cccc1CN Amb18251089 [0,2,0,0,0,0|2,0,0]=4 6079 B9R1.14 CC[n]1cccc1CS Amb22270990 [0,2,0,0,0,0|1,1,0]=4 6080 B9R1.14 CC[n]1cccc1C[O-] Amb22411416 [0,2,0,0,0,0|1,0,1]=4 6081 B9R1.14 CCc1[nH]ccc1CC Amb25122201 [0,2,0,0,0,0|2,0,0]=4 6082 B9R1.14 CCc1[nH]ccc1CN Amb24354849 [0,2,0,0,0,0|2,0,0]=4 6083 B9R1.14 CCc1[n]c[nH]c1CO Amb25297466 [0,2,0,0,0,0|2,0,0]=4 6084 B9R1.14 CCc1[n]c[s]c1CO Amb18838819 [0,2,0,0,0,0|1,1,0]=4 6085 B9R1.14 CCc1[n]coc1CN Amb18832747 [0,2,0,0,0,0|2,0,0]=4 6086 B9R1.14 CCc1[n]coc1CO Amb25250769 [0,2,0,0,0,0|1,0,0]=3 6087 B9R1.14 CCc1cc[s]c1CCl Amb25686979 [0,2,0,0,0,0|1,1,0]=4 6088 B9R1.14 CCc1cc[s]c1CN Amb18954316 [0,2,0,0,0,0|1,1,0]=4 6089 B9R1.14 CCc1cc[s]c1CO Amb24352853 [0,2,0,0,0,0|0,1,0]=3 6090 B9R1.14 CCc1ccoc1C=O Amb18139773 [0,2,0,0,0,0|0,0,2]=4 6091 B9R1.14 CCc1o[n]cc1C=O Amb18832856 [0,2,0,0,0,0|2,0,0]=4 6092 B9R1.14 CCc1o[n]cc1CBr Amb24740721 [0,2,0,0,0,0|2,0,0]=4 6093 B9R1.14 CCc1o[n]cc1CO Amb24417162 [0,2,0,0,0,0|2,0,0]=4 6094 B9R1.14 CCc1oc[n]c1C=O Amb18832852 [0,2,0,0,0,0|2,0,0]=4 6095 B9R1.14 CCc1oc[n]c1CCl Amb25132509 [0,2,0,0,0,0|2,0,0]=4 6096 B9R1.14 CCc1oc[n]c1CN Amb18251098 [0,2,0,0,0,0|2,0,0]=4 6097 B9R1.14 CCc1occc1C=O Amb18832921 [0,2,0,0,0,0|1,0,0]=3 6098 B9R1.14 CCc1occc1CBr Amb25738291 [0,2,0,0,0,0|1,0,0]=3 6099 B9R1.14 CCc1occc1CCl Amb24748886 [0,2,0,0,0,0|1,0,0]=3 6100 B9R1.14 CO[C@H]1C=CO[C@@H]1CO Amb25332206 [0,2,0,0,0,0|0,0,2]=4 6101 B9R1.14 COc1cc[s]c1CBr Amb25848963 [0,2,0,0,0,0|1,1,0]=4 6102 B9R1.14 COc1ccoc1C=O Amb18832783 [0,2,0,0,0,0|0,0,2]=4 6103 B9R1.14 COc1ccoc1CS Amb25090900 [0,2,0,0,0,0|0,1,0]=3 6104 B9R1.14 COc1ccsc1CO Amb16231069 [0,2,0,0,0,0|0,1,0]=3 6105 B9R1.14 CSc1[s]ccc1CO Amb24477826 [0,2,0,0,0,0|2,0,0]=4 6106 B9R1.14 CSc1cc[s]c1CO Amb25692176 [0,2,0,0,0,0|0,1,0]=3 6107 B9R1.14 CSc1ccoc1C=O Amb25129387 [0,2,0,0,0,0|0,0,2]=4 6108 B9R1.14 CSc1occc1CO Amb25052224 [0,2,0,0,0,0|2,0,0]=4 6109 B9R1.14 N#Cc1[nH]c[n]c1CO Amb18642089 [0,2,0,0,0,0|2,0,0]=4 6110 B9R1.14 N#Cc1cc[s]c1CBr Amb25793875 [0,2,0,0,0,0|1,1,0]=4 6111 B9R1.14 N#Cc1cc[s]c1CCl Amb24435034 [0,2,0,0,0,0|1,1,0]=4 6112 B9R1.14 N#Cc1cc[s]c1CO Amb24685120 [0,2,0,0,0,0|0,1,0]=3 6113 B9R1.14 N#Cc1ccoc1C=O Amb18833003 [0,2,0,0,0,0|0,0,2]=4 6114 B9R1.14 N#Cc1occc1C=O Amb18833004 [0,2,0,0,0,0|1,0,1]=4 6115 B9R1.14 NCc1[s]ccc1C#N Amb24678727 [0,2,0,0,0,0|1,1,0]=4 6116 B9R1.14 NCc1occc1C#N Amb25694984 [0,2,0,0,0,0|1,0,0]=3 6117 B9R1.14 O=Cc1occc1C=O Amb18642159 [0,2,0,0,0,0|0,0,2]=4 6118 B9R1.14 OC[n]1cccc1C=O Amb25147120 [0,2,0,0,0,0|2,0,0]=4 6119 B9R1.14 OC[n]1cccc1CO Amb25697021 [0,2,0,0,0,0|1,0,0]=3 6120 B9R1.14 OCc1[nH]c[n]c1C=O Amb24505027 [0,2,0,0,0,0|2,0,0]=4 6121 B9R1.14 OCc1[nH]ccc1C=O Amb18642273 [0,2,0,0,0,0|1,0,0]=3 6122 B9R1.14 OCc1[n]c[s]c1CBr Amb24455694 [0,2,0,0,0,0|2,0,0]=4 6123 B9R1.14 OCc1[n]c[s]c1CO Amb22749254 [0,2,0,0,0,0|1,1,0]=4 6124 B9R1.14 OCc1[s]ccc1C=O Amb24665662 [0,2,0,0,0,0|0,1,0]=3 6125 B9R1.14 OCc1c[nH]cc1CO Amb24496293 [0,2,0,0,0,0|2,0,0]=4 6126 B9R1.14 OCc1c[n][nH]c1CO Amb24481882 [0,2,0,0,0,0|2,0,0]=4 6127 B9R1.14 OCc1cc[s]c1C=O Amb24695882 [0,2,0,0,0,0|2,0,0]=4 6128 B9R1.14 OCc1ccoc1C=O Amb25363458 [0,2,0,0,0,0|0,0,2]=4 6129 B9R1.14 OCc1cocc1CO Amb23589212 [0,2,0,0,0,0|2,0,0]=4 6130 B9R1.14 OCc1oc[n]c1CBr Amb25851956 [0,2,0,0,0,0|1,0,0]=3 6131 B9R1.14 OCc1occc1CO Amb25226420 [0,2,0,0,0,0|0,0,0]=2 6132 B9R1.14 OCc1sccc1CO Amb2236395 [0,2,0,0,0,0|0,1,0]=3 6133 B9R1.14 O\C=C/1\C=CC=C1C=O Amb25179840 [0,2,0,0,0,0|1,0,1]=4 6134 B9R1.14 O\N=C/1\OC=C\C1=N\O Amb24553064 [0,2,0,0,0,0|1,0,0]=3 6135 B9R1.27 CCC1=C(O)C=CC1=O Amb25066357 [0,2,0,0,0,0|2,0,0]=4 6136 B9R1.27 C[n]1[n]cc(Br)c1CO Amb20619739 [0,2,0,0,0,0|2,0,0]=4 6137 B9R1.27 C[n]1[n]cc(Cl)c1CO Amb20619725 [0,2,0,0,0,0|2,0,0]=4 6138 B9R1.27 C[n]1[n]cc(I)c1CO Amb25091672 [0,2,0,0,0,0|2,0,0]=4 6139 B9R1.27 C[n]1c[n]c(Br)c1CO Amb23441159 [0,2,0,0,0,0|2,0,0]=4 6140 B9R1.27 C[n]1c[n]c(I)c1CO Amb25805314 [0,2,0,0,0,0|2,0,0]=4 6141 B9R1.27 C[n]1c[n]c(N)c1CO Amb24472466 [0,2,0,0,0,0|2,0,0]=4 6142 B9R1.27 Cc1[nH]cc(C)c1CO Amb24329038 [0,2,0,0,0,0|2,0,0]=4 6143 B9R1.27 Cc1[s]cc(C)c1CO Amb25296332 [0,2,0,0,0,0|2,0,0]=4 6144 B9R1.27 Cc1c[n][n](C)c1CO Amb24269234 [0,2,0,0,0,0|2,0,0]=4 6145 B9R1.27 Cc1cc[n](C)c1CO Amb23441151 [0,2,0,0,0,0|1,0,0]=3 6146 B9R1.27 N[n]1cc[n+](N)c1CO Amb24407507 [0,2,0,0,0,0|2,0,0]=4 6147 B9R1.27 OCN1C(=O)C=CC1=O Amb17616653 [0,2,0,0,0,0|2,0,0]=4 6148 B9R1.27 OCc1c(C)coc1C Amb10982618 [0,2,0,0,0,0|2,0,0]=4 6149 B9R1.202 CC1(CBr)OC=CC1=O Amb25061336 [0,2,0,0,0,0|1,0,1]=4 6150 B9R1.202 CC1(CCl)OC=CC1=O Amb25369670 [0,2,0,0,0,0|1,0,1]=4 6151 B9R1.202 CC1(CO)CC=CC1=O Amb24662340 [0,2,0,0,0,0|1,0,1]=4 6152 B9R1.202 OCC1(O)CC=CC1=O Amb24661467 [0,2,0,0,0,0|1,0,1]=4 6153 B9R1.202 OC[C@@]1(O)CC=CC1=O Amb24583598 [0,2,0,0,0,0|1,0,1]=4 6154 B7R1.3 C=C1CC=CC=N1 Amb24084856 [0,0,1,1,0,0|2,0,0]=4 6155 B7R1.3 ClC=1CNC=CC1 Amb25732680 [0,0,1,1,0,0|2,0,0]=4 6156 B7R1.3 NC=1CNC=CC1 Amb24744414 [0,0,1,1,0,0|2,0,0]=4 6157 B7R1.3 O=C1COCC=C1 Amb22234519 [0,0,1,1,0,0|0,0,2]=4 6158 B7R1.3 OC1CC=COC1 Amb25663138 [0,0,1,1,0,0|0,0,2]=4 6159 B7R1.3 OC1COCC=C1 Amb25662556 [0,0,1,1,0,0|0,0,2]=4 6160 B7R1.3 OC=1CNC=CC1 Amb24744451 [0,0,1,1,0,0|1,0,0]=3 6161 B7R1.3 O[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056043 [0,0,1,1,0,0|1,0,1]=4 6162 B7R1.3 O[13c]1ccccc1 Amb22367569 [0,0,1,1,0,0|1,0,1]=4 6163 B7R1.3 O[C@H]1CC=COC1 Amb25272017 [0,0,1,1,0,0|0,0,2]=4 6164 B7R1.3 Oc1cc[13cH]cc1 Amb22367413 [0,0,1,1,0,0|1,0,1]=4 6165 B7R1.3 Oc1cccc[n]1 Amb20622006 [0,0,1,1,0,0|2,0,0]=4 6166 B7R1.3 Oc1cccc[n]1 Amb24082004 [0,0,1,1,0,0|2,0,0]=4 6167 B7R1.3 Oc1ccccc1 Amb22229793 [0,0,1,1,0,0|1,0,1]=4 6168 B7R1.3 Oc1ccccc1 Amb22337931 [0,0,1,1,0,0|1,0,1]=4 6169 B7R1.3 Oc1ccccc1 Amb22367059 [0,0,1,1,0,0|1,0,1]=4 6170 B7R1.3 Oc1ccccc1 Amb24066113 [0,0,1,1,0,0|1,0,1]=4 6171 B7R1.3 S=C1CN=CC=C1 Amb25336406 [0,0,1,1,0,0|1,1,0]=4 6172 B7R1.3 [18OH]c1ccccc1 Amb22367529 [0,0,1,1,0,0|1,0,1]=4 6173 B7R1.15 CC1=C[C@H](O)[C@@H]1O Amb25357588 [0,0,1,1,0,0|0,0,2]=4 6174 B7R1.7 O=C\C=C/C1CO1 Amb25695433 [0,0,1,1,0,0|0,0,2]=4 6175 B7R1.7 O=C\C=C\C1CO1 Amb25799580 [0,0,1,1,0,0|0,0,2]=4 6176 B7R1.7 OC\C=C\C1CO1 Amb24464685 [0,0,1,1,0,0|0,0,2]=4 6177 B7R1.24 C1=CC=NC=CO1 Amb24616297 [0,0,1,1,0,0|1,0,1]=4 6178 B7R1.24 C1C=COCCO1 Amb25096349 [0,0,1,1,0,0|0,0,2]=4 6179 B7R1.24 C1CCC=CC=C1 Amb22002708 [0,0,1,1,0,0|2,0,0]=4 6180 B7R1.24 C1CNC=CC=C1 Amb25728494 [0,0,1,1,0,0|2,0,0]=4 6181 B7R1.29 C=C[C@]1(CO)CO1 Amb24675559 [0,0,1,1,0,0|0,0,2]=4 6182 B9R2.50 C1CC2=C1CC=CC2 Amb17778803 [0,0,0,1,0,1|2,0,0]=4 6183 B9R2.50 C1Cc2cc[n]cc21 Amb24748385 [0,0,0,1,0,1|2,0,0]=4 6184 B9R2.50 C1Cc2ccccc12 Amb17778802 [0,0,0,1,0,1|2,0,0]=4 6185 B9R2.50 C1Nc2[n]cccc21 Amb24078633 [0,0,0,1,0,1|2,0,0]=4 6186 B9R2.50 C1Nc2ccc[n]c21 Amb24093564 [0,0,0,1,0,1|2,0,0]=4 6187 B9R2.56 OCC12OC1C=CO2 Amb24093540 [0,0,0,1,0,1|0,0,2]=4 6188 B9R2.39 O[C@@H]1C[C@@H]2C=C[C@H]1O2 Amb24749631 [0,1,0,1,0,0|0,0,2]=4 6189 B9R2.2 C1CC1c2cc[n]o2 Amb22900253 [0,1,0,1,0,0|2,0,0]=4 6190 B9R2.2 C1CC1c2ccc[nH]2 Amb25075548 [0,1,0,1,0,0|2,0,0]=4 6191 B9R2.2 C1CC1c2ccc[s]2 Amb24323171 [0,1,0,1,0,0|1,1,0]=4 6192 B9R2.2 C1CC1c2ccco2 Amb24323177 [0,1,0,1,0,0|1,0,0]=3 6193 B9R2.2 C1NC1c2ccc[s]2 Amb18222208 [0,1,0,1,0,0|1,1,0]=4 6194 B9R2.2 C1NC1c2ccco2 Amb18224247 [0,1,0,1,0,0|1,0,0]=3 6195 B9R2.2 C1OC1c2c[nH]c[n]2 Amb24670026 [0,1,0,1,0,0|2,0,0]=4 6196 B9R2.2 C1OC1c2c[nH]cc2 Amb18062029 [0,1,0,1,0,0|2,0,0]=4 6197 B9R2.2 C1OC1c2c[n]c[s]2 Amb24097147 [0,1,0,1,0,0|1,1,0]=4 6198 B9R2.2 C1OC1c2c[s]c[n]2 Amb25067225 [0,1,0,1,0,0|2,0,0]=4 6199 B9R2.2 C1OC1c2cc[nH][n]2 Amb24667843 [0,1,0,1,0,0|2,0,0]=4 6200 B9R2.2 C1OC1c2cocc2 Amb24483221 [0,1,0,1,0,0|2,0,0]=4 6201 B9R2.2 C1O[C@@H]1c2ccc[s]2 Amb24384733 [0,1,0,1,0,0|0,1,0]=3 6202 B9R2.2 C1O[C@H]1c2[n]cc[s]2 Amb25126543 [0,1,0,1,0,0|1,1,0]=4 6203 B9R2.2 c1coc(c1)C2CO2 Amb1135121 [0,1,0,1,0,0|0,0,0]=2 6204 B9R2.2 c1coc(n1)C2CC2 Amb17399789 [0,1,0,1,0,0|2,0,0]=4 6205 B9R2.2 c1csc(c1)C2CO2 Amb1140287 [0,1,0,1,0,0|0,1,0]=3 6206 B9R2.3 C1CCc2[nH]ccc21 Amb25731586 [0,1,0,1,0,0|2,0,0]=4 6207 B9R2.3 C1CNc2[s]ccc21 Amb18203312 [0,1,0,1,0,0|1,1,0]=4 6208 B9R2.3 C1CNc2cc[s]c21 Amb18203309 [0,1,0,1,0,0|1,1,0]=4 6209 B9R2.3 C1CNc2o[n]cc21 Amb18833119 [0,1,0,1,0,0|2,0,0]=4 6210 B9R2.3 C1CNc2occc21 Amb18833124 [0,1,0,1,0,0|1,0,0]=3 6211 B9R2.3 C1C[n]2[n]ccc2O1 Amb25246770 [0,1,0,1,0,0|2,0,0]=4 6212 B9R2.3 C1C[n]2cccc2S1 Amb24065321 [0,1,0,1,0,0|2,0,0]=4 6213 B9R2.3 C1Cc2cccn2C1 Amb17689384 [0,1,0,1,0,0|2,0,0]=4 6214 B9R2.3 C1N=C2N=CC=C2S1 Amb23412511 [0,1,0,1,0,0|1,1,0]=4 6215 B9R2.3 C1N=Cc2cc[nH]c21 Amb24376278 [0,1,0,1,0,0|2,0,0]=4 6216 B9R2.3 C1NCc2[n]coc21 Amb18833121 [0,1,0,1,0,0|2,0,0]=4 6217 B9R2.3 C1NCc2[s]ccc21 Amb18203310 [0,1,0,1,0,0|1,1,0]=4 6218 B9R2.3 C1NCc2c[n]oc21 Amb18833118 [0,1,0,1,0,0|2,0,0]=4 6219 B9R2.3 C1NCc2cc[nH]c21 Amb18203410 [0,1,0,1,0,0|2,0,0]=4 6220 B9R2.3 C1NCc2occc21 Amb18203409 [0,1,0,1,0,0|1,0,0]=3 6221 B9R2.3 C1OCc2[nH]c[n]c21 Amb24088971 [0,1,0,1,0,0|2,0,0]=4 6222 B9R2.3 C1OCc2c[n][nH]c21 Amb23456045 [0,1,0,1,0,0|2,0,0]=4 6223 B9R2.3 C1OCc2ccoc21 Amb24390804 [0,1,0,1,0,0|0,0,0]=2 6224 B9R2.3 C1OCc2cocc21 Amb24531367 [0,1,0,1,0,0|2,0,0]=4 6225 B9R2.3 C1SCc2cc[s]c21 Amb24714226 [0,1,0,1,0,0|0,2,0]=4 6226 B9R2.3 c1[n]c2ccoc2[s]1 Amb24081815 [0,1,0,1,0,0|1,0,1]=4 6227 B9R2.3 c1[n]c2occc2[s]1 Amb23412528 [0,1,0,1,0,0|0,1,1]=4 6228 B9R2.3 c1[n]oc2cocc21 Amb25063868 [0,1,0,1,0,0|1,0,1]=4 6229 B9R2.3 c1cc2occc2[nH]1 Amb24066086 [0,1,0,1,0,0|1,0,1]=4 6230 B9R2.3 c1o[n]c2cc[s]c21 Amb24392852 [0,1,0,1,0,0|0,1,1]=4 6231 B9R2.3 c1o[n]c2ccoc21 Amb24081805 [0,1,0,1,0,0|0,0,1]=3 6232 B5R1.2 O=C1CC=C1 Amb24477666 [1,0,0,0,1,0|0,0,2]=4 6233 B5R1.2 OC1C=CO1 Amb25810658 [1,0,0,0,1,0|0,0,1]=3 6234 B5R1.3 BrCC=1CC1 Amb24477919 [0,0,0,0,2,0|1,0,1]=4 6235 B5R1.3 OCC1C=C1 Amb25025229 [0,0,0,0,2,0|0,0,1]=3 6236 B9R1.89 OCC1C=CC=CC=C1 Amb24716635 [0,0,0,0,0,2|1,0,1]=4 6237 B9R1.89 OCC1C=CCCCO1 Amb25262906 [0,0,0,0,0,2|0,0,2]=4 6238 B9R1.89 OCC1CC=CCC=C1 Amb25780957 [0,0,0,0,0,2|1,0,1]=4 6239 B9R1.89 OCC1CCOCC=C1 Amb25296401 [0,0,0,0,0,2|0,0,2]=4 6240 B9R1.89 OC[C@@H]1C=CCCCO1 Amb25306512 [0,0,0,0,0,2|0,0,2]=4 6241 B9R1.89 OC[C@@H]1CC=CCCO1 Amb25741386 [0,0,0,0,0,2|0,0,2]=4