0 B7R1.3 Brc1ccccc1 Amb2795756 [0,0,0,0,0,0|1,0,0]=1 1 B7R1.3 Brc1ccccn1 Amb535814 [0,0,0,0,0,0|2,0,0]=2 2 B7R1.3 Brc1cccnc1 Amb535815 [0,0,0,0,0,0|2,0,0]=2 3 B7R1.3 Brc1cccnn1 Amb10599679 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.3 Brc1cccnn1 Amb30588506 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.3 Brc1ccncc1 Amb21864762 [0,0,0,0,0,0|2,0,0]=2 6 B7R1.3 Brc1ccncc1 Amb2455980 [0,0,0,0,0,0|2,0,0]=2 7 B7R1.3 Brc1ccncc1 Amb33513273 [0,0,0,0,0,0|2,0,0]=2 8 B7R1.3 Brc1ccncc1 Amb534987 [0,0,0,0,0,0|2,0,0]=2 9 B7R1.3 Brc1ccncn1 Amb10599355 [0,0,0,0,0,0|3,0,0]=3 10 B7R1.3 Brc1ccncn1 Amb19887431 [0,0,0,0,0,0|3,0,0]=3 11 B7R1.3 Brc1ccncn1 Amb20670685 [0,0,0,0,0,0|3,0,0]=3 12 B7R1.3 Brc1ccnnc1 Amb10976038 [0,0,0,0,0,0|3,0,0]=3 13 B7R1.3 Brc1ccnnc1 Amb19929892 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.3 Brc1ccnnc1 Amb20670983 [0,0,0,0,0,0|3,0,0]=3 15 B7R1.3 Brc1ccnnc1 Amb21963548 [0,0,0,0,0,0|3,0,0]=3 16 B7R1.3 Brc1cnccn1 Amb32661567 [0,0,0,0,0,0|3,0,0]=3 17 B7R1.3 Brc1cnccn1 Amb33528247 [0,0,0,0,0,0|3,0,0]=3 18 B7R1.3 Brc1cncnc1 Amb2455810 [0,0,0,0,0,0|3,0,0]=3 19 B7R1.3 Brc1cncnn1 Amb25146644 [0,0,0,0,0,0|4,0,0]=4 20 B7R1.3 Brc1cnnnc1 Amb22498013 [0,0,0,0,0,0|4,0,0]=4 21 B7R1.3 Brc1ncccn1 Amb2455857 [0,0,0,0,0,0|3,0,0]=3 22 B7R1.3 CC1C=CC=CN1 Amb27843995 [0,0,0,0,0,0|2,0,1]=3 23 B7R1.3 C[n+]1ccccc1 Amb1394991 [0,0,0,0,0,0|2,0,0]=2 24 B7R1.3 C[n+]1ccccc1 Amb431211 [0,0,0,0,0,0|2,0,0]=2 25 B7R1.3 Cc1cc[o+]cc1 Amb27592946 [0,0,0,0,0,0|2,0,0]=2 26 B7R1.3 Cc1ccccn1 Amb2447016 [0,0,0,0,0,0|2,0,0]=2 27 B7R1.3 Cc1ccccn1 Amb33872315 [0,0,0,0,0,0|2,0,0]=2 28 B7R1.3 Cc1cccnc1 Amb2447038 [0,0,0,0,0,0|2,0,0]=2 29 B7R1.3 Cc1cccnn1 Amb2455766 [0,0,0,0,0,0|3,0,0]=3 30 B7R1.3 Cc1ccncc1 Amb2610072 [0,0,0,0,0,0|2,0,0]=2 31 B7R1.3 Cc1ccncn1 Amb2447543 [0,0,0,0,0,0|3,0,0]=3 32 B7R1.3 Cc1ccnnc1 Amb2724641 [0,0,0,0,0,0|3,0,0]=3 33 B7R1.3 Cc1cnccn1 Amb2689666 [0,0,0,0,0,0|3,0,0]=3 34 B7R1.3 Cc1cncnc1 Amb2455760 [0,0,0,0,0,0|3,0,0]=3 35 B7R1.3 Cc1ncccn1 Amb2447047 [0,0,0,0,0,0|3,0,0]=3 36 B7R1.3 Clc1ccccc1 Amb2793069 [0,0,0,0,0,0|1,0,0]=1 37 B7R1.3 Clc1ccccn1 Amb3939993 [0,0,0,0,0,0|2,0,0]=2 38 B7R1.3 Clc1cccnc1 Amb8387117 [0,0,0,0,0,0|2,0,0]=2 39 B7R1.3 Clc1cccnn1 Amb19894724 [0,0,0,0,0,0|3,0,0]=3 40 B7R1.3 Clc1cccnn1 Amb3319392 [0,0,0,0,0,0|3,0,0]=3 41 B7R1.3 Clc1ccncc1 Amb22489495 [0,0,0,0,0,0|2,0,0]=2 42 B7R1.3 Clc1ccncc1 Amb4476999 [0,0,0,0,0,0|2,0,0]=2 43 B7R1.3 Clc1ccncc1 Amb6306685 [0,0,0,0,0,0|2,0,0]=2 44 B7R1.3 Clc1ccncn1 Amb19944555 [0,0,0,0,0,0|3,0,0]=3 45 B7R1.3 Clc1ccncn1 Amb22494628 [0,0,0,0,0,0|3,0,0]=3 46 B7R1.3 Clc1ccncn1 Amb5846632 [0,0,0,0,0,0|3,0,0]=3 47 B7R1.3 Clc1ccnnc1 Amb22235621 [0,0,0,0,0,0|3,0,0]=3 48 B7R1.3 Clc1cnccn1 Amb2686448 [0,0,0,0,0,0|3,0,0]=3 49 B7R1.3 Clc1cncnc1 Amb6307278 [0,0,0,0,0,0|3,0,0]=3 50 B7R1.3 Clc1cnncn1 Amb27850848 [0,0,0,0,0,0|4,0,0]=4 51 B7R1.3 Clc1ncccn1 Amb534989 [0,0,0,0,0,0|3,0,0]=3 52 B7R1.3 F[n+]1ccccc1 Amb8515415 [0,0,0,0,0,0|2,0,0]=2 53 B7R1.3 Fc1ccccc1 Amb2688018 [0,0,0,0,0,0|1,0,0]=1 54 B7R1.3 Fc1ccccn1 Amb1159303 [0,0,0,0,0,0|2,0,0]=2 55 B7R1.3 Fc1cccnc1 Amb2688409 [0,0,0,0,0,0|2,0,0]=2 56 B7R1.3 Fc1cccnn1 Amb26052528 [0,0,0,0,0,0|3,0,0]=3 57 B7R1.3 Fc1ccncc1 Amb8393040 [0,0,0,0,0,0|2,0,0]=2 58 B7R1.3 Fc1ccncc1 Amb8396932 [0,0,0,0,0,0|2,0,0]=2 59 B7R1.3 Fc1ccncn1 Amb20242179 [0,0,0,0,0,0|3,0,0]=3 60 B7R1.3 Fc1cnccn1 Amb16185867 [0,0,0,0,0,0|3,0,0]=3 61 B7R1.3 Fc1cncnc1 Amb8390615 [0,0,0,0,0,0|3,0,0]=3 62 B7R1.3 Fc1ncccn1 Amb10839452 [0,0,0,0,0,0|3,0,0]=3 63 B7R1.3 Ic1ccccc1 Amb22491511 [0,0,0,0,0,0|1,0,0]=1 64 B7R1.3 Ic1ccccc1 Amb2688833 [0,0,0,0,0,0|1,0,0]=1 65 B7R1.3 Ic1ccccn1 Amb4605859 [0,0,0,0,0,0|2,0,0]=2 66 B7R1.3 Ic1cccnc1 Amb2610015 [0,0,0,0,0,0|2,0,0]=2 67 B7R1.3 Ic1cccnn1 Amb22749745 [0,0,0,0,0,0|3,0,0]=3 68 B7R1.3 Ic1ccncc1 Amb534992 [0,0,0,0,0,0|2,0,0]=2 69 B7R1.3 Ic1ccncn1 Amb20671489 [0,0,0,0,0,0|3,0,0]=3 70 B7R1.3 Ic1ccnnc1 Amb26360619 [0,0,0,0,0,0|3,0,0]=3 71 B7R1.3 Ic1cnccn1 Amb2447110 [0,0,0,0,0,0|3,0,0]=3 72 B7R1.3 Ic1cncnc1 Amb2609465 [0,0,0,0,0,0|3,0,0]=3 73 B7R1.3 Ic1ncccn1 Amb15691086 [0,0,0,0,0,0|3,0,0]=3 74 B7R1.3 N=C1C=CNC=N1 Amb33719075 [0,0,0,0,0,0|3,0,0]=3 75 B7R1.3 NC1=CC=CCN1 Amb27391599 [0,0,0,0,0,0|2,0,1]=3 76 B7R1.3 NC1=CC=CCO1 Amb22167473 [0,0,0,0,0,0|2,0,1]=3 77 B7R1.3 NC1=CNC=CN1 Amb27844568 [0,0,0,0,0,0|3,0,0]=3 78 B7R1.3 NC1=CNCC=C1 Amb25116751 [0,0,0,0,0,0|2,0,1]=3 79 B7R1.3 NC1N=CC=CS1 Amb27850553 [0,0,0,0,0,0|3,0,1]=4 80 B7R1.3 N[n+]1ccccc1 Amb1147477 [0,0,0,0,0,0|2,0,0]=2 81 B7R1.3 N[n+]1ccncc1 Amb25258571 [0,0,0,0,0,0|3,0,0]=3 82 B7R1.3 Nc1ccccc1 Amb1935238 [0,0,0,0,0,0|1,0,0]=1 83 B7R1.3 Nc1ccccc1 Amb33716473 [0,0,0,0,0,0|1,0,0]=1 84 B7R1.3 Nc1ccccc1 Amb6383295 [0,0,0,0,0,0|1,0,0]=1 85 B7R1.3 Nc1ccccc1 Amb6609036 [0,0,0,0,0,0|1,0,0]=1 86 B7R1.3 Nc1ccccc1 Amb8513537 [0,0,0,0,0,0|1,0,0]=1 87 B7R1.3 Nc1ccccc1 Amb8516488 [0,0,0,0,0,0|1,0,0]=1 88 B7R1.3 Nc1ccccn1 Amb22284355 [0,0,0,0,0,0|2,0,0]=2 89 B7R1.3 Nc1ccccn1 Amb6335265 [0,0,0,0,0,0|2,0,0]=2 90 B7R1.3 Nc1cccnc1 Amb2609930 [0,0,0,0,0,0|2,0,0]=2 91 B7R1.3 Nc1cccnn1 Amb22489517 [0,0,0,0,0,0|3,0,0]=3 92 B7R1.3 Nc1cccnn1 Amb5751229 [0,0,0,0,0,0|3,0,0]=3 93 B7R1.3 Nc1ccncc1 Amb1933715 [0,0,0,0,0,0|2,0,0]=2 94 B7R1.3 Nc1ccncc1 Amb24066203 [0,0,0,0,0,0|2,0,0]=2 95 B7R1.3 Nc1ccncn1 Amb10070370 [0,0,0,0,0,0|3,0,0]=3 96 B7R1.3 Nc1ccncn1 Amb2684180 [0,0,0,0,0,0|3,0,0]=3 97 B7R1.3 Nc1ccnnc1 Amb23439148 [0,0,0,0,0,0|3,0,0]=3 98 B7R1.3 Nc1ccnnc1 Amb33544447 [0,0,0,0,0,0|3,0,0]=3 99 B7R1.3 Nc1cnccn1 Amb1207361 [0,0,0,0,0,0|3,0,0]=3 100 B7R1.3 Nc1cncnc1 Amb5751337 [0,0,0,0,0,0|3,0,0]=3 101 B7R1.3 Nc1cncnn1 Amb18200315 [0,0,0,0,0,0|4,0,0]=4 102 B7R1.3 Nc1cnncn1 Amb20669555 [0,0,0,0,0,0|4,0,0]=4 103 B7R1.3 Nc1ncccn1 Amb1950559 [0,0,0,0,0,0|3,0,0]=3 104 B7R1.3 Nc1nccnn1 Amb579151 [0,0,0,0,0,0|4,0,0]=4 105 B7R1.3 Nc1ncncn1 Amb2720384 [0,0,0,0,0,0|4,0,0]=4 106 B7R1.3 O=C1C=CC=CN1 Amb18039970 [0,0,0,0,0,0|1,0,1]=2 107 B7R1.3 O=C1C=CC=CO1 Amb21951679 [0,0,0,0,0,0|1,0,1]=2 108 B7R1.3 O=C1C=CC=NN1 Amb19372847 [0,0,0,0,0,0|2,0,1]=3 109 B7R1.3 O=C1C=CCC=N1 Amb24076140 [0,0,0,0,0,0|1,0,2]=3 110 B7R1.3 O=C1C=CCCC1 Amb17843126 [0,0,0,0,0,0|0,0,4]=4 111 B7R1.3 O=C1C=CCCN1 Amb22001783 [0,0,0,0,0,0|1,0,3]=4 112 B7R1.3 O=C1C=CCCO1 Amb15693457 [0,0,0,0,0,0|1,0,3]=4 113 B7R1.3 O=C1C=CCOC1 Amb22234519 [0,0,0,0,0,0|1,0,3]=4 114 B7R1.3 O=C1C=CCSC1 Amb26544956 [0,0,0,0,0,0|1,0,3]=4 115 B7R1.3 O=C1C=CN=CN1 Amb19748726 [0,0,0,0,0,0|2,0,1]=3 116 B7R1.3 O=C1C=CNC=C1 Amb18039969 [0,0,0,0,0,0|1,0,1]=2 117 B7R1.3 O=C1C=CNC=N1 Amb20239372 [0,0,0,0,0,0|2,0,1]=3 118 B7R1.3 O=C1C=CNCC1 Amb2700614 [0,0,0,0,0,0|1,0,3]=4 119 B7R1.3 O=C1C=CNN=C1 Amb22235288 [0,0,0,0,0,0|2,0,1]=3 120 B7R1.3 O=C1C=COCC1 Amb22000873 [0,0,0,0,0,0|1,0,3]=4 121 B7R1.3 O=C1C=CSC=C1 Amb22364507 [0,0,0,0,0,0|1,0,1]=2 122 B7R1.3 O=C1C=CSCC1 Amb25375022 [0,0,0,0,0,0|1,0,3]=4 123 B7R1.3 O=C1C=NC=CN1 Amb22406482 [0,0,0,0,0,0|2,0,1]=3 124 B7R1.3 O=C1C=NC=NC1 Amb24093715 [0,0,0,0,0,0|2,0,2]=4 125 B7R1.3 O=C1CC=NC=N1 Amb10601894 [0,0,0,0,0,0|2,0,2]=4 126 B7R1.3 O=C1CCC=CN1 Amb26365285 [0,0,0,0,0,0|1,0,3]=4 127 B7R1.3 O=C1CSC=CN1 Amb2386683 [0,0,0,0,0,0|2,0,2]=4 128 B7R1.3 O=C1N=CC=CN1 Amb19261228 [0,0,0,0,0,0|2,0,1]=3 129 B7R1.3 O=C1N=CC=CN1 Amb20241236 [0,0,0,0,0,0|2,0,1]=3 130 B7R1.3 O=C1N=CC=CN1 Amb22489504 [0,0,0,0,0,0|2,0,1]=3 131 B7R1.3 O=c1ccocc1 Amb22233061 [0,0,0,0,0,0|1,0,1]=2 132 B7R1.3 O=n1ccccc1 Amb20622007 [0,0,0,0,0,0|1,0,1]=2 133 B7R1.3 OC1=CN=NCC1 Amb22756935 [0,0,0,0,0,0|2,0,2]=4 134 B7R1.3 OC1C=CCCC1 Amb4605824 [0,0,0,0,0,0|0,0,4]=4 135 B7R1.3 OC1C=CCNC1 Amb24426687 [0,0,0,0,0,0|1,0,3]=4 136 B7R1.3 OC1C=CCNC1 Amb31291592 [0,0,0,0,0,0|1,0,3]=4 137 B7R1.3 OC1C=CCOC1 Amb25662556 [0,0,0,0,0,0|1,0,3]=4 138 B7R1.3 OC1C=CCSC1 Amb25832664 [0,0,0,0,0,0|1,0,3]=4 139 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [0,0,0,0,0,0|0,0,4]=4 140 B7R1.3 O[C@H]1C=CCOC1 Amb8393976 [0,0,0,0,0,0|1,0,3]=4 141 B7R1.3 Oc1ccccc1 Amb2793000 [0,0,0,0,0,0|0,0,0]=0 142 B7R1.3 Oc1ccccc1 Amb34916329 [0,0,0,0,0,0|0,0,0]=0 143 B7R1.3 Oc1ccccn1 Amb2609925 [0,0,0,0,0,0|1,0,0]=1 144 B7R1.3 Oc1ccccn1 Amb33716976 [0,0,0,0,0,0|1,0,0]=1 145 B7R1.3 Oc1cccnc1 Amb534212 [0,0,0,0,0,0|1,0,0]=1 146 B7R1.3 Oc1cccnn1 Amb2610009 [0,0,0,0,0,0|2,0,0]=2 147 B7R1.3 Oc1ccncc1 Amb2610065 [0,0,0,0,0,0|1,0,0]=1 148 B7R1.3 Oc1ccncn1 Amb2591540 [0,0,0,0,0,0|2,0,0]=2 149 B7R1.3 Oc1ccnnc1 Amb10602745 [0,0,0,0,0,0|2,0,0]=2 150 B7R1.3 Oc1ccnnc1 Amb22640973 [0,0,0,0,0,0|2,0,0]=2 151 B7R1.3 Oc1ccnnc1 Amb24053159 [0,0,0,0,0,0|2,0,0]=2 152 B7R1.3 Oc1cnccn1 Amb8438914 [0,0,0,0,0,0|2,0,0]=2 153 B7R1.3 Oc1cncnc1 Amb22500888 [0,0,0,0,0,0|2,0,0]=2 154 B7R1.3 Oc1cncnc1 Amb8397263 [0,0,0,0,0,0|2,0,0]=2 155 B7R1.3 Oc1cnncn1 Amb23440657 [0,0,0,0,0,0|3,0,0]=3 156 B7R1.3 Oc1ncccn1 Amb1106427 [0,0,0,0,0,0|2,0,0]=2 157 B7R1.3 Oc1ncccn1 Amb6297230 [0,0,0,0,0,0|2,0,0]=2 158 B7R1.3 Oc1ncccn1 Amb8396065 [0,0,0,0,0,0|2,0,0]=2 159 B7R1.3 Oc1nccnn1 Amb26633517 [0,0,0,0,0,0|3,0,0]=3 160 B7R1.3 S=C1C=CC=CN1 Amb20246884 [0,0,0,0,0,0|1,1,0]=2 161 B7R1.3 S=C1C=CN=CC1 Amb24062778 [0,0,0,0,0,0|1,1,1]=3 162 B7R1.3 S=C1C=CNC=C1 Amb20093140 [0,0,0,0,0,0|1,1,0]=2 163 B7R1.3 S=C1C=CNC=N1 Amb19414436 [0,0,0,0,0,0|2,1,0]=3 164 B7R1.3 S=C1C=COC=C1 Amb26446862 [0,0,0,0,0,0|1,1,0]=2 165 B7R1.3 S=C1C=CSC=C1 Amb22347568 [0,0,0,0,0,0|1,1,0]=2 166 B7R1.3 S=C1C=NC=CN1 Amb18545446 [0,0,0,0,0,0|2,1,0]=3 167 B7R1.3 S=C1N=CC=CN1 Amb18545462 [0,0,0,0,0,0|2,1,0]=3 168 B7R1.3 Sc1ccccc1 Amb2793090 [0,0,0,0,0,0|0,1,0]=1 169 B7R1.3 Sc1ccccn1 Amb2689072 [0,0,0,0,0,0|1,1,0]=2 170 B7R1.3 Sc1cccnc1 Amb13887011 [0,0,0,0,0,0|1,1,0]=2 171 B7R1.3 Sc1cccnn1 Amb5751230 [0,0,0,0,0,0|2,1,0]=3 172 B7R1.3 Sc1ccncc1 Amb6271419 [0,0,0,0,0,0|1,1,0]=2 173 B7R1.3 Sc1ccncn1 Amb5716288 [0,0,0,0,0,0|2,1,0]=3 174 B7R1.3 Sc1ccnnc1 Amb23440857 [0,0,0,0,0,0|2,1,0]=3 175 B7R1.3 Sc1cnccn1 Amb6662686 [0,0,0,0,0,0|2,1,0]=3 176 B7R1.3 Sc1cncnc1 Amb24054542 [0,0,0,0,0,0|2,1,0]=3 177 B7R1.3 Sc1ncccn1 Amb1651281 [0,0,0,0,0,0|2,1,0]=3 178 B7R1.3 Sc1nccnn1 Amb32416081 [0,0,0,0,0,0|3,1,0]=4 179 B7R1.3 [BH3-][n+]1ccccc1 Amb19889385 [0,0,0,0,0,0|2,0,0]=2 180 B7R1.3 [Hg+]c1ccccc1 Amb22054115 [0,0,0,0,0,0|1,0,0]=1 181 B7R1.3 [Li]c1ccccc1 Amb8516466 [0,0,0,0,0,0|1,0,0]=1 182 B7R1.3 [Mg+]c1ccccc1 Amb22045898 [0,0,0,0,0,0|1,0,0]=1 183 B7R1.3 [O-][n+]1ccccc1 Amb2609924 [0,0,0,0,0,0|1,0,1]=2 184 B7R1.3 [O-][n+]1ccccn1 Amb10573263 [0,0,0,0,0,0|2,0,1]=3 185 B7R1.3 [O-][n+]1ccncc1 Amb10552402 [0,0,0,0,0,0|2,0,1]=3 186 B7R1.3 [O-]c1ccc[nH+]c1 Amb22492605 [0,0,0,0,0,0|1,0,1]=2 187 B7R1.3 [O-]c1ccccc1 Amb20240913 [0,0,0,0,0,0|0,0,1]=1 188 B7R1.3 [O-]c1ccccc1 Amb31292462 [0,0,0,0,0,0|0,0,1]=1 189 B7R1.3 [O-]c1cccnc1 Amb8513337 [0,0,0,0,0,0|1,0,1]=2 190 B7R1.3 [S-][n+]1ccccc1 Amb26535921 [0,0,0,0,0,0|1,1,0]=2 191 B7R1.3 [S-]c1ccccc1 Amb22360782 [0,0,0,0,0,0|0,1,0]=1 192 B7R1.3 [SH2+]c1ccccc1 Amb24524316 [0,0,0,0,0,0|0,1,0]=1 193 B7R1.3 [SeH]c1ccccc1 Amb8513211 [0,0,0,0,0,0|0,1,0]=1 194 B7R1.3 [SiH3]c1ccccc1 Amb2690322 [0,0,0,0,0,0|1,0,0]=1 195 B6R1.1 C1=CCC=CC1 Amb8513501 [1,0,0,0,0,0|0,0,2]=3 196 B6R1.1 C1=CCCC=C1 Amb6297761 [1,0,0,0,0,0|0,0,2]=3 197 B6R1.1 C1=CNCN=C1 Amb27644334 [1,0,0,0,0,0|2,0,1]=4 198 B6R1.1 C1=CSC=NO1 Amb25146359 [1,0,0,0,0,0|3,0,0]=4 199 B6R1.1 [c-]1ccccc1 Amb27780724 [1,0,0,0,0,0|0,0,1]=2 200 B6R1.1 c1cc[nH+]cc1 Amb10838355 [1,0,0,0,0,0|1,0,0]=2 201 B6R1.1 c1cc[nH+]cc1 Amb19748292 [1,0,0,0,0,0|1,0,0]=2 202 B6R1.1 c1cc[nH+]cc1 Amb22731658 [1,0,0,0,0,0|1,0,0]=2 203 B6R1.1 c1cc[nH+]cc1 Amb22731943 [1,0,0,0,0,0|1,0,0]=2 204 B6R1.1 c1cc[nH+]cc1 Amb2725623 [1,0,0,0,0,0|1,0,0]=2 205 B6R1.1 c1cc[nH+]cc1 Amb8513536 [1,0,0,0,0,0|1,0,0]=2 206 B6R1.1 c1cc[nH+]cc1 Amb8513800 [1,0,0,0,0,0|1,0,0]=2 207 B6R1.1 c1ccccc1 Amb22054011 [1,0,0,0,0,0|0,0,0]=1 208 B6R1.1 c1ccncc1 Amb22361291 [1,0,0,0,0,0|1,0,0]=2 209 B6R1.1 c1ccncc1 Amb22735749 [1,0,0,0,0,0|1,0,0]=2 210 B6R1.1 c1ccncc1 Amb2610064 [1,0,0,0,0,0|1,0,0]=2 211 B6R1.1 c1ccncc1 Amb33719203 [1,0,0,0,0,0|1,0,0]=2 212 B6R1.1 c1ccncc1 Amb34910815 [1,0,0,0,0,0|1,0,0]=2 213 B6R1.1 c1ccncc1 Amb6366076 [1,0,0,0,0,0|1,0,0]=2 214 B6R1.1 c1ccncc1 Amb8387118 [1,0,0,0,0,0|1,0,0]=2 215 B6R1.1 c1ccncc1 Amb8513315 [1,0,0,0,0,0|1,0,0]=2 216 B6R1.1 c1ccncc1 Amb8513785 [1,0,0,0,0,0|1,0,0]=2 217 B6R1.1 c1ccncc1 Amb8513826 [1,0,0,0,0,0|1,0,0]=2 218 B6R1.1 c1ccncc1 Amb8514615 [1,0,0,0,0,0|1,0,0]=2 219 B6R1.1 c1ccnnc1 Amb22234668 [1,0,0,0,0,0|2,0,0]=3 220 B6R1.1 c1ccnnc1 Amb5720312 [1,0,0,0,0,0|2,0,0]=3 221 B6R1.1 c1cnccn1 Amb2690420 [1,0,0,0,0,0|2,0,0]=3 222 B6R1.1 c1cncnc1 Amb2786776 [1,0,0,0,0,0|2,0,0]=3 223 B6R1.1 c1cnncn1 Amb8470966 [1,0,0,0,0,0|3,0,0]=4 224 B6R1.1 c1cnnnc1 Amb22497604 [1,0,0,0,0,0|3,0,0]=4 225 B6R1.1 c1ncncn1 Amb9825129 [1,0,0,0,0,0|3,0,0]=4 226 B8R1.2 BrCC1=CC=CC#C1 Amb27477926 [0,1,0,0,0,0|1,0,2]=4 227 B8R1.2 BrCc1ccccc1 Amb3939707 [0,1,0,0,0,0|1,0,0]=2 228 B8R1.2 BrCc1ccccn1 Amb3939990 [0,1,0,0,0,0|2,0,0]=3 229 B8R1.2 BrCc1ccccn1 Amb8393294 [0,1,0,0,0,0|2,0,0]=3 230 B8R1.2 BrCc1cccnc1 Amb3939989 [0,1,0,0,0,0|2,0,0]=3 231 B8R1.2 BrCc1cccnc1 Amb9826052 [0,1,0,0,0,0|2,0,0]=3 232 B8R1.2 BrCc1cccnn1 Amb10070423 [0,1,0,0,0,0|3,0,0]=4 233 B8R1.2 BrCc1cccnn1 Amb22234747 [0,1,0,0,0,0|3,0,0]=4 234 B8R1.2 BrCc1ccncc1 Amb3939991 [0,1,0,0,0,0|2,0,0]=3 235 B8R1.2 BrCc1ccncc1 Amb9826062 [0,1,0,0,0,0|2,0,0]=3 236 B8R1.2 BrCc1ccncn1 Amb22235520 [0,1,0,0,0,0|3,0,0]=4 237 B8R1.2 BrCc1ccnnc1 Amb25966814 [0,1,0,0,0,0|3,0,0]=4 238 B8R1.2 BrCc1cnccn1 Amb16185761 [0,1,0,0,0,0|3,0,0]=4 239 B8R1.2 BrCc1cnccn1 Amb22498353 [0,1,0,0,0,0|3,0,0]=4 240 B8R1.2 BrCc1cncnc1 Amb22001742 [0,1,0,0,0,0|3,0,0]=4 241 B8R1.2 BrCc1cncnc1 Amb22751382 [0,1,0,0,0,0|3,0,0]=4 242 B8R1.2 BrCc1ncccn1 Amb26456265 [0,1,0,0,0,0|3,0,0]=4 243 B8R1.2 Br[Mg]c1ccccn1 Amb22000542 [0,1,0,0,0,0|2,0,0]=3 244 B8R1.2 Br[Mg]c1cccnc1 Amb28989773 [0,1,0,0,0,0|2,0,0]=3 245 B8R1.2 Br[Se]c1ccccc1 Amb8514629 [0,1,0,0,0,0|0,1,0]=2 246 B8R1.2 C#Cc1ccccc1 Amb2793084 [0,1,0,0,0,0|1,0,0]=2 247 B8R1.2 C#Cc1ccccn1 Amb2720532 [0,1,0,0,0,0|2,0,0]=3 248 B8R1.2 C#Cc1ccccn1 Amb32664778 [0,1,0,0,0,0|2,0,0]=3 249 B8R1.2 C#Cc1cccnc1 Amb10067163 [0,1,0,0,0,0|2,0,0]=3 250 B8R1.2 C#Cc1cccnn1 Amb23439062 [0,1,0,0,0,0|3,0,0]=4 251 B8R1.2 C#Cc1ccncc1 Amb13891877 [0,1,0,0,0,0|2,0,0]=3 252 B8R1.2 C#Cc1ccncc1 Amb33541704 [0,1,0,0,0,0|2,0,0]=3 253 B8R1.2 C#Cc1ccncn1 Amb33547137 [0,1,0,0,0,0|3,0,0]=4 254 B8R1.2 C#Cc1ccnnc1 Amb27207293 [0,1,0,0,0,0|3,0,0]=4 255 B8R1.2 C#Cc1cnccn1 Amb19895048 [0,1,0,0,0,0|3,0,0]=4 256 B8R1.2 C#Cc1cncnc1 Amb2423750 [0,1,0,0,0,0|3,0,0]=4 257 B8R1.2 C#Cc1ncccn1 Amb19957825 [0,1,0,0,0,0|3,0,0]=4 258 B8R1.2 C=Cc1ccccc1 Amb6608811 [0,1,0,0,0,0|1,0,0]=2 259 B8R1.2 C=Cc1ccccn1 Amb6600549 [0,1,0,0,0,0|2,0,0]=3 260 B8R1.2 C=Cc1cccnc1 Amb33544464 [0,1,0,0,0,0|2,0,0]=3 261 B8R1.2 C=Cc1cccnn1 Amb25026421 [0,1,0,0,0,0|3,0,0]=4 262 B8R1.2 C=Cc1ccncc1 Amb3940417 [0,1,0,0,0,0|2,0,0]=3 263 B8R1.2 C=Cc1ccncn1 Amb24056360 [0,1,0,0,0,0|3,0,0]=4 264 B8R1.2 C=Cc1cnccn1 Amb2695475 [0,1,0,0,0,0|3,0,0]=4 265 B8R1.2 C=Cc1cncnc1 Amb24056355 [0,1,0,0,0,0|3,0,0]=4 266 B8R1.2 C=Cc1ncccn1 Amb23411991 [0,1,0,0,0,0|3,0,0]=4 267 B8R1.2 C=Nc1ccccc1 Amb24605672 [0,1,0,0,0,0|1,0,0]=2 268 B8R1.2 C=Nc1ccccn1 Amb26956421 [0,1,0,0,0,0|2,0,0]=3 269 B8R1.2 CCC1=CC=CNC1 Amb27643536 [0,1,0,0,0,0|2,0,1]=4 270 B8R1.2 CC[n+]1ccccc1 Amb8516219 [0,1,0,0,0,0|2,0,0]=3 271 B8R1.2 CC[n+]1ccccc1 Amb8516636 [0,1,0,0,0,0|2,0,0]=3 272 B8R1.2 CCc1ccccc1 Amb2447474 [0,1,0,0,0,0|1,0,0]=2 273 B8R1.2 CCc1ccccn1 Amb6608978 [0,1,0,0,0,0|2,0,0]=3 274 B8R1.2 CCc1cccnc1 Amb4037096 [0,1,0,0,0,0|2,0,0]=3 275 B8R1.2 CCc1cccnn1 Amb28290156 [0,1,0,0,0,0|3,0,0]=4 276 B8R1.2 CCc1ccncc1 Amb8513449 [0,1,0,0,0,0|2,0,0]=3 277 B8R1.2 CCc1ccncn1 Amb20242304 [0,1,0,0,0,0|3,0,0]=4 278 B8R1.2 CCc1cnccn1 Amb6374282 [0,1,0,0,0,0|3,0,0]=4 279 B8R1.2 CCc1cncnc1 Amb24097063 [0,1,0,0,0,0|3,0,0]=4 280 B8R1.2 CCc1ncccn1 Amb33544267 [0,1,0,0,0,0|3,0,0]=4 281 B8R1.2 CNC1=CC[N-]C=C1 Amb26860853 [0,1,0,0,0,0|2,0,1]=4 282 B8R1.2 CNc1ccccc1 Amb2721038 [0,1,0,0,0,0|1,0,0]=2 283 B8R1.2 CNc1ccccc1 Amb4037054 [0,1,0,0,0,0|1,0,0]=2 284 B8R1.2 CNc1ccccn1 Amb3429849 [0,1,0,0,0,0|2,0,0]=3 285 B8R1.2 CNc1cccnc1 Amb8396762 [0,1,0,0,0,0|2,0,0]=3 286 B8R1.2 CNc1cccnn1 Amb18947507 [0,1,0,0,0,0|3,0,0]=4 287 B8R1.2 CNc1ccncc1 Amb2610661 [0,1,0,0,0,0|2,0,0]=3 288 B8R1.2 CNc1ccncn1 Amb18944730 [0,1,0,0,0,0|3,0,0]=4 289 B8R1.2 CNc1ccnnc1 Amb23560757 [0,1,0,0,0,0|3,0,0]=4 290 B8R1.2 CNc1cnccn1 Amb1102655 [0,1,0,0,0,0|3,0,0]=4 291 B8R1.2 CNc1cncnc1 Amb18268827 [0,1,0,0,0,0|3,0,0]=4 292 B8R1.2 CNc1ncccn1 Amb2609521 [0,1,0,0,0,0|3,0,0]=4 293 B8R1.2 COC1=CCC=CC1 Amb10842162 [0,1,0,0,0,0|0,0,2]=3 294 B8R1.2 COc1ccccc1 Amb2842269 [0,1,0,0,0,0|0,0,0]=1 295 B8R1.2 COc1ccccn1 Amb4037280 [0,1,0,0,0,0|1,0,0]=2 296 B8R1.2 COc1cccnc1 Amb8517634 [0,1,0,0,0,0|1,0,0]=2 297 B8R1.2 COc1cccnn1 Amb5751228 [0,1,0,0,0,0|2,0,0]=3 298 B8R1.2 COc1ccncc1 Amb2609546 [0,1,0,0,0,0|1,0,0]=2 299 B8R1.2 COc1ccncc1 Amb28991347 [0,1,0,0,0,0|1,0,0]=2 300 B8R1.2 COc1ccncn1 Amb15692928 [0,1,0,0,0,0|2,0,0]=3 301 B8R1.2 COc1ccnnc1 Amb21857844 [0,1,0,0,0,0|2,0,0]=3 302 B8R1.2 COc1cnccn1 Amb2689275 [0,1,0,0,0,0|2,0,0]=3 303 B8R1.2 COc1cncnc1 Amb8439425 [0,1,0,0,0,0|2,0,0]=3 304 B8R1.2 COc1cncnn1 Amb27664155 [0,1,0,0,0,0|3,0,0]=4 305 B8R1.2 COc1ncccn1 Amb2609513 [0,1,0,0,0,0|2,0,0]=3 306 B8R1.2 CPc1ccccc1 Amb25341327 [0,1,0,0,0,0|1,0,0]=2 307 B8R1.2 CSC1=CC=CNC1 Amb27205077 [0,1,0,0,0,0|1,1,1]=4 308 B8R1.2 CSc1ccccc1 Amb2690593 [0,1,0,0,0,0|0,1,0]=2 309 B8R1.2 CSc1ccccn1 Amb8392843 [0,1,0,0,0,0|1,1,0]=3 310 B8R1.2 CSc1cccnc1 Amb24087396 [0,1,0,0,0,0|1,1,0]=3 311 B8R1.2 CSc1ccncc1 Amb24103013 [0,1,0,0,0,0|1,1,0]=3 312 B8R1.2 CSc1ccncn1 Amb27958790 [0,1,0,0,0,0|2,1,0]=4 313 B8R1.2 CSc1ccnnc1 Amb28368536 [0,1,0,0,0,0|2,1,0]=4 314 B8R1.2 CSc1cnccn1 Amb2689740 [0,1,0,0,0,0|2,1,0]=4 315 B8R1.2 CSc1ncccn1 Amb22295856 [0,1,0,0,0,0|2,1,0]=4 316 B8R1.2 CSc1ncccn1 Amb2455862 [0,1,0,0,0,0|2,1,0]=4 317 B8R1.2 ClCc1cc[nH+]cc1 Amb4258486 [0,1,0,0,0,0|2,0,0]=3 318 B8R1.2 ClCc1ccccc1 Amb2792911 [0,1,0,0,0,0|1,0,0]=2 319 B8R1.2 ClCc1ccccn1 Amb22489454 [0,1,0,0,0,0|2,0,0]=3 320 B8R1.2 ClCc1ccccn1 Amb534985 [0,1,0,0,0,0|2,0,0]=3 321 B8R1.2 ClCc1ccccn1 Amb6296082 [0,1,0,0,0,0|2,0,0]=3 322 B8R1.2 ClCc1cccnc1 Amb2725600 [0,1,0,0,0,0|2,0,0]=3 323 B8R1.2 ClCc1cccnc1 Amb534994 [0,1,0,0,0,0|2,0,0]=3 324 B8R1.2 ClCc1cccnn1 Amb21960122 [0,1,0,0,0,0|3,0,0]=4 325 B8R1.2 ClCc1cccnn1 Amb22000870 [0,1,0,0,0,0|3,0,0]=4 326 B8R1.2 ClCc1ccncc1 Amb2715054 [0,1,0,0,0,0|2,0,0]=3 327 B8R1.2 ClCc1ccncn1 Amb21864735 [0,1,0,0,0,0|3,0,0]=4 328 B8R1.2 ClCc1ccncn1 Amb22491514 [0,1,0,0,0,0|3,0,0]=4 329 B8R1.2 ClCc1ccnnc1 Amb27599955 [0,1,0,0,0,0|3,0,0]=4 330 B8R1.2 ClCc1cnccn1 Amb15741173 [0,1,0,0,0,0|3,0,0]=4 331 B8R1.2 ClCc1cnccn1 Amb8860572 [0,1,0,0,0,0|3,0,0]=4 332 B8R1.2 ClCc1cncnc1 Amb10605864 [0,1,0,0,0,0|3,0,0]=4 333 B8R1.2 ClCc1cncnc1 Amb20671193 [0,1,0,0,0,0|3,0,0]=4 334 B8R1.2 ClCc1ncccn1 Amb5754387 [0,1,0,0,0,0|3,0,0]=4 335 B8R1.2 ClCc1ncccn1 Amb7101515 [0,1,0,0,0,0|3,0,0]=4 336 B8R1.2 Cl[Se]c1ccccc1 Amb8513798 [0,1,0,0,0,0|0,1,0]=2 337 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [0,1,0,0,0,0|1,0,0]=2 338 B8R1.2 FCc1ccccc1 Amb10838335 [0,1,0,0,0,0|1,0,0]=2 339 B8R1.2 FCc1cccnc1 Amb25259171 [0,1,0,0,0,0|2,0,0]=3 340 B8R1.2 FCc1ccncc1 Amb22372287 [0,1,0,0,0,0|2,0,0]=3 341 B8R1.2 ICc1ccccc1 Amb4006861 [0,1,0,0,0,0|1,0,0]=2 342 B8R1.2 ICc1ccccn1 Amb26963503 [0,1,0,0,0,0|2,0,0]=3 343 B8R1.2 ICc1cccnc1 Amb10602162 [0,1,0,0,0,0|2,0,0]=3 344 B8R1.2 ICc1cccnc1 Amb33527054 [0,1,0,0,0,0|2,0,0]=3 345 B8R1.2 ICc1ccncc1 Amb33552994 [0,1,0,0,0,0|2,0,0]=3 346 B8R1.2 ICc1ncccn1 Amb28186407 [0,1,0,0,0,0|3,0,0]=4 347 B8R1.2 I[Se]c1ccccc1 Amb10601593 [0,1,0,0,0,0|0,1,0]=2 348 B8R1.2 N#CC1=CC=CNC1 Amb27166581 [0,1,0,0,0,0|2,0,1]=4 349 B8R1.2 N#Cc1ccccc1 Amb21864642 [0,1,0,0,0,0|1,0,0]=2 350 B8R1.2 N#Cc1ccccc1 Amb2793082 [0,1,0,0,0,0|1,0,0]=2 351 B8R1.2 N#Cc1ccccn1 Amb2721574 [0,1,0,0,0,0|2,0,0]=3 352 B8R1.2 N#Cc1cccnc1 Amb1792577 [0,1,0,0,0,0|2,0,0]=3 353 B8R1.2 N#Cc1cccnn1 Amb13884089 [0,1,0,0,0,0|3,0,0]=4 354 B8R1.2 N#Cc1ccncc1 Amb2609937 [0,1,0,0,0,0|2,0,0]=3 355 B8R1.2 N#Cc1ccncn1 Amb13884090 [0,1,0,0,0,0|3,0,0]=4 356 B8R1.2 N#Cc1ccnnc1 Amb20622003 [0,1,0,0,0,0|3,0,0]=4 357 B8R1.2 N#Cc1cnccn1 Amb2686609 [0,1,0,0,0,0|3,0,0]=4 358 B8R1.2 N#Cc1cncnc1 Amb10066992 [0,1,0,0,0,0|3,0,0]=4 359 B8R1.2 N#Cc1ncccn1 Amb2686610 [0,1,0,0,0,0|3,0,0]=4 360 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [0,1,0,0,0,0|1,0,0]=2 361 B8R1.2 N=Nc1cnccn1 Amb27849107 [0,1,0,0,0,0|3,0,0]=4 362 B8R1.2 NCC1=CCOC=C1 Amb28313810 [0,1,0,0,0,0|2,0,1]=4 363 B8R1.2 NCC1=COC=CO1 Amb28241554 [0,1,0,0,0,0|3,0,0]=4 364 B8R1.2 NCC1C=CC=CN1 Amb28119968 [0,1,0,0,0,0|2,0,1]=4 365 B8R1.2 NCc1ccccc1 Amb19958612 [0,1,0,0,0,0|1,0,0]=2 366 B8R1.2 NCc1ccccc1 Amb2725314 [0,1,0,0,0,0|1,0,0]=2 367 B8R1.2 NCc1ccccc1 Amb2792834 [0,1,0,0,0,0|1,0,0]=2 368 B8R1.2 NCc1ccccc1 Amb6383294 [0,1,0,0,0,0|1,0,0]=2 369 B8R1.2 NCc1ccccn1 Amb20620292 [0,1,0,0,0,0|2,0,0]=3 370 B8R1.2 NCc1ccccn1 Amb2684477 [0,1,0,0,0,0|2,0,0]=3 371 B8R1.2 NCc1cccnc1 Amb1481403 [0,1,0,0,0,0|2,0,0]=3 372 B8R1.2 NCc1cccnc1 Amb2189172 [0,1,0,0,0,0|2,0,0]=3 373 B8R1.2 NCc1cccnc1 Amb6383332 [0,1,0,0,0,0|2,0,0]=3 374 B8R1.2 NCc1cccnn1 Amb24183396 [0,1,0,0,0,0|3,0,0]=4 375 B8R1.2 NCc1cccnn1 Amb8009405 [0,1,0,0,0,0|3,0,0]=4 376 B8R1.2 NCc1ccncc1 Amb1156526 [0,1,0,0,0,0|2,0,0]=3 377 B8R1.2 NCc1ccncc1 Amb20622010 [0,1,0,0,0,0|2,0,0]=3 378 B8R1.2 NCc1ccncn1 Amb3941350 [0,1,0,0,0,0|3,0,0]=4 379 B8R1.2 NCc1ccncn1 Amb7101495 [0,1,0,0,0,0|3,0,0]=4 380 B8R1.2 NCc1ccncn1 Amb8503484 [0,1,0,0,0,0|3,0,0]=4 381 B8R1.2 NCc1ccnnc1 Amb19957512 [0,1,0,0,0,0|3,0,0]=4 382 B8R1.2 NCc1ccnnc1 Amb22405863 [0,1,0,0,0,0|3,0,0]=4 383 B8R1.2 NCc1ccnnc1 Amb8009406 [0,1,0,0,0,0|3,0,0]=4 384 B8R1.2 NCc1cnccn1 Amb10067734 [0,1,0,0,0,0|3,0,0]=4 385 B8R1.2 NCc1cnccn1 Amb10068908 [0,1,0,0,0,0|3,0,0]=4 386 B8R1.2 NCc1cnccn1 Amb33543243 [0,1,0,0,0,0|3,0,0]=4 387 B8R1.2 NCc1cnccn1 Amb8629877 [0,1,0,0,0,0|3,0,0]=4 388 B8R1.2 NCc1cncnc1 Amb22899160 [0,1,0,0,0,0|3,0,0]=4 389 B8R1.2 NCc1cncnc1 Amb33716254 [0,1,0,0,0,0|3,0,0]=4 390 B8R1.2 NCc1cncnc1 Amb5492751 [0,1,0,0,0,0|3,0,0]=4 391 B8R1.2 NCc1ncccn1 Amb10068909 [0,1,0,0,0,0|3,0,0]=4 392 B8R1.2 NCc1ncccn1 Amb1139642 [0,1,0,0,0,0|3,0,0]=4 393 B8R1.2 NCc1ncccn1 Amb33533773 [0,1,0,0,0,0|3,0,0]=4 394 B8R1.2 NCc1ncccn1 Amb33549601 [0,1,0,0,0,0|3,0,0]=4 395 B8R1.2 NNc1ccccc1 Amb22002446 [0,1,0,0,0,0|1,0,0]=2 396 B8R1.2 NNc1ccccc1 Amb2793062 [0,1,0,0,0,0|1,0,0]=2 397 B8R1.2 NNc1ccccc1 Amb8513467 [0,1,0,0,0,0|1,0,0]=2 398 B8R1.2 NNc1ccccn1 Amb1104567 [0,1,0,0,0,0|2,0,0]=3 399 B8R1.2 NNc1ccccn1 Amb6297231 [0,1,0,0,0,0|2,0,0]=3 400 B8R1.2 NNc1cccnc1 Amb10177783 [0,1,0,0,0,0|2,0,0]=3 401 B8R1.2 NNc1cccnc1 Amb16192849 [0,1,0,0,0,0|2,0,0]=3 402 B8R1.2 NNc1cccnc1 Amb2092671 [0,1,0,0,0,0|2,0,0]=3 403 B8R1.2 NNc1cccnn1 Amb16185786 [0,1,0,0,0,0|3,0,0]=4 404 B8R1.2 NNc1cccnn1 Amb16231295 [0,1,0,0,0,0|3,0,0]=4 405 B8R1.2 NNc1ccncc1 Amb32409472 [0,1,0,0,0,0|2,0,0]=3 406 B8R1.2 NNc1ccncc1 Amb5494094 [0,1,0,0,0,0|2,0,0]=3 407 B8R1.2 NNc1ccncc1 Amb6296706 [0,1,0,0,0,0|2,0,0]=3 408 B8R1.2 NNc1ccncc1 Amb6297752 [0,1,0,0,0,0|2,0,0]=3 409 B8R1.2 NNc1ccncn1 Amb22011554 [0,1,0,0,0,0|3,0,0]=4 410 B8R1.2 NNc1ccncn1 Amb22757340 [0,1,0,0,0,0|3,0,0]=4 411 B8R1.2 NNc1ccnnc1 Amb22896609 [0,1,0,0,0,0|3,0,0]=4 412 B8R1.2 NNc1ccnnc1 Amb35750211 [0,1,0,0,0,0|3,0,0]=4 413 B8R1.2 NNc1cnccn1 Amb1111598 [0,1,0,0,0,0|3,0,0]=4 414 B8R1.2 NNc1cncnc1 Amb25843840 [0,1,0,0,0,0|3,0,0]=4 415 B8R1.2 NNc1cncnc1 Amb28995292 [0,1,0,0,0,0|3,0,0]=4 416 B8R1.2 NNc1ncccn1 Amb1114665 [0,1,0,0,0,0|3,0,0]=4 417 B8R1.2 NNc1ncccn1 Amb2182937 [0,1,0,0,0,0|3,0,0]=4 418 B8R1.2 NNc1ncccn1 Amb22587655 [0,1,0,0,0,0|3,0,0]=4 419 B8R1.2 NOc1ccccc1 Amb18123833 [0,1,0,0,0,0|0,0,0]=1 420 B8R1.2 NOc1ccccc1 Amb22231364 [0,1,0,0,0,0|0,0,0]=1 421 B8R1.2 NOc1ccccn1 Amb24101187 [0,1,0,0,0,0|1,0,0]=2 422 B8R1.2 NOc1cccnc1 Amb27603515 [0,1,0,0,0,0|1,0,0]=2 423 B8R1.2 NOc1ccncc1 Amb8386473 [0,1,0,0,0,0|1,0,0]=2 424 B8R1.2 N\N=C1/C=CC=CN1 Amb22732534 [0,1,0,0,0,0|2,0,0]=3 425 B8R1.2 O=Bc1ccccc1 Amb25221658 [0,1,0,0,0,0|0,0,1]=2 426 B8R1.2 O=CC1=CC=CSC1 Amb28194907 [0,1,0,0,0,0|1,0,2]=4 427 B8R1.2 O=CC1=CCC=CO1 Amb27437201 [0,1,0,0,0,0|1,0,2]=4 428 B8R1.2 O=CC1=CNC=CC1 Amb27216667 [0,1,0,0,0,0|1,0,2]=4 429 B8R1.2 O=Cc1ccccc1 Amb2792754 [0,1,0,0,0,0|0,0,1]=2 430 B8R1.2 O=Cc1ccccn1 Amb2720349 [0,1,0,0,0,0|1,0,1]=3 431 B8R1.2 O=Cc1cccnc1 Amb2720350 [0,1,0,0,0,0|1,0,1]=3 432 B8R1.2 O=Cc1cccnn1 Amb8010287 [0,1,0,0,0,0|2,0,1]=4 433 B8R1.2 O=Cc1ccncc1 Amb932832 [0,1,0,0,0,0|1,0,1]=3 434 B8R1.2 O=Cc1ccncn1 Amb8009550 [0,1,0,0,0,0|2,0,1]=4 435 B8R1.2 O=Cc1ccnnc1 Amb8010397 [0,1,0,0,0,0|2,0,1]=4 436 B8R1.2 O=Cc1cnccn1 Amb8009498 [0,1,0,0,0,0|2,0,1]=4 437 B8R1.2 O=Cc1cncnc1 Amb2235993 [0,1,0,0,0,0|2,0,1]=4 438 B8R1.2 O=Cc1ncccn1 Amb8010587 [0,1,0,0,0,0|2,0,1]=4 439 B8R1.2 O=Nc1ccccc1 Amb9785158 [0,1,0,0,0,0|0,0,1]=2 440 B8R1.2 O=Nc1ccccn1 Amb31031129 [0,1,0,0,0,0|1,0,1]=3 441 B8R1.2 O=Nc1cccnn1 Amb27962605 [0,1,0,0,0,0|2,0,1]=4 442 B8R1.2 O=Nc1ccnnc1 Amb28368778 [0,1,0,0,0,0|2,0,1]=4 443 B8R1.2 O=[IH2]c1ccccc1 Amb15692855 [0,1,0,0,0,0|0,0,1]=2 444 B8R1.2 OCc1ccccc1 Amb3939216 [0,1,0,0,0,0|0,0,0]=1 445 B8R1.2 OCc1ccccn1 Amb16231923 [0,1,0,0,0,0|1,0,0]=2 446 B8R1.2 OCc1ccccn1 Amb2610526 [0,1,0,0,0,0|1,0,0]=2 447 B8R1.2 OCc1cccnc1 Amb2720347 [0,1,0,0,0,0|1,0,0]=2 448 B8R1.2 OCc1cccnn1 Amb5282882 [0,1,0,0,0,0|2,0,0]=3 449 B8R1.2 OCc1ccncc1 Amb24183964 [0,1,0,0,0,0|1,0,0]=2 450 B8R1.2 OCc1ccncc1 Amb2720348 [0,1,0,0,0,0|1,0,0]=2 451 B8R1.2 OCc1ccncn1 Amb7101500 [0,1,0,0,0,0|2,0,0]=3 452 B8R1.2 OCc1ccnnc1 Amb21856410 [0,1,0,0,0,0|2,0,0]=3 453 B8R1.2 OCc1cnccn1 Amb2723066 [0,1,0,0,0,0|2,0,0]=3 454 B8R1.2 OCc1cncnc1 Amb8397262 [0,1,0,0,0,0|2,0,0]=3 455 B8R1.2 OCc1cnncn1 Amb28048979 [0,1,0,0,0,0|3,0,0]=4 456 B8R1.2 OCc1ncccn1 Amb33531368 [0,1,0,0,0,0|2,0,0]=3 457 B8R1.2 ONc1ccccc1 Amb17672282 [0,1,0,0,0,0|0,0,0]=1 458 B8R1.2 ONc1cccnn1 Amb27771477 [0,1,0,0,0,0|2,0,0]=3 459 B8R1.2 ONc1ccncc1 Amb27829868 [0,1,0,0,0,0|1,0,0]=2 460 B8R1.2 ONc1ncccn1 Amb2793974 [0,1,0,0,0,0|2,0,0]=3 461 B8R1.2 O\N=C1/C=CCCC1 Amb28316146 [0,1,0,0,0,0|0,0,3]=4 462 B8R1.2 SCc1ccccc1 Amb6608752 [0,1,0,0,0,0|0,1,0]=2 463 B8R1.2 SCc1ccccn1 Amb33542790 [0,1,0,0,0,0|1,1,0]=3 464 B8R1.2 SCc1cccnc1 Amb21984718 [0,1,0,0,0,0|1,1,0]=3 465 B8R1.2 SCc1cccnn1 Amb27461545 [0,1,0,0,0,0|2,1,0]=4 466 B8R1.2 SCc1ccncc1 Amb22008603 [0,1,0,0,0,0|1,1,0]=3 467 B8R1.2 SCc1ccncn1 Amb24099658 [0,1,0,0,0,0|2,1,0]=4 468 B8R1.2 SCc1cnccn1 Amb8392836 [0,1,0,0,0,0|2,1,0]=4 469 B8R1.2 SCc1cncnc1 Amb24546720 [0,1,0,0,0,0|2,1,0]=4 470 B8R1.2 SCc1ncccn1 Amb27837560 [0,1,0,0,0,0|2,1,0]=4 471 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [0,1,0,0,0,0|1,0,0]=2 472 B8R1.2 [C-]#[N+]c1ccccn1 Amb25840846 [0,1,0,0,0,0|2,0,0]=3 473 B8R1.2 [C-]#[N+]c1cccnc1 Amb3973078 [0,1,0,0,0,0|2,0,0]=3 474 B8R1.2 [C-]#[N+]c1ccncc1 Amb27805408 [0,1,0,0,0,0|2,0,0]=3 475 B8R1.2 [C-]#[N+]c1ccncn1 Amb33269018 [0,1,0,0,0,0|3,0,0]=4 476 B8R1.2 [C-]#[N+]c1cnccn1 Amb33359980 [0,1,0,0,0,0|3,0,0]=4 477 B8R1.2 [C-]#[N+]c1cncnc1 Amb32797403 [0,1,0,0,0,0|3,0,0]=4 478 B8R1.2 [C-]#[N+]c1ncccn1 Amb26441166 [0,1,0,0,0,0|3,0,0]=4 479 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [0,1,0,0,0,0|1,0,0]=2 480 B8R1.2 [NH3+]Cc1ccccc1 Amb8488224 [0,1,0,0,0,0|1,0,0]=2 481 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [0,1,0,0,0,0|1,0,0]=2 482 B8R1.3 Bc1ccc(N)cc1 Amb27254259 [0,1,0,0,0,0|1,0,0]=2 483 B8R1.3 Brc1ccc(Br)cc1 Amb17758775 [0,1,0,0,0,0|1,0,0]=2 484 B8R1.3 Brc1ccc(Br)nc1 Amb2615409 [0,1,0,0,0,0|2,0,0]=3 485 B8R1.3 Brc1ccc(Br)nn1 Amb2609463 [0,1,0,0,0,0|3,0,0]=4 486 B8R1.3 Brc1ccc(I)cc1 Amb2685277 [0,1,0,0,0,0|1,0,0]=2 487 B8R1.3 Brc1ccc(I)cn1 Amb33548840 [0,1,0,0,0,0|2,0,0]=3 488 B8R1.3 Brc1ccc(I)nc1 Amb1794233 [0,1,0,0,0,0|2,0,0]=3 489 B8R1.3 Brc1ccc(I)nn1 Amb24320668 [0,1,0,0,0,0|3,0,0]=4 490 B8R1.3 Brc1cnc(Br)cn1 Amb10067562 [0,1,0,0,0,0|3,0,0]=4 491 B8R1.3 Brc1cnc(Br)nc1 Amb13884714 [0,1,0,0,0,0|3,0,0]=4 492 B8R1.3 Brc1cnc(I)cn1 Amb8630260 [0,1,0,0,0,0|3,0,0]=4 493 B8R1.3 Brc1cnc(I)nc1 Amb8387128 [0,1,0,0,0,0|3,0,0]=4 494 B8R1.3 Brc1ncc(I)cn1 Amb25705769 [0,1,0,0,0,0|3,0,0]=4 495 B8R1.3 CC1=CNC(=O)C=C1 Amb18039971 [0,1,0,0,0,0|1,0,1]=3 496 B8R1.3 CC1=CNC(=O)C=N1 Amb22489545 [0,1,0,0,0,0|2,0,1]=4 497 B8R1.3 CC1=CNC(=O)N=C1 Amb21964512 [0,1,0,0,0,0|2,0,1]=4 498 B8R1.3 CC1=CNC(=S)C=C1 Amb22490585 [0,1,0,0,0,0|1,1,0]=3 499 B8R1.3 CC1=CNC(=S)C=N1 Amb26937573 [0,1,0,0,0,0|2,1,0]=4 500 B8R1.3 CC1=COC(=O)C=C1 Amb27595539 [0,1,0,0,0,0|1,0,1]=3 501 B8R1.3 CC1=NNC(=O)C=C1 Amb18372841 [0,1,0,0,0,0|2,0,1]=4 502 B8R1.3 CC1=NNC(=O)C=C1 Amb19373006 [0,1,0,0,0,0|2,0,1]=4 503 B8R1.3 CC1=NNC(=O)C=C1 Amb19894726 [0,1,0,0,0,0|2,0,1]=4 504 B8R1.3 CC1=NNC(=S)C=C1 Amb18038145 [0,1,0,0,0,0|2,1,0]=4 505 B8R1.3 CN1C=CC(=N)C=C1 Amb19561378 [0,1,0,0,0,0|2,0,0]=3 506 B8R1.3 CN1C=CC(N)=CC1 Amb25113880 [0,1,0,0,0,0|2,0,1]=4 507 B8R1.3 C[n+]1ccc(Br)cc1 Amb10572945 [0,1,0,0,0,0|2,0,0]=3 508 B8R1.3 C[n+]1ccc(N)cc1 Amb10573322 [0,1,0,0,0,0|2,0,0]=3 509 B8R1.3 C[n+]1ccc(N)cc1 Amb3428934 [0,1,0,0,0,0|2,0,0]=3 510 B8R1.3 Cc1cc[n+](N)cc1 Amb10552645 [0,1,0,0,0,0|2,0,0]=3 511 B8R1.3 Cc1cc[n+]([O-])cc1 Amb8394895 [0,1,0,0,0,0|1,0,1]=3 512 B8R1.3 Cc1cc[n+]([O-])cn1 Amb23437191 [0,1,0,0,0,0|2,0,1]=4 513 B8R1.3 Cc1ccc(Br)cc1 Amb2685512 [0,1,0,0,0,0|1,0,0]=2 514 B8R1.3 Cc1ccc(Br)cn1 Amb2610021 [0,1,0,0,0,0|2,0,0]=3 515 B8R1.3 Cc1ccc(Br)n[nH+]1 Amb24099879 [0,1,0,0,0,0|3,0,0]=4 516 B8R1.3 Cc1ccc(Br)nc1 Amb2691958 [0,1,0,0,0,0|2,0,0]=3 517 B8R1.3 Cc1ccc(Br)nn1 Amb8439533 [0,1,0,0,0,0|3,0,0]=4 518 B8R1.3 Cc1ccc(C)cc1 Amb6357465 [0,1,0,0,0,0|1,0,0]=2 519 B8R1.3 Cc1ccc(C)cc1 Amb6608997 [0,1,0,0,0,0|1,0,0]=2 520 B8R1.3 Cc1ccc(C)nc1 Amb8393614 [0,1,0,0,0,0|2,0,0]=3 521 B8R1.3 Cc1ccc(C)nn1 Amb22236100 [0,1,0,0,0,0|3,0,0]=4 522 B8R1.3 Cc1ccc(Cl)cc1 Amb33550129 [0,1,0,0,0,0|1,0,0]=2 523 B8R1.3 Cc1ccc(Cl)cn1 Amb5490932 [0,1,0,0,0,0|2,0,0]=3 524 B8R1.3 Cc1ccc(Cl)n[nH+]1 Amb24099954 [0,1,0,0,0,0|3,0,0]=4 525 B8R1.3 Cc1ccc(Cl)nc1 Amb2722518 [0,1,0,0,0,0|2,0,0]=3 526 B8R1.3 Cc1ccc(Cl)nn1 Amb2525829 [0,1,0,0,0,0|3,0,0]=4 527 B8R1.3 Cc1ccc(F)cc1 Amb2447473 [0,1,0,0,0,0|1,0,0]=2 528 B8R1.3 Cc1ccc(F)cn1 Amb6306445 [0,1,0,0,0,0|2,0,0]=3 529 B8R1.3 Cc1ccc(F)nc1 Amb2688233 [0,1,0,0,0,0|2,0,0]=3 530 B8R1.3 Cc1ccc(F)nn1 Amb23401885 [0,1,0,0,0,0|3,0,0]=4 531 B8R1.3 Cc1ccc(I)cc1 Amb6537943 [0,1,0,0,0,0|1,0,0]=2 532 B8R1.3 Cc1ccc(I)cn1 Amb10602945 [0,1,0,0,0,0|2,0,0]=3 533 B8R1.3 Cc1ccc(I)nc1 Amb24057144 [0,1,0,0,0,0|2,0,0]=3 534 B8R1.3 Cc1ccc(I)nn1 Amb19374181 [0,1,0,0,0,0|3,0,0]=4 535 B8R1.3 Cc1ccc(N)cc1 Amb2792847 [0,1,0,0,0,0|1,0,0]=2 536 B8R1.3 Cc1ccc(N)cc1 Amb9825674 [0,1,0,0,0,0|1,0,0]=2 537 B8R1.3 Cc1ccc(N)cn1 Amb6306437 [0,1,0,0,0,0|2,0,0]=3 538 B8R1.3 Cc1ccc(N)nc1 Amb22831186 [0,1,0,0,0,0|2,0,0]=3 539 B8R1.3 Cc1ccc(N)nc1 Amb2609947 [0,1,0,0,0,0|2,0,0]=3 540 B8R1.3 Cc1ccc(N)nn1 Amb30585086 [0,1,0,0,0,0|3,0,0]=4 541 B8R1.3 Cc1ccc(N)nn1 Amb3428569 [0,1,0,0,0,0|3,0,0]=4 542 B8R1.3 Cc1ccc(O)cc1 Amb2793057 [0,1,0,0,0,0|0,0,0]=1 543 B8R1.3 Cc1ccc(O)cn1 Amb2609944 [0,1,0,0,0,0|1,0,0]=2 544 B8R1.3 Cc1ccc(O)nc1 Amb2722524 [0,1,0,0,0,0|1,0,0]=2 545 B8R1.3 Cc1ccc(O)nc1 Amb35826776 [0,1,0,0,0,0|1,0,0]=2 546 B8R1.3 Cc1ccc(O)nn1 Amb2794468 [0,1,0,0,0,0|2,0,0]=3 547 B8R1.3 Cc1ccc(P)cc1 Amb27792147 [0,1,0,0,0,0|1,0,0]=2 548 B8R1.3 Cc1ccc(S)cc1 Amb2689732 [0,1,0,0,0,0|0,1,0]=2 549 B8R1.3 Cc1ccc(S)cn1 Amb24062573 [0,1,0,0,0,0|1,1,0]=3 550 B8R1.3 Cc1ccc(S)nc1 Amb1137634 [0,1,0,0,0,0|1,1,0]=3 551 B8R1.3 Cc1ccc(S)nn1 Amb33537932 [0,1,0,0,0,0|2,1,0]=4 552 B8R1.3 Cc1ccc([S-])cc1 Amb22729202 [0,1,0,0,0,0|0,1,0]=2 553 B8R1.3 Cc1ccc([S-])cn1 Amb33456950 [0,1,0,0,0,0|1,1,0]=3 554 B8R1.3 Cc1ccc([SiH3])nc1 Amb27470508 [0,1,0,0,0,0|2,0,0]=3 555 B8R1.3 Cc1ccn(=O)cc1 Amb22492616 [0,1,0,0,0,0|1,0,1]=3 556 B8R1.3 Cc1cnc(Br)cn1 Amb10599598 [0,1,0,0,0,0|3,0,0]=4 557 B8R1.3 Cc1cnc(Br)nc1 Amb33533819 [0,1,0,0,0,0|3,0,0]=4 558 B8R1.3 Cc1cnc(C)cn1 Amb6374281 [0,1,0,0,0,0|3,0,0]=4 559 B8R1.3 Cc1cnc(C)nc1 Amb20621139 [0,1,0,0,0,0|3,0,0]=4 560 B8R1.3 Cc1cnc(Cl)cn1 Amb10067215 [0,1,0,0,0,0|3,0,0]=4 561 B8R1.3 Cc1cnc(Cl)nc1 Amb8394580 [0,1,0,0,0,0|3,0,0]=4 562 B8R1.3 Cc1cnc(F)cn1 Amb25971939 [0,1,0,0,0,0|3,0,0]=4 563 B8R1.3 Cc1cnc(F)nc1 Amb8396988 [0,1,0,0,0,0|3,0,0]=4 564 B8R1.3 Cc1cnc(I)cn1 Amb22493755 [0,1,0,0,0,0|3,0,0]=4 565 B8R1.3 Cc1cnc(I)nc1 Amb22452406 [0,1,0,0,0,0|3,0,0]=4 566 B8R1.3 Cc1cnc(N)cn1 Amb8385703 [0,1,0,0,0,0|3,0,0]=4 567 B8R1.3 Cc1cnc(N)cn1 Amb8631396 [0,1,0,0,0,0|3,0,0]=4 568 B8R1.3 Cc1cnc(N)nc1 Amb4458276 [0,1,0,0,0,0|3,0,0]=4 569 B8R1.3 Cc1cnc(O)nc1 Amb21961467 [0,1,0,0,0,0|2,0,0]=3 570 B8R1.3 Cc1cnc(O)nc1 Amb8630426 [0,1,0,0,0,0|2,0,0]=3 571 B8R1.3 Cc1cnc(S)nc1 Amb10609022 [0,1,0,0,0,0|2,1,0]=4 572 B8R1.3 Cc1cnc(S)nc1 Amb1935082 [0,1,0,0,0,0|2,1,0]=4 573 B8R1.3 Cc1ncc(Br)cn1 Amb10071186 [0,1,0,0,0,0|3,0,0]=4 574 B8R1.3 Cc1ncc(Cl)cn1 Amb10603828 [0,1,0,0,0,0|3,0,0]=4 575 B8R1.3 Cc1ncc(F)cn1 Amb21963518 [0,1,0,0,0,0|3,0,0]=4 576 B8R1.3 Cc1ncc(N)cn1 Amb33528746 [0,1,0,0,0,0|3,0,0]=4 577 B8R1.3 Cc1ncc(O)cn1 Amb8397260 [0,1,0,0,0,0|2,0,0]=3 578 B8R1.3 Clc1ccc(Br)cc1 Amb3940229 [0,1,0,0,0,0|1,0,0]=2 579 B8R1.3 Clc1ccc(Br)cn1 Amb1088769 [0,1,0,0,0,0|2,0,0]=3 580 B8R1.3 Clc1ccc(Br)nc1 Amb2609485 [0,1,0,0,0,0|2,0,0]=3 581 B8R1.3 Clc1ccc(Br)nn1 Amb10599245 [0,1,0,0,0,0|3,0,0]=4 582 B8R1.3 Clc1ccc(Cl)cc1 Amb6608826 [0,1,0,0,0,0|1,0,0]=2 583 B8R1.3 Clc1ccc(Cl)nc1 Amb3939994 [0,1,0,0,0,0|2,0,0]=3 584 B8R1.3 Clc1ccc(Cl)nn1 Amb2686970 [0,1,0,0,0,0|3,0,0]=4 585 B8R1.3 Clc1ccc(I)cc1 Amb2686130 [0,1,0,0,0,0|1,0,0]=2 586 B8R1.3 Clc1ccc(I)cn1 Amb1088772 [0,1,0,0,0,0|2,0,0]=3 587 B8R1.3 Clc1ccc(I)nc1 Amb8396772 [0,1,0,0,0,0|2,0,0]=3 588 B8R1.3 Clc1ccc(I)nn1 Amb8630866 [0,1,0,0,0,0|3,0,0]=4 589 B8R1.3 Clc1cnc(Br)cn1 Amb10071604 [0,1,0,0,0,0|3,0,0]=4 590 B8R1.3 Clc1cnc(Br)nc1 Amb19888117 [0,1,0,0,0,0|3,0,0]=4 591 B8R1.3 Clc1cnc(Cl)cn1 Amb4449855 [0,1,0,0,0,0|3,0,0]=4 592 B8R1.3 Clc1cnc(Cl)nc1 Amb6298014 [0,1,0,0,0,0|3,0,0]=4 593 B8R1.3 Clc1cnc(I)cn1 Amb19957536 [0,1,0,0,0,0|3,0,0]=4 594 B8R1.3 Clc1cnc(I)nc1 Amb8396062 [0,1,0,0,0,0|3,0,0]=4 595 B8R1.3 Clc1ncc(Br)cn1 Amb2447331 [0,1,0,0,0,0|3,0,0]=4 596 B8R1.3 Clc1ncc(I)cn1 Amb8439543 [0,1,0,0,0,0|3,0,0]=4 597 B8R1.3 FC1=NNC(=S)C=C1 Amb22388266 [0,1,0,0,0,0|2,1,0]=4 598 B8R1.3 Fc1ccc(Br)cc1 Amb2685184 [0,1,0,0,0,0|1,0,0]=2 599 B8R1.3 Fc1ccc(Br)cn1 Amb2447411 [0,1,0,0,0,0|2,0,0]=3 600 B8R1.3 Fc1ccc(Br)nc1 Amb2447410 [0,1,0,0,0,0|2,0,0]=3 601 B8R1.3 Fc1ccc(Br)nn1 Amb20618416 [0,1,0,0,0,0|3,0,0]=4 602 B8R1.3 Fc1ccc(Cl)cc1 Amb2685938 [0,1,0,0,0,0|1,0,0]=2 603 B8R1.3 Fc1ccc(Cl)cn1 Amb8383904 [0,1,0,0,0,0|2,0,0]=3 604 B8R1.3 Fc1ccc(Cl)nc1 Amb2691960 [0,1,0,0,0,0|2,0,0]=3 605 B8R1.3 Fc1ccc(Cl)nn1 Amb22388694 [0,1,0,0,0,0|3,0,0]=4 606 B8R1.3 Fc1ccc(F)cc1 Amb2687053 [0,1,0,0,0,0|1,0,0]=2 607 B8R1.3 Fc1ccc(F)nc1 Amb15691012 [0,1,0,0,0,0|2,0,0]=3 608 B8R1.3 Fc1ccc(F)nn1 Amb8629956 [0,1,0,0,0,0|3,0,0]=4 609 B8R1.3 Fc1ccc(I)cc1 Amb2688123 [0,1,0,0,0,0|1,0,0]=2 610 B8R1.3 Fc1ccc(I)cn1 Amb1084266 [0,1,0,0,0,0|2,0,0]=3 611 B8R1.3 Fc1ccc(I)nc1 Amb15691013 [0,1,0,0,0,0|2,0,0]=3 612 B8R1.3 Fc1ccc(I)nn1 Amb24610871 [0,1,0,0,0,0|3,0,0]=4 613 B8R1.3 Fc1ccc(S)cc1 Amb10838800 [0,1,0,0,0,0|0,1,0]=2 614 B8R1.3 Fc1ccc(S)cc1 Amb2688425 [0,1,0,0,0,0|0,1,0]=2 615 B8R1.3 Fc1ccc(S)cn1 Amb25724347 [0,1,0,0,0,0|1,1,0]=3 616 B8R1.3 Fc1ccc(S)nc1 Amb24696289 [0,1,0,0,0,0|1,1,0]=3 617 B8R1.3 Fc1ccc([Mg+])cc1 Amb22043963 [0,1,0,0,0,0|1,0,0]=2 618 B8R1.3 Fc1cnc(Br)cn1 Amb20618552 [0,1,0,0,0,0|3,0,0]=4 619 B8R1.3 Fc1cnc(Br)nc1 Amb10067795 [0,1,0,0,0,0|3,0,0]=4 620 B8R1.3 Fc1cnc(Cl)cn1 Amb10599249 [0,1,0,0,0,0|3,0,0]=4 621 B8R1.3 Fc1cnc(Cl)nc1 Amb10067268 [0,1,0,0,0,0|3,0,0]=4 622 B8R1.3 Fc1cnc(F)cn1 Amb23401789 [0,1,0,0,0,0|3,0,0]=4 623 B8R1.3 Fc1cnc(F)nc1 Amb24097054 [0,1,0,0,0,0|3,0,0]=4 624 B8R1.3 Fc1cnc(I)nc1 Amb24412518 [0,1,0,0,0,0|3,0,0]=4 625 B8R1.3 Fc1ncc(Br)cn1 Amb2455750 [0,1,0,0,0,0|3,0,0]=4 626 B8R1.3 Fc1ncc(Cl)cn1 Amb22499635 [0,1,0,0,0,0|3,0,0]=4 627 B8R1.3 Fc1ncc(I)cn1 Amb21857990 [0,1,0,0,0,0|3,0,0]=4 628 B8R1.3 Ic1ccc(I)cc1 Amb6608925 [0,1,0,0,0,0|1,0,0]=2 629 B8R1.3 Ic1ccc(I)nc1 Amb2609493 [0,1,0,0,0,0|2,0,0]=3 630 B8R1.3 Ic1ccc(I)nn1 Amb2780400 [0,1,0,0,0,0|3,0,0]=4 631 B8R1.3 Ic1cnc(I)cn1 Amb24320745 [0,1,0,0,0,0|3,0,0]=4 632 B8R1.3 Ic1cnc(I)nc1 Amb24323026 [0,1,0,0,0,0|3,0,0]=4 633 B8R1.3 N=C1C=CC(=N)C=C1 Amb22730871 [0,1,0,0,0,0|1,0,0]=2 634 B8R1.3 N=C1C=CN(O)C=C1 Amb24113163 [0,1,0,0,0,0|1,0,0]=2 635 B8R1.3 NC1=CNC(=O)C=C1 Amb19958325 [0,1,0,0,0,0|1,0,1]=3 636 B8R1.3 NC1=NNC(=O)C=C1 Amb18124225 [0,1,0,0,0,0|2,0,1]=4 637 B8R1.3 NC1=NNC(=O)C=C1 Amb24271086 [0,1,0,0,0,0|2,0,1]=4 638 B8R1.3 Nc1cc[n+]([O-])cc1 Amb17506866 [0,1,0,0,0,0|1,0,1]=3 639 B8R1.3 Nc1cc[n+]([O-])cc1 Amb31284005 [0,1,0,0,0,0|1,0,1]=3 640 B8R1.3 Nc1cc[n+]([O-])cn1 Amb27964391 [0,1,0,0,0,0|2,0,1]=4 641 B8R1.3 Nc1ccc(Br)cc1 Amb6364741 [0,1,0,0,0,0|1,0,0]=2 642 B8R1.3 Nc1ccc(Br)cn1 Amb1353208 [0,1,0,0,0,0|2,0,0]=3 643 B8R1.3 Nc1ccc(Br)cn1 Amb18090795 [0,1,0,0,0,0|2,0,0]=3 644 B8R1.3 Nc1ccc(Br)nc1 Amb1073022 [0,1,0,0,0,0|2,0,0]=3 645 B8R1.3 Nc1ccc(Br)nn1 Amb2724939 [0,1,0,0,0,0|3,0,0]=4 646 B8R1.3 Nc1ccc(Cl)cc1 Amb1935181 [0,1,0,0,0,0|1,0,0]=2 647 B8R1.3 Nc1ccc(Cl)cn1 Amb2227699 [0,1,0,0,0,0|2,0,0]=3 648 B8R1.3 Nc1ccc(Cl)nc1 Amb535785 [0,1,0,0,0,0|2,0,0]=3 649 B8R1.3 Nc1ccc(Cl)nn1 Amb1152568 [0,1,0,0,0,0|3,0,0]=4 650 B8R1.3 Nc1ccc(F)cc1 Amb2688013 [0,1,0,0,0,0|1,0,0]=2 651 B8R1.3 Nc1ccc(F)cn1 Amb1086331 [0,1,0,0,0,0|2,0,0]=3 652 B8R1.3 Nc1ccc(F)nc1 Amb2612060 [0,1,0,0,0,0|2,0,0]=3 653 B8R1.3 Nc1ccc(F)nn1 Amb10067581 [0,1,0,0,0,0|3,0,0]=4 654 B8R1.3 Nc1ccc(I)cc1 Amb6543392 [0,1,0,0,0,0|1,0,0]=2 655 B8R1.3 Nc1ccc(I)cn1 Amb1784469 [0,1,0,0,0,0|2,0,0]=3 656 B8R1.3 Nc1ccc(I)nc1 Amb1147296 [0,1,0,0,0,0|2,0,0]=3 657 B8R1.3 Nc1ccc(I)nn1 Amb13883812 [0,1,0,0,0,0|3,0,0]=4 658 B8R1.3 Nc1ccc(I)nn1 Amb33622589 [0,1,0,0,0,0|3,0,0]=4 659 B8R1.3 Nc1ccc(N)cc1 Amb20621980 [0,1,0,0,0,0|1,0,0]=2 660 B8R1.3 Nc1ccc(N)cc1 Amb2725554 [0,1,0,0,0,0|1,0,0]=2 661 B8R1.3 Nc1ccc(N)cc1 Amb6365692 [0,1,0,0,0,0|1,0,0]=2 662 B8R1.3 Nc1ccc(N)nc1 Amb19958409 [0,1,0,0,0,0|2,0,0]=3 663 B8R1.3 Nc1ccc(N)nc1 Amb2609933 [0,1,0,0,0,0|2,0,0]=3 664 B8R1.3 Nc1ccc(N)nn1 Amb10067596 [0,1,0,0,0,0|3,0,0]=4 665 B8R1.3 Nc1ccc(N)nn1 Amb22489557 [0,1,0,0,0,0|3,0,0]=4 666 B8R1.3 Nc1ccc(O)cc1 Amb22732595 [0,1,0,0,0,0|0,0,0]=1 667 B8R1.3 Nc1ccc(O)cc1 Amb6456547 [0,1,0,0,0,0|0,0,0]=1 668 B8R1.3 Nc1ccc(O)cc1 Amb8516484 [0,1,0,0,0,0|0,0,0]=1 669 B8R1.3 Nc1ccc(O)cc1 Amb8629248 [0,1,0,0,0,0|0,0,0]=1 670 B8R1.3 Nc1ccc(O)cn1 Amb19894703 [0,1,0,0,0,0|1,0,0]=2 671 B8R1.3 Nc1ccc(O)cn1 Amb22304742 [0,1,0,0,0,0|1,0,0]=2 672 B8R1.3 Nc1ccc(O)cn1 Amb2699118 [0,1,0,0,0,0|1,0,0]=2 673 B8R1.3 Nc1ccc(O)nc1 Amb2610801 [0,1,0,0,0,0|1,0,0]=2 674 B8R1.3 Nc1ccc(O)nc1 Amb8631698 [0,1,0,0,0,0|1,0,0]=2 675 B8R1.3 Nc1ccc(O)nn1 Amb18943976 [0,1,0,0,0,0|2,0,0]=3 676 B8R1.3 Nc1ccc(O)nn1 Amb33537423 [0,1,0,0,0,0|2,0,0]=3 677 B8R1.3 Nc1ccc(S)cc1 Amb6297793 [0,1,0,0,0,0|0,1,0]=2 678 B8R1.3 Nc1ccc(S)cn1 Amb2567500 [0,1,0,0,0,0|1,1,0]=3 679 B8R1.3 Nc1ccc(S)nc1 Amb8386689 [0,1,0,0,0,0|1,1,0]=3 680 B8R1.3 Nc1cnc(Br)cn1 Amb2694930 [0,1,0,0,0,0|3,0,0]=4 681 B8R1.3 Nc1cnc(Br)nc1 Amb10602821 [0,1,0,0,0,0|3,0,0]=4 682 B8R1.3 Nc1cnc(Cl)cn1 Amb10067206 [0,1,0,0,0,0|3,0,0]=4 683 B8R1.3 Nc1cnc(Cl)nc1 Amb10067614 [0,1,0,0,0,0|3,0,0]=4 684 B8R1.3 Nc1cnc(F)nc1 Amb18641719 [0,1,0,0,0,0|3,0,0]=4 685 B8R1.3 Nc1cnc(I)cn1 Amb19957532 [0,1,0,0,0,0|3,0,0]=4 686 B8R1.3 Nc1cnc(I)nc1 Amb28185909 [0,1,0,0,0,0|3,0,0]=4 687 B8R1.3 Nc1cnc(N)cn1 Amb19516034 [0,1,0,0,0,0|3,0,0]=4 688 B8R1.3 Nc1cnc(N)cn1 Amb22436787 [0,1,0,0,0,0|3,0,0]=4 689 B8R1.3 Nc1cnc(N)nc1 Amb2223199 [0,1,0,0,0,0|3,0,0]=4 690 B8R1.3 Nc1cnc(O)cn1 Amb10599609 [0,1,0,0,0,0|2,0,0]=3 691 B8R1.3 Nc1cnc(O)nc1 Amb18941527 [0,1,0,0,0,0|2,0,0]=3 692 B8R1.3 Nc1ncc(Br)cn1 Amb837049 [0,1,0,0,0,0|3,0,0]=4 693 B8R1.3 Nc1ncc(Cl)cn1 Amb2227684 [0,1,0,0,0,0|3,0,0]=4 694 B8R1.3 Nc1ncc(F)cn1 Amb10603549 [0,1,0,0,0,0|3,0,0]=4 695 B8R1.3 Nc1ncc(I)cn1 Amb3939619 [0,1,0,0,0,0|3,0,0]=4 696 B8R1.3 Nc1ncc(O)cn1 Amb8397252 [0,1,0,0,0,0|2,0,0]=3 697 B8R1.3 O=C1C=CC(=O)C=C1 Amb6600120 [0,1,0,0,0,0|0,0,1]=2 698 B8R1.3 O=C1C=CC(=O)C=C1 Amb8516773 [0,1,0,0,0,0|0,0,1]=2 699 B8R1.3 O=C1C=CC(=O)N=N1 Amb22498641 [0,1,0,0,0,0|2,0,1]=4 700 B8R1.3 O=C1C=CC(=O)NN1 Amb19651991 [0,1,0,0,0,0|2,0,1]=4 701 B8R1.3 O=C1C=CC(Br)=CN1 Amb18010721 [0,1,0,0,0,0|1,0,1]=3 702 B8R1.3 O=C1C=CC(Br)=NN1 Amb22491266 [0,1,0,0,0,0|2,0,1]=4 703 B8R1.3 O=C1C=CC(Cl)=CN1 Amb18039972 [0,1,0,0,0,0|1,0,1]=3 704 B8R1.3 O=C1C=CC(Cl)=CO1 Amb20247269 [0,1,0,0,0,0|1,0,1]=3 705 B8R1.3 O=C1C=CC(Cl)=NN1 Amb19148928 [0,1,0,0,0,0|2,0,1]=4 706 B8R1.3 O=C1C=CC(F)=CN1 Amb18040570 [0,1,0,0,0,0|1,0,1]=3 707 B8R1.3 O=C1C=CC(F)=NN1 Amb22387070 [0,1,0,0,0,0|2,0,1]=4 708 B8R1.3 O=C1C=CC(F)C=C1 Amb28124983 [0,1,0,0,0,0|0,0,2]=3 709 B8R1.3 O=C1C=CC(I)=CN1 Amb22001395 [0,1,0,0,0,0|1,0,1]=3 710 B8R1.3 O=C1C=CC(I)=CO1 Amb20247268 [0,1,0,0,0,0|1,0,1]=3 711 B8R1.3 O=C1C=CC(I)=NN1 Amb24445162 [0,1,0,0,0,0|2,0,1]=4 712 B8R1.3 O=C1C=CC(O)=CN1 Amb19889905 [0,1,0,0,0,0|1,0,0]=2 713 B8R1.3 O=C1C=CC(O)=NN1 Amb22058718 [0,1,0,0,0,0|2,0,0]=3 714 B8R1.3 O=C1C=CC(O)CC1 Amb28048996 [0,1,0,0,0,0|0,0,3]=4 715 B8R1.3 O=C1C=CC(O)OC1 Amb17593180 [0,1,0,0,0,0|1,0,2]=4 716 B8R1.3 O=C1C=CN(O)C=C1 Amb24608607 [0,1,0,0,0,0|1,0,0]=2 717 B8R1.3 O=C1C=NC(F)=CN1 Amb22388305 [0,1,0,0,0,0|2,0,1]=4 718 B8R1.3 O=C1C=NC(S)=CN1 Amb27668199 [0,1,0,0,0,0|2,0,1]=4 719 B8R1.3 O=C1N=CC(Br)=CN1 Amb19895337 [0,1,0,0,0,0|2,0,1]=4 720 B8R1.3 O=C1N=CC(Br)=CN1 Amb21857588 [0,1,0,0,0,0|2,0,1]=4 721 B8R1.3 O=C1N=CC(Cl)=CN1 Amb20239358 [0,1,0,0,0,0|2,0,1]=4 722 B8R1.3 O=C1N=CC(I)=CN1 Amb22388529 [0,1,0,0,0,0|2,0,1]=4 723 B8R1.3 O=c1ccc(Br)co1 Amb22231971 [0,1,0,0,0,0|1,0,1]=3 724 B8R1.3 O=n1ccc(Cl)cc1 Amb20620849 [0,1,0,0,0,0|1,0,1]=3 725 B8R1.3 Oc1ccc(Br)cc1 Amb2685387 [0,1,0,0,0,0|0,0,0]=1 726 B8R1.3 Oc1ccc(Br)cn1 Amb6366091 [0,1,0,0,0,0|1,0,0]=2 727 B8R1.3 Oc1ccc(Br)nc1 Amb8386698 [0,1,0,0,0,0|1,0,0]=2 728 B8R1.3 Oc1ccc(Br)nn1 Amb10599725 [0,1,0,0,0,0|2,0,0]=3 729 B8R1.3 Oc1ccc(Cl)cc1 Amb2793047 [0,1,0,0,0,0|0,0,0]=1 730 B8R1.3 Oc1ccc(Cl)cn1 Amb2795178 [0,1,0,0,0,0|1,0,0]=2 731 B8R1.3 Oc1ccc(Cl)nc1 Amb2612341 [0,1,0,0,0,0|1,0,0]=2 732 B8R1.3 Oc1ccc(Cl)nn1 Amb9214994 [0,1,0,0,0,0|2,0,0]=3 733 B8R1.3 Oc1ccc(F)cc1 Amb2688292 [0,1,0,0,0,0|0,0,0]=1 734 B8R1.3 Oc1ccc(F)cn1 Amb32729351 [0,1,0,0,0,0|1,0,0]=2 735 B8R1.3 Oc1ccc(F)cn1 Amb8393030 [0,1,0,0,0,0|1,0,0]=2 736 B8R1.3 Oc1ccc(F)nc1 Amb8394587 [0,1,0,0,0,0|1,0,0]=2 737 B8R1.3 Oc1ccc(I)cc1 Amb4605825 [0,1,0,0,0,0|0,0,0]=1 738 B8R1.3 Oc1ccc(I)cn1 Amb6565029 [0,1,0,0,0,0|1,0,0]=2 739 B8R1.3 Oc1ccc(I)nc1 Amb8383456 [0,1,0,0,0,0|1,0,0]=2 740 B8R1.3 Oc1ccc(O)cc1 Amb34915911 [0,1,0,0,0,0|0,0,0]=1 741 B8R1.3 Oc1ccc(O)cc1 Amb3940928 [0,1,0,0,0,0|0,0,0]=1 742 B8R1.3 Oc1ccc(O)nc1 Amb8438918 [0,1,0,0,0,0|1,0,0]=2 743 B8R1.3 Oc1ccc(O)nn1 Amb1971461 [0,1,0,0,0,0|2,0,0]=3 744 B8R1.3 Oc1ccc(P)cc1 Amb27974686 [0,1,0,0,0,0|0,0,0]=1 745 B8R1.3 Oc1ccc(S)cc1 Amb6306674 [0,1,0,0,0,0|0,0,0]=1 746 B8R1.3 Oc1ccc(S)cn1 Amb3632336 [0,1,0,0,0,0|1,0,0]=2 747 B8R1.3 Oc1ccc(S)nc1 Amb26326885 [0,1,0,0,0,0|1,0,0]=2 748 B8R1.3 Oc1ccc(S)nn1 Amb18642599 [0,1,0,0,0,0|2,0,0]=3 749 B8R1.3 Oc1cnc(Br)cn1 Amb10070093 [0,1,0,0,0,0|2,0,0]=3 750 B8R1.3 Oc1cnc(Br)nc1 Amb20617468 [0,1,0,0,0,0|2,0,0]=3 751 B8R1.3 Oc1cnc(Cl)cn1 Amb15690617 [0,1,0,0,0,0|2,0,0]=3 752 B8R1.3 Oc1cnc(Cl)nc1 Amb10602072 [0,1,0,0,0,0|2,0,0]=3 753 B8R1.3 Oc1cnc(F)nc1 Amb27781092 [0,1,0,0,0,0|2,0,0]=3 754 B8R1.3 Oc1cnc(I)cn1 Amb22496537 [0,1,0,0,0,0|2,0,0]=3 755 B8R1.3 Oc1cnc(I)nc1 Amb26444564 [0,1,0,0,0,0|2,0,0]=3 756 B8R1.3 Oc1cnc(O)cn1 Amb10599610 [0,1,0,0,0,0|2,0,0]=3 757 B8R1.3 Oc1ncc(Br)cn1 Amb2455916 [0,1,0,0,0,0|2,0,0]=3 758 B8R1.3 Oc1ncc(Cl)cn1 Amb20668359 [0,1,0,0,0,0|2,0,0]=3 759 B8R1.3 Oc1ncc(Cl)cn1 Amb6297333 [0,1,0,0,0,0|2,0,0]=3 760 B8R1.3 Oc1ncc(F)cn1 Amb19888513 [0,1,0,0,0,0|2,0,0]=3 761 B8R1.3 Oc1ncc(I)cn1 Amb8439545 [0,1,0,0,0,0|2,0,0]=3 762 B8R1.3 S=C1C=CC(Br)=NN1 Amb28351171 [0,1,0,0,0,0|2,1,0]=4 763 B8R1.3 S=C1C=CC(Cl)=CN1 Amb22728282 [0,1,0,0,0,0|1,1,0]=3 764 B8R1.3 S=C1C=CC(I)=CN1 Amb24636127 [0,1,0,0,0,0|1,1,0]=3 765 B8R1.3 S=C1C=NC(Br)=CN1 Amb25981495 [0,1,0,0,0,0|2,1,0]=4 766 B8R1.3 S=C1N=CC(Br)=CN1 Amb33551812 [0,1,0,0,0,0|2,1,0]=4 767 B8R1.3 Sc1ccc(Br)cc1 Amb974787 [0,1,0,0,0,0|0,1,0]=2 768 B8R1.3 Sc1ccc(Br)cn1 Amb1126340 [0,1,0,0,0,0|1,1,0]=3 769 B8R1.3 Sc1ccc(Br)nc1 Amb28206732 [0,1,0,0,0,0|1,1,0]=3 770 B8R1.3 Sc1ccc(Cl)cc1 Amb2686488 [0,1,0,0,0,0|0,1,0]=2 771 B8R1.3 Sc1ccc(Cl)cn1 Amb1136127 [0,1,0,0,0,0|1,1,0]=3 772 B8R1.3 Sc1ccc(Cl)nn1 Amb2371704 [0,1,0,0,0,0|2,1,0]=4 773 B8R1.3 Sc1ccc(I)cc1 Amb7773588 [0,1,0,0,0,0|0,1,0]=2 774 B8R1.3 Sc1ccc(S)cc1 Amb9820127 [0,1,0,0,0,0|0,1,0]=2 775 B8R1.3 Sc1ccc(S)nn1 Amb10560052 [0,1,0,0,0,0|2,1,0]=4 776 B8R1.3 Sc1ncc(Br)cn1 Amb28363865 [0,1,0,0,0,0|2,1,0]=4 777 B8R1.3 Sc1ncc(Cl)cn1 Amb2796320 [0,1,0,0,0,0|2,1,0]=4 778 B8R1.3 Sc1ncc(I)cn1 Amb27866585 [0,1,0,0,0,0|2,1,0]=4 779 B8R1.3 [Mg+]c1ccc(Cl)cc1 Amb22044013 [0,1,0,0,0,0|1,0,0]=2 780 B8R1.3 [NH3+]c1ccc([NH3+])nc1 Amb6365966 [0,1,0,0,0,0|2,0,0]=3 781 B8R1.3 [O-][n+]1cc[n+]([O-])cc1 Amb10552403 [0,1,0,0,0,0|2,0,1]=4 782 B8R1.3 [O-][n+]1ccc(Br)cc1 Amb2794356 [0,1,0,0,0,0|1,0,1]=3 783 B8R1.3 [O-][n+]1ccc(Br)cn1 Amb23437591 [0,1,0,0,0,0|2,0,1]=4 784 B8R1.3 [O-][n+]1ccc(Cl)cc1 Amb8517608 [0,1,0,0,0,0|1,0,1]=3 785 B8R1.3 [O-][n+]1ccc(F)cc1 Amb23439373 [0,1,0,0,0,0|1,0,1]=3 786 B8R1.3 [O-][n+]1ccc(O)cc1 Amb2610020 [0,1,0,0,0,0|1,0,0]=2 787 B8R1.3 [O-]c1ccc(Cl)cc1 Amb22002485 [0,1,0,0,0,0|0,0,1]=2 788 B8R1.3 [SiH3]c1ccc(Cl)cc1 Amb27251994 [0,1,0,0,0,0|1,0,0]=2 789 B8R1.4 Bc1ccnc(F)c1 Amb28053671 [0,1,0,0,0,0|2,0,0]=3 790 B8R1.4 Brc1cc(Br)ncn1 Amb33528212 [0,1,0,0,0,0|3,0,0]=4 791 B8R1.4 Brc1cc(I)ccn1 Amb1088767 [0,1,0,0,0,0|2,0,0]=3 792 B8R1.4 Brc1cc(I)ncn1 Amb24323025 [0,1,0,0,0,0|3,0,0]=4 793 B8R1.4 Brc1cc[nH+]c(Br)c1 Amb22045290 [0,1,0,0,0,0|2,0,0]=3 794 B8R1.4 Brc1cccc(Br)c1 Amb2686715 [0,1,0,0,0,0|1,0,0]=2 795 B8R1.4 Brc1cccc(Br)n1 Amb2725521 [0,1,0,0,0,0|2,0,0]=3 796 B8R1.4 Brc1cccc(I)c1 Amb2447545 [0,1,0,0,0,0|1,0,0]=2 797 B8R1.4 Brc1cccc(I)n1 Amb10071333 [0,1,0,0,0,0|2,0,0]=3 798 B8R1.4 Brc1ccnc(Br)c1 Amb1088773 [0,1,0,0,0,0|2,0,0]=3 799 B8R1.4 Brc1ccnc(Br)n1 Amb10071187 [0,1,0,0,0,0|3,0,0]=4 800 B8R1.4 Brc1ccnc(I)c1 Amb8386490 [0,1,0,0,0,0|2,0,0]=3 801 B8R1.4 Brc1cncc(Br)c1 Amb1154154 [0,1,0,0,0,0|2,0,0]=3 802 B8R1.4 Brc1cncc(Br)n1 Amb10599637 [0,1,0,0,0,0|3,0,0]=4 803 B8R1.4 Brc1cncc(I)c1 Amb6565050 [0,1,0,0,0,0|2,0,0]=3 804 B8R1.4 Brc1cncc(I)n1 Amb24320742 [0,1,0,0,0,0|3,0,0]=4 805 B8R1.4 Brc1cnnc(Br)c1 Amb33548903 [0,1,0,0,0,0|3,0,0]=4 806 B8R1.4 Brc1nccc(I)n1 Amb25309184 [0,1,0,0,0,0|3,0,0]=4 807 B8R1.4 C=C1C=C(C)C=CN1 Amb24070501 [0,1,0,0,0,0|2,0,0]=3 808 B8R1.4 C=C1C=CNC(C)=C1 Amb24084773 [0,1,0,0,0,0|2,0,0]=3 809 B8R1.4 CC1=CC(=O)C=CN1 Amb22492433 [0,1,0,0,0,0|1,0,1]=3 810 B8R1.4 CC1=CC(=O)C=CN1 Amb33714765 [0,1,0,0,0,0|1,0,1]=3 811 B8R1.4 CC1=CC(=O)C=CO1 Amb22386932 [0,1,0,0,0,0|1,0,1]=3 812 B8R1.4 CC1=CC(=O)C=NN1 Amb24501997 [0,1,0,0,0,0|2,0,1]=4 813 B8R1.4 CC1=CC(=O)N=CN1 Amb19879021 [0,1,0,0,0,0|2,0,1]=4 814 B8R1.4 CC1=CC(=O)NC=C1 Amb18034270 [0,1,0,0,0,0|1,0,1]=3 815 B8R1.4 CC1=CC(=O)NC=N1 Amb19116078 [0,1,0,0,0,0|2,0,1]=4 816 B8R1.4 CC1=CC(=O)NC=N1 Amb33621237 [0,1,0,0,0,0|2,0,1]=4 817 B8R1.4 CC1=CC(=O)NN=C1 Amb19892393 [0,1,0,0,0,0|2,0,1]=4 818 B8R1.4 CC1=CC(=S)C=CN1 Amb24062502 [0,1,0,0,0,0|1,1,0]=3 819 B8R1.4 CC1=CC(=S)NC=N1 Amb18013063 [0,1,0,0,0,0|2,1,0]=4 820 B8R1.4 CC1=CC(=S)NN=C1 Amb24370677 [0,1,0,0,0,0|2,1,0]=4 821 B8R1.4 CC1=CC=CC(=O)N1 Amb18540672 [0,1,0,0,0,0|1,0,1]=3 822 B8R1.4 CC1=CC=CC(=O)N1 Amb32789652 [0,1,0,0,0,0|1,0,1]=3 823 B8R1.4 CC1=CC=CC(=O)O1 Amb20247496 [0,1,0,0,0,0|1,0,1]=3 824 B8R1.4 CC1=CC=NC(=O)N1 Amb22371457 [0,1,0,0,0,0|2,0,1]=4 825 B8R1.4 CC1=CC=NC(=S)N1 Amb18800681 [0,1,0,0,0,0|2,1,0]=4 826 B8R1.4 CC1=CCC=C(C)C1 Amb22227756 [0,1,0,0,0,0|1,0,2]=4 827 B8R1.4 CC1=CN=CC(=O)N1 Amb20240903 [0,1,0,0,0,0|2,0,1]=4 828 B8R1.4 CC1=NC(=O)C=CN1 Amb33552640 [0,1,0,0,0,0|2,0,1]=4 829 B8R1.4 CC1=NC(=O)NC=C1 Amb19267100 [0,1,0,0,0,0|2,0,1]=4 830 B8R1.4 CC1=NC(=O)NC=C1 Amb22168002 [0,1,0,0,0,0|2,0,1]=4 831 B8R1.4 CC1=NC(=S)NC=C1 Amb22727957 [0,1,0,0,0,0|2,1,0]=4 832 B8R1.4 CC1=NC=CC(=O)N1 Amb22058797 [0,1,0,0,0,0|2,0,1]=4 833 B8R1.4 CC1=NC=CC(=O)N1 Amb33719419 [0,1,0,0,0,0|2,0,1]=4 834 B8R1.4 C[n+]1cccc(Br)c1 Amb10975994 [0,1,0,0,0,0|2,0,0]=3 835 B8R1.4 C[n+]1cccc(Cl)c1 Amb2609543 [0,1,0,0,0,0|2,0,0]=3 836 B8R1.4 C[n+]1cccc(O)c1 Amb10552608 [0,1,0,0,0,0|1,0,0]=2 837 B8R1.4 C[n+]1cccc(O)c1 Amb10573234 [0,1,0,0,0,0|1,0,0]=2 838 B8R1.4 C[n+]1cccc(O)c1 Amb19652047 [0,1,0,0,0,0|1,0,0]=2 839 B8R1.4 C[n+]1cccc(O)c1 Amb32652599 [0,1,0,0,0,0|1,0,0]=2 840 B8R1.4 C[n+]1cccc(O)c1 Amb4013611 [0,1,0,0,0,0|1,0,0]=2 841 B8R1.4 Cc1c[n+]([O-])ccn1 Amb27614374 [0,1,0,0,0,0|2,0,1]=4 842 B8R1.4 Cc1cc(Br)ccn1 Amb22754761 [0,1,0,0,0,0|2,0,0]=3 843 B8R1.4 Cc1cc(Br)ccn1 Amb2447671 [0,1,0,0,0,0|2,0,0]=3 844 B8R1.4 Cc1cc(Br)ccn1 Amb8503380 [0,1,0,0,0,0|2,0,0]=3 845 B8R1.4 Cc1cc(Br)cnn1 Amb26594276 [0,1,0,0,0,0|3,0,0]=4 846 B8R1.4 Cc1cc(Br)cnn1 Amb35789715 [0,1,0,0,0,0|3,0,0]=4 847 B8R1.4 Cc1cc(Br)ncn1 Amb10600007 [0,1,0,0,0,0|3,0,0]=4 848 B8R1.4 Cc1cc(C)ncn1 Amb8513149 [0,1,0,0,0,0|3,0,0]=4 849 B8R1.4 Cc1cc(Cl)ccn1 Amb2686432 [0,1,0,0,0,0|2,0,0]=3 850 B8R1.4 Cc1cc(Cl)ccn1 Amb6365914 [0,1,0,0,0,0|2,0,0]=3 851 B8R1.4 Cc1cc(Cl)cnn1 Amb25087262 [0,1,0,0,0,0|3,0,0]=4 852 B8R1.4 Cc1cc(Cl)ncn1 Amb2537123 [0,1,0,0,0,0|3,0,0]=4 853 B8R1.4 Cc1cc(F)ccn1 Amb15691009 [0,1,0,0,0,0|2,0,0]=3 854 B8R1.4 Cc1cc(F)ncn1 Amb24070267 [0,1,0,0,0,0|3,0,0]=4 855 B8R1.4 Cc1cc(I)ccn1 Amb15691010 [0,1,0,0,0,0|2,0,0]=3 856 B8R1.4 Cc1cc(I)ncn1 Amb24461637 [0,1,0,0,0,0|3,0,0]=4 857 B8R1.4 Cc1cc(N)ccn1 Amb1153241 [0,1,0,0,0,0|2,0,0]=3 858 B8R1.4 Cc1cc(N)ccn1 Amb17190918 [0,1,0,0,0,0|2,0,0]=3 859 B8R1.4 Cc1cc(N)cnn1 Amb23440870 [0,1,0,0,0,0|3,0,0]=4 860 B8R1.4 Cc1cc(N)cnn1 Amb28934879 [0,1,0,0,0,0|3,0,0]=4 861 B8R1.4 Cc1cc(N)ncn1 Amb2889515 [0,1,0,0,0,0|3,0,0]=4 862 B8R1.4 Cc1cc(O)ccn1 Amb8386833 [0,1,0,0,0,0|1,0,0]=2 863 B8R1.4 Cc1cc(O)ncn1 Amb2591526 [0,1,0,0,0,0|2,0,0]=3 864 B8R1.4 Cc1cc(O)ncn1 Amb33715886 [0,1,0,0,0,0|2,0,0]=3 865 B8R1.4 Cc1cc(S)ncn1 Amb2591542 [0,1,0,0,0,0|2,1,0]=4 866 B8R1.4 Cc1cc([S-])ccn1 Amb30585122 [0,1,0,0,0,0|1,1,0]=3 867 B8R1.4 Cc1ccc[n+](N)c1 Amb28423948 [0,1,0,0,0,0|2,0,0]=3 868 B8R1.4 Cc1ccc[n+]([NH-])c1 Amb27446822 [0,1,0,0,0,0|2,0,0]=3 869 B8R1.4 Cc1ccc[n+]([O-])c1 Amb17776980 [0,1,0,0,0,0|1,0,1]=3 870 B8R1.4 Cc1ccc[n+]([O-])n1 Amb27817004 [0,1,0,0,0,0|2,0,1]=4 871 B8R1.4 Cc1cccc(Br)c1 Amb2685511 [0,1,0,0,0,0|1,0,0]=2 872 B8R1.4 Cc1cccc(Br)n1 Amb2685342 [0,1,0,0,0,0|2,0,0]=3 873 B8R1.4 Cc1cccc(C)c1 Amb6608996 [0,1,0,0,0,0|1,0,0]=2 874 B8R1.4 Cc1cccc(C)n1 Amb22734688 [0,1,0,0,0,0|2,0,0]=3 875 B8R1.4 Cc1cccc(C)n1 Amb2609959 [0,1,0,0,0,0|2,0,0]=3 876 B8R1.4 Cc1cccc(Cl)c1 Amb6296593 [0,1,0,0,0,0|1,0,0]=2 877 B8R1.4 Cc1cccc(Cl)n1 Amb3939995 [0,1,0,0,0,0|2,0,0]=3 878 B8R1.4 Cc1cccc(F)c1 Amb2688427 [0,1,0,0,0,0|1,0,0]=2 879 B8R1.4 Cc1cccc(F)n1 Amb2688234 [0,1,0,0,0,0|2,0,0]=3 880 B8R1.4 Cc1cccc(I)c1 Amb2688892 [0,1,0,0,0,0|1,0,0]=2 881 B8R1.4 Cc1cccc(I)n1 Amb16230965 [0,1,0,0,0,0|2,0,0]=3 882 B8R1.4 Cc1cccc(N)c1 Amb2792819 [0,1,0,0,0,0|1,0,0]=2 883 B8R1.4 Cc1cccc(N)c1 Amb4026398 [0,1,0,0,0,0|1,0,0]=2 884 B8R1.4 Cc1cccc(N)n1 Amb1935084 [0,1,0,0,0,0|2,0,0]=3 885 B8R1.4 Cc1cccc(O)c1 Amb3939017 [0,1,0,0,0,0|0,0,0]=1 886 B8R1.4 Cc1cccc(O)n1 Amb2725655 [0,1,0,0,0,0|1,0,0]=2 887 B8R1.4 Cc1cccc(S)c1 Amb2690595 [0,1,0,0,0,0|0,1,0]=2 888 B8R1.4 Cc1cccc(S)n1 Amb17943113 [0,1,0,0,0,0|1,1,0]=3 889 B8R1.4 Cc1cccn(=O)c1 Amb20621989 [0,1,0,0,0,0|1,0,1]=3 890 B8R1.4 Cc1ccnc(Br)c1 Amb4476992 [0,1,0,0,0,0|2,0,0]=3 891 B8R1.4 Cc1ccnc(Br)n1 Amb8629076 [0,1,0,0,0,0|3,0,0]=4 892 B8R1.4 Cc1ccnc(C)c1 Amb6891936 [0,1,0,0,0,0|2,0,0]=3 893 B8R1.4 Cc1ccnc(C)n1 Amb22491311 [0,1,0,0,0,0|3,0,0]=4 894 B8R1.4 Cc1ccnc(Cl)c1 Amb2686244 [0,1,0,0,0,0|2,0,0]=3 895 B8R1.4 Cc1ccnc(Cl)n1 Amb2786105 [0,1,0,0,0,0|3,0,0]=4 896 B8R1.4 Cc1ccnc(F)c1 Amb2447353 [0,1,0,0,0,0|2,0,0]=3 897 B8R1.4 Cc1ccnc(I)c1 Amb19930103 [0,1,0,0,0,0|2,0,0]=3 898 B8R1.4 Cc1ccnc(I)n1 Amb22497942 [0,1,0,0,0,0|3,0,0]=4 899 B8R1.4 Cc1ccnc(N)c1 Amb1353207 [0,1,0,0,0,0|2,0,0]=3 900 B8R1.4 Cc1ccnc(N)n1 Amb2684479 [0,1,0,0,0,0|3,0,0]=4 901 B8R1.4 Cc1ccnc(O)n1 Amb2717748 [0,1,0,0,0,0|2,0,0]=3 902 B8R1.4 Cc1ccnc(O)n1 Amb8397264 [0,1,0,0,0,0|2,0,0]=3 903 B8R1.4 Cc1ccnc(S)c1 Amb22298792 [0,1,0,0,0,0|1,1,0]=3 904 B8R1.4 Cc1ccnc(S)n1 Amb17758427 [0,1,0,0,0,0|2,1,0]=4 905 B8R1.4 Cc1ccnc(S)n1 Amb3467894 [0,1,0,0,0,0|2,1,0]=4 906 B8R1.4 Cc1cncc(Br)c1 Amb21964859 [0,1,0,0,0,0|2,0,0]=3 907 B8R1.4 Cc1cncc(Br)c1 Amb2610070 [0,1,0,0,0,0|2,0,0]=3 908 B8R1.4 Cc1cncc(Br)n1 Amb10068364 [0,1,0,0,0,0|3,0,0]=4 909 B8R1.4 Cc1cncc(C)c1 Amb8387099 [0,1,0,0,0,0|2,0,0]=3 910 B8R1.4 Cc1cncc(C)n1 Amb8387600 [0,1,0,0,0,0|3,0,0]=4 911 B8R1.4 Cc1cncc(Cl)c1 Amb10602291 [0,1,0,0,0,0|2,0,0]=3 912 B8R1.4 Cc1cncc(Cl)n1 Amb2725017 [0,1,0,0,0,0|3,0,0]=4 913 B8R1.4 Cc1cncc(F)c1 Amb8393037 [0,1,0,0,0,0|2,0,0]=3 914 B8R1.4 Cc1cncc(I)c1 Amb27870759 [0,1,0,0,0,0|2,0,0]=3 915 B8R1.4 Cc1cncc(I)n1 Amb28129757 [0,1,0,0,0,0|3,0,0]=4 916 B8R1.4 Cc1cncc(N)c1 Amb10071116 [0,1,0,0,0,0|2,0,0]=3 917 B8R1.4 Cc1cncc(N)c1 Amb2447680 [0,1,0,0,0,0|2,0,0]=3 918 B8R1.4 Cc1cncc(N)n1 Amb10071574 [0,1,0,0,0,0|3,0,0]=4 919 B8R1.4 Cc1cncc(O)c1 Amb3978939 [0,1,0,0,0,0|1,0,0]=2 920 B8R1.4 Cc1cncc(O)n1 Amb10599623 [0,1,0,0,0,0|2,0,0]=3 921 B8R1.4 Cc1cncc(S)c1 Amb24062447 [0,1,0,0,0,0|1,1,0]=3 922 B8R1.4 Cc1cnnc(C)c1 Amb25244726 [0,1,0,0,0,0|3,0,0]=4 923 B8R1.4 Cc1cnnc(Cl)c1 Amb19889581 [0,1,0,0,0,0|3,0,0]=4 924 B8R1.4 Cc1cnnc(Cl)c1 Amb33544511 [0,1,0,0,0,0|3,0,0]=4 925 B8R1.4 Cc1cnnc(F)c1 Amb29879742 [0,1,0,0,0,0|3,0,0]=4 926 B8R1.4 Cc1cnnc(I)c1 Amb25960029 [0,1,0,0,0,0|3,0,0]=4 927 B8R1.4 Cc1cnnc(N)c1 Amb33543930 [0,1,0,0,0,0|3,0,0]=4 928 B8R1.4 Cc1cnnc(O)c1 Amb32882487 [0,1,0,0,0,0|2,0,0]=3 929 B8R1.4 Cc1cnnc(O)n1 Amb28315727 [0,1,0,0,0,0|3,0,0]=4 930 B8R1.4 Cc1nccc(Br)n1 Amb10599356 [0,1,0,0,0,0|3,0,0]=4 931 B8R1.4 Cc1nccc(Cl)n1 Amb19889582 [0,1,0,0,0,0|3,0,0]=4 932 B8R1.4 Cc1nccc(Cl)n1 Amb31307748 [0,1,0,0,0,0|3,0,0]=4 933 B8R1.4 Cc1nccc(Cl)n1 Amb33532358 [0,1,0,0,0,0|3,0,0]=4 934 B8R1.4 Cc1nccc(I)n1 Amb33549147 [0,1,0,0,0,0|3,0,0]=4 935 B8R1.4 Cc1nccc(N)n1 Amb19514680 [0,1,0,0,0,0|3,0,0]=4 936 B8R1.4 Cc1nccc(N)n1 Amb4424874 [0,1,0,0,0,0|3,0,0]=4 937 B8R1.4 Cc1nccc(O)n1 Amb34931051 [0,1,0,0,0,0|2,0,0]=3 938 B8R1.4 Cc1nccc(O)n1 Amb5846634 [0,1,0,0,0,0|2,0,0]=3 939 B8R1.4 Clc1cc(Br)ccn1 Amb6297075 [0,1,0,0,0,0|2,0,0]=3 940 B8R1.4 Clc1cc(Br)cnn1 Amb20670774 [0,1,0,0,0,0|3,0,0]=4 941 B8R1.4 Clc1cc(Br)ncn1 Amb10599309 [0,1,0,0,0,0|3,0,0]=4 942 B8R1.4 Clc1cc(Cl)ncn1 Amb488373 [0,1,0,0,0,0|3,0,0]=4 943 B8R1.4 Clc1cc(I)ccn1 Amb2447146 [0,1,0,0,0,0|2,0,0]=3 944 B8R1.4 Clc1cc(I)ncn1 Amb22496104 [0,1,0,0,0,0|3,0,0]=4 945 B8R1.4 Clc1cccc(Br)c1 Amb2684988 [0,1,0,0,0,0|1,0,0]=2 946 B8R1.4 Clc1cccc(Br)n1 Amb8386470 [0,1,0,0,0,0|2,0,0]=3 947 B8R1.4 Clc1cccc(Cl)c1 Amb8385421 [0,1,0,0,0,0|1,0,0]=2 948 B8R1.4 Clc1cccc(Cl)n1 Amb2609916 [0,1,0,0,0,0|2,0,0]=3 949 B8R1.4 Clc1cccc(I)c1 Amb2686129 [0,1,0,0,0,0|1,0,0]=2 950 B8R1.4 Clc1cccc(I)n1 Amb6565077 [0,1,0,0,0,0|2,0,0]=3 951 B8R1.4 Clc1ccnc(Br)c1 Amb2455915 [0,1,0,0,0,0|2,0,0]=3 952 B8R1.4 Clc1ccnc(Br)n1 Amb13884110 [0,1,0,0,0,0|3,0,0]=4 953 B8R1.4 Clc1ccnc(Cl)c1 Amb1088997 [0,1,0,0,0,0|2,0,0]=3 954 B8R1.4 Clc1ccnc(Cl)n1 Amb1154662 [0,1,0,0,0,0|3,0,0]=4 955 B8R1.4 Clc1ccnc(I)c1 Amb20248134 [0,1,0,0,0,0|2,0,0]=3 956 B8R1.4 Clc1ccnc(I)n1 Amb25024199 [0,1,0,0,0,0|3,0,0]=4 957 B8R1.4 Clc1cncc(Br)c1 Amb2696794 [0,1,0,0,0,0|2,0,0]=3 958 B8R1.4 Clc1cncc(Br)n1 Amb10599628 [0,1,0,0,0,0|3,0,0]=4 959 B8R1.4 Clc1cncc(Cl)c1 Amb8385150 [0,1,0,0,0,0|2,0,0]=3 960 B8R1.4 Clc1cncc(Cl)n1 Amb2455791 [0,1,0,0,0,0|3,0,0]=4 961 B8R1.4 Clc1cncc(I)c1 Amb6565104 [0,1,0,0,0,0|2,0,0]=3 962 B8R1.4 Clc1cncc(I)n1 Amb25262810 [0,1,0,0,0,0|3,0,0]=4 963 B8R1.4 Clc1cnnc(Cl)c1 Amb10982612 [0,1,0,0,0,0|3,0,0]=4 964 B8R1.4 Clc1nccc(Br)n1 Amb13884111 [0,1,0,0,0,0|3,0,0]=4 965 B8R1.4 Clc1nccc(I)n1 Amb22292152 [0,1,0,0,0,0|3,0,0]=4 966 B8R1.4 FC1=CC=CN(Cl)N1 Amb24527704 [0,1,0,0,0,0|3,0,0]=4 967 B8R1.4 FC1=CC=NC(=S)N1 Amb27590317 [0,1,0,0,0,0|2,1,0]=4 968 B8R1.4 FC1=CN=CC(=S)N1 Amb22388306 [0,1,0,0,0,0|2,1,0]=4 969 B8R1.4 Fc1cc(Br)ccn1 Amb2455787 [0,1,0,0,0,0|2,0,0]=3 970 B8R1.4 Fc1cc(Br)ncn1 Amb20615920 [0,1,0,0,0,0|3,0,0]=4 971 B8R1.4 Fc1cc(Cl)ccn1 Amb13884059 [0,1,0,0,0,0|2,0,0]=3 972 B8R1.4 Fc1cc(Cl)ncn1 Amb10067303 [0,1,0,0,0,0|3,0,0]=4 973 B8R1.4 Fc1cc(F)ncn1 Amb10839561 [0,1,0,0,0,0|3,0,0]=4 974 B8R1.4 Fc1cc(I)ccn1 Amb2455816 [0,1,0,0,0,0|2,0,0]=3 975 B8R1.4 Fc1cc(I)ncn1 Amb24537069 [0,1,0,0,0,0|3,0,0]=4 976 B8R1.4 Fc1cc(S)ccn1 Amb26416447 [0,1,0,0,0,0|1,1,0]=3 977 B8R1.4 Fc1cccc(Br)c1 Amb2685183 [0,1,0,0,0,0|1,0,0]=2 978 B8R1.4 Fc1cccc(Br)n1 Amb2455909 [0,1,0,0,0,0|2,0,0]=3 979 B8R1.4 Fc1cccc(Cl)c1 Amb2685937 [0,1,0,0,0,0|1,0,0]=2 980 B8R1.4 Fc1cccc(Cl)n1 Amb8396767 [0,1,0,0,0,0|2,0,0]=3 981 B8R1.4 Fc1cccc(F)c1 Amb2687052 [0,1,0,0,0,0|1,0,0]=2 982 B8R1.4 Fc1cccc(F)n1 Amb2687277 [0,1,0,0,0,0|2,0,0]=3 983 B8R1.4 Fc1cccc(I)c1 Amb2688122 [0,1,0,0,0,0|1,0,0]=2 984 B8R1.4 Fc1cccc(I)n1 Amb24056006 [0,1,0,0,0,0|2,0,0]=3 985 B8R1.4 Fc1cccc(S)c1 Amb2688424 [0,1,0,0,0,0|0,1,0]=2 986 B8R1.4 Fc1cccc(S)n1 Amb25238819 [0,1,0,0,0,0|1,1,0]=3 987 B8R1.4 Fc1cccc([Mg+])c1 Amb21618833 [0,1,0,0,0,0|1,0,0]=2 988 B8R1.4 Fc1ccnc(Br)c1 Amb8396775 [0,1,0,0,0,0|2,0,0]=3 989 B8R1.4 Fc1ccnc(Br)n1 Amb20618448 [0,1,0,0,0,0|3,0,0]=4 990 B8R1.4 Fc1ccnc(Cl)c1 Amb1088996 [0,1,0,0,0,0|2,0,0]=3 991 B8R1.4 Fc1ccnc(F)c1 Amb8388363 [0,1,0,0,0,0|2,0,0]=3 992 B8R1.4 Fc1ccnc(F)n1 Amb2691921 [0,1,0,0,0,0|3,0,0]=4 993 B8R1.4 Fc1ccnc(I)n1 Amb26573182 [0,1,0,0,0,0|3,0,0]=4 994 B8R1.4 Fc1ccnc(S)c1 Amb24332692 [0,1,0,0,0,0|1,1,0]=3 995 B8R1.4 Fc1cncc(Br)c1 Amb2447544 [0,1,0,0,0,0|2,0,0]=3 996 B8R1.4 Fc1cncc(Br)n1 Amb20618548 [0,1,0,0,0,0|3,0,0]=4 997 B8R1.4 Fc1cncc(Cl)c1 Amb15691042 [0,1,0,0,0,0|2,0,0]=3 998 B8R1.4 Fc1cncc(F)c1 Amb6297625 [0,1,0,0,0,0|2,0,0]=3 999 B8R1.4 Fc1cncc(F)n1 Amb21961620 [0,1,0,0,0,0|3,0,0]=4 1000 B8R1.4 Fc1cncc(I)c1 Amb6565120 [0,1,0,0,0,0|2,0,0]=3 1001 B8R1.4 Fc1cncc(I)n1 Amb21961558 [0,1,0,0,0,0|3,0,0]=4 1002 B8R1.4 Fc1cncc(S)c1 Amb28141866 [0,1,0,0,0,0|1,1,0]=3 1003 B8R1.4 Fc1nccc(Br)n1 Amb20242091 [0,1,0,0,0,0|3,0,0]=4 1004 B8R1.4 Fc1nccc(Cl)n1 Amb22276512 [0,1,0,0,0,0|3,0,0]=4 1005 B8R1.4 Fc1nccc(I)n1 Amb26639398 [0,1,0,0,0,0|3,0,0]=4 1006 B8R1.4 Ic1cc(I)ncn1 Amb2455912 [0,1,0,0,0,0|3,0,0]=4 1007 B8R1.4 Ic1cccc(I)c1 Amb2687312 [0,1,0,0,0,0|1,0,0]=2 1008 B8R1.4 Ic1cccc(I)n1 Amb6565069 [0,1,0,0,0,0|2,0,0]=3 1009 B8R1.4 Ic1ccnc(I)c1 Amb10602540 [0,1,0,0,0,0|2,0,0]=3 1010 B8R1.4 Ic1ccnc(I)n1 Amb16231000 [0,1,0,0,0,0|3,0,0]=4 1011 B8R1.4 Ic1cncc(I)c1 Amb4057230 [0,1,0,0,0,0|2,0,0]=3 1012 B8R1.4 Ic1cncc(I)n1 Amb2455937 [0,1,0,0,0,0|3,0,0]=4 1013 B8R1.4 N=C1C=CNC(=O)N1 Amb22522784 [0,1,0,0,0,0|2,0,1]=4 1014 B8R1.4 NC1=CC(=O)N=CN1 Amb22489480 [0,1,0,0,0,0|2,0,1]=4 1015 B8R1.4 NC1=CC(=O)NC=C1 Amb18641608 [0,1,0,0,0,0|1,0,1]=3 1016 B8R1.4 NC1=CC(=O)NC=C1 Amb33716235 [0,1,0,0,0,0|1,0,1]=3 1017 B8R1.4 NC1=CC(=O)NN=C1 Amb18641633 [0,1,0,0,0,0|2,0,1]=4 1018 B8R1.4 NC1=CC(=S)NC=N1 Amb18523140 [0,1,0,0,0,0|2,1,0]=4 1019 B8R1.4 NC1=CC=CC(=O)N1 Amb18641610 [0,1,0,0,0,0|1,0,1]=3 1020 B8R1.4 NC1=CC=CC(=S)N1 Amb23440527 [0,1,0,0,0,0|1,1,0]=3 1021 B8R1.4 NC1=CC=NC(=O)N1 Amb20239413 [0,1,0,0,0,0|2,0,1]=4 1022 B8R1.4 NC1=CC=NC(O)N1 Amb28239207 [0,1,0,0,0,0|2,0,1]=4 1023 B8R1.4 NC1=NC(=O)C=CN1 Amb21951843 [0,1,0,0,0,0|2,0,1]=4 1024 B8R1.4 NC1=NC(=O)NC=C1 Amb18511886 [0,1,0,0,0,0|2,0,1]=4 1025 B8R1.4 NC1=NC(=S)NC=C1 Amb21683243 [0,1,0,0,0,0|2,1,0]=4 1026 B8R1.4 NC1=NC=CC(=O)N1 Amb18278001 [0,1,0,0,0,0|2,0,1]=4 1027 B8R1.4 N[n+]1cccc(I)c1 Amb27162167 [0,1,0,0,0,0|2,0,0]=3 1028 B8R1.4 Nc1cc(Br)ccn1 Amb22831299 [0,1,0,0,0,0|2,0,0]=3 1029 B8R1.4 Nc1cc(Br)ccn1 Amb2540669 [0,1,0,0,0,0|2,0,0]=3 1030 B8R1.4 Nc1cc(Br)cnn1 Amb22263100 [0,1,0,0,0,0|3,0,0]=4 1031 B8R1.4 Nc1cc(Br)ncn1 Amb10600056 [0,1,0,0,0,0|3,0,0]=4 1032 B8R1.4 Nc1cc(Cl)ccn1 Amb22493978 [0,1,0,0,0,0|2,0,0]=3 1033 B8R1.4 Nc1cc(Cl)ccn1 Amb2610815 [0,1,0,0,0,0|2,0,0]=3 1034 B8R1.4 Nc1cc(Cl)cnn1 Amb18124329 [0,1,0,0,0,0|3,0,0]=4 1035 B8R1.4 Nc1cc(Cl)ncn1 Amb844749 [0,1,0,0,0,0|3,0,0]=4 1036 B8R1.4 Nc1cc(F)ccn1 Amb16230409 [0,1,0,0,0,0|2,0,0]=3 1037 B8R1.4 Nc1cc(F)ccn1 Amb28854821 [0,1,0,0,0,0|2,0,0]=3 1038 B8R1.4 Nc1cc(F)ncn1 Amb16204889 [0,1,0,0,0,0|3,0,0]=4 1039 B8R1.4 Nc1cc(I)ccn1 Amb8629875 [0,1,0,0,0,0|2,0,0]=3 1040 B8R1.4 Nc1cc(I)ncn1 Amb19957612 [0,1,0,0,0,0|3,0,0]=4 1041 B8R1.4 Nc1cc(N)ncn1 Amb22369069 [0,1,0,0,0,0|3,0,0]=4 1042 B8R1.4 Nc1cc(N)ncn1 Amb24100882 [0,1,0,0,0,0|3,0,0]=4 1043 B8R1.4 Nc1cc(N)ncn1 Amb2591545 [0,1,0,0,0,0|3,0,0]=4 1044 B8R1.4 Nc1cc(O)ccn1 Amb21864971 [0,1,0,0,0,0|1,0,0]=2 1045 B8R1.4 Nc1cc(O)ccn1 Amb2697549 [0,1,0,0,0,0|1,0,0]=2 1046 B8R1.4 Nc1cc(O)cnn1 Amb27169669 [0,1,0,0,0,0|2,0,0]=3 1047 B8R1.4 Nc1cc(O)ncn1 Amb2591552 [0,1,0,0,0,0|2,0,0]=3 1048 B8R1.4 Nc1ccc[n+]([O-])c1 Amb10576561 [0,1,0,0,0,0|1,0,1]=3 1049 B8R1.4 Nc1ccc[n+]([O-])c1 Amb32409824 [0,1,0,0,0,0|1,0,1]=3 1050 B8R1.4 Nc1cccc(Br)[nH+]1 Amb33513100 [0,1,0,0,0,0|2,0,0]=3 1051 B8R1.4 Nc1cccc(Br)c1 Amb2684945 [0,1,0,0,0,0|1,0,0]=2 1052 B8R1.4 Nc1cccc(Br)n1 Amb2609453 [0,1,0,0,0,0|2,0,0]=3 1053 B8R1.4 Nc1cccc(Cl)c1 Amb2792822 [0,1,0,0,0,0|1,0,0]=2 1054 B8R1.4 Nc1cccc(Cl)n1 Amb2609504 [0,1,0,0,0,0|2,0,0]=3 1055 B8R1.4 Nc1cccc(F)c1 Amb2389842 [0,1,0,0,0,0|1,0,0]=2 1056 B8R1.4 Nc1cccc(F)c1 Amb2688012 [0,1,0,0,0,0|1,0,0]=2 1057 B8R1.4 Nc1cccc(F)n1 Amb2691843 [0,1,0,0,0,0|2,0,0]=3 1058 B8R1.4 Nc1cccc(I)c1 Amb1159093 [0,1,0,0,0,0|1,0,0]=2 1059 B8R1.4 Nc1cccc(I)n1 Amb6565080 [0,1,0,0,0,0|2,0,0]=3 1060 B8R1.4 Nc1cccc(N)c1 Amb16233978 [0,1,0,0,0,0|1,0,0]=2 1061 B8R1.4 Nc1cccc(N)c1 Amb2725541 [0,1,0,0,0,0|1,0,0]=2 1062 B8R1.4 Nc1cccc(N)c1 Amb3940452 [0,1,0,0,0,0|1,0,0]=2 1063 B8R1.4 Nc1cccc(N)n1 Amb2611113 [0,1,0,0,0,0|2,0,0]=3 1064 B8R1.4 Nc1cccc(O)c1 Amb6447190 [0,1,0,0,0,0|0,0,0]=1 1065 B8R1.4 Nc1cccc(O)n1 Amb24081549 [0,1,0,0,0,0|1,0,0]=2 1066 B8R1.4 Nc1cccc(O)n1 Amb33544412 [0,1,0,0,0,0|1,0,0]=2 1067 B8R1.4 Nc1cccc(S)c1 Amb32652999 [0,1,0,0,0,0|0,1,0]=2 1068 B8R1.4 Nc1cccc(S)c1 Amb535732 [0,1,0,0,0,0|0,1,0]=2 1069 B8R1.4 Nc1cccn(=O)c1 Amb17749044 [0,1,0,0,0,0|1,0,1]=3 1070 B8R1.4 Nc1ccn[n+]([O-])c1 Amb25702083 [0,1,0,0,0,0|2,0,1]=4 1071 B8R1.4 Nc1ccnc(Br)c1 Amb2455863 [0,1,0,0,0,0|2,0,0]=3 1072 B8R1.4 Nc1ccnc(Br)c1 Amb32409353 [0,1,0,0,0,0|2,0,0]=3 1073 B8R1.4 Nc1ccnc(Br)n1 Amb10601008 [0,1,0,0,0,0|3,0,0]=4 1074 B8R1.4 Nc1ccnc(Cl)c1 Amb534986 [0,1,0,0,0,0|2,0,0]=3 1075 B8R1.4 Nc1ccnc(Cl)n1 Amb2610008 [0,1,0,0,0,0|3,0,0]=4 1076 B8R1.4 Nc1ccnc(F)c1 Amb8396906 [0,1,0,0,0,0|2,0,0]=3 1077 B8R1.4 Nc1ccnc(F)n1 Amb8495537 [0,1,0,0,0,0|3,0,0]=4 1078 B8R1.4 Nc1ccnc(I)n1 Amb24637009 [0,1,0,0,0,0|3,0,0]=4 1079 B8R1.4 Nc1ccnc(N)c1 Amb33483437 [0,1,0,0,0,0|2,0,0]=3 1080 B8R1.4 Nc1ccnc(N)c1 Amb8396965 [0,1,0,0,0,0|2,0,0]=3 1081 B8R1.4 Nc1ccnc(N)n1 Amb8516877 [0,1,0,0,0,0|3,0,0]=4 1082 B8R1.4 Nc1ccnc(O)c1 Amb2697410 [0,1,0,0,0,0|1,0,0]=2 1083 B8R1.4 Nc1ccnc(S)c1 Amb18278072 [0,1,0,0,0,0|1,1,0]=3 1084 B8R1.4 Nc1ccnc(S)n1 Amb2591530 [0,1,0,0,0,0|2,1,0]=4 1085 B8R1.4 Nc1cncc(Br)c1 Amb2540663 [0,1,0,0,0,0|2,0,0]=3 1086 B8R1.4 Nc1cncc(Br)n1 Amb10599650 [0,1,0,0,0,0|3,0,0]=4 1087 B8R1.4 Nc1cncc(Cl)c1 Amb2610802 [0,1,0,0,0,0|2,0,0]=3 1088 B8R1.4 Nc1cncc(Cl)c1 Amb30585100 [0,1,0,0,0,0|2,0,0]=3 1089 B8R1.4 Nc1cncc(Cl)n1 Amb2455800 [0,1,0,0,0,0|3,0,0]=4 1090 B8R1.4 Nc1cncc(F)c1 Amb24102512 [0,1,0,0,0,0|2,0,0]=3 1091 B8R1.4 Nc1cncc(F)c1 Amb8396769 [0,1,0,0,0,0|2,0,0]=3 1092 B8R1.4 Nc1cncc(F)n1 Amb21961326 [0,1,0,0,0,0|3,0,0]=4 1093 B8R1.4 Nc1cncc(I)n1 Amb24319382 [0,1,0,0,0,0|3,0,0]=4 1094 B8R1.4 Nc1cncc(N)c1 Amb33328755 [0,1,0,0,0,0|2,0,0]=3 1095 B8R1.4 Nc1cncc(N)c1 Amb8396927 [0,1,0,0,0,0|2,0,0]=3 1096 B8R1.4 Nc1cncc(N)n1 Amb18641612 [0,1,0,0,0,0|3,0,0]=4 1097 B8R1.4 Nc1cncc(N)n1 Amb19958397 [0,1,0,0,0,0|3,0,0]=4 1098 B8R1.4 Nc1cncc(O)c1 Amb17739826 [0,1,0,0,0,0|1,0,0]=2 1099 B8R1.4 Nc1cncc(O)c1 Amb2697550 [0,1,0,0,0,0|1,0,0]=2 1100 B8R1.4 Nc1cncc(O)n1 Amb10600359 [0,1,0,0,0,0|2,0,0]=3 1101 B8R1.4 Nc1cnnc(Br)c1 Amb22500401 [0,1,0,0,0,0|3,0,0]=4 1102 B8R1.4 Nc1cnnc(Cl)c1 Amb18124331 [0,1,0,0,0,0|3,0,0]=4 1103 B8R1.4 Nc1nccc(Br)n1 Amb10975351 [0,1,0,0,0,0|3,0,0]=4 1104 B8R1.4 Nc1nccc(Cl)n1 Amb2570571 [0,1,0,0,0,0|3,0,0]=4 1105 B8R1.4 Nc1nccc(F)n1 Amb22495090 [0,1,0,0,0,0|3,0,0]=4 1106 B8R1.4 Nc1nccc(I)n1 Amb10602752 [0,1,0,0,0,0|3,0,0]=4 1107 B8R1.4 Nc1nccc(O)n1 Amb8397233 [0,1,0,0,0,0|2,0,0]=3 1108 B8R1.4 O=C1C=C(Br)C=CN1 Amb22292027 [0,1,0,0,0,0|1,0,1]=3 1109 B8R1.4 O=C1C=C(Br)C=NN1 Amb24481408 [0,1,0,0,0,0|2,0,1]=4 1110 B8R1.4 O=C1C=C(Br)N=CC1 Amb23401280 [0,1,0,0,0,0|1,0,2]=4 1111 B8R1.4 O=C1C=C(Cl)C=CN1 Amb18625105 [0,1,0,0,0,0|1,0,1]=3 1112 B8R1.4 O=C1C=C(Cl)C=CO1 Amb22001907 [0,1,0,0,0,0|1,0,1]=3 1113 B8R1.4 O=C1C=C(Cl)C=NN1 Amb19664791 [0,1,0,0,0,0|2,0,1]=4 1114 B8R1.4 O=C1C=C(Cl)N=CC1 Amb22500053 [0,1,0,0,0,0|1,0,2]=4 1115 B8R1.4 O=C1C=C(Cl)NC=N1 Amb20620851 [0,1,0,0,0,0|2,0,1]=4 1116 B8R1.4 O=C1C=C(F)C=CN1 Amb22008561 [0,1,0,0,0,0|1,0,1]=3 1117 B8R1.4 O=C1C=C(F)C=NN1 Amb25089266 [0,1,0,0,0,0|2,0,1]=4 1118 B8R1.4 O=C1C=C(I)C=CN1 Amb19664790 [0,1,0,0,0,0|1,0,1]=3 1119 B8R1.4 O=C1C=C(I)C=NN1 Amb19958225 [0,1,0,0,0,0|2,0,1]=4 1120 B8R1.4 O=C1C=C(I)N=CN1 Amb26362491 [0,1,0,0,0,0|2,0,1]=4 1121 B8R1.4 O=C1C=C(O)C=CN1 Amb19958639 [0,1,0,0,0,0|1,0,0]=2 1122 B8R1.4 O=C1C=C(O)CCC1 Amb17844413 [0,1,0,0,0,0|0,0,3]=4 1123 B8R1.4 O=C1C=C(O)COC1 Amb28048998 [0,1,0,0,0,0|1,0,2]=4 1124 B8R1.4 O=C1C=C(O)N=CN1 Amb19131914 [0,1,0,0,0,0|2,0,0]=3 1125 B8R1.4 O=C1C=C(S)NC=N1 Amb20620608 [0,1,0,0,0,0|2,0,1]=4 1126 B8R1.4 O=C1C=C=CC(=O)C1 Amb27486115 [0,1,0,0,0,0|0,0,3]=4 1127 B8R1.4 O=C1C=CC=C(Br)N1 Amb18040563 [0,1,0,0,0,0|1,0,1]=3 1128 B8R1.4 O=C1C=CC=C(Cl)N1 Amb20623033 [0,1,0,0,0,0|1,0,1]=3 1129 B8R1.4 O=C1C=CC=C(Cl)O1 Amb22337145 [0,1,0,0,0,0|1,0,1]=3 1130 B8R1.4 O=C1C=CC=C(I)N1 Amb24651389 [0,1,0,0,0,0|1,0,1]=3 1131 B8R1.4 O=C1C=CC=C(O)N1 Amb22347822 [0,1,0,0,0,0|1,0,0]=2 1132 B8R1.4 O=C1C=CC=[N+]([O-])N1 Amb27985357 [0,1,0,0,0,0|2,0,1]=4 1133 B8R1.4 O=C1C=CCC(=O)O1 Amb453190 [0,1,0,0,0,0|1,0,2]=4 1134 B8R1.4 O=C1C=CCC(O)C1 Amb27227199 [0,1,0,0,0,0|0,0,3]=4 1135 B8R1.4 O=C1C=CNC(=O)N1 Amb18028577 [0,1,0,0,0,0|2,0,1]=4 1136 B8R1.4 O=C1C=CNC(=O)O1 Amb21937546 [0,1,0,0,0,0|2,0,1]=4 1137 B8R1.4 O=C1C=CNC(=S)C1 Amb27207898 [0,1,0,0,0,0|1,0,2]=4 1138 B8R1.4 O=C1C=CNC(=S)N1 Amb18028423 [0,1,0,0,0,0|2,0,1]=4 1139 B8R1.4 O=C1C=CNC(Cl)=C1 Amb22489481 [0,1,0,0,0,0|1,0,1]=3 1140 B8R1.4 O=C1C=COC(=O)C1 Amb25358147 [0,1,0,0,0,0|1,0,2]=4 1141 B8R1.4 O=C1C=COC(O)=C1 Amb28456629 [0,1,0,0,0,0|1,0,0]=2 1142 B8R1.4 O=C1C=NC=C(Br)N1 Amb22499624 [0,1,0,0,0,0|2,0,1]=4 1143 B8R1.4 O=C1C=NC=C(Cl)N1 Amb20527586 [0,1,0,0,0,0|2,0,1]=4 1144 B8R1.4 O=C1C=NC=C(F)N1 Amb22387081 [0,1,0,0,0,0|2,0,1]=4 1145 B8R1.4 O=C1C=NN=C(O)N1 Amb18277581 [0,1,0,0,0,0|3,0,0]=4 1146 B8R1.4 O=C1CC(O)=NC=N1 Amb19748545 [0,1,0,0,0,0|2,0,1]=4 1147 B8R1.4 O=C1CC=CC(Cl)=N1 Amb2609501 [0,1,0,0,0,0|1,0,2]=4 1148 B8R1.4 O=C1N=C(Cl)C=CN1 Amb22001986 [0,1,0,0,0,0|2,0,1]=4 1149 B8R1.4 O=C1NC=CC(=S)N1 Amb21964570 [0,1,0,0,0,0|2,0,1]=4 1150 B8R1.4 O=n1cccc(F)c1 Amb20621374 [0,1,0,0,0,0|1,0,1]=3 1151 B8R1.4 O=n1cccc(O)c1 Amb20621449 [0,1,0,0,0,0|1,0,0]=2 1152 B8R1.4 OC1=NC(=S)NC=C1 Amb19748546 [0,1,0,0,0,0|2,0,0]=3 1153 B8R1.4 ON1=CC(Cl)=CC=C1 Amb17772574 [0,1,0,0,0,0|1,0,0]=2 1154 B8R1.4 Oc1cc(Br)ccn1 Amb2609499 [0,1,0,0,0,0|1,0,0]=2 1155 B8R1.4 Oc1cc(Br)ncn1 Amb10600043 [0,1,0,0,0,0|2,0,0]=3 1156 B8R1.4 Oc1cc(Cl)ccn1 Amb2686116 [0,1,0,0,0,0|1,0,0]=2 1157 B8R1.4 Oc1cc(Cl)cnn1 Amb22295742 [0,1,0,0,0,0|2,0,0]=3 1158 B8R1.4 Oc1cc(Cl)ncn1 Amb2609464 [0,1,0,0,0,0|2,0,0]=3 1159 B8R1.4 Oc1cc(F)ncn1 Amb26068762 [0,1,0,0,0,0|2,0,0]=3 1160 B8R1.4 Oc1cc(O)ncn1 Amb6370863 [0,1,0,0,0,0|2,0,0]=3 1161 B8R1.4 Oc1cc(S)ccn1 Amb24695775 [0,1,0,0,0,0|1,0,0]=2 1162 B8R1.4 Oc1cccc(Br)c1 Amb2685386 [0,1,0,0,0,0|0,0,0]=1 1163 B8R1.4 Oc1cccc(Br)n1 Amb2613094 [0,1,0,0,0,0|1,0,0]=2 1164 B8R1.4 Oc1cccc(Cl)c1 Amb3939547 [0,1,0,0,0,0|0,0,0]=1 1165 B8R1.4 Oc1cccc(F)c1 Amb2688291 [0,1,0,0,0,0|0,0,0]=1 1166 B8R1.4 Oc1cccc(F)n1 Amb10603071 [0,1,0,0,0,0|1,0,0]=2 1167 B8R1.4 Oc1cccc(I)c1 Amb1159079 [0,1,0,0,0,0|0,0,0]=1 1168 B8R1.4 Oc1cccc(O)c1 Amb2793030 [0,1,0,0,0,0|0,0,0]=1 1169 B8R1.4 Oc1cccc(O)n1 Amb2696834 [0,1,0,0,0,0|1,0,0]=2 1170 B8R1.4 Oc1cccc(O)n1 Amb4034458 [0,1,0,0,0,0|1,0,0]=2 1171 B8R1.4 Oc1cccc(S)c1 Amb8383400 [0,1,0,0,0,0|0,0,0]=1 1172 B8R1.4 Oc1cccc(S)n1 Amb24470326 [0,1,0,0,0,0|1,0,0]=2 1173 B8R1.4 Oc1ccnc(Br)c1 Amb8386887 [0,1,0,0,0,0|1,0,0]=2 1174 B8R1.4 Oc1ccnc(Br)n1 Amb20617245 [0,1,0,0,0,0|2,0,0]=3 1175 B8R1.4 Oc1ccnc(Cl)c1 Amb2610061 [0,1,0,0,0,0|1,0,0]=2 1176 B8R1.4 Oc1ccnc(Cl)n1 Amb20241261 [0,1,0,0,0,0|2,0,0]=3 1177 B8R1.4 Oc1ccnc(F)c1 Amb10603604 [0,1,0,0,0,0|1,0,0]=2 1178 B8R1.4 Oc1ccnc(F)n1 Amb24695651 [0,1,0,0,0,0|2,0,0]=3 1179 B8R1.4 Oc1ccnc(I)c1 Amb27482579 [0,1,0,0,0,0|1,0,0]=2 1180 B8R1.4 Oc1ccnc(O)c1 Amb2609927 [0,1,0,0,0,0|1,0,0]=2 1181 B8R1.4 Oc1ccnc(O)c1 Amb33719306 [0,1,0,0,0,0|1,0,0]=2 1182 B8R1.4 Oc1ccnc(S)c1 Amb26929419 [0,1,0,0,0,0|1,0,0]=2 1183 B8R1.4 Oc1ccnc(S)n1 Amb753232 [0,1,0,0,0,0|2,0,0]=3 1184 B8R1.4 Oc1cncc(Br)c1 Amb2447638 [0,1,0,0,0,0|1,0,0]=2 1185 B8R1.4 Oc1cncc(Br)n1 Amb10600358 [0,1,0,0,0,0|2,0,0]=3 1186 B8R1.4 Oc1cncc(Cl)c1 Amb2725476 [0,1,0,0,0,0|1,0,0]=2 1187 B8R1.4 Oc1cncc(Cl)n1 Amb8855268 [0,1,0,0,0,0|2,0,0]=3 1188 B8R1.4 Oc1cncc(F)c1 Amb10576207 [0,1,0,0,0,0|1,0,0]=2 1189 B8R1.4 Oc1cncc(I)c1 Amb8426264 [0,1,0,0,0,0|1,0,0]=2 1190 B8R1.4 Oc1cncc(I)n1 Amb22388360 [0,1,0,0,0,0|2,0,0]=3 1191 B8R1.4 Oc1cncc(O)c1 Amb10602196 [0,1,0,0,0,0|1,0,0]=2 1192 B8R1.4 Oc1cncc(O)n1 Amb10600360 [0,1,0,0,0,0|2,0,0]=3 1193 B8R1.4 Oc1cnnc(Cl)c1 Amb22728711 [0,1,0,0,0,0|2,0,0]=3 1194 B8R1.4 Oc1cnnc(O)c1 Amb21963471 [0,1,0,0,0,0|2,0,0]=3 1195 B8R1.4 Oc1cnnc(S)n1 Amb837005 [0,1,0,0,0,0|3,0,0]=4 1196 B8R1.4 Oc1nccc(Br)n1 Amb10599404 [0,1,0,0,0,0|2,0,0]=3 1197 B8R1.4 Oc1nccc(F)n1 Amb25312300 [0,1,0,0,0,0|2,0,0]=3 1198 B8R1.4 Oc1nccc(I)n1 Amb26939094 [0,1,0,0,0,0|2,0,0]=3 1199 B8R1.4 Oc1nccc(S)n1 Amb3997279 [0,1,0,0,0,0|2,0,0]=3 1200 B8R1.4 S=C1C=C(Cl)C=CN1 Amb25268659 [0,1,0,0,0,0|1,1,0]=3 1201 B8R1.4 S=C1C=C(S)C=CN1 Amb28072789 [0,1,0,0,0,0|1,1,0]=3 1202 B8R1.4 S=C1C=CC=C(Br)N1 Amb24470776 [0,1,0,0,0,0|1,1,0]=3 1203 B8R1.4 S=C1C=CC=C(Cl)N1 Amb26006996 [0,1,0,0,0,0|1,1,0]=3 1204 B8R1.4 S=C1N=CC=C(Cl)N1 Amb22015367 [0,1,0,0,0,0|2,1,0]=4 1205 B8R1.4 Sc1cccc(Br)c1 Amb2372548 [0,1,0,0,0,0|0,1,0]=2 1206 B8R1.4 Sc1cccc(Cl)c1 Amb2686487 [0,1,0,0,0,0|0,1,0]=2 1207 B8R1.4 Sc1cccc(I)c1 Amb24483276 [0,1,0,0,0,0|0,1,0]=2 1208 B8R1.4 Sc1cccc(S)c1 Amb9820126 [0,1,0,0,0,0|0,1,0]=2 1209 B8R1.4 Sc1ccnc(Cl)c1 Amb22001495 [0,1,0,0,0,0|1,1,0]=3 1210 B8R1.4 Sc1ccnc(S)n1 Amb2591544 [0,1,0,0,0,0|2,1,0]=4 1211 B8R1.4 Sc1cncc(Br)c1 Amb22499840 [0,1,0,0,0,0|1,1,0]=3 1212 B8R1.4 Sc1nccc(I)n1 Amb2447123 [0,1,0,0,0,0|2,1,0]=4 1213 B8R1.4 [2H]c1nccc(Br)n1 Amb10597346 [0,1,0,0,0,0|3,0,0]=4 1214 B8R1.4 [2H]c1nccc(N)n1 Amb10597348 [0,1,0,0,0,0|3,0,0]=4 1215 B8R1.4 [Mg+]c1cccc(Cl)c1 Amb22044012 [0,1,0,0,0,0|1,0,0]=2 1216 B8R1.4 [O-][NH+]1C=CC=C(F)C1 Amb28315880 [0,1,0,0,0,0|1,0,2]=4 1217 B8R1.4 [O-][n+]1cccc(Br)c1 Amb2610013 [0,1,0,0,0,0|1,0,1]=3 1218 B8R1.4 [O-][n+]1cccc(Cl)c1 Amb8396904 [0,1,0,0,0,0|1,0,1]=3 1219 B8R1.4 [O-][n+]1cccc(F)c1 Amb13887013 [0,1,0,0,0,0|1,0,1]=3 1220 B8R1.4 [O-][n+]1cccc(I)c1 Amb2609502 [0,1,0,0,0,0|1,0,1]=3 1221 B8R1.4 [O-][n+]1cccc(O)c1 Amb2609929 [0,1,0,0,0,0|1,0,0]=2 1222 B8R1.4 [O-][n+]1ccnc(Cl)c1 Amb22057475 [0,1,0,0,0,0|2,0,1]=4 1223 B8R1.4 [O-][n+]1cncc(Br)c1 Amb22499690 [0,1,0,0,0,0|2,0,1]=4 1224 B8R1.4 [O-][n+]1cncc(Cl)c1 Amb27389854 [0,1,0,0,0,0|2,0,1]=4 1225 B8R1.4 [SiH3]c1cccc([SiH3])n1 Amb27453611 [0,1,0,0,0,0|2,0,0]=3 1226 B8R1.5 Brc1ccccc1Br Amb2686714 [0,1,0,0,0,0|1,0,0]=2 1227 B8R1.5 Brc1ccccc1I Amb2447546 [0,1,0,0,0,0|1,0,0]=2 1228 B8R1.5 Brc1cccnc1Br Amb2447549 [0,1,0,0,0,0|2,0,0]=3 1229 B8R1.5 Brc1cccnc1I Amb33549220 [0,1,0,0,0,0|2,0,0]=3 1230 B8R1.5 Brc1ccncc1Br Amb2609488 [0,1,0,0,0,0|2,0,0]=3 1231 B8R1.5 Brc1ccncc1I Amb20242567 [0,1,0,0,0,0|2,0,0]=3 1232 B8R1.5 Brc1ccnnc1Br Amb28059527 [0,1,0,0,0,0|3,0,0]=4 1233 B8R1.5 Brc1cnccc1I Amb20670449 [0,1,0,0,0,0|2,0,0]=3 1234 B8R1.5 Brc1cncnc1Br Amb23450328 [0,1,0,0,0,0|3,0,0]=4 1235 B8R1.5 Brc1cncnc1I Amb22497760 [0,1,0,0,0,0|3,0,0]=4 1236 B8R1.5 Brc1cnncc1Br Amb24553149 [0,1,0,0,0,0|3,0,0]=4 1237 B8R1.5 Brc1ncccc1I Amb19888868 [0,1,0,0,0,0|2,0,0]=3 1238 B8R1.5 Brc1nccnc1Br Amb19957641 [0,1,0,0,0,0|3,0,0]=4 1239 B8R1.5 Brc1nccnc1I Amb26542123 [0,1,0,0,0,0|3,0,0]=4 1240 B8R1.5 Brc1ncncc1I Amb23589497 [0,1,0,0,0,0|3,0,0]=4 1241 B8R1.5 C=C1CC=CCC1O Amb28139511 [0,1,0,0,0,0|0,0,3]=4 1242 B8R1.5 C=C1CSC=CC1=O Amb27598782 [0,1,0,0,0,0|1,0,2]=4 1243 B8R1.5 CC1=C(C)NC=CN1 Amb28383183 [0,1,0,0,0,0|3,0,0]=4 1244 B8R1.5 CC1=CC=CNC1=O Amb18028406 [0,1,0,0,0,0|1,0,1]=3 1245 B8R1.5 CC1=CC=CNC1=S Amb33530577 [0,1,0,0,0,0|1,1,0]=3 1246 B8R1.5 CC1=CC=CNC1N Amb27633696 [0,1,0,0,0,0|2,0,1]=4 1247 B8R1.5 CC1=CC=COC1N Amb27981010 [0,1,0,0,0,0|2,0,1]=4 1248 B8R1.5 CC1=CC=NNC1=O Amb21960917 [0,1,0,0,0,0|2,0,1]=4 1249 B8R1.5 CC1=CN=CNC1=O Amb21937121 [0,1,0,0,0,0|2,0,1]=4 1250 B8R1.5 CC1=CN=CNC1=S Amb28253321 [0,1,0,0,0,0|2,1,0]=4 1251 B8R1.5 CC1=CNC=CC1=N Amb19205207 [0,1,0,0,0,0|2,0,0]=3 1252 B8R1.5 CC1=CNC=CC1=O Amb33714756 [0,1,0,0,0,0|1,0,1]=3 1253 B8R1.5 CC1=NC=CNC1=O Amb22436791 [0,1,0,0,0,0|2,0,1]=4 1254 B8R1.5 CC1=NC=CNC1=O Amb32653329 [0,1,0,0,0,0|2,0,1]=4 1255 B8R1.5 CC1C=NC=CC1=S Amb34915431 [0,1,0,0,0,0|1,1,1]=4 1256 B8R1.5 CN1C=CC=CC1=N Amb22011801 [0,1,0,0,0,0|2,0,0]=3 1257 B8R1.5 CN1C=CC=CC1=O Amb19664826 [0,1,0,0,0,0|1,0,1]=3 1258 B8R1.5 CN1C=CC=CC1Cl Amb28285206 [0,1,0,0,0,0|2,0,1]=4 1259 B8R1.5 CN1C=CC=NC1=O Amb22292010 [0,1,0,0,0,0|2,0,1]=4 1260 B8R1.5 CN1C=CC=NC1=S Amb25242705 [0,1,0,0,0,0|2,1,0]=4 1261 B8R1.5 CN1N=CC=CC1=O Amb28122931 [0,1,0,0,0,0|2,0,1]=4 1262 B8R1.5 C[n+]1ccccc1Cl Amb10074893 [0,1,0,0,0,0|2,0,0]=3 1263 B8R1.5 C[n+]1ccccc1Cl Amb5794569 [0,1,0,0,0,0|2,0,0]=3 1264 B8R1.5 C[n+]1ccccc1F Amb26628402 [0,1,0,0,0,0|2,0,0]=3 1265 B8R1.5 C[n+]1ccccc1F Amb33140972 [0,1,0,0,0,0|2,0,0]=3 1266 B8R1.5 C[n+]1ccccc1N Amb1145103 [0,1,0,0,0,0|2,0,0]=3 1267 B8R1.5 C[n+]1cccnc1N Amb27852410 [0,1,0,0,0,0|3,0,0]=4 1268 B8R1.5 Cc1cccc[n+]1C Amb1147466 [0,1,0,0,0,0|2,0,0]=3 1269 B8R1.5 Cc1cccc[n+]1N Amb10552646 [0,1,0,0,0,0|2,0,0]=3 1270 B8R1.5 Cc1cccc[n+]1[O-] Amb8389159 [0,1,0,0,0,0|1,0,1]=3 1271 B8R1.5 Cc1ccccc1Br Amb2685510 [0,1,0,0,0,0|1,0,0]=2 1272 B8R1.5 Cc1ccccc1C Amb2447373 [0,1,0,0,0,0|1,0,0]=2 1273 B8R1.5 Cc1ccccc1Cl Amb1694836 [0,1,0,0,0,0|1,0,0]=2 1274 B8R1.5 Cc1ccccc1F Amb2688426 [0,1,0,0,0,0|1,0,0]=2 1275 B8R1.5 Cc1ccccc1I Amb2688891 [0,1,0,0,0,0|1,0,0]=2 1276 B8R1.5 Cc1ccccc1N Amb2793015 [0,1,0,0,0,0|1,0,0]=2 1277 B8R1.5 Cc1ccccc1O Amb2447562 [0,1,0,0,0,0|0,0,0]=1 1278 B8R1.5 Cc1ccccc1S Amb2690594 [0,1,0,0,0,0|0,1,0]=2 1279 B8R1.5 Cc1ccccc1[Mg+] Amb22733193 [0,1,0,0,0,0|1,0,0]=2 1280 B8R1.5 Cc1ccccc1[NH3+] Amb10565982 [0,1,0,0,0,0|1,0,0]=2 1281 B8R1.5 Cc1ccccn1=O Amb20247250 [0,1,0,0,0,0|1,0,1]=3 1282 B8R1.5 Cc1cccnc1Br Amb2447402 [0,1,0,0,0,0|2,0,0]=3 1283 B8R1.5 Cc1cccnc1C Amb8514941 [0,1,0,0,0,0|2,0,0]=3 1284 B8R1.5 Cc1cccnc1Cl Amb3940000 [0,1,0,0,0,0|2,0,0]=3 1285 B8R1.5 Cc1cccnc1F Amb2447290 [0,1,0,0,0,0|2,0,0]=3 1286 B8R1.5 Cc1cccnc1I Amb10069327 [0,1,0,0,0,0|2,0,0]=3 1287 B8R1.5 Cc1cccnc1N Amb16233775 [0,1,0,0,0,0|2,0,0]=3 1288 B8R1.5 Cc1cccnc1N Amb2694490 [0,1,0,0,0,0|2,0,0]=3 1289 B8R1.5 Cc1cccnc1O Amb2389971 [0,1,0,0,0,0|1,0,0]=2 1290 B8R1.5 Cc1cccnc1S Amb10573534 [0,1,0,0,0,0|1,1,0]=3 1291 B8R1.5 Cc1ccncc1Br Amb2609939 [0,1,0,0,0,0|2,0,0]=3 1292 B8R1.5 Cc1ccncc1C Amb2793076 [0,1,0,0,0,0|2,0,0]=3 1293 B8R1.5 Cc1ccncc1Cl Amb8393041 [0,1,0,0,0,0|2,0,0]=3 1294 B8R1.5 Cc1ccncc1F Amb2447281 [0,1,0,0,0,0|2,0,0]=3 1295 B8R1.5 Cc1ccncc1I Amb21858494 [0,1,0,0,0,0|2,0,0]=3 1296 B8R1.5 Cc1ccncc1N Amb2796181 [0,1,0,0,0,0|2,0,0]=3 1297 B8R1.5 Cc1ccncc1O Amb8630818 [0,1,0,0,0,0|1,0,0]=2 1298 B8R1.5 Cc1ccncc1S Amb24675739 [0,1,0,0,0,0|1,1,0]=3 1299 B8R1.5 Cc1ccnnc1C Amb26507989 [0,1,0,0,0,0|3,0,0]=4 1300 B8R1.5 Cc1ccnnc1Cl Amb16231020 [0,1,0,0,0,0|3,0,0]=4 1301 B8R1.5 Cc1ccnnc1Cl Amb23440184 [0,1,0,0,0,0|3,0,0]=4 1302 B8R1.5 Cc1ccnnc1N Amb18123964 [0,1,0,0,0,0|3,0,0]=4 1303 B8R1.5 Cc1cnccc1Br Amb8393017 [0,1,0,0,0,0|2,0,0]=3 1304 B8R1.5 Cc1cnccc1Br Amb8503379 [0,1,0,0,0,0|2,0,0]=3 1305 B8R1.5 Cc1cnccc1Br Amb8630971 [0,1,0,0,0,0|2,0,0]=3 1306 B8R1.5 Cc1cnccc1Cl Amb2686247 [0,1,0,0,0,0|2,0,0]=3 1307 B8R1.5 Cc1cnccc1Cl Amb8393026 [0,1,0,0,0,0|2,0,0]=3 1308 B8R1.5 Cc1cnccc1F Amb15691008 [0,1,0,0,0,0|2,0,0]=3 1309 B8R1.5 Cc1cnccc1F Amb22276539 [0,1,0,0,0,0|2,0,0]=3 1310 B8R1.5 Cc1cnccc1I Amb24066118 [0,1,0,0,0,0|2,0,0]=3 1311 B8R1.5 Cc1cnccc1I Amb32795033 [0,1,0,0,0,0|2,0,0]=3 1312 B8R1.5 Cc1cnccc1N Amb6429136 [0,1,0,0,0,0|2,0,0]=3 1313 B8R1.5 Cc1cnccc1O Amb8386832 [0,1,0,0,0,0|1,0,0]=2 1314 B8R1.5 Cc1cnccc1S Amb20670270 [0,1,0,0,0,0|1,1,0]=3 1315 B8R1.5 Cc1cncnc1Br Amb19957660 [0,1,0,0,0,0|3,0,0]=4 1316 B8R1.5 Cc1cncnc1C Amb24097057 [0,1,0,0,0,0|3,0,0]=4 1317 B8R1.5 Cc1cncnc1C Amb30585099 [0,1,0,0,0,0|3,0,0]=4 1318 B8R1.5 Cc1cncnc1Cl Amb19957387 [0,1,0,0,0,0|3,0,0]=4 1319 B8R1.5 Cc1cncnc1Cl Amb22756224 [0,1,0,0,0,0|3,0,0]=4 1320 B8R1.5 Cc1cncnc1F Amb27438598 [0,1,0,0,0,0|3,0,0]=4 1321 B8R1.5 Cc1cncnc1N Amb10603746 [0,1,0,0,0,0|3,0,0]=4 1322 B8R1.5 Cc1cncnc1O Amb8438965 [0,1,0,0,0,0|2,0,0]=3 1323 B8R1.5 Cc1cnncc1Br Amb18825271 [0,1,0,0,0,0|3,0,0]=4 1324 B8R1.5 Cc1cnncc1C Amb24599955 [0,1,0,0,0,0|3,0,0]=4 1325 B8R1.5 Cc1cnncc1N Amb18833123 [0,1,0,0,0,0|3,0,0]=4 1326 B8R1.5 Cc1nccc[n+]1[O-] Amb26370311 [0,1,0,0,0,0|2,0,1]=4 1327 B8R1.5 Cc1ncccc1Br Amb2612474 [0,1,0,0,0,0|2,0,0]=3 1328 B8R1.5 Cc1ncccc1Cl Amb8630901 [0,1,0,0,0,0|2,0,0]=3 1329 B8R1.5 Cc1ncccc1F Amb15691011 [0,1,0,0,0,0|2,0,0]=3 1330 B8R1.5 Cc1ncccc1I Amb10602320 [0,1,0,0,0,0|2,0,0]=3 1331 B8R1.5 Cc1ncccc1N Amb8392991 [0,1,0,0,0,0|2,0,0]=3 1332 B8R1.5 Cc1ncccc1O Amb24062097 [0,1,0,0,0,0|1,0,0]=2 1333 B8R1.5 Cc1ncccc1O Amb2613384 [0,1,0,0,0,0|1,0,0]=2 1334 B8R1.5 Cc1ncccc1S Amb24062554 [0,1,0,0,0,0|1,1,0]=3 1335 B8R1.5 Cc1nccnc1Br Amb15701217 [0,1,0,0,0,0|3,0,0]=4 1336 B8R1.5 Cc1nccnc1C Amb8513879 [0,1,0,0,0,0|3,0,0]=4 1337 B8R1.5 Cc1nccnc1Cl Amb17515939 [0,1,0,0,0,0|3,0,0]=4 1338 B8R1.5 Cc1nccnc1F Amb24686578 [0,1,0,0,0,0|3,0,0]=4 1339 B8R1.5 Cc1nccnc1I Amb22751685 [0,1,0,0,0,0|3,0,0]=4 1340 B8R1.5 Cc1nccnc1N Amb16233707 [0,1,0,0,0,0|3,0,0]=4 1341 B8R1.5 Cc1nccnc1N Amb31217478 [0,1,0,0,0,0|3,0,0]=4 1342 B8R1.5 Cc1nccnc1S Amb22299180 [0,1,0,0,0,0|2,1,0]=4 1343 B8R1.5 Cc1ncncc1Br Amb10602876 [0,1,0,0,0,0|3,0,0]=4 1344 B8R1.5 Cc1ncncc1Cl Amb20241071 [0,1,0,0,0,0|3,0,0]=4 1345 B8R1.5 Cc1ncncc1F Amb26618850 [0,1,0,0,0,0|3,0,0]=4 1346 B8R1.5 Cc1ncncc1I Amb19957397 [0,1,0,0,0,0|3,0,0]=4 1347 B8R1.5 Cc1ncncc1N Amb8384275 [0,1,0,0,0,0|3,0,0]=4 1348 B8R1.5 Cc1ncncc1O Amb18641411 [0,1,0,0,0,0|2,0,0]=3 1349 B8R1.5 Cc1ncncc1S Amb32876666 [0,1,0,0,0,0|2,1,0]=4 1350 B8R1.5 Cc1nnccc1Cl Amb27602444 [0,1,0,0,0,0|3,0,0]=4 1351 B8R1.5 Cc1nnccc1N Amb25121067 [0,1,0,0,0,0|3,0,0]=4 1352 B8R1.5 Cc1nnccc1N Amb28934869 [0,1,0,0,0,0|3,0,0]=4 1353 B8R1.5 Cc1nnccc1O Amb26872893 [0,1,0,0,0,0|2,0,0]=3 1354 B8R1.5 Cc1nncnc1O Amb21811929 [0,1,0,0,0,0|3,0,0]=4 1355 B8R1.5 ClC1=C(Cl)COC=C1 Amb27830823 [0,1,0,0,0,0|2,0,1]=4 1356 B8R1.5 Clc1ccccc1Br Amb2684987 [0,1,0,0,0,0|1,0,0]=2 1357 B8R1.5 Clc1ccccc1Cl Amb2793060 [0,1,0,0,0,0|1,0,0]=2 1358 B8R1.5 Clc1ccccc1I Amb2686128 [0,1,0,0,0,0|1,0,0]=2 1359 B8R1.5 Clc1cccnc1Br Amb8383861 [0,1,0,0,0,0|2,0,0]=3 1360 B8R1.5 Clc1cccnc1Cl Amb2610843 [0,1,0,0,0,0|2,0,0]=3 1361 B8R1.5 Clc1cccnc1I Amb8630902 [0,1,0,0,0,0|2,0,0]=3 1362 B8R1.5 Clc1ccncc1Br Amb21960104 [0,1,0,0,0,0|2,0,0]=3 1363 B8R1.5 Clc1ccncc1Br Amb2610058 [0,1,0,0,0,0|2,0,0]=3 1364 B8R1.5 Clc1ccncc1Cl Amb16230951 [0,1,0,0,0,0|2,0,0]=3 1365 B8R1.5 Clc1ccncc1Cl Amb16230974 [0,1,0,0,0,0|2,0,0]=3 1366 B8R1.5 Clc1ccncc1Cl Amb8384509 [0,1,0,0,0,0|2,0,0]=3 1367 B8R1.5 Clc1ccncc1I Amb22640979 [0,1,0,0,0,0|2,0,0]=3 1368 B8R1.5 Clc1ccncc1I Amb8426248 [0,1,0,0,0,0|2,0,0]=3 1369 B8R1.5 Clc1ccnnc1Cl Amb19958452 [0,1,0,0,0,0|3,0,0]=4 1370 B8R1.5 Clc1cnccc1Br Amb8392999 [0,1,0,0,0,0|2,0,0]=3 1371 B8R1.5 Clc1cnccc1I Amb10067171 [0,1,0,0,0,0|2,0,0]=3 1372 B8R1.5 Clc1cncnc1Br Amb25924386 [0,1,0,0,0,0|3,0,0]=4 1373 B8R1.5 Clc1cncnc1Cl Amb8394848 [0,1,0,0,0,0|3,0,0]=4 1374 B8R1.5 Clc1cncnc1I Amb24375646 [0,1,0,0,0,0|3,0,0]=4 1375 B8R1.5 Clc1cnncc1Cl Amb20242023 [0,1,0,0,0,0|3,0,0]=4 1376 B8R1.5 Clc1cnncc1Cl Amb22235749 [0,1,0,0,0,0|3,0,0]=4 1377 B8R1.5 Clc1ncccc1Br Amb1261628 [0,1,0,0,0,0|2,0,0]=3 1378 B8R1.5 Clc1ncccc1I Amb1088774 [0,1,0,0,0,0|2,0,0]=3 1379 B8R1.5 Clc1nccnc1Br Amb22494203 [0,1,0,0,0,0|3,0,0]=4 1380 B8R1.5 Clc1nccnc1Cl Amb2686969 [0,1,0,0,0,0|3,0,0]=4 1381 B8R1.5 Clc1nccnc1I Amb25781777 [0,1,0,0,0,0|3,0,0]=4 1382 B8R1.5 Clc1ncncc1Br Amb19514825 [0,1,0,0,0,0|3,0,0]=4 1383 B8R1.5 Clc1ncncc1Br Amb22756245 [0,1,0,0,0,0|3,0,0]=4 1384 B8R1.5 Clc1ncncc1I Amb15691084 [0,1,0,0,0,0|3,0,0]=4 1385 B8R1.5 Cn1ccccc1=O Amb2609945 [0,1,0,0,0,0|1,0,1]=3 1386 B8R1.5 Cn1cnccc1=O Amb2609512 [0,1,0,0,0,0|2,0,1]=4 1387 B8R1.5 FC1=CC=CNC1=S Amb33549260 [0,1,0,0,0,0|1,1,0]=3 1388 B8R1.5 FC1=NC=CNC1=S Amb22388303 [0,1,0,0,0,0|2,1,0]=4 1389 B8R1.5 Fc1ccccc1Br Amb2685182 [0,1,0,0,0,0|1,0,0]=2 1390 B8R1.5 Fc1ccccc1Cl Amb2685936 [0,1,0,0,0,0|1,0,0]=2 1391 B8R1.5 Fc1ccccc1F Amb2687051 [0,1,0,0,0,0|1,0,0]=2 1392 B8R1.5 Fc1ccccc1I Amb2688121 [0,1,0,0,0,0|1,0,0]=2 1393 B8R1.5 Fc1ccccc1S Amb2688423 [0,1,0,0,0,0|0,1,0]=2 1394 B8R1.5 Fc1ccccc1[Zn+] Amb22353246 [0,1,0,0,0,0|1,0,0]=2 1395 B8R1.5 Fc1cccnc1Br Amb8396940 [0,1,0,0,0,0|2,0,0]=3 1396 B8R1.5 Fc1cccnc1Cl Amb8387987 [0,1,0,0,0,0|2,0,0]=3 1397 B8R1.5 Fc1cccnc1F Amb8387989 [0,1,0,0,0,0|2,0,0]=3 1398 B8R1.5 Fc1cccnc1I Amb2696626 [0,1,0,0,0,0|2,0,0]=3 1399 B8R1.5 Fc1cccnc1S Amb26943430 [0,1,0,0,0,0|1,1,0]=3 1400 B8R1.5 Fc1ccncc1Br Amb8396941 [0,1,0,0,0,0|2,0,0]=3 1401 B8R1.5 Fc1ccncc1Cl Amb8396770 [0,1,0,0,0,0|2,0,0]=3 1402 B8R1.5 Fc1ccncc1F Amb8397120 [0,1,0,0,0,0|2,0,0]=3 1403 B8R1.5 Fc1ccncc1S Amb24476591 [0,1,0,0,0,0|1,1,0]=3 1404 B8R1.5 Fc1cnccc1Br Amb16185873 [0,1,0,0,0,0|2,0,0]=3 1405 B8R1.5 Fc1cnccc1Br Amb8393013 [0,1,0,0,0,0|2,0,0]=3 1406 B8R1.5 Fc1cnccc1Cl Amb8386192 [0,1,0,0,0,0|2,0,0]=3 1407 B8R1.5 Fc1cnccc1Cl Amb8393025 [0,1,0,0,0,0|2,0,0]=3 1408 B8R1.5 Fc1cnccc1I Amb4560976 [0,1,0,0,0,0|2,0,0]=3 1409 B8R1.5 Fc1cnccc1S Amb26337431 [0,1,0,0,0,0|1,1,0]=3 1410 B8R1.5 Fc1cncnc1Cl Amb10067338 [0,1,0,0,0,0|3,0,0]=4 1411 B8R1.5 Fc1cncnc1I Amb25312491 [0,1,0,0,0,0|3,0,0]=4 1412 B8R1.5 Fc1cncnc1S Amb4016304 [0,1,0,0,0,0|2,1,0]=4 1413 B8R1.5 Fc1ncccc1Br Amb2455785 [0,1,0,0,0,0|2,0,0]=3 1414 B8R1.5 Fc1ncccc1Cl Amb8390107 [0,1,0,0,0,0|2,0,0]=3 1415 B8R1.5 Fc1ncccc1I Amb2455815 [0,1,0,0,0,0|2,0,0]=3 1416 B8R1.5 Fc1ncccc1S Amb26907632 [0,1,0,0,0,0|1,1,0]=3 1417 B8R1.5 Fc1nccnc1Br Amb25081564 [0,1,0,0,0,0|3,0,0]=4 1418 B8R1.5 Fc1nccnc1Cl Amb26028405 [0,1,0,0,0,0|3,0,0]=4 1419 B8R1.5 Fc1nccnc1F Amb21961621 [0,1,0,0,0,0|3,0,0]=4 1420 B8R1.5 Fc1nccnc1I Amb19889036 [0,1,0,0,0,0|3,0,0]=4 1421 B8R1.5 Fc1ncncc1Br Amb26575022 [0,1,0,0,0,0|3,0,0]=4 1422 B8R1.5 Fc1ncncc1I Amb26575497 [0,1,0,0,0,0|3,0,0]=4 1423 B8R1.5 Ic1ccccc1I Amb2687311 [0,1,0,0,0,0|1,0,0]=2 1424 B8R1.5 Ic1ccncc1I Amb2609494 [0,1,0,0,0,0|2,0,0]=3 1425 B8R1.5 Ic1nccnc1I Amb26541892 [0,1,0,0,0,0|3,0,0]=4 1426 B8R1.5 NC1=CC=CNC1=O Amb18641609 [0,1,0,0,0,0|1,0,1]=3 1427 B8R1.5 NC1=CC=CNC1=S Amb19958555 [0,1,0,0,0,0|1,1,0]=3 1428 B8R1.5 NC1=CC=CON1N Amb28313952 [0,1,0,0,0,0|3,0,0]=4 1429 B8R1.5 NC1=CC=NNC1=O Amb18641632 [0,1,0,0,0,0|2,0,1]=4 1430 B8R1.5 NC1=CN=CNC1=O Amb33544216 [0,1,0,0,0,0|2,0,1]=4 1431 B8R1.5 NC1=CNC=CC1=O Amb22489482 [0,1,0,0,0,0|1,0,1]=3 1432 B8R1.5 NC1=NC=CNC1=O Amb22388516 [0,1,0,0,0,0|2,0,1]=4 1433 B8R1.5 NC1=NC=CNC1=S Amb24756997 [0,1,0,0,0,0|2,1,0]=4 1434 B8R1.5 NC1C=CC=CN1Cl Amb28119490 [0,1,0,0,0,0|2,0,1]=4 1435 B8R1.5 NN1C=CC=CC1=O Amb18641421 [0,1,0,0,0,0|1,0,1]=3 1436 B8R1.5 Nc1[nH+]cccc1Br Amb33513099 [0,1,0,0,0,0|2,0,0]=3 1437 B8R1.5 Nc1cccc[n+]1N Amb346872 [0,1,0,0,0,0|2,0,0]=3 1438 B8R1.5 Nc1cccc[n+]1[O-] Amb1044003 [0,1,0,0,0,0|1,0,1]=3 1439 B8R1.5 Nc1ccccc1Br Amb2684944 [0,1,0,0,0,0|1,0,0]=2 1440 B8R1.5 Nc1ccccc1Cl Amb2792845 [0,1,0,0,0,0|1,0,0]=2 1441 B8R1.5 Nc1ccccc1F Amb20242666 [0,1,0,0,0,0|1,0,0]=2 1442 B8R1.5 Nc1ccccc1F Amb2688011 [0,1,0,0,0,0|1,0,0]=2 1443 B8R1.5 Nc1ccccc1I Amb1158874 [0,1,0,0,0,0|1,0,0]=2 1444 B8R1.5 Nc1ccccc1N Amb1935251 [0,1,0,0,0,0|1,0,0]=2 1445 B8R1.5 Nc1ccccc1N Amb20240557 [0,1,0,0,0,0|1,0,0]=2 1446 B8R1.5 Nc1ccccc1N Amb22052498 [0,1,0,0,0,0|1,0,0]=2 1447 B8R1.5 Nc1ccccc1O Amb1927020 [0,1,0,0,0,0|0,0,0]=1 1448 B8R1.5 Nc1ccccc1O Amb22167536 [0,1,0,0,0,0|0,0,0]=1 1449 B8R1.5 Nc1ccccc1O Amb22735013 [0,1,0,0,0,0|0,0,0]=1 1450 B8R1.5 Nc1ccccc1S Amb2684539 [0,1,0,0,0,0|0,1,0]=2 1451 B8R1.5 Nc1cccn[n+]1[O-] Amb28140675 [0,1,0,0,0,0|2,0,1]=4 1452 B8R1.5 Nc1cccnc1Br Amb1040351 [0,1,0,0,0,0|2,0,0]=3 1453 B8R1.5 Nc1cccnc1Br Amb22831599 [0,1,0,0,0,0|2,0,0]=3 1454 B8R1.5 Nc1cccnc1Cl Amb22498703 [0,1,0,0,0,0|2,0,0]=3 1455 B8R1.5 Nc1cccnc1Cl Amb534659 [0,1,0,0,0,0|2,0,0]=3 1456 B8R1.5 Nc1cccnc1F Amb20620254 [0,1,0,0,0,0|2,0,0]=3 1457 B8R1.5 Nc1cccnc1F Amb8392987 [0,1,0,0,0,0|2,0,0]=3 1458 B8R1.5 Nc1cccnc1I Amb16234033 [0,1,0,0,0,0|2,0,0]=3 1459 B8R1.5 Nc1cccnc1N Amb535787 [0,1,0,0,0,0|2,0,0]=3 1460 B8R1.5 Nc1cccnc1N Amb8396954 [0,1,0,0,0,0|2,0,0]=3 1461 B8R1.5 Nc1cccnc1O Amb13951755 [0,1,0,0,0,0|1,0,0]=2 1462 B8R1.5 Nc1cccnc1O Amb2610529 [0,1,0,0,0,0|1,0,0]=2 1463 B8R1.5 Nc1cccnc1P Amb27640861 [0,1,0,0,0,0|2,0,0]=3 1464 B8R1.5 Nc1cccnc1S Amb8929758 [0,1,0,0,0,0|1,1,0]=3 1465 B8R1.5 Nc1ccncc1Br Amb1420330 [0,1,0,0,0,0|2,0,0]=3 1466 B8R1.5 Nc1ccncc1Cl Amb443853 [0,1,0,0,0,0|2,0,0]=3 1467 B8R1.5 Nc1ccncc1F Amb2609506 [0,1,0,0,0,0|2,0,0]=3 1468 B8R1.5 Nc1ccncc1I Amb2696275 [0,1,0,0,0,0|2,0,0]=3 1469 B8R1.5 Nc1ccncc1N Amb535063 [0,1,0,0,0,0|2,0,0]=3 1470 B8R1.5 Nc1ccncc1O Amb10071345 [0,1,0,0,0,0|1,0,0]=2 1471 B8R1.5 Nc1ccncc1O Amb2697376 [0,1,0,0,0,0|1,0,0]=2 1472 B8R1.5 Nc1ccncc1O Amb33996606 [0,1,0,0,0,0|1,0,0]=2 1473 B8R1.5 Nc1ccncc1S Amb18124311 [0,1,0,0,0,0|1,1,0]=3 1474 B8R1.5 Nc1ccncc1S Amb23439490 [0,1,0,0,0,0|1,1,0]=3 1475 B8R1.5 Nc1ccnnc1Br Amb18197845 [0,1,0,0,0,0|3,0,0]=4 1476 B8R1.5 Nc1ccnnc1Cl Amb10603687 [0,1,0,0,0,0|3,0,0]=4 1477 B8R1.5 Nc1ccnnc1N Amb2610057 [0,1,0,0,0,0|3,0,0]=4 1478 B8R1.5 Nc1ccnnc1S Amb18203048 [0,1,0,0,0,0|2,1,0]=4 1479 B8R1.5 Nc1cncc[n+]1[O-] Amb27862922 [0,1,0,0,0,0|2,0,1]=4 1480 B8R1.5 Nc1cnccc1Br Amb10602218 [0,1,0,0,0,0|2,0,0]=3 1481 B8R1.5 Nc1cnccc1Cl Amb2609897 [0,1,0,0,0,0|2,0,0]=3 1482 B8R1.5 Nc1cnccc1Cl Amb33313560 [0,1,0,0,0,0|2,0,0]=3 1483 B8R1.5 Nc1cnccc1F Amb24097469 [0,1,0,0,0,0|2,0,0]=3 1484 B8R1.5 Nc1cnccc1F Amb32653163 [0,1,0,0,0,0|2,0,0]=3 1485 B8R1.5 Nc1cnccc1I Amb4560896 [0,1,0,0,0,0|2,0,0]=3 1486 B8R1.5 Nc1cnccc1O Amb535789 [0,1,0,0,0,0|1,0,0]=2 1487 B8R1.5 Nc1cnccc1O Amb7969438 [0,1,0,0,0,0|1,0,0]=2 1488 B8R1.5 Nc1cnccc1O Amb7969634 [0,1,0,0,0,0|1,0,0]=2 1489 B8R1.5 Nc1cnccc1S Amb33528190 [0,1,0,0,0,0|1,1,0]=3 1490 B8R1.5 Nc1cncnc1Br Amb19957552 [0,1,0,0,0,0|3,0,0]=4 1491 B8R1.5 Nc1cncnc1Cl Amb16185817 [0,1,0,0,0,0|3,0,0]=4 1492 B8R1.5 Nc1cncnc1F Amb33035688 [0,1,0,0,0,0|3,0,0]=4 1493 B8R1.5 Nc1cncnc1I Amb22235429 [0,1,0,0,0,0|3,0,0]=4 1494 B8R1.5 Nc1cncnc1N Amb2591560 [0,1,0,0,0,0|3,0,0]=4 1495 B8R1.5 Nc1cncnc1N Amb32990193 [0,1,0,0,0,0|3,0,0]=4 1496 B8R1.5 Nc1cncnc1O Amb18641631 [0,1,0,0,0,0|2,0,0]=3 1497 B8R1.5 Nc1cncnc1O Amb22167158 [0,1,0,0,0,0|2,0,0]=3 1498 B8R1.5 Nc1cncnc1S Amb18642522 [0,1,0,0,0,0|2,1,0]=4 1499 B8R1.5 Nc1cnncc1Br Amb22235292 [0,1,0,0,0,0|3,0,0]=4 1500 B8R1.5 Nc1cnncc1Cl Amb18124330 [0,1,0,0,0,0|3,0,0]=4 1501 B8R1.5 Nc1cnncc1N Amb18124217 [0,1,0,0,0,0|3,0,0]=4 1502 B8R1.5 Nc1ncccc1Br Amb1084295 [0,1,0,0,0,0|2,0,0]=3 1503 B8R1.5 Nc1ncccc1Cl Amb1279989 [0,1,0,0,0,0|2,0,0]=3 1504 B8R1.5 Nc1ncccc1F Amb8396937 [0,1,0,0,0,0|2,0,0]=3 1505 B8R1.5 Nc1ncccc1I Amb4560883 [0,1,0,0,0,0|2,0,0]=3 1506 B8R1.5 Nc1ncccc1O Amb2697548 [0,1,0,0,0,0|1,0,0]=2 1507 B8R1.5 Nc1ncccc1O Amb534658 [0,1,0,0,0,0|1,0,0]=2 1508 B8R1.5 Nc1nccnc1Br Amb16233874 [0,1,0,0,0,0|3,0,0]=4 1509 B8R1.5 Nc1nccnc1Cl Amb2715518 [0,1,0,0,0,0|3,0,0]=4 1510 B8R1.5 Nc1nccnc1F Amb22388326 [0,1,0,0,0,0|3,0,0]=4 1511 B8R1.5 Nc1nccnc1I Amb10601938 [0,1,0,0,0,0|3,0,0]=4 1512 B8R1.5 Nc1nccnc1N Amb7172694 [0,1,0,0,0,0|3,0,0]=4 1513 B8R1.5 Nc1ncncc1Br Amb16233875 [0,1,0,0,0,0|3,0,0]=4 1514 B8R1.5 Nc1ncncc1Cl Amb19957574 [0,1,0,0,0,0|3,0,0]=4 1515 B8R1.5 Nc1ncncc1F Amb4011496 [0,1,0,0,0,0|3,0,0]=4 1516 B8R1.5 Nc1ncncc1I Amb19957575 [0,1,0,0,0,0|3,0,0]=4 1517 B8R1.5 Nc1ncncc1O Amb21964294 [0,1,0,0,0,0|2,0,0]=3 1518 B8R1.5 Nc1nnccc1Br Amb27482578 [0,1,0,0,0,0|3,0,0]=4 1519 B8R1.5 Nc1nnccc1Br Amb33295360 [0,1,0,0,0,0|3,0,0]=4 1520 B8R1.5 Nc1nnccc1S Amb27613243 [0,1,0,0,0,0|2,1,0]=4 1521 B8R1.5 O=C1C=CC=CC1=O Amb17593118 [0,1,0,0,0,0|0,0,1]=2 1522 B8R1.5 O=C1C=CC=CN1O Amb20622284 [0,1,0,0,0,0|1,0,0]=2 1523 B8R1.5 O=C1C=CC=NC1=O Amb27802733 [0,1,0,0,0,0|1,0,1]=3 1524 B8R1.5 O=C1C=CCC=C1Cl Amb27181091 [0,1,0,0,0,0|0,0,2]=3 1525 B8R1.5 O=C1C=CCCC1=O Amb28049024 [0,1,0,0,0,0|0,0,3]=4 1526 B8R1.5 O=C1C=CCCC1O Amb27165534 [0,1,0,0,0,0|0,0,3]=4 1527 B8R1.5 O=C1C=CNC=C1I Amb22465984 [0,1,0,0,0,0|1,0,1]=3 1528 B8R1.5 O=C1C=COC=C1Br Amb28324212 [0,1,0,0,0,0|1,0,1]=3 1529 B8R1.5 O=C1C=COC=C1O Amb19133754 [0,1,0,0,0,0|1,0,0]=2 1530 B8R1.5 O=C1CCCC=C1O Amb2699837 [0,1,0,0,0,0|0,0,3]=4 1531 B8R1.5 O=C1CN=NC=C1O Amb27794999 [0,1,0,0,0,0|2,0,1]=4 1532 B8R1.5 O=C1COC=CC1=S Amb27835579 [0,1,0,0,0,0|1,0,2]=4 1533 B8R1.5 O=C1N=CNC=C1Br Amb22043912 [0,1,0,0,0,0|2,0,1]=4 1534 B8R1.5 O=C1N=CNC=C1Cl Amb22490583 [0,1,0,0,0,0|2,0,1]=4 1535 B8R1.5 O=C1NC=CC=C1Br Amb18542924 [0,1,0,0,0,0|1,0,1]=3 1536 B8R1.5 O=C1NC=CC=C1Cl Amb20243356 [0,1,0,0,0,0|1,0,1]=3 1537 B8R1.5 O=C1NC=CC=C1I Amb22001887 [0,1,0,0,0,0|1,0,1]=3 1538 B8R1.5 O=C1NC=CC=C1O Amb18537411 [0,1,0,0,0,0|1,0,0]=2 1539 B8R1.5 O=C1NC=CC=C1S Amb25261155 [0,1,0,0,0,0|1,0,1]=3 1540 B8R1.5 O=C1NC=CN=C1Cl Amb19148377 [0,1,0,0,0,0|2,0,1]=4 1541 B8R1.5 O=C1NC=CN=C1I Amb28316181 [0,1,0,0,0,0|2,0,1]=4 1542 B8R1.5 O=C1NC=CN=C1S Amb28316182 [0,1,0,0,0,0|2,0,1]=4 1543 B8R1.5 O=C1NC=CNC1=O Amb19894734 [0,1,0,0,0,0|2,0,1]=4 1544 B8R1.5 O=C1NC=CSC1O Amb27882387 [0,1,0,0,0,0|2,0,1]=4 1545 B8R1.5 O=C1NC=NC=C1F Amb22489479 [0,1,0,0,0,0|2,0,1]=4 1546 B8R1.5 O=C1NC=NC=C1I Amb22371454 [0,1,0,0,0,0|2,0,1]=4 1547 B8R1.5 O=C1NC=NC=C1O Amb22436766 [0,1,0,0,0,0|2,0,0]=3 1548 B8R1.5 O=C1NC=NC=C1O Amb22728033 [0,1,0,0,0,0|2,0,0]=3 1549 B8R1.5 O=C1NC=NC=C1S Amb28422458 [0,1,0,0,0,0|2,0,1]=4 1550 B8R1.5 O=C1NN=CC=C1Br Amb23455497 [0,1,0,0,0,0|2,0,1]=4 1551 B8R1.5 O=C1NN=CC=C1Cl Amb33543639 [0,1,0,0,0,0|2,0,1]=4 1552 B8R1.5 O=C1NN=CC=C1F Amb24659506 [0,1,0,0,0,0|2,0,1]=4 1553 B8R1.5 O=C1NN=CC=C1I Amb25329683 [0,1,0,0,0,0|2,0,1]=4 1554 B8R1.5 O=C1OC=CC=C1Br Amb26073988 [0,1,0,0,0,0|1,0,1]=3 1555 B8R1.5 O=C1OC=CC=C1Cl Amb20247271 [0,1,0,0,0,0|1,0,1]=3 1556 B8R1.5 O=C1OC=CC=C1I Amb20247272 [0,1,0,0,0,0|1,0,1]=3 1557 B8R1.5 O=C1OC=CC=C1O Amb17933813 [0,1,0,0,0,0|1,0,0]=2 1558 B8R1.5 O=C1OCC=CC1O Amb27795928 [0,1,0,0,0,0|1,0,2]=4 1559 B8R1.5 O=c1ccocc1O Amb7172743 [0,1,0,0,0,0|1,0,0]=2 1560 B8R1.5 O=n1ccccc1Br Amb20620597 [0,1,0,0,0,0|1,0,1]=3 1561 B8R1.5 O=n1ccccc1Cl Amb20620850 [0,1,0,0,0,0|1,0,1]=3 1562 B8R1.5 O=n1ccccc1F Amb20621375 [0,1,0,0,0,0|1,0,1]=3 1563 B8R1.5 O=n1ccccc1O Amb20621417 [0,1,0,0,0,0|1,0,0]=2 1564 B8R1.5 OC1=CC=CNC1O Amb28045872 [0,1,0,0,0,0|1,0,1]=3 1565 B8R1.5 OC1=CC=NNC1=S Amb27440901 [0,1,0,0,0,0|2,0,0]=3 1566 B8R1.5 OC1=COC=CC1=S Amb24558826 [0,1,0,0,0,0|1,0,0]=2 1567 B8R1.5 OC1C=CC=NC1=S Amb25850841 [0,1,0,0,0,0|1,0,1]=3 1568 B8R1.5 ON1C=CC=CC1=S Amb26615251 [0,1,0,0,0,0|1,0,0]=2 1569 B8R1.5 Oc1ccccc1Br Amb1161818 [0,1,0,0,0,0|0,0,0]=1 1570 B8R1.5 Oc1ccccc1Cl Amb3939627 [0,1,0,0,0,0|0,0,0]=1 1571 B8R1.5 Oc1ccccc1F Amb2688290 [0,1,0,0,0,0|0,0,0]=1 1572 B8R1.5 Oc1ccccc1I Amb4605844 [0,1,0,0,0,0|0,0,0]=1 1573 B8R1.5 Oc1ccccc1O Amb2609033 [0,1,0,0,0,0|0,0,0]=1 1574 B8R1.5 Oc1ccccc1P Amb27256691 [0,1,0,0,0,0|0,0,0]=1 1575 B8R1.5 Oc1ccccc1S Amb2688798 [0,1,0,0,0,0|0,0,0]=1 1576 B8R1.5 Oc1cccnc1Br Amb535840 [0,1,0,0,0,0|1,0,0]=2 1577 B8R1.5 Oc1cccnc1Cl Amb2725475 [0,1,0,0,0,0|1,0,0]=2 1578 B8R1.5 Oc1cccnc1F Amb15690844 [0,1,0,0,0,0|1,0,0]=2 1579 B8R1.5 Oc1cccnc1I Amb2610016 [0,1,0,0,0,0|1,0,0]=2 1580 B8R1.5 Oc1cccnc1O Amb2609926 [0,1,0,0,0,0|1,0,0]=2 1581 B8R1.5 Oc1cccnc1S Amb2698064 [0,1,0,0,0,0|1,0,0]=2 1582 B8R1.5 Oc1ccncc1Br Amb15691018 [0,1,0,0,0,0|1,0,0]=2 1583 B8R1.5 Oc1ccncc1Cl Amb10602284 [0,1,0,0,0,0|1,0,0]=2 1584 B8R1.5 Oc1ccncc1F Amb10602312 [0,1,0,0,0,0|1,0,0]=2 1585 B8R1.5 Oc1ccncc1F Amb19895479 [0,1,0,0,0,0|1,0,0]=2 1586 B8R1.5 Oc1ccncc1O Amb2696835 [0,1,0,0,0,0|1,0,0]=2 1587 B8R1.5 Oc1ccncc1S Amb26907895 [0,1,0,0,0,0|1,0,0]=2 1588 B8R1.5 Oc1ccnnc1O Amb24518788 [0,1,0,0,0,0|2,0,0]=3 1589 B8R1.5 Oc1cnccc1Br Amb15691017 [0,1,0,0,0,0|1,0,0]=2 1590 B8R1.5 Oc1cnccc1Br Amb21955133 [0,1,0,0,0,0|1,0,0]=2 1591 B8R1.5 Oc1cnccc1Cl Amb10602670 [0,1,0,0,0,0|1,0,0]=2 1592 B8R1.5 Oc1cnccc1I Amb34913402 [0,1,0,0,0,0|1,0,0]=2 1593 B8R1.5 Oc1cnccc1I Amb8388785 [0,1,0,0,0,0|1,0,0]=2 1594 B8R1.5 Oc1cnccc1S Amb27803956 [0,1,0,0,0,0|1,0,0]=2 1595 B8R1.5 Oc1cncnc1Br Amb24374920 [0,1,0,0,0,0|2,0,0]=3 1596 B8R1.5 Oc1cncnc1F Amb28246222 [0,1,0,0,0,0|2,0,0]=3 1597 B8R1.5 Oc1cncnc1I Amb27964580 [0,1,0,0,0,0|2,0,0]=3 1598 B8R1.5 Oc1cnncc1Br Amb26580562 [0,1,0,0,0,0|2,0,0]=3 1599 B8R1.5 Oc1cnncc1Br Amb33804046 [0,1,0,0,0,0|2,0,0]=3 1600 B8R1.5 Oc1cnncc1Cl Amb22235763 [0,1,0,0,0,0|2,0,0]=3 1601 B8R1.5 Oc1ncccc1Br Amb2842954 [0,1,0,0,0,0|1,0,0]=2 1602 B8R1.5 Oc1ncccc1Cl Amb2610062 [0,1,0,0,0,0|1,0,0]=2 1603 B8R1.5 Oc1ncccc1F Amb8384343 [0,1,0,0,0,0|1,0,0]=2 1604 B8R1.5 Oc1nccnc1Br Amb22500205 [0,1,0,0,0,0|2,0,0]=3 1605 B8R1.5 Oc1nccnc1Cl Amb22011655 [0,1,0,0,0,0|2,0,0]=3 1606 B8R1.5 Oc1nccnc1O Amb2722687 [0,1,0,0,0,0|2,0,0]=3 1607 B8R1.5 Oc1ncncc1Br Amb10602883 [0,1,0,0,0,0|2,0,0]=3 1608 B8R1.5 Oc1ncncc1Br Amb22492474 [0,1,0,0,0,0|2,0,0]=3 1609 B8R1.5 Oc1ncncc1Cl Amb33543832 [0,1,0,0,0,0|2,0,0]=3 1610 B8R1.5 Oc1ncncc1F Amb4017129 [0,1,0,0,0,0|2,0,0]=3 1611 B8R1.5 Oc1ncncc1I Amb4009898 [0,1,0,0,0,0|2,0,0]=3 1612 B8R1.5 Oc1nnccc1Cl Amb19958663 [0,1,0,0,0,0|2,0,0]=3 1613 B8R1.5 Pc1ccccc1Br Amb27201493 [0,1,0,0,0,0|1,0,0]=2 1614 B8R1.5 Pc1ccccc1P Amb22227663 [0,1,0,0,0,0|1,0,0]=2 1615 B8R1.5 S=C1NC=CC=C1Br Amb19374472 [0,1,0,0,0,0|1,1,0]=3 1616 B8R1.5 S=C1NC=CC=C1Cl Amb17933337 [0,1,0,0,0,0|1,1,0]=3 1617 B8R1.5 S=C1NC=NC=C1Br Amb25253477 [0,1,0,0,0,0|2,1,0]=4 1618 B8R1.5 Sc1ccccc1Br Amb2685507 [0,1,0,0,0,0|0,1,0]=2 1619 B8R1.5 Sc1ccccc1Cl Amb2686486 [0,1,0,0,0,0|0,1,0]=2 1620 B8R1.5 Sc1ccccc1I Amb25883385 [0,1,0,0,0,0|0,1,0]=2 1621 B8R1.5 Sc1ccccc1S Amb8515838 [0,1,0,0,0,0|0,1,0]=2 1622 B8R1.5 Sc1cccnc1Br Amb27209236 [0,1,0,0,0,0|1,1,0]=3 1623 B8R1.5 Sc1cccnc1Cl Amb27848171 [0,1,0,0,0,0|1,1,0]=3 1624 B8R1.5 Sc1ccncc1Br Amb25032081 [0,1,0,0,0,0|1,1,0]=3 1625 B8R1.5 Sc1ccncc1Cl Amb23557574 [0,1,0,0,0,0|1,1,0]=3 1626 B8R1.5 Sc1cnccc1Cl Amb28455349 [0,1,0,0,0,0|1,1,0]=3 1627 B8R1.5 Sc1ncccc1Br Amb33538374 [0,1,0,0,0,0|1,1,0]=3 1628 B8R1.5 Sc1ncccc1Cl Amb2371701 [0,1,0,0,0,0|1,1,0]=3 1629 B8R1.5 [BH3-][n+]1ccccc1C Amb33776327 [0,1,0,0,0,0|2,0,0]=3 1630 B8R1.5 [NH3+]c1ccccc1Cl Amb6365999 [0,1,0,0,0,0|1,0,0]=2 1631 B8R1.5 [O-][n+]1ccccc1Br Amb10068286 [0,1,0,0,0,0|1,0,1]=3 1632 B8R1.5 [O-][n+]1ccccc1Br Amb34914994 [0,1,0,0,0,0|1,0,1]=3 1633 B8R1.5 [O-][n+]1ccccc1Br Amb9825871 [0,1,0,0,0,0|1,0,1]=3 1634 B8R1.5 [O-][n+]1ccccc1Cl Amb8389209 [0,1,0,0,0,0|1,0,1]=3 1635 B8R1.5 [O-][n+]1ccccc1O Amb2609928 [0,1,0,0,0,0|1,0,0]=2 1636 B8R1.5 [O-][n+]1ccccc1S Amb1154773 [0,1,0,0,0,0|1,0,1]=3 1637 B8R1.5 [O-][n+]1ccncc1Br Amb27862342 [0,1,0,0,0,0|2,0,1]=4 1638 B8R1.5 [O-][n+]1ccncc1Cl Amb26979797 [0,1,0,0,0,0|2,0,1]=4 1639 B8R1.5 [O-][n+]1ccncc1O Amb27597940 [0,1,0,0,0,0|2,0,0]=3 1640 B8R1.72 CC1(C)C=CNC=C1 Amb27838379 [0,1,0,0,0,0|2,0,1]=4 1641 B8R1.72 O=P1(Cl)C=COC=C1 Amb24671250 [0,1,0,0,0,0|2,0,1]=4 1642 B8R1.72 O=S1(=O)C=CNC=C1 Amb25243210 [0,1,0,0,0,0|2,0,1]=4 1643 B6R0.1 C=C=CC(=O)C=C Amb28200674 [0,0,1,0,0,0|0,0,2]=3 1644 B6R0.1 C=C=CC(O)C=C Amb28074635 [0,0,1,0,0,0|0,0,2]=3 1645 B6R0.1 C=CC(=O)\C=C\Cl Amb27233658 [0,0,1,0,0,0|1,0,1]=3 1646 B6R0.1 C=CC(O)CC=O Amb27401128 [0,0,1,0,0,0|1,0,2]=4 1647 B6R0.1 C=CCC(=C)C=O Amb18120415 [0,0,1,0,0,0|2,0,1]=4 1648 B6R0.1 C=CCC(=O)C=C Amb27164626 [0,0,1,0,0,0|0,0,2]=3 1649 B6R0.1 C=CCC(C)C=C Amb25705690 [0,0,1,0,0,0|1,0,2]=4 1650 B6R0.1 C=CCC(Cl)C=C Amb25115865 [0,0,1,0,0,0|1,0,2]=4 1651 B6R0.1 C=CCC(O)C=C Amb8513481 [0,0,1,0,0,0|0,0,2]=3 1652 B6R0.1 C=CC[C@@H](N)C=C Amb27213303 [0,0,1,0,0,0|1,0,2]=4 1653 B6R0.1 C=CC[C@@H](O)C=C Amb27636288 [0,0,1,0,0,0|0,0,2]=3 1654 B6R0.1 C=CC[C@H](N)C=C Amb28313731 [0,0,1,0,0,0|1,0,2]=4 1655 B6R0.1 C=CC\C(C)=C\C Amb24479822 [0,0,1,0,0,0|1,0,2]=4 1656 B6R0.1 C=CNC(=O)C=C Amb27848738 [0,0,1,0,0,0|1,0,1]=3 1657 B6R0.1 C=COC(=O)C=C Amb22231745 [0,0,1,0,0,0|1,0,1]=3 1658 B6R0.1 C=C\C(Br)=C/C=O Amb28052705 [0,0,1,0,0,0|2,0,0]=3 1659 B6R0.1 C=C\C(Br)=C/CCl Amb28118478 [0,0,1,0,0,0|2,0,1]=4 1660 B6R0.1 C=C\C(C)=C/C=O Amb18638879 [0,0,1,0,0,0|2,0,0]=3 1661 B6R0.1 C=C\C(C)=C/CC Amb27493400 [0,0,1,0,0,0|1,0,2]=4 1662 B6R0.1 C=C\C(C)=C/CCl Amb25025997 [0,0,1,0,0,0|2,0,1]=4 1663 B6R0.1 C=C\C=C(/C)CBr Amb27634848 [0,0,1,0,0,0|2,0,1]=4 1664 B6R0.1 C=C\C=C(/C)CO Amb17843900 [0,0,1,0,0,0|2,0,1]=4 1665 B6R0.1 C=C\C=C(/Cl)C=O Amb27797386 [0,0,1,0,0,0|2,0,0]=3 1666 B6R0.1 C=C\C=C(\Br)C=O Amb18126250 [0,0,1,0,0,0|2,0,0]=3 1667 B6R0.1 C=C\C=C(\F)CCl Amb27236794 [0,0,1,0,0,0|2,0,1]=4 1668 B6R0.1 CC\C=C(/O)C=O Amb27849683 [0,0,1,0,0,0|1,0,2]=4 1669 B6R0.1 CC\C=C(\O)C=O Amb27195226 [0,0,1,0,0,0|1,0,2]=4 1670 B6R0.1 CO\C=C(/O)C=O Amb27797385 [0,0,1,0,0,0|2,0,1]=4 1671 B6R0.1 C\C(C=O)=C/C=O Amb27597073 [0,0,1,0,0,0|3,0,0]=4 1672 B6R0.1 C\C=C/C(Br)=C/Cl Amb27396622 [0,0,1,0,0,0|2,0,1]=4 1673 B6R0.1 C\C=C/C(Cl)=C\Br Amb27407128 [0,0,1,0,0,0|2,0,1]=4 1674 B6R0.1 C\C=C\C(=O)C=O Amb27838207 [0,0,1,0,0,0|1,0,2]=4 1675 B6R0.1 C\C=C\C(Br)=C\Cl Amb28248126 [0,0,1,0,0,0|2,0,1]=4 1676 B6R0.1 C\C=C\C(C)=C\Cl Amb27640596 [0,0,1,0,0,0|2,0,1]=4 1677 B6R0.1 O=C\C=C(/Br)C=O Amb27169466 [0,0,1,0,0,0|3,0,0]=4 1678 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [0,0,1,0,0,0|1,0,2]=4 1679 B6R0.4 C=C(C)\C=C\C=O Amb18120435 [0,0,1,0,0,0|2,0,0]=3 1680 B6R0.4 C=C(C)\C=C\CCl Amb25991091 [0,0,1,0,0,0|2,0,1]=4 1681 B6R0.4 C=C(C)\C=C\CN Amb33199533 [0,0,1,0,0,0|2,0,1]=4 1682 B6R0.4 C=C(C)\C=C\CO Amb33473880 [0,0,1,0,0,0|2,0,1]=4 1683 B6R0.4 C=C(F)\C=C\CCl Amb28363835 [0,0,1,0,0,0|2,0,1]=4 1684 B6R0.4 C=C=CCC(=O)O Amb26657414 [0,0,1,0,0,0|1,0,2]=4 1685 B6R0.4 C=CCCC(=C)C Amb22228883 [0,0,1,0,0,0|1,0,2]=4 1686 B6R0.4 C=CCCC(=O)O Amb3940112 [0,0,1,0,0,0|1,0,2]=4 1687 B6R0.4 C=CNCC(=O)O Amb28346027 [0,0,1,0,0,0|2,0,1]=4 1688 B6R0.4 C=COCC(=C)C Amb26873422 [0,0,1,0,0,0|2,0,1]=4 1689 B6R0.4 C=COCC(=O)O Amb27247261 [0,0,1,0,0,0|2,0,1]=4 1690 B6R0.4 C=C\C=C/C(C)=O Amb27165543 [0,0,1,0,0,0|0,0,2]=3 1691 B6R0.4 C=C\C=C\C(=O)Cl Amb26530329 [0,0,1,0,0,0|1,0,1]=3 1692 B6R0.4 C=C\C=C\C(C)Br Amb27392285 [0,0,1,0,0,0|1,0,2]=4 1693 B6R0.4 C=C\C=C\C(C)C Amb27185806 [0,0,1,0,0,0|1,0,2]=4 1694 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [0,0,1,0,0,0|1,0,2]=4 1695 B6R0.4 CC(C)=C\C=C\Br Amb28244792 [0,0,1,0,0,0|2,0,1]=4 1696 B6R0.4 CC(C)=C\C=C\Cl Amb27760419 [0,0,1,0,0,0|2,0,1]=4 1697 B6R0.4 CC(O)\C=C\C=O Amb18639615 [0,0,1,0,0,0|1,0,2]=4 1698 B6R0.4 CC=C=CC(=O)O Amb17593065 [0,0,1,0,0,0|1,0,2]=4 1699 B6R0.4 CC\C=C/C(=O)O Amb28429841 [0,0,1,0,0,0|1,0,2]=4 1700 B6R0.4 CC\C=C\C(=O)O Amb6608967 [0,0,1,0,0,0|1,0,2]=4 1701 B6R0.4 CO\C=C\C(=O)O Amb18121767 [0,0,1,0,0,0|2,0,1]=4 1702 B6R0.4 CS\C=C\C(=O)O Amb30584688 [0,0,1,0,0,0|2,0,1]=4 1703 B6R0.4 C\C=C\CC(=O)O Amb3941538 [0,0,1,0,0,0|1,0,2]=4 1704 B6R0.4 N#C\C=C\C(=O)O Amb25853809 [0,0,1,0,0,0|2,0,1]=4 1705 B6R0.4 NC\C=C/C(=O)O Amb24117018 [0,0,1,0,0,0|2,0,1]=4 1706 B6R0.4 NC\C=C\C(=O)O Amb33422010 [0,0,1,0,0,0|2,0,1]=4 1707 B6R0.4 NC\C=C\C(=O)O Amb33422035 [0,0,1,0,0,0|2,0,1]=4 1708 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [0,0,1,0,0,0|2,0,1]=4 1709 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [0,0,1,0,0,0|2,0,1]=4 1710 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [0,0,1,0,0,0|2,0,1]=4 1711 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [0,0,1,0,0,0|2,0,1]=4 1712 B6R0.4 O=C(O)\C=C\CF Amb33470171 [0,0,1,0,0,0|2,0,1]=4 1713 B6R0.4 O=C(O)\C=C\CO Amb32662006 [0,0,1,0,0,0|2,0,1]=4 1714 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [0,0,1,0,0,0|2,0,0]=3 1715 B6R0.4 O=C\C=C\B(O)O Amb22899676 [0,0,1,0,0,0|3,0,0]=4 1716 B6R0.6 C=C=C\C=C\C#N Amb17593042 [0,0,1,0,0,0|1,0,2]=4 1717 B6R0.6 C=CCC\C=C\C Amb22734684 [0,0,1,0,0,0|1,0,2]=4 1718 B6R0.6 C=CS\C=C\CO Amb27219812 [0,0,1,0,0,0|1,0,1]=3 1719 B6R0.6 C=C\C=C\C=C\C Amb27627431 [0,0,1,0,0,0|1,0,0]=2 1720 B6R0.6 C=C\C=C\C=C\Cl Amb27656821 [0,0,1,0,0,0|1,0,0]=2 1721 B6R0.6 C=C\C=C\CCBr Amb32679337 [0,0,1,0,0,0|1,0,2]=4 1722 B6R0.6 C=C\C=C\CCC Amb33171502 [0,0,1,0,0,0|1,0,2]=4 1723 B6R0.6 C=C\C=C\CCN Amb18639048 [0,0,1,0,0,0|1,0,2]=4 1724 B6R0.6 C=C\C=C\CCN Amb32679368 [0,0,1,0,0,0|1,0,2]=4 1725 B6R0.6 C=C\C=C\CCO Amb34916666 [0,0,1,0,0,0|0,0,2]=3 1726 B6R0.6 C=C\C=C\CNC Amb25244153 [0,0,1,0,0,0|2,0,1]=4 1727 B6R0.6 CC\C=C\C=C/Br Amb27392254 [0,0,1,0,0,0|1,0,2]=4 1728 B6R0.6 CC\C=C\C=C\Br Amb27233492 [0,0,1,0,0,0|1,0,2]=4 1729 B6R0.6 CO\C=C\C=C/Cl Amb27863084 [0,0,1,0,0,0|2,0,1]=4 1730 B6R0.6 C\C=C\C=C\C#N Amb2720975 [0,0,1,0,0,0|1,0,2]=4 1731 B6R0.6 C\C=C\C=C\C=O Amb33986154 [0,0,1,0,0,0|0,0,2]=3 1732 B6R0.6 C\C=C\C=C\CBr Amb27433479 [0,0,1,0,0,0|1,0,2]=4 1733 B6R0.6 C\C=C\C=C\CCl Amb32652238 [0,0,1,0,0,0|1,0,2]=4 1734 B6R0.6 C\C=C\C=C\CN Amb18639062 [0,0,1,0,0,0|1,0,2]=4 1735 B6R0.6 C\C=C\C=C\CN Amb24117256 [0,0,1,0,0,0|1,0,2]=4 1736 B6R0.6 C\C=C\C=C\CO Amb27848287 [0,0,1,0,0,0|0,0,2]=3 1737 B6R0.6 C\C=C\S\C=C\C Amb27210562 [0,0,1,0,0,0|2,0,1]=4 1738 B6R0.6 Cl\C=C\S\C=C\Cl Amb28343062 [0,0,1,0,0,0|3,0,0]=4 1739 B6R0.6 N\C=C/C=C/C=O Amb27838284 [0,0,1,0,0,0|1,0,1]=3 1740 B6R0.6 N\C=C\C=C\C=O Amb27873733 [0,0,1,0,0,0|1,0,1]=3 1741 B6R0.6 O=C=C\C=C/C=O Amb28128301 [0,0,1,0,0,0|1,0,2]=4 1742 B6R0.6 O=C\C=C/C=C\S Amb27166146 [0,0,1,0,0,0|1,0,1]=3 1743 B6R0.6 O=C\C=C/CC=O Amb28050289 [0,0,1,0,0,0|1,0,2]=4 1744 B6R0.6 O=C\C=C/CCO Amb27235316 [0,0,1,0,0,0|1,0,2]=4 1745 B6R0.6 O=C\C=C\C=C\Br Amb16233577 [0,0,1,0,0,0|1,0,1]=3 1746 B6R0.6 O=C\C=C\C=C\Cl Amb27760447 [0,0,1,0,0,0|1,0,1]=3 1747 B6R0.6 O=C\C=C\C=C\O Amb27646525 [0,0,1,0,0,0|1,0,0]=2 1748 B6R0.6 O=C\C=C\C=C\S Amb28051864 [0,0,1,0,0,0|1,0,1]=3 1749 B6R0.6 O=C\C=C\CC=O Amb17593064 [0,0,1,0,0,0|1,0,2]=4 1750 B6R0.6 OC\C=C\C=C\Br Amb27750080 [0,0,1,0,0,0|1,0,1]=3 1751 B6R0.6 OC\C=C\C=C\Cl Amb27858902 [0,0,1,0,0,0|1,0,1]=3 1752 B8R2.11 O=C1c2ccsc21 Amb27802559 [0,0,0,1,0,0|1,0,1]=3 1753 B8R2.25 C1=CC2=CC2C=N1 Amb27228609 [0,0,0,1,0,0|2,0,1]=4 1754 B8R2.25 c1ccc2c(c1)C2 Amb22731756 [0,0,0,1,0,0|1,0,0]=2 1755 B8R2.25 c1ccc2c(c1)N2 Amb26988536 [0,0,0,1,0,0|1,0,0]=2 1756 B8R2.34 C1=CC2C=CC1C2 Amb33780114 [0,0,0,1,0,0|1,0,2]=4 1757 B8R2.34 C1=CC2C=CC1C2 Amb8517348 [0,0,0,1,0,0|1,0,2]=4 1758 B8R2.38 O=C1C=CC2=CC12 Amb27861243 [0,0,0,1,0,0|0,0,2]=3 1759 B6R1.2 Bc1ccco1 Amb28286917 [0,0,0,0,1,0|2,0,0]=3 1760 B6R1.2 Bn1cccc1 Amb27463207 [0,0,0,0,1,0|2,0,0]=3 1761 B6R1.2 Brc1ccc[se]1 Amb21964756 [0,0,0,0,1,0|2,0,0]=3 1762 B6R1.2 Brc1ccco1 Amb2723041 [0,0,0,0,1,0|2,0,0]=3 1763 B6R1.2 Brc1cccs1 Amb2685504 [0,0,0,0,1,0|2,0,0]=3 1764 B6R1.2 Brc1ccno1 Amb20242149 [0,0,0,0,1,0|3,0,0]=4 1765 B6R1.2 Brc1ccns1 Amb33544135 [0,0,0,0,1,0|3,0,0]=4 1766 B6R1.2 Brc1ccoc1 Amb2720289 [0,0,0,0,1,0|2,0,0]=3 1767 B6R1.2 Brc1ccon1 Amb13890359 [0,0,0,0,1,0|3,0,0]=4 1768 B6R1.2 Brc1ccsc1 Amb2685505 [0,0,0,0,1,0|2,0,0]=3 1769 B6R1.2 Brc1ccsn1 Amb18828880 [0,0,0,0,1,0|3,0,0]=4 1770 B6R1.2 Brc1cnco1 Amb24058248 [0,0,0,0,1,0|3,0,0]=4 1771 B6R1.2 Brc1cnco1 Amb32667046 [0,0,0,0,1,0|3,0,0]=4 1772 B6R1.2 Brc1cncs1 Amb2455804 [0,0,0,0,1,0|3,0,0]=4 1773 B6R1.2 Brc1cnoc1 Amb2447384 [0,0,0,0,1,0|3,0,0]=4 1774 B6R1.2 Brc1cnsc1 Amb1091886 [0,0,0,0,1,0|3,0,0]=4 1775 B6R1.2 Brc1cocn1 Amb26843131 [0,0,0,0,1,0|3,0,0]=4 1776 B6R1.2 Brc1cocn1 Amb32667192 [0,0,0,0,1,0|3,0,0]=4 1777 B6R1.2 Brc1cscn1 Amb2447456 [0,0,0,0,1,0|3,0,0]=4 1778 B6R1.2 Brc1ncco1 Amb10071482 [0,0,0,0,1,0|3,0,0]=4 1779 B6R1.2 Brc1ncco1 Amb19514894 [0,0,0,0,1,0|3,0,0]=4 1780 B6R1.2 Brc1nccs1 Amb535721 [0,0,0,0,1,0|3,0,0]=4 1781 B6R1.2 CC1=CC=CC1 Amb26338978 [0,0,0,0,1,0|1,0,1]=3 1782 B6R1.2 Cc1ccco1 Amb2447070 [0,0,0,0,1,0|2,0,0]=3 1783 B6R1.2 Cc1cccs1 Amb2447069 [0,0,0,0,1,0|2,0,0]=3 1784 B6R1.2 Cc1ccno1 Amb33544333 [0,0,0,0,1,0|3,0,0]=4 1785 B6R1.2 Cc1ccns1 Amb22734260 [0,0,0,0,1,0|3,0,0]=4 1786 B6R1.2 Cc1ccoc1 Amb2447077 [0,0,0,0,1,0|2,0,0]=3 1787 B6R1.2 Cc1ccon1 Amb4005631 [0,0,0,0,1,0|3,0,0]=4 1788 B6R1.2 Cc1ccsc1 Amb2447071 [0,0,0,0,1,0|2,0,0]=3 1789 B6R1.2 Cc1ccsn1 Amb20621563 [0,0,0,0,1,0|3,0,0]=4 1790 B6R1.2 Cc1cnco1 Amb23403175 [0,0,0,0,1,0|3,0,0]=4 1791 B6R1.2 Cc1cncs1 Amb8396856 [0,0,0,0,1,0|3,0,0]=4 1792 B6R1.2 Cc1cnoc1 Amb2697202 [0,0,0,0,1,0|3,0,0]=4 1793 B6R1.2 Cc1cnsc1 Amb22370679 [0,0,0,0,1,0|3,0,0]=4 1794 B6R1.2 Cc1cocn1 Amb33544147 [0,0,0,0,1,0|3,0,0]=4 1795 B6R1.2 Cc1cscn1 Amb1163532 [0,0,0,0,1,0|3,0,0]=4 1796 B6R1.2 Cc1ncco1 Amb17399783 [0,0,0,0,1,0|3,0,0]=4 1797 B6R1.2 Cc1ncco1 Amb22757206 [0,0,0,0,1,0|3,0,0]=4 1798 B6R1.2 Cc1nccs1 Amb2455765 [0,0,0,0,1,0|3,0,0]=4 1799 B6R1.2 ClC1=CCC=C1 Amb22584067 [0,0,0,0,1,0|1,0,1]=3 1800 B6R1.2 Clc1ccco1 Amb27805575 [0,0,0,0,1,0|2,0,0]=3 1801 B6R1.2 Clc1cccs1 Amb2686481 [0,0,0,0,1,0|2,0,0]=3 1802 B6R1.2 Clc1ccoc1 Amb24333769 [0,0,0,0,1,0|2,0,0]=3 1803 B6R1.2 Clc1ccon1 Amb33543597 [0,0,0,0,1,0|3,0,0]=4 1804 B6R1.2 Clc1ccsc1 Amb2686482 [0,0,0,0,1,0|2,0,0]=3 1805 B6R1.2 Clc1ccsn1 Amb21927817 [0,0,0,0,1,0|3,0,0]=4 1806 B6R1.2 Clc1cncs1 Amb21864727 [0,0,0,0,1,0|3,0,0]=4 1807 B6R1.2 Clc1cncs1 Amb33549695 [0,0,0,0,1,0|3,0,0]=4 1808 B6R1.2 Clc1cnoc1 Amb27974688 [0,0,0,0,1,0|3,0,0]=4 1809 B6R1.2 Clc1cnsc1 Amb28049472 [0,0,0,0,1,0|3,0,0]=4 1810 B6R1.2 Clc1cscn1 Amb10602719 [0,0,0,0,1,0|3,0,0]=4 1811 B6R1.2 Clc1ncco1 Amb22054705 [0,0,0,0,1,0|3,0,0]=4 1812 B6R1.2 Clc1ncco1 Amb32655821 [0,0,0,0,1,0|3,0,0]=4 1813 B6R1.2 Clc1nccs1 Amb2455949 [0,0,0,0,1,0|3,0,0]=4 1814 B6R1.2 Cn1cccc1 Amb6608780 [0,0,0,0,1,0|2,0,0]=3 1815 B6R1.2 Cn1cccn1 Amb1088902 [0,0,0,0,1,0|3,0,0]=4 1816 B6R1.2 Cn1ccnc1 Amb22337441 [0,0,0,0,1,0|3,0,0]=4 1817 B6R1.2 Cn1ccnc1 Amb2689449 [0,0,0,0,1,0|3,0,0]=4 1818 B6R1.2 Fc1ccco1 Amb27470402 [0,0,0,0,1,0|2,0,0]=3 1819 B6R1.2 Fc1cccs1 Amb8388025 [0,0,0,0,1,0|2,0,0]=3 1820 B6R1.2 Fc1ccoc1 Amb26369802 [0,0,0,0,1,0|2,0,0]=3 1821 B6R1.2 Fc1ccsc1 Amb33543454 [0,0,0,0,1,0|2,0,0]=3 1822 B6R1.2 Fc1cnoc1 Amb28255557 [0,0,0,0,1,0|3,0,0]=4 1823 B6R1.2 Fc1cocn1 Amb27214748 [0,0,0,0,1,0|3,0,0]=4 1824 B6R1.2 Fc1nccs1 Amb20621379 [0,0,0,0,1,0|3,0,0]=4 1825 B6R1.2 Fn1ccnc1 Amb28133827 [0,0,0,0,1,0|3,0,0]=4 1826 B6R1.2 IC1C=CC=C1 Amb25189843 [0,0,0,0,1,0|1,0,1]=3 1827 B6R1.2 Ic1ccco1 Amb17672748 [0,0,0,0,1,0|2,0,0]=3 1828 B6R1.2 Ic1cccs1 Amb2688889 [0,0,0,0,1,0|2,0,0]=3 1829 B6R1.2 Ic1ccns1 Amb25136169 [0,0,0,0,1,0|3,0,0]=4 1830 B6R1.2 Ic1ccoc1 Amb24686192 [0,0,0,0,1,0|2,0,0]=3 1831 B6R1.2 Ic1ccsc1 Amb8393328 [0,0,0,0,1,0|2,0,0]=3 1832 B6R1.2 Ic1ccsn1 Amb32685567 [0,0,0,0,1,0|3,0,0]=4 1833 B6R1.2 Ic1cnco1 Amb33250373 [0,0,0,0,1,0|3,0,0]=4 1834 B6R1.2 Ic1cncs1 Amb24087561 [0,0,0,0,1,0|3,0,0]=4 1835 B6R1.2 Ic1cnoc1 Amb19957573 [0,0,0,0,1,0|3,0,0]=4 1836 B6R1.2 Ic1cnsc1 Amb12805582 [0,0,0,0,1,0|3,0,0]=4 1837 B6R1.2 Ic1cocn1 Amb24620615 [0,0,0,0,1,0|3,0,0]=4 1838 B6R1.2 Ic1cocn1 Amb32684147 [0,0,0,0,1,0|3,0,0]=4 1839 B6R1.2 Ic1cscn1 Amb22057367 [0,0,0,0,1,0|3,0,0]=4 1840 B6R1.2 Ic1ncco1 Amb33547666 [0,0,0,0,1,0|3,0,0]=4 1841 B6R1.2 Ic1nccs1 Amb6296420 [0,0,0,0,1,0|3,0,0]=4 1842 B6R1.2 In1ccnc1 Amb25965700 [0,0,0,0,1,0|3,0,0]=4 1843 B6R1.2 N=C1C=CNC1 Amb28135748 [0,0,0,0,1,0|2,0,1]=4 1844 B6R1.2 N=C1NC=CS1 Amb22166858 [0,0,0,0,1,0|3,0,0]=4 1845 B6R1.2 NC1=NCC=C1 Amb25208790 [0,0,0,0,1,0|2,0,1]=4 1846 B6R1.2 N[c-]1cccc1 Amb34916047 [0,0,0,0,1,0|1,0,1]=3 1847 B6R1.2 Nc1ccco1 Amb18203215 [0,0,0,0,1,0|2,0,0]=3 1848 B6R1.2 Nc1ccno1 Amb33528297 [0,0,0,0,1,0|3,0,0]=4 1849 B6R1.2 Nc1ccns1 Amb18203020 [0,0,0,0,1,0|3,0,0]=4 1850 B6R1.2 Nc1ccns1 Amb28555333 [0,0,0,0,1,0|3,0,0]=4 1851 B6R1.2 Nc1ccoc1 Amb22230735 [0,0,0,0,1,0|2,0,0]=3 1852 B6R1.2 Nc1ccon1 Amb613464 [0,0,0,0,1,0|3,0,0]=4 1853 B6R1.2 Nc1ccsc1 Amb13889594 [0,0,0,0,1,0|2,0,0]=3 1854 B6R1.2 Nc1ccsc1 Amb17935671 [0,0,0,0,1,0|2,0,0]=3 1855 B6R1.2 Nc1ccsc1 Amb19515444 [0,0,0,0,1,0|2,0,0]=3 1856 B6R1.2 Nc1ccsc1 Amb22405919 [0,0,0,0,1,0|2,0,0]=3 1857 B6R1.2 Nc1ccsn1 Amb22235783 [0,0,0,0,1,0|3,0,0]=4 1858 B6R1.2 Nc1ccsn1 Amb33553648 [0,0,0,0,1,0|3,0,0]=4 1859 B6R1.2 Nc1cnco1 Amb21962026 [0,0,0,0,1,0|3,0,0]=4 1860 B6R1.2 Nc1cnco1 Amb21963496 [0,0,0,0,1,0|3,0,0]=4 1861 B6R1.2 Nc1cncs1 Amb32664220 [0,0,0,0,1,0|3,0,0]=4 1862 B6R1.2 Nc1cncs1 Amb8395996 [0,0,0,0,1,0|3,0,0]=4 1863 B6R1.2 Nc1cncs1 Amb8631404 [0,0,0,0,1,0|3,0,0]=4 1864 B6R1.2 Nc1cnoc1 Amb10602604 [0,0,0,0,1,0|3,0,0]=4 1865 B6R1.2 Nc1cnoc1 Amb10602605 [0,0,0,0,1,0|3,0,0]=4 1866 B6R1.2 Nc1cnsc1 Amb19958803 [0,0,0,0,1,0|3,0,0]=4 1867 B6R1.2 Nc1cnsc1 Amb30584670 [0,0,0,0,1,0|3,0,0]=4 1868 B6R1.2 Nc1cnsc1 Amb8009360 [0,0,0,0,1,0|3,0,0]=4 1869 B6R1.2 Nc1cocn1 Amb22284836 [0,0,0,0,1,0|3,0,0]=4 1870 B6R1.2 Nc1cscn1 Amb10600518 [0,0,0,0,1,0|3,0,0]=4 1871 B6R1.2 Nc1cscn1 Amb22495658 [0,0,0,0,1,0|3,0,0]=4 1872 B6R1.2 Nc1ncco1 Amb6751913 [0,0,0,0,1,0|3,0,0]=4 1873 B6R1.2 Nc1nccs1 Amb2609403 [0,0,0,0,1,0|3,0,0]=4 1874 B6R1.2 Nc1nccs1 Amb2707210 [0,0,0,0,1,0|3,0,0]=4 1875 B6R1.2 Nn1cccc1 Amb2684521 [0,0,0,0,1,0|2,0,0]=3 1876 B6R1.2 Nn1cccn1 Amb22233569 [0,0,0,0,1,0|3,0,0]=4 1877 B6R1.2 Nn1ccnc1 Amb22728066 [0,0,0,0,1,0|3,0,0]=4 1878 B6R1.2 Nn1ccnc1 Amb24184022 [0,0,0,0,1,0|3,0,0]=4 1879 B6R1.2 O=C1C=CCC1 Amb4019519 [0,0,0,0,1,0|0,0,3]=4 1880 B6R1.2 O=C1C=CCN1 Amb20241082 [0,0,0,0,1,0|1,0,2]=4 1881 B6R1.2 O=C1C=CCO1 Amb2792769 [0,0,0,0,1,0|1,0,2]=4 1882 B6R1.2 O=C1C=CCS1 Amb22336458 [0,0,0,0,1,0|1,0,2]=4 1883 B6R1.2 O=C1C=CN=N1 Amb22230022 [0,0,0,0,1,0|2,0,1]=4 1884 B6R1.2 O=C1C=CNN1 Amb19958916 [0,0,0,0,1,0|2,0,1]=4 1885 B6R1.2 O=C1C=COC1 Amb24107591 [0,0,0,0,1,0|1,0,2]=4 1886 B6R1.2 O=C1C=CSN1 Amb19895016 [0,0,0,0,1,0|2,0,1]=4 1887 B6R1.2 O=C1C=CSS1 Amb27421370 [0,0,0,0,1,0|2,0,1]=4 1888 B6R1.2 O=C1C=NN=C1 Amb28351406 [0,0,0,0,1,0|2,0,1]=4 1889 B6R1.2 O=C1CC=CC1 Amb2686649 [0,0,0,0,1,0|0,0,3]=4 1890 B6R1.2 O=C1CC=CN1 Amb22235167 [0,0,0,0,1,0|1,0,2]=4 1891 B6R1.2 O=C1N=CC=N1 Amb25138138 [0,0,0,0,1,0|2,0,1]=4 1892 B6R1.2 O=C1NC=CN1 Amb19516737 [0,0,0,0,1,0|2,0,1]=4 1893 B6R1.2 O=C1NC=CO1 Amb20671008 [0,0,0,0,1,0|2,0,1]=4 1894 B6R1.2 O=C1NC=CS1 Amb19271596 [0,0,0,0,1,0|2,0,1]=4 1895 B6R1.2 O=C1OC=CO1 Amb20239430 [0,0,0,0,1,0|2,0,1]=4 1896 B6R1.2 O=S1C=CC=C1 Amb27787698 [0,0,0,0,1,0|1,0,1]=3 1897 B6R1.2 OC1=NC=NC1 Amb26446352 [0,0,0,0,1,0|2,0,1]=4 1898 B6R1.2 OC1C=CCC1 Amb33546881 [0,0,0,0,1,0|0,0,3]=4 1899 B6R1.2 OC1C=CNN1 Amb33716474 [0,0,0,0,1,0|2,0,1]=4 1900 B6R1.2 OC1CC=CC1 Amb2686648 [0,0,0,0,1,0|0,0,3]=4 1901 B6R1.2 O[C@H]1C=CCC1 Amb28133982 [0,0,0,0,1,0|0,0,3]=4 1902 B6R1.2 O[C@H]1C=COC1 Amb27242778 [0,0,0,0,1,0|1,0,2]=4 1903 B6R1.2 Oc1ccco1 Amb25991417 [0,0,0,0,1,0|1,0,0]=2 1904 B6R1.2 Oc1cccs1 Amb17201836 [0,0,0,0,1,0|1,0,0]=2 1905 B6R1.2 Oc1ccon1 Amb33547602 [0,0,0,0,1,0|2,0,0]=3 1906 B6R1.2 Oc1ccsc1 Amb16231253 [0,0,0,0,1,0|1,0,0]=2 1907 B6R1.2 Oc1ccsn1 Amb22371253 [0,0,0,0,1,0|2,0,0]=3 1908 B6R1.2 Oc1cnco1 Amb25301524 [0,0,0,0,1,0|2,0,0]=3 1909 B6R1.2 Oc1cncs1 Amb10599639 [0,0,0,0,1,0|2,0,0]=3 1910 B6R1.2 Oc1cnoc1 Amb24601068 [0,0,0,0,1,0|2,0,0]=3 1911 B6R1.2 Oc1cnsc1 Amb33744137 [0,0,0,0,1,0|2,0,0]=3 1912 B6R1.2 Oc1cnsn1 Amb1107309 [0,0,0,0,1,0|3,0,0]=4 1913 B6R1.2 Oc1cscn1 Amb10600519 [0,0,0,0,1,0|2,0,0]=3 1914 B6R1.2 Oc1csnn1 Amb33321615 [0,0,0,0,1,0|3,0,0]=4 1915 B6R1.2 Oc1ncno1 Amb26965847 [0,0,0,0,1,0|3,0,0]=4 1916 B6R1.2 Oc1nnco1 Amb22586631 [0,0,0,0,1,0|3,0,0]=4 1917 B6R1.2 Oc1nncs1 Amb19516957 [0,0,0,0,1,0|3,0,0]=4 1918 B6R1.2 On1cccn1 Amb10067876 [0,0,0,0,1,0|2,0,0]=3 1919 B6R1.2 On1ccnc1 Amb10552377 [0,0,0,0,1,0|2,0,0]=3 1920 B6R1.2 S=C1C=CCO1 Amb27971151 [0,0,0,0,1,0|1,1,1]=4 1921 B6R1.2 S=C1C=CSS1 Amb19132030 [0,0,0,0,1,0|2,1,0]=4 1922 B6R1.2 S=C1CC=CN1 Amb27239207 [0,0,0,0,1,0|1,1,1]=4 1923 B6R1.2 S=C1NC=CN1 Amb19148165 [0,0,0,0,1,0|2,1,0]=4 1924 B6R1.2 S=C1NC=CO1 Amb21936248 [0,0,0,0,1,0|2,1,0]=4 1925 B6R1.2 S=C1NC=CS1 Amb22492748 [0,0,0,0,1,0|2,1,0]=4 1926 B6R1.2 S=C1SC=CS1 Amb20001458 [0,0,0,0,1,0|2,1,0]=4 1927 B6R1.2 Sc1ccco1 Amb26641519 [0,0,0,0,1,0|1,1,0]=3 1928 B6R1.2 Sc1cccs1 Amb2689075 [0,0,0,0,1,0|1,1,0]=3 1929 B6R1.2 Sc1ccoc1 Amb25979686 [0,0,0,0,1,0|1,1,0]=3 1930 B6R1.2 Sc1ccon1 Amb26338955 [0,0,0,0,1,0|2,1,0]=4 1931 B6R1.2 Sc1ccsc1 Amb16232450 [0,0,0,0,1,0|1,1,0]=3 1932 B6R1.2 Sc1cnsc1 Amb25992586 [0,0,0,0,1,0|2,1,0]=4 1933 B6R1.2 Sc1cocn1 Amb27966248 [0,0,0,0,1,0|2,1,0]=4 1934 B6R1.2 Sc1cscn1 Amb24099741 [0,0,0,0,1,0|2,1,0]=4 1935 B6R1.2 Sc1nccs1 Amb1137208 [0,0,0,0,1,0|2,1,0]=4 1936 B6R1.2 Sn1ccnc1 Amb27959165 [0,0,0,0,1,0|2,1,0]=4 1937 B6R1.2 [O-][n+]1ccsc1 Amb25684211 [0,0,0,0,1,0|2,0,1]=4 1938 B6R1.2 [SiH2]=C1NC=CN1 Amb27225499 [0,0,0,0,1,0|3,0,0]=4 1939 B8R1.22 BrC1C=CC=CCC1 Amb27629198 [0,0,0,0,0,1|1,0,2]=4 1940 B8R1.22 ClC1C=CC=CC=C1 Amb28121076 [0,0,0,0,0,1|1,0,1]=3 1941 B8R1.22 ClC1CC=CC=CC1 Amb28198665 [0,0,0,0,0,1|1,0,2]=4 1942 B8R1.22 NC1=CC=C=NC=C1 Amb27467651 [0,0,0,0,0,1|1,0,1]=3 1943 B8R1.22 NC1=NNC=CC=C1 Amb27469656 [0,0,0,0,0,1|2,0,0]=3 1944 B8R1.22 NC1C=CC=CC=C1 Amb27620329 [0,0,0,0,0,1|1,0,1]=3 1945 B8R1.22 O=C1C=CC=CC=C1 Amb19883798 [0,0,0,0,0,1|0,0,1]=2 1946 B8R1.22 O=C1C=CC=CCC1 Amb17593120 [0,0,0,0,0,1|0,0,2]=3 1947 B8R1.22 O=C1C=CC=NC=C1 Amb27599481 [0,0,0,0,0,1|0,0,1]=2 1948 B8R1.22 O=C1C=CCC=CC1 Amb28316220 [0,0,0,0,0,1|0,0,2]=3 1949 B8R1.22 O=C1C=CCCC=C1 Amb22364722 [0,0,0,0,0,1|0,0,2]=3 1950 B8R1.22 OC1C=CC=CCC1 Amb27766443 [0,0,0,0,0,1|0,0,2]=3 1951 B5R0.1 C=CC=C(C)C Amb22229813 [1,0,1,0,0,0|1,0,1]=4 1952 B5R0.1 C=CCC(=C)C Amb22347764 [1,0,1,0,0,0|1,0,1]=4 1953 B5R0.1 C=CCC(=O)O Amb3940098 [1,0,1,0,0,0|1,0,1]=4 1954 B5R0.1 C\C=C/C(=O)O Amb27779315 [1,0,1,0,0,0|1,0,1]=4 1955 B5R0.1 C\C=C\C(=O)O Amb8385856 [1,0,1,0,0,0|1,0,1]=4 1956 B5R0.1 N\C=C\C(=O)O Amb27217920 [1,0,1,0,0,0|2,0,0]=4 1957 B5R0.1 O=C(O)\C=C/Br Amb18644453 [1,0,1,0,0,0|2,0,0]=4 1958 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [1,0,1,0,0,0|2,0,0]=4 1959 B5R0.1 O=C(O)\C=C/I Amb28315824 [1,0,1,0,0,0|2,0,0]=4 1960 B5R0.1 O=C(O)\C=C\Br Amb27423608 [1,0,1,0,0,0|2,0,0]=4 1961 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [1,0,1,0,0,0|2,0,0]=4 1962 B5R0.1 O=C(O)\C=C\I Amb30584673 [1,0,1,0,0,0|2,0,0]=4 1963 B5R0.1 O=C(O)\C=C\O Amb26055842 [1,0,1,0,0,0|2,0,0]=4 1964 B5R0.1 O=C(O)\C=C\S Amb28401590 [1,0,1,0,0,0|2,0,0]=4 1965 B5R0.2 C=CC#CC=C Amb24671264 [1,0,1,0,0,0|0,0,2]=4 1966 B5R0.2 C=CCCC=C Amb8513514 [1,0,1,0,0,0|0,0,2]=4 1967 B5R0.2 C=CCNC=C Amb28134893 [1,0,1,0,0,0|1,0,1]=4 1968 B5R0.2 C=CCOC=C Amb17933943 [1,0,1,0,0,0|1,0,1]=4 1969 B5R0.2 C=CC\C=C/C Amb26426294 [1,0,1,0,0,0|0,0,2]=4 1970 B5R0.2 C=CSSC=C Amb27776219 [1,0,1,0,0,0|2,0,0]=4 1971 B5R0.2 C=C\C=C\C#N Amb17593012 [1,0,1,0,0,0|1,0,1]=4 1972 B5R0.2 C=C\C=C\C=C Amb17939040 [1,0,1,0,0,0|0,0,0]=2 1973 B5R0.2 C=C\C=C\C=O Amb26369847 [1,0,1,0,0,0|0,0,1]=3 1974 B5R0.2 C=C\C=C\CBr Amb24350542 [1,0,1,0,0,0|1,0,1]=4 1975 B5R0.2 C=C\C=C\CC Amb8513434 [1,0,1,0,0,0|0,0,2]=4 1976 B5R0.2 C=C\C=C\CCl Amb24401492 [1,0,1,0,0,0|1,0,1]=4 1977 B5R0.2 C=C\C=C\CN Amb26011188 [1,0,1,0,0,0|1,0,1]=4 1978 B5R0.2 C=C\C=C\CN Amb32824809 [1,0,1,0,0,0|1,0,1]=4 1979 B5R0.2 C\C=C/C=C/C Amb26318493 [1,0,1,0,0,0|0,0,2]=4 1980 B5R0.2 C\C=C\C=C\Br Amb27791828 [1,0,1,0,0,0|1,0,1]=4 1981 B5R0.2 C\C=C\C=C\C Amb27622458 [1,0,1,0,0,0|0,0,2]=4 1982 B5R0.2 O=C\C=C/C=O Amb28146767 [1,0,1,0,0,0|1,0,1]=4 1983 B5R0.2 O=C\C=C\C=O Amb17593019 [1,0,1,0,0,0|1,0,1]=4 1984 B5R0.2 O=C\C=C\CO Amb24356008 [1,0,1,0,0,0|1,0,1]=4 1985 B5R0.2 O\C=C\C=N\O Amb27831482 [1,0,1,0,0,0|2,0,0]=4 1986 B5R0.3 C=CC(=O)C=C Amb22265893 [1,0,1,0,0,0|0,0,1]=3 1987 B5R0.3 C=CC(C)C=C Amb22337672 [1,0,1,0,0,0|1,0,1]=4 1988 B5R0.3 C=CC(O)C=C Amb8383420 [1,0,1,0,0,0|0,0,1]=3 1989 B5R0.3 C=C\C(Br)=C\Cl Amb27407129 [1,0,1,0,0,0|2,0,0]=4 1990 B5R0.3 C=C\C(C)=C/Br Amb27420834 [1,0,1,0,0,0|2,0,0]=4 1991 B5R0.3 C=C\C(C)=C\N Amb27488688 [1,0,1,0,0,0|2,0,0]=4 1992 B5R0.3 O=C\C(O)=C\O Amb27863726 [1,0,1,0,0,0|2,0,0]=4 1993 B7R0.2 C=C(C)\C=C(/C)C=O Amb27464033 [0,1,1,0,0,0|2,0,0]=4 1994 B7R0.2 C=CC(=O)CC(=C)C Amb28048969 [0,1,1,0,0,0|0,0,2]=4 1995 B7R0.2 C=CC(=O)\C=C(/C)Br Amb28316132 [0,1,1,0,0,0|0,0,2]=4 1996 B7R0.2 C=CC(=O)\C=C(\C)Br Amb27861245 [0,1,1,0,0,0|0,0,2]=4 1997 B7R0.2 C=CC(O)C=C(Cl)Cl Amb28455169 [0,1,1,0,0,0|1,0,1]=4 1998 B7R0.2 C=C[C@H](O)CC(=C)C Amb27854005 [0,1,1,0,0,0|0,0,2]=4 1999 B7R0.2 C=C\C(Br)=C/C(C)=O Amb24505183 [0,1,1,0,0,0|1,0,1]=4 2000 B7R0.2 C=C\C(C)=C/C(=O)O Amb18641686 [0,1,1,0,0,0|2,0,0]=4 2001 B7R0.2 C=C\C(C)=C/C(C)=O Amb27210017 [0,1,1,0,0,0|1,0,1]=4 2002 B7R0.2 C=C\C(C)=C/C(N)=O Amb27195399 [0,1,1,0,0,0|2,0,0]=4 2003 B7R0.2 C=C\C(C)=C\C(C)=O Amb25234874 [0,1,1,0,0,0|1,0,1]=4 2004 B7R0.2 C=C\C(O)=C/C(C)=O Amb24553056 [0,1,1,0,0,0|0,0,1]=3 2005 B7R0.3 C=CC(=O)C\C=C\C Amb26475455 [0,1,1,0,0,0|0,0,2]=4 2006 B7R0.3 C=CC(=O)\C=C\CC Amb27156684 [0,1,1,0,0,0|0,0,2]=4 2007 B7R0.3 C=CC(O)C\C=C/C Amb25983129 [0,1,1,0,0,0|0,0,2]=4 2008 B7R0.3 C=CC(O)C\C=C\C Amb27666343 [0,1,1,0,0,0|0,0,2]=4 2009 B7R0.3 C=CC(O)\C=C\CC Amb27451021 [0,1,1,0,0,0|0,0,2]=4 2010 B7R0.3 C=CC=C=C(C)C=O Amb28388607 [0,1,1,0,0,0|2,0,0]=4 2011 B7R0.3 C=CCCC(O)C=C Amb27406053 [0,1,1,0,0,0|0,0,2]=4 2012 B7R0.3 C=CCC[C@H](O)C=C Amb27653189 [0,1,1,0,0,0|0,0,2]=4 2013 B7R0.3 C=CCNC(=O)C=C Amb9480567 [0,1,1,0,0,0|0,0,2]=4 2014 B7R0.3 C=CCOC(=O)C=C Amb4034462 [0,1,1,0,0,0|0,0,2]=4 2015 B7R0.3 C=CC\C=C(/C)C=O Amb18123725 [0,1,1,0,0,0|2,0,0]=4 2016 B7R0.3 C=C\C=C\C(=O)C=C Amb27210567 [0,1,1,0,0,0|0,0,1]=3 2017 B7R0.3 C=C\C=C\C(C)C=C Amb4035858 [0,1,1,0,0,0|1,0,1]=4 2018 B7R0.3 C\C=C/C=C(/C)C=O Amb27392706 [0,1,1,0,0,0|2,0,0]=4 2019 B7R0.3 C\C=C\C=C(/C)C=O Amb27204994 [0,1,1,0,0,0|2,0,0]=4 2020 B7R0.3 O=C\C(Br)=C\C=C\O Amb27204776 [0,1,1,0,0,0|2,0,0]=4 2021 B7R0.3 O=C\C(Cl)=C\C=C\O Amb28131732 [0,1,1,0,0,0|2,0,0]=4 2022 B7R0.3 O=C\C=C\C(=O)C=O Amb27440015 [0,1,1,0,0,0|1,0,1]=4 2023 B7R0.5 C=C(C)C(=O)\C=C\C Amb24422389 [0,1,1,0,0,0|0,0,2]=4 2024 B7R0.5 C=C(C)\C(C)=C\C=O Amb27852094 [0,1,1,0,0,0|2,0,0]=4 2025 B7R0.5 C=C(O)C(O)\C=C\C Amb28140639 [0,1,1,0,0,0|0,0,2]=4 2026 B7R0.5 C=CCC(=O)C(=C)C Amb17593136 [0,1,1,0,0,0|0,0,2]=4 2027 B7R0.5 C=CCC(O)C(=C)C Amb4035448 [0,1,1,0,0,0|0,0,2]=4 2028 B7R0.5 C=COC(=O)C(=C)C Amb22045212 [0,1,1,0,0,0|1,0,1]=4 2029 B7R0.5 C=C\C=C(/Cl)C(=O)O Amb18642910 [0,1,1,0,0,0|2,0,0]=4 2030 B7R0.5 C=C\C=C(\C)C(=O)O Amb27221069 [0,1,1,0,0,0|2,0,0]=4 2031 B7R0.7 C=CCC(=O)CC=C Amb24706994 [0,1,1,0,0,0|0,0,2]=4 2032 B7R0.7 C=CCC(=O)OC=C Amb27242220 [0,1,1,0,0,0|0,0,2]=4 2033 B7R0.7 C=CCC(=O)\C=C/C Amb27604137 [0,1,1,0,0,0|0,0,2]=4 2034 B7R0.7 C=CCC(=O)\C=C\C Amb24584475 [0,1,1,0,0,0|0,0,2]=4 2035 B7R0.7 C=CCC(O)CC=C Amb8513442 [0,1,1,0,0,0|0,0,2]=4 2036 B7R0.7 C=CCC(O)\C=C\C Amb25359897 [0,1,1,0,0,0|0,0,2]=4 2037 B7R0.7 C=CC[C@@H](O)\C=C\C Amb27410498 [0,1,1,0,0,0|0,0,2]=4 2038 B7R0.7 C=CNC(=O)NC=C Amb27839558 [0,1,1,0,0,0|1,0,1]=4 2039 B7R0.7 C=COC(=O)OC=C Amb27491742 [0,1,1,0,0,0|1,0,1]=4 2040 B7R0.7 C=COC(=O)\C=C\C Amb8514531 [0,1,1,0,0,0|0,0,2]=4 2041 B7R0.7 C\C=C\C(=O)\C=C/Cl Amb28316111 [0,1,1,0,0,0|0,0,2]=4 2042 B7R0.7 C\C=C\C(=O)\C=C\Br Amb28422704 [0,1,1,0,0,0|0,0,2]=4 2043 B7R0.7 C\C=C\C(=O)\C=C\Cl Amb27657841 [0,1,1,0,0,0|0,0,2]=4 2044 B7R0.7 C\C=C\C(=O)\C=C\N Amb27422017 [0,1,1,0,0,0|0,0,2]=4 2045 B7R0.7 C\C=C\C(=O)\C=C\O Amb28054394 [0,1,1,0,0,0|0,0,2]=4 2046 B7R0.7 OB(\C=C\Cl)\C=C\Cl Amb28121289 [0,1,1,0,0,0|2,0,0]=4 2047 B7R0.10 C=CC(=C)C(=O)C=C Amb27185481 [0,1,1,0,0,0|0,0,1]=3 2048 B7R0.10 C=CC(=C)C(O)C=C Amb28128381 [0,1,1,0,0,0|0,0,1]=3 2049 B7R0.10 C=CC(=O)C(=O)C=C Amb27844983 [0,1,1,0,0,0|0,0,1]=3 2050 B7R0.10 C=CC(=O)\C(C)=C/C Amb27434163 [0,1,1,0,0,0|0,0,2]=4 2051 B7R0.10 C=CC(C)C(O)C=C Amb25204344 [0,1,1,0,0,0|0,0,2]=4 2052 B7R0.10 C=CC(O)C(O)C=C Amb22167268 [0,1,1,0,0,0|0,0,2]=4 2053 B7R0.10 C=CC(O)\C(Cl)=C/C Amb27978659 [0,1,1,0,0,0|0,0,2]=4 2054 B7R0.10 C=C[C@H](O)[C@H](O)C=C Amb27664078 [0,1,1,0,0,0|0,0,2]=4 2055 B7R0.10 C=C[C@H](O)\C(C)=C/C Amb28321314 [0,1,1,0,0,0|0,0,2]=4 2056 B7R0.11 C=CC(C)(O)\C=C\Br Amb27424141 [0,1,1,0,0,0|1,0,1]=4 2057 B7R0.12 C=CC[C@@H](C=C)CO Amb28053913 [0,1,1,0,0,0|0,0,2]=4 2058 B7R0.12 C=C\C=C(/CO)OC Amb28345020 [0,1,1,0,0,0|1,0,1]=4 2059 B7R0.4 C=C(C)C\C=C\C=O Amb18640955 [0,1,1,0,0,0|1,0,1]=4 2060 B7R0.4 C=C\C=C\CC(=O)O Amb34916435 [0,1,1,0,0,0|1,0,0]=3 2061 B7R0.4 C=C\C=C\C[C@@H](C)O Amb27946739 [0,1,1,0,0,0|0,0,2]=4 2062 B7R0.4 CC(=O)\C=C/C=C\Br Amb27858614 [0,1,1,0,0,0|0,0,2]=4 2063 B7R0.4 CC(=O)\C=C\C=C\Cl Amb27233379 [0,1,1,0,0,0|0,0,2]=4 2064 B7R0.4 CC(C)=C\C=C/C=O Amb27169113 [0,1,1,0,0,0|1,0,1]=4 2065 B7R0.4 CC(O)\C=C\C=C\Cl Amb27454846 [0,1,1,0,0,0|0,0,2]=4 2066 B7R0.4 C\C=C/C=C/C(C)=O Amb28129038 [0,1,1,0,0,0|0,0,2]=4 2067 B7R0.4 C\C=C\C=C/C(C)O Amb22342426 [0,1,1,0,0,0|0,0,2]=4 2068 B7R0.4 C\C=C\C=C\C(=N)N Amb28428922 [0,1,1,0,0,0|2,0,0]=4 2069 B7R0.4 C\C=C\C=C\C(=O)Cl Amb32664141 [0,1,1,0,0,0|1,0,1]=4 2070 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [0,1,1,0,0,0|1,0,0]=3 2071 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33512746 [0,1,1,0,0,0|1,0,1]=4 2072 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33723188 [0,1,1,0,0,0|1,0,1]=4 2073 B7R0.4 C\C=C\C=C\C(C)=O Amb17593137 [0,1,1,0,0,0|0,0,2]=4 2074 B7R0.4 C\C=C\C=C\C(C)O Amb27843477 [0,1,1,0,0,0|0,0,2]=4 2075 B7R0.4 C\C=C\C=C\C(N)=O Amb28400805 [0,1,1,0,0,0|1,0,1]=4 2076 B7R0.4 C\C=C\C=C\[C@@H](C)O Amb27223068 [0,1,1,0,0,0|0,0,2]=4 2077 B7R0.4 O=C(O)\C=C/C=N/O Amb27449866 [0,1,1,0,0,0|2,0,0]=4 2078 B7R0.4 O=C(O)\C=C\C=C\Cl Amb28189602 [0,1,1,0,0,0|1,0,0]=3 2079 B7R0.6 C=C(Br)\C=C\C(=O)O Amb26530913 [0,1,1,0,0,0|1,0,0]=3 2080 B7R0.6 C=C(C)\C=C/C(C)=O Amb28061353 [0,1,1,0,0,0|0,0,2]=4 2081 B7R0.6 C=C(C)\C=C\B(O)O Amb25348319 [0,1,1,0,0,0|2,0,0]=4 2082 B7R0.6 C=C(C)\C=C\C(=C)C Amb27229870 [0,1,1,0,0,0|1,0,0]=3 2083 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [0,1,1,0,0,0|1,0,0]=3 2084 B7R0.6 C=C(C)\C=C\C(C)=O Amb33172526 [0,1,1,0,0,0|0,0,2]=4 2085 B7R0.6 C=C(N)\C=C\C(=C)O Amb27976241 [0,1,1,0,0,0|0,0,0]=2 2086 B7R0.6 C=C(O)\C=C\C(=O)O Amb26391061 [0,1,1,0,0,0|1,0,0]=3 2087 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [0,1,1,0,0,0|1,0,1]=4 2088 B7R0.6 NC(=O)\C=C/C(=O)O Amb2719749 [0,1,1,0,0,0|2,0,0]=4 2089 B7R0.6 NC(=O)\C=C\C(=O)O Amb9277095 [0,1,1,0,0,0|2,0,0]=4 2090 B7R0.6 O=C(O)\C=C/C(=O)O Amb2792876 [0,1,1,0,0,0|2,0,0]=4 2091 B7R0.6 O=C(O)\C=C\C(=O)Cl Amb25890079 [0,1,1,0,0,0|2,0,0]=4 2092 B7R0.6 O=C(O)\C=C\C(=O)O Amb6608657 [0,1,1,0,0,0|2,0,0]=4 2093 B7R0.6 O=C(O)\C=C\C(=O)O Amb8513055 [0,1,1,0,0,0|2,0,0]=4 2094 B7R0.6 O=C(O)\C=C\C(=O)S Amb27468769 [0,1,1,0,0,0|2,0,0]=4 2095 B7R0.6 O=C([O-])\C=C/C(=O)O Amb22168115 [0,1,1,0,0,0|2,0,0]=4 2096 B7R0.6 O=C([O-])\C=C/C(=O)O Amb9787714 [0,1,1,0,0,0|2,0,0]=4 2097 B7R0.8 C=C\C=C\C(C)(C)O Amb27603756 [0,1,1,0,0,0|0,0,2]=4 2098 B7R0.1 B\C=C\C=C\C=C\N Amb28068718 [0,1,1,0,0,0|1,0,0]=3 2099 B7R0.1 C#C\C=C\C=C\C=O Amb27968252 [0,1,1,0,0,0|0,0,2]=4 2100 B7R0.1 C#C\C=C\C=C\CO Amb28065184 [0,1,1,0,0,0|0,0,2]=4 2101 B7R0.1 C=CCC\C=C\CO Amb27406831 [0,1,1,0,0,0|0,0,2]=4 2102 B7R0.1 C=C\C=C/C=C/C=O Amb27166172 [0,1,1,0,0,0|0,0,1]=3 2103 B7R0.1 C=C\C=C\C=C\CBr Amb27659022 [0,1,1,0,0,0|1,0,0]=3 2104 B7R0.1 C=C\C=C\CCC=C Amb26026784 [0,1,1,0,0,0|1,0,1]=4 2105 B7R0.1 CC=C=C\C=C\CO Amb27853778 [0,1,1,0,0,0|0,0,2]=4 2106 B7R0.1 CC\C=C\C=C\C=O Amb8392847 [0,1,1,0,0,0|0,0,2]=4 2107 B7R0.1 CC\C=C\C=C\CO Amb32953372 [0,1,1,0,0,0|0,0,2]=4 2108 B7R0.1 C\C=C\C=C\CCO Amb27459750 [0,1,1,0,0,0|0,0,2]=4 2109 B7R0.1 C\C=C\C\C=C\C=O Amb27202097 [0,1,1,0,0,0|0,0,2]=4 2110 B7R0.1 Cl\C=C/C=C/C=C/Br Amb28325602 [0,1,1,0,0,0|1,0,0]=3 2111 B7R0.1 Cl\C=C\C=C\C=C\Br Amb27192169 [0,1,1,0,0,0|1,0,0]=3 2112 B7R0.1 O=CC\C=C\C=C\Br Amb27222551 [0,1,1,0,0,0|0,0,2]=4 2113 B7R0.1 O=C\C=C/C=C/C=O Amb17593128 [0,1,1,0,0,0|0,0,1]=3 2114 B7R0.1 O=C\C=C\C=C\C=O Amb25209344 [0,1,1,0,0,0|0,0,1]=3 2115 B7R0.1 O=C\C=C\C=C\CCl Amb28292786 [0,1,1,0,0,0|0,0,2]=4 2116 B7R0.1 O=C\C=C\C=C\CO Amb27424442 [0,1,1,0,0,0|0,0,1]=3 2117 B7R0.1 OC\C=C/C=C\CO Amb26515771 [0,1,1,0,0,0|0,0,2]=4 2118 B7R0.1 OC\C=C\C=C\CO Amb33328625 [0,1,1,0,0,0|0,0,2]=4 2119 B7R0.1 O\C=C\C=C\CCO Amb27605420 [0,1,1,0,0,0|0,0,2]=4 2120 B7R1.1 BrC=C1C=CC=C1 Amb28118986 [0,1,0,0,1,0|1,0,0]=3 2121 B7R1.1 BrCc1cccs1 Amb10602501 [0,1,0,0,1,0|2,0,0]=4 2122 B7R1.1 BrCc1ccoc1 Amb33543824 [0,1,0,0,1,0|2,0,0]=4 2123 B7R1.1 BrCc1ccsc1 Amb33528728 [0,1,0,0,1,0|2,0,0]=4 2124 B7R1.1 BrCn1cccc1 Amb28121283 [0,1,0,0,1,0|2,0,0]=4 2125 B7R1.1 Br[Zn]c1cccs1 Amb6300113 [0,1,0,0,1,0|2,0,0]=4 2126 B7R1.1 C#C[c-]1cccc1 Amb34197080 [0,1,0,0,1,0|1,0,1]=4 2127 B7R1.1 C#Cc1ccco1 Amb24178904 [0,1,0,0,1,0|2,0,0]=4 2128 B7R1.1 C#Cc1cccs1 Amb2721505 [0,1,0,0,1,0|2,0,0]=4 2129 B7R1.1 C#Cc1ccoc1 Amb25283258 [0,1,0,0,1,0|2,0,0]=4 2130 B7R1.1 C#Cc1ccsc1 Amb10603690 [0,1,0,0,1,0|2,0,0]=4 2131 B7R1.1 C=C[c-]1cccc1 Amb34916052 [0,1,0,0,1,0|1,0,1]=4 2132 B7R1.1 C=Cc1ccco1 Amb22295842 [0,1,0,0,1,0|2,0,0]=4 2133 B7R1.1 C=Cc1cccs1 Amb33542804 [0,1,0,0,1,0|2,0,0]=4 2134 B7R1.1 C=Cc1ccoc1 Amb24056798 [0,1,0,0,1,0|2,0,0]=4 2135 B7R1.1 C=Cc1ccsc1 Amb22263008 [0,1,0,0,1,0|2,0,0]=4 2136 B7R1.1 C=Cn1cccc1 Amb25810319 [0,1,0,0,1,0|2,0,0]=4 2137 B7R1.1 CCC1C=CC=C1 Amb2227637 [0,1,0,0,1,0|1,0,1]=4 2138 B7R1.1 CC[c-]1cccc1 Amb34916048 [0,1,0,0,1,0|1,0,1]=4 2139 B7R1.1 CCc1ccco1 Amb8393153 [0,1,0,0,1,0|2,0,0]=4 2140 B7R1.1 CCc1cccs1 Amb2687955 [0,1,0,0,1,0|2,0,0]=4 2141 B7R1.1 CCc1ccoc1 Amb28059964 [0,1,0,0,1,0|2,0,0]=4 2142 B7R1.1 CCc1ccsc1 Amb2687956 [0,1,0,0,1,0|2,0,0]=4 2143 B7R1.1 CCn1cccc1 Amb2687940 [0,1,0,0,1,0|2,0,0]=4 2144 B7R1.1 CNc1ccsc1 Amb20620164 [0,1,0,0,1,0|2,0,0]=4 2145 B7R1.1 CNc1ccsc1 Amb28827635 [0,1,0,0,1,0|2,0,0]=4 2146 B7R1.1 COC1=NCC=C1 Amb27877548 [0,1,0,0,1,0|1,0,1]=4 2147 B7R1.1 COc1ccco1 Amb8513561 [0,1,0,0,1,0|1,0,0]=3 2148 B7R1.1 COc1cccs1 Amb2689282 [0,1,0,0,1,0|1,0,0]=3 2149 B7R1.1 COc1ccno1 Amb27591646 [0,1,0,0,1,0|2,0,0]=4 2150 B7R1.1 COc1ccsc1 Amb8517358 [0,1,0,0,1,0|1,0,0]=3 2151 B7R1.1 COc1ccsn1 Amb23592267 [0,1,0,0,1,0|2,0,0]=4 2152 B7R1.1 COc1cncs1 Amb28050388 [0,1,0,0,1,0|2,0,0]=4 2153 B7R1.1 COc1cnoc1 Amb27475968 [0,1,0,0,1,0|2,0,0]=4 2154 B7R1.1 COc1cocn1 Amb27445542 [0,1,0,0,1,0|2,0,0]=4 2155 B7R1.1 COc1nccs1 Amb2447656 [0,1,0,0,1,0|2,0,0]=4 2156 B7R1.1 CSc1ccco1 Amb21961438 [0,1,0,0,1,0|1,1,0]=4 2157 B7R1.1 CSc1cccs1 Amb2724421 [0,1,0,0,1,0|1,1,0]=4 2158 B7R1.1 CSc1ccsc1 Amb2780309 [0,1,0,0,1,0|1,1,0]=4 2159 B7R1.1 C[Se]c1ccsc1 Amb17779305 [0,1,0,0,1,0|1,1,0]=4 2160 B7R1.1 C[SiH2]c1ccco1 Amb28368539 [0,1,0,0,1,0|2,0,0]=4 2161 B7R1.1 ClCc1cccs1 Amb6717230 [0,1,0,0,1,0|2,0,0]=4 2162 B7R1.1 ClCc1ccoc1 Amb8999150 [0,1,0,0,1,0|2,0,0]=4 2163 B7R1.1 ClCc1ccsc1 Amb33528072 [0,1,0,0,1,0|2,0,0]=4 2164 B7R1.1 FCc1cccs1 Amb26568225 [0,1,0,0,1,0|2,0,0]=4 2165 B7R1.1 I[Zn]c1ccsc1 Amb6300273 [0,1,0,0,1,0|2,0,0]=4 2166 B7R1.1 N#Cc1ccco1 Amb1694826 [0,1,0,0,1,0|2,0,0]=4 2167 B7R1.1 N#Cc1cccs1 Amb1154392 [0,1,0,0,1,0|2,0,0]=4 2168 B7R1.1 N#Cc1ccoc1 Amb8514869 [0,1,0,0,1,0|2,0,0]=4 2169 B7R1.1 N#Cc1ccsc1 Amb2725780 [0,1,0,0,1,0|2,0,0]=4 2170 B7R1.1 NCc1ccco1 Amb2720356 [0,1,0,0,1,0|2,0,0]=4 2171 B7R1.1 NCc1ccco1 Amb29847168 [0,1,0,0,1,0|2,0,0]=4 2172 B7R1.1 NCc1cccs1 Amb20622043 [0,1,0,0,1,0|2,0,0]=4 2173 B7R1.1 NCc1cccs1 Amb2720340 [0,1,0,0,1,0|2,0,0]=4 2174 B7R1.1 NCc1ccoc1 Amb2723044 [0,1,0,0,1,0|2,0,0]=4 2175 B7R1.1 NCc1ccoc1 Amb2723045 [0,1,0,0,1,0|2,0,0]=4 2176 B7R1.1 NCc1ccsc1 Amb1140991 [0,1,0,0,1,0|2,0,0]=4 2177 B7R1.1 NCc1ccsc1 Amb6487448 [0,1,0,0,1,0|2,0,0]=4 2178 B7R1.1 NCn1cccc1 Amb27202741 [0,1,0,0,1,0|2,0,0]=4 2179 B7R1.1 NNc1ccco1 Amb18203069 [0,1,0,0,1,0|2,0,0]=4 2180 B7R1.1 NNc1cccs1 Amb18203361 [0,1,0,0,1,0|2,0,0]=4 2181 B7R1.1 N\C=C1\C=CC=N1 Amb27623643 [0,1,0,0,1,0|2,0,0]=4 2182 B7R1.1 N\C=C1\C=CN=C1 Amb28368683 [0,1,0,0,1,0|2,0,0]=4 2183 B7R1.1 O=CC1=CC=CC1 Amb25799627 [0,1,0,0,1,0|0,0,2]=4 2184 B7R1.1 O=CC1C=CC=C1 Amb27408563 [0,1,0,0,1,0|0,0,2]=4 2185 B7R1.1 O=C[c-]1cccc1 Amb22168256 [0,1,0,0,1,0|0,0,2]=4 2186 B7R1.1 O=C[c-]1cccc1 Amb33801815 [0,1,0,0,1,0|0,0,2]=4 2187 B7R1.1 O=Cc1ccco1 Amb2720358 [0,1,0,0,1,0|1,0,1]=4 2188 B7R1.1 O=Cc1cccs1 Amb2690601 [0,1,0,0,1,0|1,0,1]=4 2189 B7R1.1 O=Cc1ccoc1 Amb2720357 [0,1,0,0,1,0|1,0,1]=4 2190 B7R1.1 O=Cc1ccsc1 Amb2720343 [0,1,0,0,1,0|1,0,1]=4 2191 B7R1.1 OCC1=CC=CC1 Amb27457780 [0,1,0,0,1,0|0,0,1]=3 2192 B7R1.1 OCc1ccco1 Amb837335 [0,1,0,0,1,0|1,0,0]=3 2193 B7R1.1 OCc1cccs1 Amb837506 [0,1,0,0,1,0|1,0,0]=3 2194 B7R1.1 OCc1ccno1 Amb33531764 [0,1,0,0,1,0|2,0,0]=4 2195 B7R1.1 OCc1ccns1 Amb16185717 [0,1,0,0,1,0|2,0,0]=4 2196 B7R1.1 OCc1ccoc1 Amb837377 [0,1,0,0,1,0|1,0,0]=3 2197 B7R1.1 OCc1ccon1 Amb19515377 [0,1,0,0,1,0|2,0,0]=4 2198 B7R1.1 OCc1ccsc1 Amb837384 [0,1,0,0,1,0|1,0,0]=3 2199 B7R1.1 OCc1ccsn1 Amb22896461 [0,1,0,0,1,0|2,0,0]=4 2200 B7R1.1 OCc1cnco1 Amb10070754 [0,1,0,0,1,0|2,0,0]=4 2201 B7R1.1 OCc1cncs1 Amb2455733 [0,1,0,0,1,0|2,0,0]=4 2202 B7R1.1 OCc1cnoc1 Amb22011478 [0,1,0,0,1,0|2,0,0]=4 2203 B7R1.1 OCc1cnsc1 Amb22757389 [0,1,0,0,1,0|2,0,0]=4 2204 B7R1.1 OCc1cocn1 Amb10071193 [0,1,0,0,1,0|2,0,0]=4 2205 B7R1.1 OCc1cscn1 Amb32652998 [0,1,0,0,1,0|2,0,0]=4 2206 B7R1.1 OCc1cscn1 Amb33531860 [0,1,0,0,1,0|2,0,0]=4 2207 B7R1.1 OCc1ncco1 Amb10071191 [0,1,0,0,1,0|2,0,0]=4 2208 B7R1.1 OCc1nccs1 Amb2723142 [0,1,0,0,1,0|2,0,0]=4 2209 B7R1.1 OCn1cccc1 Amb28400396 [0,1,0,0,1,0|1,0,0]=3 2210 B7R1.1 OCn1cccn1 Amb10552412 [0,1,0,0,1,0|2,0,0]=4 2211 B7R1.1 OCn1ccnc1 Amb5493972 [0,1,0,0,1,0|2,0,0]=4 2212 B7R1.1 ONc1ccco1 Amb27209570 [0,1,0,0,1,0|1,0,0]=3 2213 B7R1.1 O\N=C1/C=CCC1 Amb27838262 [0,1,0,0,1,0|0,0,2]=4 2214 B7R1.1 S=Cc1ccco1 Amb28368735 [0,1,0,0,1,0|1,1,0]=4 2215 B7R1.1 SCc1ccco1 Amb2688612 [0,1,0,0,1,0|1,1,0]=4 2216 B7R1.1 SCc1cccs1 Amb3428574 [0,1,0,0,1,0|1,1,0]=4 2217 B7R1.1 SCc1ccoc1 Amb26593625 [0,1,0,0,1,0|1,1,0]=4 2218 B7R1.1 SCc1ccsc1 Amb28246879 [0,1,0,0,1,0|1,1,0]=4 2219 B7R1.1 [C-]#[N+]c1ccco1 Amb27962733 [0,1,0,0,1,0|2,0,0]=4 2220 B7R1.1 [C-]#[N+]c1ccoc1 Amb33449618 [0,1,0,0,1,0|2,0,0]=4 2221 B7R1.1 [C-]#[N+]c1ccsc1 Amb33380765 [0,1,0,0,1,0|2,0,0]=4 2222 B7R1.1 [N-]=[N+]=C1C=CC=N1 Amb27613195 [0,1,0,0,1,0|2,0,0]=4 2223 B7R1.2 Brc1cc(I)cs1 Amb27963171 [0,1,0,0,1,0|2,0,0]=4 2224 B7R1.2 Brc1ccc(Br)o1 Amb19651339 [0,1,0,0,1,0|2,0,0]=4 2225 B7R1.2 Brc1ccc(Br)s1 Amb2447247 [0,1,0,0,1,0|2,0,0]=4 2226 B7R1.2 Brc1ccc(I)s1 Amb5720292 [0,1,0,0,1,0|2,0,0]=4 2227 B7R1.2 Brc1csc(Br)c1 Amb2723434 [0,1,0,0,1,0|2,0,0]=4 2228 B7R1.2 Brc1csc(I)c1 Amb24320667 [0,1,0,0,1,0|2,0,0]=4 2229 B7R1.2 Cc1cc(Br)co1 Amb18828030 [0,1,0,0,1,0|2,0,0]=4 2230 B7R1.2 Cc1cc(Br)cs1 Amb2685344 [0,1,0,0,1,0|2,0,0]=4 2231 B7R1.2 Cc1cc(Cl)cs1 Amb8388001 [0,1,0,0,1,0|2,0,0]=4 2232 B7R1.2 Cc1cc(F)cs1 Amb27170659 [0,1,0,0,1,0|2,0,0]=4 2233 B7R1.2 Cc1cc(I)cs1 Amb27144872 [0,1,0,0,1,0|2,0,0]=4 2234 B7R1.2 Cc1cc(N)cs1 Amb18833057 [0,1,0,0,1,0|2,0,0]=4 2235 B7R1.2 Cc1cc(N)cs1 Amb22276155 [0,1,0,0,1,0|2,0,0]=4 2236 B7R1.2 Cc1cc(O)cs1 Amb24523671 [0,1,0,0,1,0|1,0,0]=3 2237 B7R1.2 Cc1cc(O)no1 Amb2370655 [0,1,0,0,1,0|2,0,0]=4 2238 B7R1.2 Cc1cc(O)ns1 Amb2420511 [0,1,0,0,1,0|2,0,0]=4 2239 B7R1.2 Cc1cc(O)on1 Amb22337742 [0,1,0,0,1,0|2,0,0]=4 2240 B7R1.2 Cc1cc(O)on1 Amb4418352 [0,1,0,0,1,0|2,0,0]=4 2241 B7R1.2 Cc1cc(S)cs1 Amb28363926 [0,1,0,0,1,0|1,1,0]=4 2242 B7R1.2 Cc1ccc(Br)o1 Amb10600628 [0,1,0,0,1,0|2,0,0]=4 2243 B7R1.2 Cc1ccc(Br)s1 Amb8383934 [0,1,0,0,1,0|2,0,0]=4 2244 B7R1.2 Cc1ccc(C)o1 Amb2447078 [0,1,0,0,1,0|2,0,0]=4 2245 B7R1.2 Cc1ccc(C)s1 Amb2447067 [0,1,0,0,1,0|2,0,0]=4 2246 B7R1.2 Cc1ccc(Cl)o1 Amb25242029 [0,1,0,0,1,0|2,0,0]=4 2247 B7R1.2 Cc1ccc(Cl)s1 Amb16230980 [0,1,0,0,1,0|2,0,0]=4 2248 B7R1.2 Cc1ccc(F)o1 Amb27397440 [0,1,0,0,1,0|2,0,0]=4 2249 B7R1.2 Cc1ccc(I)o1 Amb25723970 [0,1,0,0,1,0|2,0,0]=4 2250 B7R1.2 Cc1ccc(I)s1 Amb2688858 [0,1,0,0,1,0|2,0,0]=4 2251 B7R1.2 Cc1ccc(N)o1 Amb10600629 [0,1,0,0,1,0|2,0,0]=4 2252 B7R1.2 Cc1ccc(N)s1 Amb19890911 [0,1,0,0,1,0|2,0,0]=4 2253 B7R1.2 Cc1ccc(N)s1 Amb9901860 [0,1,0,0,1,0|2,0,0]=4 2254 B7R1.2 Cc1ccc(O)o1 Amb26645726 [0,1,0,0,1,0|1,0,0]=3 2255 B7R1.2 Cc1ccc(O)s1 Amb17593190 [0,1,0,0,1,0|1,0,0]=3 2256 B7R1.2 Cc1ccc(S)o1 Amb25888543 [0,1,0,0,1,0|1,1,0]=4 2257 B7R1.2 Cc1ccc(S)s1 Amb20623930 [0,1,0,0,1,0|1,1,0]=4 2258 B7R1.2 Cc1ccn(C)c1 Amb24333650 [0,1,0,0,1,0|2,0,0]=4 2259 B7R1.2 Cc1cnc(O)s1 Amb13884319 [0,1,0,0,1,0|2,0,0]=4 2260 B7R1.2 Cc1cnn(O)c1 Amb28203190 [0,1,0,0,1,0|2,0,0]=4 2261 B7R1.2 Cc1coc(Br)c1 Amb10600631 [0,1,0,0,1,0|2,0,0]=4 2262 B7R1.2 Cc1coc(I)c1 Amb32685628 [0,1,0,0,1,0|2,0,0]=4 2263 B7R1.2 Cc1coc(N)c1 Amb10600632 [0,1,0,0,1,0|2,0,0]=4 2264 B7R1.2 Cc1csc(Br)c1 Amb10600630 [0,1,0,0,1,0|2,0,0]=4 2265 B7R1.2 Cc1csc(C)c1 Amb2447068 [0,1,0,0,1,0|2,0,0]=4 2266 B7R1.2 Cc1csc(Cl)c1 Amb26641847 [0,1,0,0,1,0|2,0,0]=4 2267 B7R1.2 Cc1csc(I)c1 Amb22496053 [0,1,0,0,1,0|2,0,0]=4 2268 B7R1.2 Cc1csc(N)c1 Amb19958131 [0,1,0,0,1,0|2,0,0]=4 2269 B7R1.2 Cc1csc(N)c1 Amb2778988 [0,1,0,0,1,0|2,0,0]=4 2270 B7R1.2 Cc1csc(O)c1 Amb20617904 [0,1,0,0,1,0|1,0,0]=3 2271 B7R1.2 Cc1csc(S)c1 Amb26419420 [0,1,0,0,1,0|1,1,0]=4 2272 B7R1.2 Cc1nc(O)cs1 Amb10600550 [0,1,0,0,1,0|2,0,0]=4 2273 B7R1.2 Cc1ncc(O)o1 Amb26530422 [0,1,0,0,1,0|2,0,0]=4 2274 B7R1.2 Cc1ncc(O)s1 Amb10599445 [0,1,0,0,1,0|2,0,0]=4 2275 B7R1.2 Clc1cc(Br)cs1 Amb10602627 [0,1,0,0,1,0|2,0,0]=4 2276 B7R1.2 Clc1ccc(Br)o1 Amb28122976 [0,1,0,0,1,0|2,0,0]=4 2277 B7R1.2 Clc1ccc(Br)s1 Amb2685041 [0,1,0,0,1,0|2,0,0]=4 2278 B7R1.2 Clc1ccc(Cl)s1 Amb2447120 [0,1,0,0,1,0|2,0,0]=4 2279 B7R1.2 Clc1ccc(I)o1 Amb24752684 [0,1,0,0,1,0|2,0,0]=4 2280 B7R1.2 Clc1ccc(I)s1 Amb20620732 [0,1,0,0,1,0|2,0,0]=4 2281 B7R1.2 Clc1coc(Cl)c1 Amb26916025 [0,1,0,0,1,0|2,0,0]=4 2282 B7R1.2 Clc1csc(Br)c1 Amb26486652 [0,1,0,0,1,0|2,0,0]=4 2283 B7R1.2 Clc1csc(Cl)c1 Amb24056457 [0,1,0,0,1,0|2,0,0]=4 2284 B7R1.2 Cn1cc(O)cn1 Amb33549858 [0,1,0,0,1,0|2,0,0]=4 2285 B7R1.2 Cn1cc(O)cn1 Amb33552990 [0,1,0,0,1,0|2,0,0]=4 2286 B7R1.2 Cn1ccc(Br)c1 Amb18243475 [0,1,0,0,1,0|2,0,0]=4 2287 B7R1.2 Cn1ccc(N)c1 Amb18559366 [0,1,0,0,1,0|2,0,0]=4 2288 B7R1.2 Cn1ccc(N)c1 Amb22498085 [0,1,0,0,1,0|2,0,0]=4 2289 B7R1.2 Cn1ccc(O)n1 Amb22388466 [0,1,0,0,1,0|2,0,0]=4 2290 B7R1.2 Cn1cnc(O)c1 Amb27471105 [0,1,0,0,1,0|2,0,0]=4 2291 B7R1.2 Fc1ccc(Br)o1 Amb18199668 [0,1,0,0,1,0|2,0,0]=4 2292 B7R1.2 Fc1ccc(Br)s1 Amb18193111 [0,1,0,0,1,0|2,0,0]=4 2293 B7R1.2 Fc1ccc(Cl)o1 Amb26862440 [0,1,0,0,1,0|2,0,0]=4 2294 B7R1.2 Fc1ccc(Cl)s1 Amb27191815 [0,1,0,0,1,0|2,0,0]=4 2295 B7R1.2 Fc1ccc(F)o1 Amb27634413 [0,1,0,0,1,0|2,0,0]=4 2296 B7R1.2 Fc1ccc(I)s1 Amb24269146 [0,1,0,0,1,0|2,0,0]=4 2297 B7R1.2 Fc1coc(Br)c1 Amb18199638 [0,1,0,0,1,0|2,0,0]=4 2298 B7R1.2 Fc1csc(Br)c1 Amb18193378 [0,1,0,0,1,0|2,0,0]=4 2299 B7R1.2 Fc1csc(F)c1 Amb24411512 [0,1,0,0,1,0|2,0,0]=4 2300 B7R1.2 Ic1ccc(I)s1 Amb2611731 [0,1,0,0,1,0|2,0,0]=4 2301 B7R1.2 Ic1csc(I)c1 Amb27814436 [0,1,0,0,1,0|2,0,0]=4 2302 B7R1.2 N=C1C=C(O)CO1 Amb27445689 [0,1,0,0,1,0|1,0,1]=4 2303 B7R1.2 N=C1C=C(O)CS1 Amb27438020 [0,1,0,0,1,0|1,0,1]=4 2304 B7R1.2 Nc1cc(Br)co1 Amb18819119 [0,1,0,0,1,0|2,0,0]=4 2305 B7R1.2 Nc1cc(Br)cs1 Amb18564069 [0,1,0,0,1,0|2,0,0]=4 2306 B7R1.2 Nc1cc(Cl)cs1 Amb23401708 [0,1,0,0,1,0|2,0,0]=4 2307 B7R1.2 Nc1cc(O)no1 Amb18941358 [0,1,0,0,1,0|2,0,0]=4 2308 B7R1.2 Nc1ccc(Br)o1 Amb13884560 [0,1,0,0,1,0|2,0,0]=4 2309 B7R1.2 Nc1ccc(Br)s1 Amb13884559 [0,1,0,0,1,0|2,0,0]=4 2310 B7R1.2 Nc1ccc(Br)s1 Amb20241251 [0,1,0,0,1,0|2,0,0]=4 2311 B7R1.2 Nc1ccc(Cl)o1 Amb25360216 [0,1,0,0,1,0|2,0,0]=4 2312 B7R1.2 Nc1ccc(Cl)s1 Amb18055064 [0,1,0,0,1,0|2,0,0]=4 2313 B7R1.2 Nc1ccc(F)o1 Amb18202898 [0,1,0,0,1,0|2,0,0]=4 2314 B7R1.2 Nc1ccc(F)s1 Amb18202738 [0,1,0,0,1,0|2,0,0]=4 2315 B7R1.2 Nc1ccc(I)o1 Amb25888418 [0,1,0,0,1,0|2,0,0]=4 2316 B7R1.2 Nc1ccc(N)o1 Amb18203063 [0,1,0,0,1,0|2,0,0]=4 2317 B7R1.2 Nc1ccc(N)s1 Amb18203358 [0,1,0,0,1,0|2,0,0]=4 2318 B7R1.2 Nc1ccc(O)o1 Amb24526005 [0,1,0,0,1,0|1,0,0]=3 2319 B7R1.2 Nc1cnc(O)s1 Amb27834031 [0,1,0,0,1,0|2,0,0]=4 2320 B7R1.2 Nc1cnn(O)c1 Amb27881666 [0,1,0,0,1,0|2,0,0]=4 2321 B7R1.2 Nc1coc(Br)c1 Amb18190961 [0,1,0,0,1,0|2,0,0]=4 2322 B7R1.2 Nc1csc(Br)c1 Amb18648086 [0,1,0,0,1,0|2,0,0]=4 2323 B7R1.2 Nc1csc(Br)c1 Amb19929503 [0,1,0,0,1,0|2,0,0]=4 2324 B7R1.2 Nc1csc(Br)c1 Amb31308081 [0,1,0,0,1,0|2,0,0]=4 2325 B7R1.2 Nc1csc(Cl)c1 Amb22492848 [0,1,0,0,1,0|2,0,0]=4 2326 B7R1.2 Nc1csc(Cl)c1 Amb22757511 [0,1,0,0,1,0|2,0,0]=4 2327 B7R1.2 Nc1csc(I)c1 Amb25788262 [0,1,0,0,1,0|2,0,0]=4 2328 B7R1.2 Nc1nc(O)cs1 Amb5717502 [0,1,0,0,1,0|2,0,0]=4 2329 B7R1.2 Nn1ccc(Br)c1 Amb26555283 [0,1,0,0,1,0|2,0,0]=4 2330 B7R1.2 Nn1cnc(O)c1 Amb27958962 [0,1,0,0,1,0|2,0,0]=4 2331 B7R1.2 O=C1C=C(O)CC1 Amb9901808 [0,1,0,0,1,0|0,0,2]=4 2332 B7R1.2 O=C1C=C(O)CN1 Amb20623530 [0,1,0,0,1,0|1,0,1]=4 2333 B7R1.2 O=C1C=C(O)CO1 Amb628324 [0,1,0,0,1,0|1,0,1]=4 2334 B7R1.2 O=C1C=CC(=O)C1 Amb22338203 [0,1,0,0,1,0|0,0,2]=4 2335 B7R1.2 O=C1C=CC(=O)N1 Amb1235242 [0,1,0,0,1,0|1,0,1]=4 2336 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [0,1,0,0,1,0|1,0,1]=4 2337 B7R1.2 O=C1C=CC(=O)O1 Amb6297783 [0,1,0,0,1,0|1,0,1]=4 2338 B7R1.2 O=C1C=CC(O)=N1 Amb22552540 [0,1,0,0,1,0|1,0,0]=3 2339 B7R1.2 O=C1C=CC(O)C1 Amb9782767 [0,1,0,0,1,0|0,0,2]=4 2340 B7R1.2 O=C1C=CC(O)N1 Amb27978638 [0,1,0,0,1,0|1,0,1]=4 2341 B7R1.2 O=C1C=CC(O)O1 Amb24544763 [0,1,0,0,1,0|1,0,1]=4 2342 B7R1.2 O=C1C=C[C@@H](O)C1 Amb27256512 [0,1,0,0,1,0|0,0,2]=4 2343 B7R1.2 O=C1C=C[C@H](O)C1 Amb2694980 [0,1,0,0,1,0|0,0,2]=4 2344 B7R1.2 OC1=CNC(=S)S1 Amb26391172 [0,1,0,0,1,0|2,0,0]=4 2345 B7R1.2 OC1=COC(=S)N1 Amb26915057 [0,1,0,0,1,0|2,0,0]=4 2346 B7R1.2 OC1=CSC(=S)N1 Amb33827704 [0,1,0,0,1,0|2,0,0]=4 2347 B7R1.2 Oc1cc(Br)co1 Amb33436075 [0,1,0,0,1,0|1,0,0]=3 2348 B7R1.2 Oc1cc(Br)cs1 Amb18819059 [0,1,0,0,1,0|1,0,0]=3 2349 B7R1.2 Oc1cc(Cl)cs1 Amb25888402 [0,1,0,0,1,0|1,0,0]=3 2350 B7R1.2 Oc1cc(Cl)no1 Amb27438670 [0,1,0,0,1,0|2,0,0]=4 2351 B7R1.2 Oc1cc(Cl)sn1 Amb21858019 [0,1,0,0,1,0|2,0,0]=4 2352 B7R1.2 Oc1ccc(Br)o1 Amb18199811 [0,1,0,0,1,0|1,0,0]=3 2353 B7R1.2 Oc1ccc(Br)s1 Amb18055072 [0,1,0,0,1,0|1,0,0]=3 2354 B7R1.2 Oc1ccc(Cl)o1 Amb25723971 [0,1,0,0,1,0|1,0,0]=3 2355 B7R1.2 Oc1ccc(Cl)s1 Amb18055065 [0,1,0,0,1,0|1,0,0]=3 2356 B7R1.2 Oc1ccc(I)o1 Amb25888416 [0,1,0,0,1,0|1,0,0]=3 2357 B7R1.2 Oc1cnc(Br)s1 Amb25137762 [0,1,0,0,1,0|2,0,0]=4 2358 B7R1.2 Oc1cnc(Cl)s1 Amb33221311 [0,1,0,0,1,0|2,0,0]=4 2359 B7R1.2 Oc1coc(I)n1 Amb35710124 [0,1,0,0,1,0|2,0,0]=4 2360 B7R1.2 Oc1csc(Br)c1 Amb33451893 [0,1,0,0,1,0|1,0,0]=3 2361 B7R1.2 Oc1csc(Br)n1 Amb18824582 [0,1,0,0,1,0|2,0,0]=4 2362 B7R1.2 Oc1csc(Cl)n1 Amb35710123 [0,1,0,0,1,0|2,0,0]=4 2363 B7R1.2 Oc1csc(O)n1 Amb10599939 [0,1,0,0,1,0|2,0,0]=4 2364 B7R1.2 Oc1nc(Br)cs1 Amb10599938 [0,1,0,0,1,0|2,0,0]=4 2365 B7R1.2 Oc1ncc(Br)s1 Amb20617312 [0,1,0,0,1,0|2,0,0]=4 2366 B7R1.2 On1cc(Br)cn1 Amb22371900 [0,1,0,0,1,0|2,0,0]=4 2367 B7R1.2 On1cc(Cl)cn1 Amb26953026 [0,1,0,0,1,0|2,0,0]=4 2368 B7R1.2 On1ccc(Br)n1 Amb28399212 [0,1,0,0,1,0|2,0,0]=4 2369 B7R1.2 Sc1cc(Br)cs1 Amb25962064 [0,1,0,0,1,0|1,1,0]=4 2370 B7R1.2 Sc1cc(Cl)cs1 Amb26645411 [0,1,0,0,1,0|1,1,0]=4 2371 B7R1.2 Sc1ccc(Br)s1 Amb24524248 [0,1,0,0,1,0|1,1,0]=4 2372 B7R1.2 Sc1ccc(Cl)s1 Amb24479766 [0,1,0,0,1,0|1,1,0]=4 2373 B7R1.2 Sc1csc(Br)c1 Amb33433579 [0,1,0,0,1,0|1,1,0]=4 2374 B7R1.2 [*]c1ccc([*])s1 Amb32414727 [0,1,0,0,1,0|2,0,0]=4 2375 B7R1.2 [2H]c1ccc(Br)o1 Amb10597228 [0,1,0,0,1,0|2,0,0]=4 2376 B7R1.2 [2H]c1ccc(N)o1 Amb10597230 [0,1,0,0,1,0|2,0,0]=4 2377 B7R1.2 [2H]c1ccc(N)s1 Amb10597229 [0,1,0,0,1,0|2,0,0]=4 2378 B7R1.2 [O-][n+]1ccn(O)c1 Amb1971431 [0,1,0,0,1,0|2,0,0]=4 2379 B7R1.4 Brc1ccoc1Br Amb6366140 [0,1,0,0,1,0|2,0,0]=4 2380 B7R1.4 Brc1ccoc1I Amb26608371 [0,1,0,0,1,0|2,0,0]=4 2381 B7R1.4 Brc1ccsc1Br Amb2237068 [0,1,0,0,1,0|2,0,0]=4 2382 B7R1.4 Brc1ccsc1I Amb20620492 [0,1,0,0,1,0|2,0,0]=4 2383 B7R1.4 Brc1cocc1Br Amb2447126 [0,1,0,0,1,0|2,0,0]=4 2384 B7R1.4 Brc1cscc1Br Amb2447129 [0,1,0,0,1,0|2,0,0]=4 2385 B7R1.4 Brc1cscc1I Amb20620489 [0,1,0,0,1,0|2,0,0]=4 2386 B7R1.4 Brc1sccc1I Amb20620493 [0,1,0,0,1,0|2,0,0]=4 2387 B7R1.4 Cc1cccn1C Amb2447020 [0,1,0,0,1,0|2,0,0]=4 2388 B7R1.4 Cc1ccoc1C Amb8515826 [0,1,0,0,1,0|2,0,0]=4 2389 B7R1.4 Cc1ccoc1O Amb33343228 [0,1,0,0,1,0|1,0,0]=3 2390 B7R1.4 Cc1ccoc1S Amb27613044 [0,1,0,0,1,0|1,1,0]=4 2391 B7R1.4 Cc1ccsc1Br Amb2236394 [0,1,0,0,1,0|2,0,0]=4 2392 B7R1.4 Cc1ccsc1C Amb2447413 [0,1,0,0,1,0|2,0,0]=4 2393 B7R1.4 Cc1ccsc1Cl Amb8396573 [0,1,0,0,1,0|2,0,0]=4 2394 B7R1.4 Cc1ccsc1F Amb27459925 [0,1,0,0,1,0|2,0,0]=4 2395 B7R1.4 Cc1ccsc1I Amb22898804 [0,1,0,0,1,0|2,0,0]=4 2396 B7R1.4 Cc1ccsc1N Amb18679496 [0,1,0,0,1,0|2,0,0]=4 2397 B7R1.4 Cc1ccsc1O Amb24639732 [0,1,0,0,1,0|1,0,0]=3 2398 B7R1.4 Cc1ccsc1S Amb25747282 [0,1,0,0,1,0|1,1,0]=4 2399 B7R1.4 Cc1cnoc1O Amb25064746 [0,1,0,0,1,0|2,0,0]=4 2400 B7R1.4 Cc1cocc1C Amb17613311 [0,1,0,0,1,0|2,0,0]=4 2401 B7R1.4 Cc1cocc1F Amb27971160 [0,1,0,0,1,0|2,0,0]=4 2402 B7R1.4 Cc1cocc1I Amb24630674 [0,1,0,0,1,0|2,0,0]=4 2403 B7R1.4 Cc1cscc1Br Amb2447459 [0,1,0,0,1,0|2,0,0]=4 2404 B7R1.4 Cc1cscc1C Amb2782126 [0,1,0,0,1,0|2,0,0]=4 2405 B7R1.4 Cc1cscc1I Amb27967883 [0,1,0,0,1,0|2,0,0]=4 2406 B7R1.4 Cc1cscc1N Amb18833058 [0,1,0,0,1,0|2,0,0]=4 2407 B7R1.4 Cc1cscc1N Amb20667756 [0,1,0,0,1,0|2,0,0]=4 2408 B7R1.4 Cc1cscc1N Amb22234035 [0,1,0,0,1,0|2,0,0]=4 2409 B7R1.4 Cc1cscc1O Amb26458243 [0,1,0,0,1,0|1,0,0]=3 2410 B7R1.4 Cc1cscc1S Amb28239564 [0,1,0,0,1,0|1,1,0]=4 2411 B7R1.4 Cc1nccn1O Amb27210147 [0,1,0,0,1,0|2,0,0]=4 2412 B7R1.4 Cc1ncsc1O Amb25268351 [0,1,0,0,1,0|2,0,0]=4 2413 B7R1.4 Cc1occc1Br Amb6572125 [0,1,0,0,1,0|2,0,0]=4 2414 B7R1.4 Cc1occc1N Amb18203072 [0,1,0,0,1,0|2,0,0]=4 2415 B7R1.4 Cc1occc1O Amb25178728 [0,1,0,0,1,0|1,0,0]=3 2416 B7R1.4 Cc1occc1S Amb8393173 [0,1,0,0,1,0|1,1,0]=4 2417 B7R1.4 Cc1sccc1Br Amb8393327 [0,1,0,0,1,0|2,0,0]=4 2418 B7R1.4 Cc1sccc1Cl Amb27412961 [0,1,0,0,1,0|2,0,0]=4 2419 B7R1.4 Cc1sccc1F Amb27607081 [0,1,0,0,1,0|2,0,0]=4 2420 B7R1.4 Cc1sccc1I Amb27661837 [0,1,0,0,1,0|2,0,0]=4 2421 B7R1.4 Cc1sccc1N Amb18833056 [0,1,0,0,1,0|2,0,0]=4 2422 B7R1.4 Cc1sccc1N Amb22276099 [0,1,0,0,1,0|2,0,0]=4 2423 B7R1.4 Cc1sccc1O Amb26621113 [0,1,0,0,1,0|1,0,0]=3 2424 B7R1.4 Clc1ccsc1Br Amb5720097 [0,1,0,0,1,0|2,0,0]=4 2425 B7R1.4 Clc1ccsc1Cl Amb2694396 [0,1,0,0,1,0|2,0,0]=4 2426 B7R1.4 Clc1ccsc1I Amb25169530 [0,1,0,0,1,0|2,0,0]=4 2427 B7R1.4 Clc1cscc1Br Amb22753835 [0,1,0,0,1,0|2,0,0]=4 2428 B7R1.4 Clc1cscc1Cl Amb5720904 [0,1,0,0,1,0|2,0,0]=4 2429 B7R1.4 Clc1sccc1Br Amb2722493 [0,1,0,0,1,0|2,0,0]=4 2430 B7R1.4 Cn1cccc1Br Amb18199426 [0,1,0,0,1,0|2,0,0]=4 2431 B7R1.4 Cn1cccc1Cl Amb25212184 [0,1,0,0,1,0|2,0,0]=4 2432 B7R1.4 Cn1cccc1I Amb24756601 [0,1,0,0,1,0|2,0,0]=4 2433 B7R1.4 Cn1cccc1O Amb27652694 [0,1,0,0,1,0|1,0,0]=3 2434 B7R1.4 Cn1cccc1S Amb25888537 [0,1,0,0,1,0|1,1,0]=4 2435 B7R1.4 Cn1cncc1O Amb27436828 [0,1,0,0,1,0|2,0,0]=4 2436 B7R1.4 Cn1nccc1O Amb13883681 [0,1,0,0,1,0|2,0,0]=4 2437 B7R1.4 Cn1nccc1O Amb22233838 [0,1,0,0,1,0|2,0,0]=4 2438 B7R1.4 Fc1ccoc1Br Amb18199675 [0,1,0,0,1,0|2,0,0]=4 2439 B7R1.4 Fc1ccoc1F Amb27877614 [0,1,0,0,1,0|2,0,0]=4 2440 B7R1.4 Fc1ccsc1Br Amb18522293 [0,1,0,0,1,0|2,0,0]=4 2441 B7R1.4 Fc1ccsc1F Amb24562839 [0,1,0,0,1,0|2,0,0]=4 2442 B7R1.4 Fc1cscc1Br Amb27663432 [0,1,0,0,1,0|2,0,0]=4 2443 B7R1.4 Fc1cscc1F Amb26598220 [0,1,0,0,1,0|2,0,0]=4 2444 B7R1.4 Fc1sccc1Br Amb25802858 [0,1,0,0,1,0|2,0,0]=4 2445 B7R1.4 Ic1cscc1I Amb4015462 [0,1,0,0,1,0|2,0,0]=4 2446 B7R1.4 Nc1ccoc1Br Amb13884558 [0,1,0,0,1,0|2,0,0]=4 2447 B7R1.4 Nc1ccsc1Br Amb13884557 [0,1,0,0,1,0|2,0,0]=4 2448 B7R1.4 Nc1ccsc1Br Amb33553014 [0,1,0,0,1,0|2,0,0]=4 2449 B7R1.4 Nc1ccsc1Cl Amb24054287 [0,1,0,0,1,0|2,0,0]=4 2450 B7R1.4 Nc1ccsc1Cl Amb25077005 [0,1,0,0,1,0|2,0,0]=4 2451 B7R1.4 Nc1ccsc1F Amb27958934 [0,1,0,0,1,0|2,0,0]=4 2452 B7R1.4 Nc1cocc1N Amb20620155 [0,1,0,0,1,0|2,0,0]=4 2453 B7R1.4 Nc1cscc1Br Amb22898796 [0,1,0,0,1,0|2,0,0]=4 2454 B7R1.4 Nc1cscc1Br Amb28827662 [0,1,0,0,1,0|2,0,0]=4 2455 B7R1.4 Nc1cscc1Cl Amb22011471 [0,1,0,0,1,0|2,0,0]=4 2456 B7R1.4 Nc1cscc1N Amb2450131 [0,1,0,0,1,0|2,0,0]=4 2457 B7R1.4 Nc1cscc1N Amb535492 [0,1,0,0,1,0|2,0,0]=4 2458 B7R1.4 Nc1csnc1O Amb27848643 [0,1,0,0,1,0|2,0,0]=4 2459 B7R1.4 Nc1sccc1Br Amb18190889 [0,1,0,0,1,0|2,0,0]=4 2460 B7R1.4 Nc1sccc1Cl Amb23401705 [0,1,0,0,1,0|2,0,0]=4 2461 B7R1.4 Nc1sccc1O Amb26606275 [0,1,0,0,1,0|1,0,0]=3 2462 B7R1.4 O=C1C=CC=C1Br Amb28435335 [0,1,0,0,1,0|0,0,1]=3 2463 B7R1.4 O=C1C=CC=C1O Amb27835626 [0,1,0,0,1,0|0,0,0]=2 2464 B7R1.4 O=C1C=CCN1O Amb28255915 [0,1,0,0,1,0|1,0,1]=4 2465 B7R1.4 O=C1C=CNC1=O Amb26887753 [0,1,0,0,1,0|1,0,1]=4 2466 B7R1.4 O=C1C=COC1O Amb27638452 [0,1,0,0,1,0|1,0,1]=4 2467 B7R1.4 O=C1CCC=C1O Amb17593067 [0,1,0,0,1,0|0,0,2]=4 2468 B7R1.4 O=C1CNC=C1O Amb27962752 [0,1,0,0,1,0|1,0,1]=4 2469 B7R1.4 O=C1COC=C1O Amb27838226 [0,1,0,0,1,0|1,0,1]=4 2470 B7R1.4 O=C1NC=CN1O Amb26589882 [0,1,0,0,1,0|2,0,0]=4 2471 B7R1.4 O=C1OC=C[C@@H]1O Amb27472742 [0,1,0,0,1,0|1,0,1]=4 2472 B7R1.4 Oc1cocc1O Amb28059187 [0,1,0,0,1,0|1,0,0]=3 2473 B7R1.4 Oc1nscc1Br Amb27438145 [0,1,0,0,1,0|2,0,0]=4 2474 B7R1.4 Oc1occc1Br Amb18199810 [0,1,0,0,1,0|1,0,0]=3 2475 B7R1.4 Oc1sccc1Br Amb22492529 [0,1,0,0,1,0|1,0,0]=3 2476 B7R1.4 Oc1sccc1Cl Amb25296805 [0,1,0,0,1,0|1,0,0]=3 2477 B7R1.4 On1ccnc1Cl Amb28246860 [0,1,0,0,1,0|2,0,0]=4 2478 B7R1.4 Sc1cscc1Br Amb27777950 [0,1,0,0,1,0|1,1,0]=4 2479 B7R1.4 Sc1sccc1Br Amb26548900 [0,1,0,0,1,0|1,1,0]=4 2480 B7R1.4 Sc1sccc1Cl Amb27832493 [0,1,0,0,1,0|1,1,0]=4 2481 B9R1.5 CC1=CC=CCCC1=O Amb27803075 [0,1,0,0,0,1|0,0,2]=4 2482 B9R1.5 CC1=CCC=CCC1O Amb27653215 [0,1,0,0,0,1|0,0,2]=4 2483 B9R1.5 CC1C=CC=CCC1=O Amb27206986 [0,1,0,0,0,1|0,0,2]=4 2484 B9R1.5 ClC1=CC=CC=CC1Cl Amb28366976 [0,1,0,0,0,1|1,0,0]=3 2485 B9R1.5 NC1=CC=CC=CC1=O Amb22295786 [0,1,0,0,0,1|0,0,1]=3 2486 B9R1.5 NC1=CSC=CNC1=O Amb28041158 [0,1,0,0,0,1|1,0,1]=4 2487 B9R1.5 O=C1C=CC=CC=C1Br Amb24465155 [0,1,0,0,0,1|0,0,1]=3 2488 B9R1.5 O=C1C=CC=CC=C1Cl Amb22731598 [0,1,0,0,0,1|0,0,1]=3 2489 B9R1.5 O=C1C=CC=CC=C1F Amb28202065 [0,1,0,0,0,1|0,0,1]=3 2490 B9R1.5 O=C1C=CC=CC=C1O Amb20242380 [0,1,0,0,0,1|0,0,0]=2 2491 B9R1.5 O=C1C=CC=CC=C1[S-] Amb26515940 [0,1,0,0,0,1|0,0,1]=3 2492 B9R1.5 O=C1C=CC=CCC1=O Amb25319856 [0,1,0,0,0,1|0,0,1]=3 2493 B9R1.5 O[C@H]1C=CCC=C[C@H]1O Amb28064031 [0,1,0,0,0,1|0,0,2]=4 2494 B9R1.48 CC1=CC=CC=C(C)O1 Amb26521492 [0,1,0,0,0,1|1,0,0]=3 2495 B9R1.48 CC1=CC=CNC(=O)N1 Amb28285240 [0,1,0,0,0,1|1,0,1]=4 2496 B9R1.48 FC1=CSC=CC(F)=C1 Amb27969770 [0,1,0,0,0,1|1,0,0]=3 2497 B9R1.48 NC1=CC(=O)C=CC=C1 Amb24683732 [0,1,0,0,0,1|0,0,1]=3 2498 B9R1.48 O=C1C=CC=CC(=O)N1 Amb27790888 [0,1,0,0,0,1|0,0,1]=3 2499 B9R1.48 O=C1C=CC=CC(Cl)=C1 Amb28206323 [0,1,0,0,0,1|0,0,1]=3 2500 B9R1.48 O=C1C=CC=CC(O)C1 Amb28430523 [0,1,0,0,0,1|0,0,1]=3 2501 B9R1.48 OC1C=CC=CC(O)C1 Amb27770332 [0,1,0,0,0,1|0,0,2]=4 2502 B9R1.49 CC1=CCC(O)CC=C1 Amb28123967 [0,1,0,0,0,1|0,0,2]=4 2503 B9R1.49 CC1=CNC(=O)NC=C1 Amb27643010 [0,1,0,0,0,1|1,0,1]=4 2504 B9R1.49 FC1=CC=C(F)SC=C1 Amb28118350 [0,1,0,0,0,1|1,0,0]=3 2505 B9R1.49 FC1=CSC(F)=CC=C1 Amb27165097 [0,1,0,0,0,1|1,0,0]=3 2506 B9R1.49 O=C1C=CC=C(O)C=C1 Amb18048395 [0,1,0,0,0,1|0,0,0]=2 2507 B9R1.89 BrCC1=CC=CC=CC1 Amb28137481 [0,1,0,0,0,1|1,0,0]=3 2508 B9R1.89 COC1=CC=CC=CC1 Amb25887191 [0,1,0,0,0,1|0,0,0]=2 2509 B9R1.89 COC1=NC=CC=CN1 Amb27225691 [0,1,0,0,0,1|1,0,0]=3 2510 B9R1.89 N#CC1C=CC=CC=C1 Amb21858988 [0,1,0,0,0,1|1,0,1]=4 2511 B9R1.89 NCC1C=CC=CC=C1 Amb24567699 [0,1,0,0,0,1|1,0,1]=4 2512 B9R1.89 O=CC1=CC=CC=CC1 Amb17593229 [0,1,0,0,0,1|0,0,1]=3 2513 B9R1.89 O=CC1=CCC=CC=C1 Amb27955933 [0,1,0,0,0,1|0,0,1]=3 2514 B9R1.89 OCC1=CCC=CCC1 Amb28315414 [0,1,0,0,0,1|0,0,2]=4 2515 B9R1.89 OC[C@@H]1C=CCC=CC1 Amb27418283 [0,1,0,0,0,1|0,0,2]=4 2516 B9R1.89 OC[C@H]1C=CCC=CC1 Amb27653026 [0,1,0,0,0,1|0,0,2]=4 2517 B9R1.148 O=S1(=O)C=CC=CC=C1 Amb22364947 [0,1,0,0,0,1|1,0,1]=4 2518 B9R1.1 Bc1ccc(OC)cc1 Amb26633014 [0,2,0,0,0,0|0,0,0]=2 2519 B9R1.1 BrCc1ccc(Br)cc1 Amb6364752 [0,2,0,0,0,0|1,0,0]=3 2520 B9R1.1 BrCc1ccc(Br)cn1 Amb22497644 [0,2,0,0,0,0|2,0,0]=4 2521 B9R1.1 BrCc1ccc(Br)cn1 Amb22831138 [0,2,0,0,0,0|2,0,0]=4 2522 B9R1.1 BrCc1ccc(Br)nc1 Amb20617927 [0,2,0,0,0,0|2,0,0]=4 2523 B9R1.1 BrCc1ccc(Br)nc1 Amb22273996 [0,2,0,0,0,0|2,0,0]=4 2524 B9R1.1 BrCc1ccc(I)cc1 Amb6296830 [0,2,0,0,0,0|1,0,0]=3 2525 B9R1.1 Brc1ccc(CI)cc1 Amb23590685 [0,2,0,0,0,0|1,0,0]=3 2526 B9R1.1 Brc1ccc(CI)nc1 Amb26908936 [0,2,0,0,0,0|2,0,0]=4 2527 B9R1.1 Brc1ccc([Zn]I)cc1 Amb6300184 [0,2,0,0,0,0|1,0,0]=3 2528 B9R1.1 C#Cc1cc[n+]([O-])cc1 Amb27228574 [0,2,0,0,0,0|1,0,1]=4 2529 B9R1.1 C#Cc1ccc(Br)cc1 Amb2447675 [0,2,0,0,0,0|1,0,0]=3 2530 B9R1.1 C#Cc1ccc(Br)cn1 Amb8396919 [0,2,0,0,0,0|2,0,0]=4 2531 B9R1.1 C#Cc1ccc(Br)nc1 Amb22388474 [0,2,0,0,0,0|2,0,0]=4 2532 B9R1.1 C#Cc1ccc(C)cc1 Amb3940469 [0,2,0,0,0,0|1,0,0]=3 2533 B9R1.1 C#Cc1ccc(C)cn1 Amb19516775 [0,2,0,0,0,0|2,0,0]=4 2534 B9R1.1 C#Cc1ccc(C)nc1 Amb17689332 [0,2,0,0,0,0|2,0,0]=4 2535 B9R1.1 C#Cc1ccc(C)nc1 Amb24108498 [0,2,0,0,0,0|2,0,0]=4 2536 B9R1.1 C#Cc1ccc(Cl)cc1 Amb8390525 [0,2,0,0,0,0|1,0,0]=3 2537 B9R1.1 C#Cc1ccc(Cl)cn1 Amb19895141 [0,2,0,0,0,0|2,0,0]=4 2538 B9R1.1 C#Cc1ccc(Cl)cn1 Amb22235952 [0,2,0,0,0,0|2,0,0]=4 2539 B9R1.1 C#Cc1ccc(Cl)nc1 Amb33544059 [0,2,0,0,0,0|2,0,0]=4 2540 B9R1.1 C#Cc1ccc(F)cc1 Amb2688308 [0,2,0,0,0,0|1,0,0]=3 2541 B9R1.1 C#Cc1ccc(F)cn1 Amb19959120 [0,2,0,0,0,0|2,0,0]=4 2542 B9R1.1 C#Cc1ccc(F)nc1 Amb13883473 [0,2,0,0,0,0|2,0,0]=4 2543 B9R1.1 C#Cc1ccc(I)cc1 Amb21858535 [0,2,0,0,0,0|1,0,0]=3 2544 B9R1.1 C#Cc1ccc(N)cc1 Amb2416682 [0,2,0,0,0,0|1,0,0]=3 2545 B9R1.1 C#Cc1ccc(N)cn1 Amb23401650 [0,2,0,0,0,0|2,0,0]=4 2546 B9R1.1 C#Cc1ccc(N)nc1 Amb19516885 [0,2,0,0,0,0|2,0,0]=4 2547 B9R1.1 C#Cc1ccc(O)cc1 Amb6336501 [0,2,0,0,0,0|0,0,0]=2 2548 B9R1.1 C#Cc1ccc(O)cn1 Amb28195303 [0,2,0,0,0,0|1,0,0]=3 2549 B9R1.1 C#Cc1ccc(O)nc1 Amb21962649 [0,2,0,0,0,0|1,0,0]=3 2550 B9R1.1 C#Cc1ccc(S)nc1 Amb27156733 [0,2,0,0,0,0|1,1,0]=4 2551 B9R1.1 C=Cc1ccc(Br)cc1 Amb3940196 [0,2,0,0,0,0|1,0,0]=3 2552 B9R1.1 C=Cc1ccc(Br)cn1 Amb21857299 [0,2,0,0,0,0|2,0,0]=4 2553 B9R1.1 C=Cc1ccc(Br)nc1 Amb23446259 [0,2,0,0,0,0|2,0,0]=4 2554 B9R1.1 C=Cc1ccc(C)cc1 Amb3940476 [0,2,0,0,0,0|1,0,0]=3 2555 B9R1.1 C=Cc1ccc(C)cn1 Amb8388023 [0,2,0,0,0,0|2,0,0]=4 2556 B9R1.1 C=Cc1ccc(C)nc1 Amb28983727 [0,2,0,0,0,0|2,0,0]=4 2557 B9R1.1 C=Cc1ccc(C)nc1 Amb504526 [0,2,0,0,0,0|2,0,0]=4 2558 B9R1.1 C=Cc1ccc(Cl)cc1 Amb2686460 [0,2,0,0,0,0|1,0,0]=3 2559 B9R1.1 C=Cc1ccc(Cl)cn1 Amb24071183 [0,2,0,0,0,0|2,0,0]=4 2560 B9R1.1 C=Cc1ccc(Cl)nc1 Amb19516435 [0,2,0,0,0,0|2,0,0]=4 2561 B9R1.1 C=Cc1ccc(F)cc1 Amb6297757 [0,2,0,0,0,0|1,0,0]=3 2562 B9R1.1 C=Cc1ccc(F)cn1 Amb26483914 [0,2,0,0,0,0|2,0,0]=4 2563 B9R1.1 C=Cc1ccc(F)nc1 Amb26024604 [0,2,0,0,0,0|2,0,0]=4 2564 B9R1.1 C=Cc1ccc(F)nc1 Amb28984235 [0,2,0,0,0,0|2,0,0]=4 2565 B9R1.1 C=Cc1ccc(I)cc1 Amb22736012 [0,2,0,0,0,0|1,0,0]=3 2566 B9R1.1 C=Cc1ccc(N)cc1 Amb2684524 [0,2,0,0,0,0|1,0,0]=3 2567 B9R1.1 C=Cc1ccc(N)nc1 Amb23446330 [0,2,0,0,0,0|2,0,0]=4 2568 B9R1.1 C=Cc1ccc(O)cc1 Amb10603802 [0,2,0,0,0,0|0,0,0]=2 2569 B9R1.1 C=Cc1ccc(O)cn1 Amb26512884 [0,2,0,0,0,0|1,0,0]=3 2570 B9R1.1 C=Cc1ccc(O)nc1 Amb23446716 [0,2,0,0,0,0|1,0,0]=3 2571 B9R1.1 C=Cc1ccc(S)cc1 Amb27801943 [0,2,0,0,0,0|0,1,0]=3 2572 B9R1.1 C=Cc1cnc(O)cn1 Amb27173150 [0,2,0,0,0,0|2,0,0]=4 2573 B9R1.1 C=Nc1ccc(Cl)cc1 Amb28049234 [0,2,0,0,0,0|1,0,0]=3 2574 B9R1.1 C=Nc1ccc(O)cc1 Amb17593237 [0,2,0,0,0,0|0,0,0]=2 2575 B9R1.1 CC1=CC=C(CO)SS1 Amb27843903 [0,2,0,0,0,0|2,0,0]=4 2576 B9R1.1 CC1=CN\C(=N\N)C=C1 Amb19132523 [0,2,0,0,0,0|2,0,0]=4 2577 B9R1.1 CC=C1C=CC(=O)C=C1 Amb28285289 [0,2,0,0,0,0|0,0,1]=3 2578 B9R1.1 CCC1=CNC(=O)C=C1 Amb19889888 [0,2,0,0,0,0|1,0,1]=4 2579 B9R1.1 CCN1C=CC(=O)C=C1 Amb24473507 [0,2,0,0,0,0|1,0,1]=4 2580 B9R1.1 CCN1C=CC(=[NH2+])C=C1 Amb22554359 [0,2,0,0,0,0|2,0,0]=4 2581 B9R1.1 CC[n+]1ccc(C)cc1 Amb27267923 [0,2,0,0,0,0|2,0,0]=4 2582 B9R1.1 CCc1cc[n+](C)cc1 Amb27955889 [0,2,0,0,0,0|2,0,0]=4 2583 B9R1.1 CCc1cc[n+]([O-])cc1 Amb2609610 [0,2,0,0,0,0|1,0,1]=4 2584 B9R1.1 CCc1ccc(Br)cc1 Amb3939114 [0,2,0,0,0,0|1,0,0]=3 2585 B9R1.1 CCc1ccc(Br)cc1 Amb9787458 [0,2,0,0,0,0|1,0,0]=3 2586 B9R1.1 CCc1ccc(Br)cn1 Amb19957826 [0,2,0,0,0,0|2,0,0]=4 2587 B9R1.1 CCc1ccc(Br)nc1 Amb10600529 [0,2,0,0,0,0|2,0,0]=4 2588 B9R1.1 CCc1ccc(C)nc1 Amb2609965 [0,2,0,0,0,0|2,0,0]=4 2589 B9R1.1 CCc1ccc(Cl)cc1 Amb17674113 [0,2,0,0,0,0|1,0,0]=3 2590 B9R1.1 CCc1ccc(Cl)cn1 Amb10600804 [0,2,0,0,0,0|2,0,0]=4 2591 B9R1.1 CCc1ccc(Cl)nc1 Amb19516432 [0,2,0,0,0,0|2,0,0]=4 2592 B9R1.1 CCc1ccc(F)cc1 Amb2687851 [0,2,0,0,0,0|1,0,0]=3 2593 B9R1.1 CCc1ccc(F)cn1 Amb23402698 [0,2,0,0,0,0|2,0,0]=4 2594 B9R1.1 CCc1ccc(F)nc1 Amb28239504 [0,2,0,0,0,0|2,0,0]=4 2595 B9R1.1 CCc1ccc(I)cc1 Amb8514902 [0,2,0,0,0,0|1,0,0]=3 2596 B9R1.1 CCc1ccc(I)nc1 Amb24436572 [0,2,0,0,0,0|2,0,0]=4 2597 B9R1.1 CCc1ccc(N)cc1 Amb2792820 [0,2,0,0,0,0|1,0,0]=3 2598 B9R1.1 CCc1ccc(N)cn1 Amb10600806 [0,2,0,0,0,0|2,0,0]=4 2599 B9R1.1 CCc1ccc(N)nc1 Amb10600531 [0,2,0,0,0,0|2,0,0]=4 2600 B9R1.1 CCc1ccc(O)cc1 Amb2227602 [0,2,0,0,0,0|0,0,0]=2 2601 B9R1.1 CCc1ccc(O)cn1 Amb10573735 [0,2,0,0,0,0|1,0,0]=3 2602 B9R1.1 CCc1ccc(O)nc1 Amb10600532 [0,2,0,0,0,0|1,0,0]=3 2603 B9R1.1 CCc1ccc(S)cc1 Amb2687959 [0,2,0,0,0,0|0,1,0]=3 2604 B9R1.1 CCc1cnc(O)cn1 Amb10599460 [0,2,0,0,0,0|2,0,0]=4 2605 B9R1.1 CCc1cnc(O)nc1 Amb18642185 [0,2,0,0,0,0|2,0,0]=4 2606 B9R1.1 CCc1cnc(O)nc1 Amb21961479 [0,2,0,0,0,0|2,0,0]=4 2607 B9R1.1 CCc1ncc(O)cn1 Amb13884796 [0,2,0,0,0,0|2,0,0]=4 2608 B9R1.1 CN=C1C=CN(C)C=C1 Amb24725213 [0,2,0,0,0,0|2,0,0]=4 2609 B9R1.1 CNC1=CNC(=O)C=C1 Amb27946359 [0,2,0,0,0,0|1,0,1]=4 2610 B9R1.1 CNc1ccc(Br)cc1 Amb2685312 [0,2,0,0,0,0|1,0,0]=3 2611 B9R1.1 CNc1ccc(Br)cn1 Amb6645941 [0,2,0,0,0,0|2,0,0]=4 2612 B9R1.1 CNc1ccc(Br)nc1 Amb19375420 [0,2,0,0,0,0|2,0,0]=4 2613 B9R1.1 CNc1ccc(C)cc1 Amb22236047 [0,2,0,0,0,0|1,0,0]=3 2614 B9R1.1 CNc1ccc(C)cc1 Amb2689513 [0,2,0,0,0,0|1,0,0]=3 2615 B9R1.1 CNc1ccc(C)cn1 Amb6641682 [0,2,0,0,0,0|2,0,0]=4 2616 B9R1.1 CNc1ccc(Cl)cc1 Amb22235624 [0,2,0,0,0,0|1,0,0]=3 2617 B9R1.1 CNc1ccc(Cl)cc1 Amb2686182 [0,2,0,0,0,0|1,0,0]=3 2618 B9R1.1 CNc1ccc(Cl)cn1 Amb6609323 [0,2,0,0,0,0|2,0,0]=4 2619 B9R1.1 CNc1ccc(Cl)nc1 Amb20670918 [0,2,0,0,0,0|2,0,0]=4 2620 B9R1.1 CNc1ccc(F)cc1 Amb2688176 [0,2,0,0,0,0|1,0,0]=3 2621 B9R1.1 CNc1ccc(F)cn1 Amb18278804 [0,2,0,0,0,0|2,0,0]=4 2622 B9R1.1 CNc1ccc(F)cn1 Amb22274171 [0,2,0,0,0,0|2,0,0]=4 2623 B9R1.1 CNc1ccc(F)nc1 Amb25910735 [0,2,0,0,0,0|2,0,0]=4 2624 B9R1.1 CNc1ccc(I)cc1 Amb10609625 [0,2,0,0,0,0|1,0,0]=3 2625 B9R1.1 CNc1ccc(I)cc1 Amb7759887 [0,2,0,0,0,0|1,0,0]=3 2626 B9R1.1 CNc1ccc(I)cn1 Amb23556457 [0,2,0,0,0,0|2,0,0]=4 2627 B9R1.1 CNc1ccc(I)nc1 Amb27637919 [0,2,0,0,0,0|2,0,0]=4 2628 B9R1.1 CNc1ccc(N)cc1 Amb2720137 [0,2,0,0,0,0|1,0,0]=3 2629 B9R1.1 CNc1ccc(N)cc1 Amb8393853 [0,2,0,0,0,0|1,0,0]=3 2630 B9R1.1 CNc1ccc(N)cn1 Amb1117528 [0,2,0,0,0,0|2,0,0]=4 2631 B9R1.1 CNc1ccc(N)cn1 Amb22396324 [0,2,0,0,0,0|2,0,0]=4 2632 B9R1.1 CNc1ccc(N)nc1 Amb19148891 [0,2,0,0,0,0|2,0,0]=4 2633 B9R1.1 CNc1ccc(N)nc1 Amb7767510 [0,2,0,0,0,0|2,0,0]=4 2634 B9R1.1 CNc1ccc(O)cc1 Amb1146863 [0,2,0,0,0,0|0,0,0]=2 2635 B9R1.1 CNc1ccc(O)cc1 Amb2370692 [0,2,0,0,0,0|0,0,0]=2 2636 B9R1.1 CNc1ccc(O)cc1 Amb8513523 [0,2,0,0,0,0|0,0,0]=2 2637 B9R1.1 CNc1ccc(P)cc1 Amb27852437 [0,2,0,0,0,0|1,0,0]=3 2638 B9R1.1 CNc1ccc(S)cc1 Amb26056262 [0,2,0,0,0,0|0,1,0]=3 2639 B9R1.1 COC1=CNC(=O)N=C1 Amb28285104 [0,2,0,0,0,0|2,0,0]=4 2640 B9R1.1 CON1C=CC(=O)C=N1 Amb27802089 [0,2,0,0,0,0|2,0,0]=4 2641 B9R1.1 COc1cc[n+]([O-])cc1 Amb5721055 [0,2,0,0,0,0|1,0,0]=3 2642 B9R1.1 COc1ccc(Br)cc1 Amb3939303 [0,2,0,0,0,0|0,0,0]=2 2643 B9R1.1 COc1ccc(Br)cn1 Amb2447115 [0,2,0,0,0,0|1,0,0]=3 2644 B9R1.1 COc1ccc(Br)nc1 Amb2447553 [0,2,0,0,0,0|1,0,0]=3 2645 B9R1.1 COc1ccc(Br)nn1 Amb10600289 [0,2,0,0,0,0|2,0,0]=4 2646 B9R1.1 COc1ccc(C)cc1 Amb6608865 [0,2,0,0,0,0|0,0,0]=2 2647 B9R1.1 COc1ccc(C)cn1 Amb15691027 [0,2,0,0,0,0|1,0,0]=3 2648 B9R1.1 COc1ccc(C)nc1 Amb8395201 [0,2,0,0,0,0|1,0,0]=3 2649 B9R1.1 COc1ccc(C)nn1 Amb5751231 [0,2,0,0,0,0|2,0,0]=4 2650 B9R1.1 COc1ccc(Cl)cc1 Amb8386699 [0,2,0,0,0,0|0,0,0]=2 2651 B9R1.1 COc1ccc(Cl)cn1 Amb2795154 [0,2,0,0,0,0|1,0,0]=3 2652 B9R1.1 COc1ccc(Cl)nc1 Amb15691028 [0,2,0,0,0,0|1,0,0]=3 2653 B9R1.1 COc1ccc(Cl)nn1 Amb2609923 [0,2,0,0,0,0|2,0,0]=4 2654 B9R1.1 COc1ccc(F)cc1 Amb2688016 [0,2,0,0,0,0|0,0,0]=2 2655 B9R1.1 COc1ccc(F)cn1 Amb8386953 [0,2,0,0,0,0|1,0,0]=3 2656 B9R1.1 COc1ccc(F)nc1 Amb21963479 [0,2,0,0,0,0|1,0,0]=3 2657 B9R1.1 COc1ccc(F)nn1 Amb23400495 [0,2,0,0,0,0|2,0,0]=4 2658 B9R1.1 COc1ccc(I)cc1 Amb6296024 [0,2,0,0,0,0|0,0,0]=2 2659 B9R1.1 COc1ccc(I)cn1 Amb10844710 [0,2,0,0,0,0|1,0,0]=3 2660 B9R1.1 COc1ccc(I)nc1 Amb2447620 [0,2,0,0,0,0|1,0,0]=3 2661 B9R1.1 COc1ccc(I)nn1 Amb16231021 [0,2,0,0,0,0|2,0,0]=4 2662 B9R1.1 COc1ccc(N)cc1 Amb6364740 [0,2,0,0,0,0|0,0,0]=2 2663 B9R1.1 COc1ccc(N)cn1 Amb1151298 [0,2,0,0,0,0|1,0,0]=3 2664 B9R1.1 COc1ccc(N)cn1 Amb29847172 [0,2,0,0,0,0|1,0,0]=3 2665 B9R1.1 COc1ccc(N)nc1 Amb19375370 [0,2,0,0,0,0|1,0,0]=3 2666 B9R1.1 COc1ccc(N)nc1 Amb33534109 [0,2,0,0,0,0|1,0,0]=3 2667 B9R1.1 COc1ccc(N)nn1 Amb34147256 [0,2,0,0,0,0|2,0,0]=4 2668 B9R1.1 COc1ccc(N)nn1 Amb8630005 [0,2,0,0,0,0|2,0,0]=4 2669 B9R1.1 COc1ccc(O)cc1 Amb2725498 [0,2,0,0,0,0|0,0,0]=2 2670 B9R1.1 COc1ccc(O)cn1 Amb2696900 [0,2,0,0,0,0|1,0,0]=3 2671 B9R1.1 COc1ccc(O)nc1 Amb18642264 [0,2,0,0,0,0|1,0,0]=3 2672 B9R1.1 COc1ccc(O)nn1 Amb21984418 [0,2,0,0,0,0|2,0,0]=4 2673 B9R1.1 COc1ccc(S)cc1 Amb2689088 [0,2,0,0,0,0|0,0,0]=2 2674 B9R1.1 COc1ccc(S)cn1 Amb27443656 [0,2,0,0,0,0|1,0,0]=3 2675 B9R1.1 COc1ccc(S)nc1 Amb27486908 [0,2,0,0,0,0|1,0,0]=3 2676 B9R1.1 COc1ccc(S)nn1 Amb24309181 [0,2,0,0,0,0|2,0,0]=4 2677 B9R1.1 COc1ccc([Mg+])cc1 Amb22053738 [0,2,0,0,0,0|0,0,0]=2 2678 B9R1.1 COc1cnc(Br)cn1 Amb10599255 [0,2,0,0,0,0|2,0,0]=4 2679 B9R1.1 COc1cnc(Br)nc1 Amb22899714 [0,2,0,0,0,0|2,0,0]=4 2680 B9R1.1 COc1cnc(C)nc1 Amb23402803 [0,2,0,0,0,0|2,0,0]=4 2681 B9R1.1 COc1cnc(Cl)cn1 Amb15693383 [0,2,0,0,0,0|2,0,0]=4 2682 B9R1.1 COc1cnc(Cl)nc1 Amb15691083 [0,2,0,0,0,0|2,0,0]=4 2683 B9R1.1 COc1cnc(F)cn1 Amb28399319 [0,2,0,0,0,0|2,0,0]=4 2684 B9R1.1 COc1cnc(I)cn1 Amb21857659 [0,2,0,0,0,0|2,0,0]=4 2685 B9R1.1 COc1cnc(I)nc1 Amb28187057 [0,2,0,0,0,0|2,0,0]=4 2686 B9R1.1 COc1cnc(N)cn1 Amb33543923 [0,2,0,0,0,0|2,0,0]=4 2687 B9R1.1 COc1cnc(N)nc1 Amb342841 [0,2,0,0,0,0|2,0,0]=4 2688 B9R1.1 COc1cnc(S)nc1 Amb25782681 [0,2,0,0,0,0|2,0,0]=4 2689 B9R1.1 COc1ncc(Br)cn1 Amb2447332 [0,2,0,0,0,0|2,0,0]=4 2690 B9R1.1 COc1ncc(Cl)cn1 Amb2796319 [0,2,0,0,0,0|2,0,0]=4 2691 B9R1.1 COc1ncc(I)cn1 Amb22498127 [0,2,0,0,0,0|2,0,0]=4 2692 B9R1.1 COc1ncc(N)cn1 Amb10070565 [0,2,0,0,0,0|2,0,0]=4 2693 B9R1.1 COc1ncc(O)cn1 Amb10602936 [0,2,0,0,0,0|2,0,0]=4 2694 B9R1.1 CSc1cc[n+]([O-])cc1 Amb25853903 [0,2,0,0,0,0|1,0,1]=4 2695 B9R1.1 CSc1ccc(Br)cc1 Amb2685502 [0,2,0,0,0,0|0,1,0]=3 2696 B9R1.1 CSc1ccc(Br)cn1 Amb2455928 [0,2,0,0,0,0|1,1,0]=4 2697 B9R1.1 CSc1ccc(Br)nc1 Amb10608144 [0,2,0,0,0,0|1,1,0]=4 2698 B9R1.1 CSc1ccc(C)cc1 Amb2780185 [0,2,0,0,0,0|0,1,0]=3 2699 B9R1.1 CSc1ccc(C)cn1 Amb27832586 [0,2,0,0,0,0|1,1,0]=4 2700 B9R1.1 CSc1ccc(C)nc1 Amb27254634 [0,2,0,0,0,0|1,1,0]=4 2701 B9R1.1 CSc1ccc(Cl)cc1 Amb2686479 [0,2,0,0,0,0|0,1,0]=3 2702 B9R1.1 CSc1ccc(Cl)cn1 Amb27391439 [0,2,0,0,0,0|1,1,0]=4 2703 B9R1.1 CSc1ccc(Cl)nc1 Amb27210196 [0,2,0,0,0,0|1,1,0]=4 2704 B9R1.1 CSc1ccc(F)cc1 Amb2688422 [0,2,0,0,0,0|0,1,0]=3 2705 B9R1.1 CSc1ccc(F)nc1 Amb25128697 [0,2,0,0,0,0|1,1,0]=4 2706 B9R1.1 CSc1ccc(I)cc1 Amb2688887 [0,2,0,0,0,0|0,1,0]=3 2707 B9R1.1 CSc1ccc(N)cc1 Amb1157791 [0,2,0,0,0,0|0,1,0]=3 2708 B9R1.1 CSc1ccc(N)cc1 Amb4006411 [0,2,0,0,0,0|0,1,0]=3 2709 B9R1.1 CSc1ccc(N)cn1 Amb8932492 [0,2,0,0,0,0|1,1,0]=4 2710 B9R1.1 CSc1ccc(N)nc1 Amb33528196 [0,2,0,0,0,0|1,1,0]=4 2711 B9R1.1 CSc1ccc(O)cc1 Amb2689508 [0,2,0,0,0,0|0,0,0]=2 2712 B9R1.1 CSc1ccc(O)cn1 Amb26573661 [0,2,0,0,0,0|1,0,0]=3 2713 B9R1.1 CSc1ccc(S)cc1 Amb9826885 [0,2,0,0,0,0|0,1,0]=3 2714 B9R1.1 CSc1ncc(O)cn1 Amb4011501 [0,2,0,0,0,0|2,0,0]=4 2715 B9R1.1 C[n+]1ccc(C#N)cc1 Amb25983182 [0,2,0,0,0,0|2,0,0]=4 2716 B9R1.1 C[n+]1ccc(C=O)cc1 Amb10552785 [0,2,0,0,0,0|1,0,1]=4 2717 B9R1.1 C[n+]1ccc(C=O)cc1 Amb27230600 [0,2,0,0,0,0|1,0,1]=4 2718 B9R1.1 C[n+]1ccc(CN)cc1 Amb24113135 [0,2,0,0,0,0|2,0,0]=4 2719 B9R1.1 C[n+]1ccc(CO)cc1 Amb2608599 [0,2,0,0,0,0|1,0,0]=3 2720 B9R1.1 Cc1ccc(C#N)cc1 Amb1648948 [0,2,0,0,0,0|1,0,0]=3 2721 B9R1.1 Cc1ccc(C#N)cn1 Amb2782592 [0,2,0,0,0,0|2,0,0]=4 2722 B9R1.1 Cc1ccc(C#N)nc1 Amb2694182 [0,2,0,0,0,0|2,0,0]=4 2723 B9R1.1 Cc1ccc(C=O)cc1 Amb2447582 [0,2,0,0,0,0|0,0,1]=3 2724 B9R1.1 Cc1ccc(C=O)cn1 Amb10603697 [0,2,0,0,0,0|1,0,1]=4 2725 B9R1.1 Cc1ccc(C=O)nc1 Amb8386307 [0,2,0,0,0,0|1,0,1]=4 2726 B9R1.1 Cc1ccc(C=S)cc1 Amb22233234 [0,2,0,0,0,0|0,1,0]=3 2727 B9R1.1 Cc1ccc(CBr)cc1 Amb3939709 [0,2,0,0,0,0|1,0,0]=3 2728 B9R1.1 Cc1ccc(CBr)cn1 Amb15694777 [0,2,0,0,0,0|2,0,0]=4 2729 B9R1.1 Cc1ccc(CBr)cn1 Amb18326669 [0,2,0,0,0,0|2,0,0]=4 2730 B9R1.1 Cc1ccc(CBr)nc1 Amb23401204 [0,2,0,0,0,0|2,0,0]=4 2731 B9R1.1 Cc1ccc(CCl)cc1 Amb2792912 [0,2,0,0,0,0|1,0,0]=3 2732 B9R1.1 Cc1ccc(CCl)cn1 Amb22235163 [0,2,0,0,0,0|2,0,0]=4 2733 B9R1.1 Cc1ccc(CCl)cn1 Amb8999106 [0,2,0,0,0,0|2,0,0]=4 2734 B9R1.1 Cc1ccc(CCl)nc1 Amb20668491 [0,2,0,0,0,0|2,0,0]=4 2735 B9R1.1 Cc1ccc(CCl)nc1 Amb21856157 [0,2,0,0,0,0|2,0,0]=4 2736 B9R1.1 Cc1ccc(CN)cc1 Amb2725507 [0,2,0,0,0,0|1,0,0]=3 2737 B9R1.1 Cc1ccc(CN)cn1 Amb33544900 [0,2,0,0,0,0|2,0,0]=4 2738 B9R1.1 Cc1ccc(CN)cn1 Amb6255800 [0,2,0,0,0,0|2,0,0]=4 2739 B9R1.1 Cc1ccc(CN)nc1 Amb1138473 [0,2,0,0,0,0|2,0,0]=4 2740 B9R1.1 Cc1ccc(CN)nc1 Amb22586821 [0,2,0,0,0,0|2,0,0]=4 2741 B9R1.1 Cc1ccc(CN)nc1 Amb22727965 [0,2,0,0,0,0|2,0,0]=4 2742 B9R1.1 Cc1ccc(CO)cc1 Amb6705746 [0,2,0,0,0,0|0,0,0]=2 2743 B9R1.1 Cc1ccc(CO)cn1 Amb33550507 [0,2,0,0,0,0|1,0,0]=3 2744 B9R1.1 Cc1ccc(CO)nc1 Amb20248030 [0,2,0,0,0,0|1,0,0]=3 2745 B9R1.1 Cc1ccc(CO)nc1 Amb32663099 [0,2,0,0,0,0|1,0,0]=3 2746 B9R1.1 Cc1ccc(CO)nn1 Amb22002148 [0,2,0,0,0,0|2,0,0]=4 2747 B9R1.1 Cc1ccc(CS)cc1 Amb2726198 [0,2,0,0,0,0|0,1,0]=3 2748 B9R1.1 Cc1ccc(CS)cn1 Amb26984226 [0,2,0,0,0,0|1,1,0]=4 2749 B9R1.1 Cc1ccc(CS)nc1 Amb26873949 [0,2,0,0,0,0|1,1,0]=4 2750 B9R1.1 Cc1ccc(N=O)cc1 Amb22167394 [0,2,0,0,0,0|0,0,1]=3 2751 B9R1.1 Cc1ccc(NN)cc1 Amb1207920 [0,2,0,0,0,0|1,0,0]=3 2752 B9R1.1 Cc1ccc(NN)cc1 Amb22489460 [0,2,0,0,0,0|1,0,0]=3 2753 B9R1.1 Cc1ccc(NN)cc1 Amb2370693 [0,2,0,0,0,0|1,0,0]=3 2754 B9R1.1 Cc1ccc(NN)cn1 Amb19957983 [0,2,0,0,0,0|2,0,0]=4 2755 B9R1.1 Cc1ccc(NN)cn1 Amb20241064 [0,2,0,0,0,0|2,0,0]=4 2756 B9R1.1 Cc1ccc(NN)nc1 Amb22757347 [0,2,0,0,0,0|2,0,0]=4 2757 B9R1.1 Cc1ccc(NN)nc1 Amb5730480 [0,2,0,0,0,0|2,0,0]=4 2758 B9R1.1 Cc1ccc(NO)cc1 Amb21961957 [0,2,0,0,0,0|0,0,0]=2 2759 B9R1.1 Cc1ccc(N[NH3+])cc1 Amb24113868 [0,2,0,0,0,0|1,0,0]=3 2760 B9R1.1 Cc1ccc(SCl)cc1 Amb17939009 [0,2,0,0,0,0|0,1,0]=3 2761 B9R1.1 Cc1ccc([Mg]Br)cc1 Amb6300518 [0,2,0,0,0,0|1,0,0]=3 2762 B9R1.1 Cc1ccc([N+]#N)cc1 Amb25056987 [0,2,0,0,0,0|1,0,0]=3 2763 B9R1.1 Cc1ccc([Zn]Br)nc1 Amb22000376 [0,2,0,0,0,0|2,0,0]=4 2764 B9R1.1 Cc1ccc([Zn]I)cc1 Amb22000447 [0,2,0,0,0,0|1,0,0]=3 2765 B9R1.1 Cc1cnc(CO)cn1 Amb33545971 [0,2,0,0,0,0|2,0,0]=4 2766 B9R1.1 Cc1cnc(CO)nc1 Amb21963539 [0,2,0,0,0,0|2,0,0]=4 2767 B9R1.1 Cc1ncc(CO)cn1 Amb8397258 [0,2,0,0,0,0|2,0,0]=4 2768 B9R1.1 ClCc1ccc(Br)cc1 Amb535681 [0,2,0,0,0,0|1,0,0]=3 2769 B9R1.1 ClCc1ccc(Br)cn1 Amb19373716 [0,2,0,0,0,0|2,0,0]=4 2770 B9R1.1 ClCc1ccc(Br)cn1 Amb19515838 [0,2,0,0,0,0|2,0,0]=4 2771 B9R1.1 ClCc1ccc(Br)nc1 Amb22500143 [0,2,0,0,0,0|2,0,0]=4 2772 B9R1.1 ClCc1ccc(Br)nc1 Amb22500149 [0,2,0,0,0,0|2,0,0]=4 2773 B9R1.1 ClCc1ccc(Cl)cc1 Amb6364749 [0,2,0,0,0,0|1,0,0]=3 2774 B9R1.1 ClCc1ccc(Cl)cn1 Amb13882788 [0,2,0,0,0,0|2,0,0]=4 2775 B9R1.1 ClCc1ccc(Cl)cn1 Amb19895169 [0,2,0,0,0,0|2,0,0]=4 2776 B9R1.1 ClCc1ccc(Cl)nc1 Amb1928595 [0,2,0,0,0,0|2,0,0]=4 2777 B9R1.1 ClCc1ccc(Cl)nc1 Amb22500029 [0,2,0,0,0,0|2,0,0]=4 2778 B9R1.1 ClCc1ccc(I)cc1 Amb2609575 [0,2,0,0,0,0|1,0,0]=3 2779 B9R1.1 ClCc1ccc(I)cn1 Amb23399976 [0,2,0,0,0,0|2,0,0]=4 2780 B9R1.1 ClSc1ccc(Cl)cc1 Amb28049700 [0,2,0,0,0,0|0,1,0]=3 2781 B9R1.1 Clc1ccc(CBr)cc1 Amb2685773 [0,2,0,0,0,0|1,0,0]=3 2782 B9R1.1 Clc1ccc(CBr)cn1 Amb10602791 [0,2,0,0,0,0|2,0,0]=4 2783 B9R1.1 Clc1ccc(CBr)cn1 Amb22001671 [0,2,0,0,0,0|2,0,0]=4 2784 B9R1.1 Clc1ccc(CBr)nc1 Amb22001697 [0,2,0,0,0,0|2,0,0]=4 2785 B9R1.1 Clc1ccc(CBr)nc1 Amb22492484 [0,2,0,0,0,0|2,0,0]=4 2786 B9R1.1 Clc1ccc(CI)cc1 Amb10552723 [0,2,0,0,0,0|1,0,0]=3 2787 B9R1.1 Clc1ccc([Zn]I)cc1 Amb22000418 [0,2,0,0,0,0|1,0,0]=3 2788 B9R1.1 FCc1ccc(Br)cc1 Amb22886704 [0,2,0,0,0,0|1,0,0]=3 2789 B9R1.1 FCc1ccc(Br)cn1 Amb28206264 [0,2,0,0,0,0|2,0,0]=4 2790 B9R1.1 FCc1ccc(F)nc1 Amb35789209 [0,2,0,0,0,0|2,0,0]=4 2791 B9R1.1 Fc1ccc(CBr)cc1 Amb432269 [0,2,0,0,0,0|1,0,0]=3 2792 B9R1.1 Fc1ccc(CBr)cn1 Amb10840577 [0,2,0,0,0,0|2,0,0]=4 2793 B9R1.1 Fc1ccc(CBr)nc1 Amb10606379 [0,2,0,0,0,0|2,0,0]=4 2794 B9R1.1 Fc1ccc(CBr)nc1 Amb6308298 [0,2,0,0,0,0|2,0,0]=4 2795 B9R1.1 Fc1ccc(CCl)cc1 Amb6364745 [0,2,0,0,0,0|1,0,0]=3 2796 B9R1.1 Fc1ccc(CCl)cn1 Amb22406083 [0,2,0,0,0,0|2,0,0]=4 2797 B9R1.1 Fc1ccc(CCl)nc1 Amb23401203 [0,2,0,0,0,0|2,0,0]=4 2798 B9R1.1 Fc1ccc(CCl)nc1 Amb33038233 [0,2,0,0,0,0|2,0,0]=4 2799 B9R1.1 Fc1ccc(CI)cc1 Amb23571307 [0,2,0,0,0,0|1,0,0]=3 2800 B9R1.1 Fc1ccc(CI)cn1 Amb27461838 [0,2,0,0,0,0|2,0,0]=4 2801 B9R1.1 Fc1ccc(CS)cc1 Amb2688054 [0,2,0,0,0,0|0,1,0]=3 2802 B9R1.1 Fc1ccc(CS)cn1 Amb33425101 [0,2,0,0,0,0|1,1,0]=4 2803 B9R1.1 Fc1ccc(CS)nc1 Amb26482888 [0,2,0,0,0,0|1,1,0]=4 2804 B9R1.1 Fc1ccc([Zn]Br)cc1 Amb17938178 [0,2,0,0,0,0|1,0,0]=3 2805 B9R1.1 N#CC1=CNC(=O)C=C1 Amb19514302 [0,2,0,0,0,0|1,0,1]=4 2806 B9R1.1 N#CC1=CNC(=O)C=C1 Amb33719081 [0,2,0,0,0,0|1,0,1]=4 2807 B9R1.1 N#CC1=COC(=O)C=C1 Amb22304830 [0,2,0,0,0,0|1,0,1]=4 2808 B9R1.1 N#Cc1cc[n+]([O-])cc1 Amb2725271 [0,2,0,0,0,0|1,0,1]=4 2809 B9R1.1 N#Cc1ccc(Br)cc1 Amb1152666 [0,2,0,0,0,0|1,0,0]=3 2810 B9R1.1 N#Cc1ccc(Br)cn1 Amb2447422 [0,2,0,0,0,0|2,0,0]=4 2811 B9R1.1 N#Cc1ccc(Br)nc1 Amb8389444 [0,2,0,0,0,0|2,0,0]=4 2812 B9R1.1 N#Cc1ccc(Cl)cc1 Amb1647607 [0,2,0,0,0,0|1,0,0]=3 2813 B9R1.1 N#Cc1ccc(Cl)cn1 Amb8386736 [0,2,0,0,0,0|2,0,0]=4 2814 B9R1.1 N#Cc1ccc(Cl)nc1 Amb2726017 [0,2,0,0,0,0|2,0,0]=4 2815 B9R1.1 N#Cc1ccc(F)cc1 Amb1152563 [0,2,0,0,0,0|1,0,0]=3 2816 B9R1.1 N#Cc1ccc(F)cn1 Amb10982482 [0,2,0,0,0,0|2,0,0]=4 2817 B9R1.1 N#Cc1ccc(F)nc1 Amb19944618 [0,2,0,0,0,0|2,0,0]=4 2818 B9R1.1 N#Cc1ccc(I)cc1 Amb1808511 [0,2,0,0,0,0|1,0,0]=3 2819 B9R1.1 N#Cc1ccc(I)cn1 Amb10067348 [0,2,0,0,0,0|2,0,0]=4 2820 B9R1.1 N#Cc1ccc(I)nc1 Amb10070318 [0,2,0,0,0,0|2,0,0]=4 2821 B9R1.1 N#Cc1ccc(N)cc1 Amb1809796 [0,2,0,0,0,0|1,0,0]=3 2822 B9R1.1 N#Cc1ccc(N)cn1 Amb8386690 [0,2,0,0,0,0|2,0,0]=4 2823 B9R1.1 N#Cc1ccc(N)cn1 Amb8629673 [0,2,0,0,0,0|2,0,0]=4 2824 B9R1.1 N#Cc1ccc(N)nc1 Amb2413582 [0,2,0,0,0,0|2,0,0]=4 2825 B9R1.1 N#Cc1ccc(O)cc1 Amb1785457 [0,2,0,0,0,0|0,0,0]=2 2826 B9R1.1 N#Cc1ccc(O)cn1 Amb6307648 [0,2,0,0,0,0|1,0,0]=3 2827 B9R1.1 N#Cc1ccc(O)nc1 Amb8993174 [0,2,0,0,0,0|1,0,0]=3 2828 B9R1.1 N#Cc1ccc(S)cc1 Amb6296884 [0,2,0,0,0,0|0,1,0]=3 2829 B9R1.1 N#Cc1ccc(S)cn1 Amb27984519 [0,2,0,0,0,0|1,1,0]=4 2830 B9R1.1 N#Cc1ccc(S)nc1 Amb33543232 [0,2,0,0,0,0|1,1,0]=4 2831 B9R1.1 N#Cc1ccn(=O)cc1 Amb20620882 [0,2,0,0,0,0|1,0,1]=4 2832 B9R1.1 N#Cc1cnc(O)cn1 Amb10599248 [0,2,0,0,0,0|2,0,0]=4 2833 B9R1.1 N#Cc1ncc(O)cn1 Amb33547382 [0,2,0,0,0,0|2,0,0]=4 2834 B9R1.1 N#[N+]c1ccc(Br)cc1 Amb5721730 [0,2,0,0,0,0|1,0,0]=3 2835 B9R1.1 N#[N+]c1ccc(Cl)cc1 Amb22730108 [0,2,0,0,0,0|1,0,0]=3 2836 B9R1.1 N#[N+]c1ccc(Cl)cc1 Amb26472679 [0,2,0,0,0,0|1,0,0]=3 2837 B9R1.1 N#[N+]c1ccc(F)cc1 Amb33549162 [0,2,0,0,0,0|1,0,0]=3 2838 B9R1.1 N#[N+]c1ccc(I)cc1 Amb27174661 [0,2,0,0,0,0|1,0,0]=3 2839 B9R1.1 N=Cc1ccc(O)cc1 Amb17593236 [0,2,0,0,0,0|0,0,0]=2 2840 B9R1.1 N=Nc1cc[n+]([O-])cc1 Amb27790290 [0,2,0,0,0,0|1,0,1]=4 2841 B9R1.1 NCC1=CNC(=O)C=C1 Amb18024213 [0,2,0,0,0,0|1,0,1]=4 2842 B9R1.1 NCC1=CNC(=O)C=C1 Amb19929382 [0,2,0,0,0,0|1,0,1]=4 2843 B9R1.1 NCC1=CNC(=O)C=C1 Amb22490775 [0,2,0,0,0,0|1,0,1]=4 2844 B9R1.1 NCC1=CNC(=S)C=C1 Amb18251217 [0,2,0,0,0,0|1,1,0]=4 2845 B9R1.1 NCc1cc[n+]([O-])cc1 Amb25090606 [0,2,0,0,0,0|1,0,1]=4 2846 B9R1.1 NCc1ccc(Br)cc1 Amb1113965 [0,2,0,0,0,0|1,0,0]=3 2847 B9R1.1 NCc1ccc(Br)cc1 Amb2684958 [0,2,0,0,0,0|1,0,0]=3 2848 B9R1.1 NCc1ccc(Br)cn1 Amb22495640 [0,2,0,0,0,0|2,0,0]=4 2849 B9R1.1 NCc1ccc(Br)cn1 Amb22495846 [0,2,0,0,0,0|2,0,0]=4 2850 B9R1.1 NCc1ccc(Br)cn1 Amb33540702 [0,2,0,0,0,0|2,0,0]=4 2851 B9R1.1 NCc1ccc(Br)nc1 Amb13890447 [0,2,0,0,0,0|2,0,0]=4 2852 B9R1.1 NCc1ccc(Br)nc1 Amb21857057 [0,2,0,0,0,0|2,0,0]=4 2853 B9R1.1 NCc1ccc(Cl)cc1 Amb1672014 [0,2,0,0,0,0|1,0,0]=3 2854 B9R1.1 NCc1ccc(Cl)cc1 Amb24066020 [0,2,0,0,0,0|1,0,0]=3 2855 B9R1.1 NCc1ccc(Cl)cn1 Amb13890636 [0,2,0,0,0,0|2,0,0]=4 2856 B9R1.1 NCc1ccc(Cl)cn1 Amb16185837 [0,2,0,0,0,0|2,0,0]=4 2857 B9R1.1 NCc1ccc(Cl)cn1 Amb21927707 [0,2,0,0,0,0|2,0,0]=4 2858 B9R1.1 NCc1ccc(Cl)nc1 Amb19514819 [0,2,0,0,0,0|2,0,0]=4 2859 B9R1.1 NCc1ccc(Cl)nc1 Amb6892087 [0,2,0,0,0,0|2,0,0]=4 2860 B9R1.1 NCc1ccc(F)cc1 Amb4037037 [0,2,0,0,0,0|1,0,0]=3 2861 B9R1.1 NCc1ccc(F)cc1 Amb535713 [0,2,0,0,0,0|1,0,0]=3 2862 B9R1.1 NCc1ccc(F)cn1 Amb20669476 [0,2,0,0,0,0|2,0,0]=4 2863 B9R1.1 NCc1ccc(F)cn1 Amb22500552 [0,2,0,0,0,0|2,0,0]=4 2864 B9R1.1 NCc1ccc(F)nc1 Amb20247920 [0,2,0,0,0,0|2,0,0]=4 2865 B9R1.1 NCc1ccc(F)nc1 Amb22738776 [0,2,0,0,0,0|2,0,0]=4 2866 B9R1.1 NCc1ccc(I)cc1 Amb3941391 [0,2,0,0,0,0|1,0,0]=3 2867 B9R1.1 NCc1ccc(I)cc1 Amb9786784 [0,2,0,0,0,0|1,0,0]=3 2868 B9R1.1 NCc1ccc(I)cn1 Amb25365536 [0,2,0,0,0,0|2,0,0]=4 2869 B9R1.1 NCc1ccc(N)cc1 Amb19143935 [0,2,0,0,0,0|1,0,0]=3 2870 B9R1.1 NCc1ccc(N)cc1 Amb6315805 [0,2,0,0,0,0|1,0,0]=3 2871 B9R1.1 NCc1ccc(N)cc1 Amb6844501 [0,2,0,0,0,0|1,0,0]=3 2872 B9R1.1 NCc1ccc(N)cn1 Amb23401800 [0,2,0,0,0,0|2,0,0]=4 2873 B9R1.1 NCc1ccc(N)cn1 Amb8386686 [0,2,0,0,0,0|2,0,0]=4 2874 B9R1.1 NCc1ccc(N)nc1 Amb23401797 [0,2,0,0,0,0|2,0,0]=4 2875 B9R1.1 NCc1ccc(N)nc1 Amb32729410 [0,2,0,0,0,0|2,0,0]=4 2876 B9R1.1 NCc1ccc(N)nc1 Amb33529581 [0,2,0,0,0,0|2,0,0]=4 2877 B9R1.1 NCc1ccc(O)cc1 Amb1117538 [0,2,0,0,0,0|0,0,0]=2 2878 B9R1.1 NCc1ccc(O)cc1 Amb2688735 [0,2,0,0,0,0|0,0,0]=2 2879 B9R1.1 NCc1ccc(O)cc1 Amb30640052 [0,2,0,0,0,0|0,0,0]=2 2880 B9R1.1 NCc1ccc(O)cc1 Amb6892133 [0,2,0,0,0,0|0,0,0]=2 2881 B9R1.1 NCc1ccc(O)cn1 Amb19895109 [0,2,0,0,0,0|1,0,0]=3 2882 B9R1.1 NCc1ccc(O)cn1 Amb25733596 [0,2,0,0,0,0|1,0,0]=3 2883 B9R1.1 NCc1ccc(O)cn1 Amb33483854 [0,2,0,0,0,0|1,0,0]=3 2884 B9R1.1 NCc1ccc(O)nc1 Amb19432844 [0,2,0,0,0,0|1,0,0]=3 2885 B9R1.1 NCc1ccc(O)nc1 Amb8855140 [0,2,0,0,0,0|1,0,0]=3 2886 B9R1.1 NCc1ccc(S)cc1 Amb25869884 [0,2,0,0,0,0|0,1,0]=3 2887 B9R1.1 NCc1ccc(S)cc1 Amb33328783 [0,2,0,0,0,0|0,1,0]=3 2888 B9R1.1 NCc1cnc(O)cn1 Amb32674652 [0,2,0,0,0,0|2,0,0]=4 2889 B9R1.1 NCc1cnc(O)cn1 Amb32683478 [0,2,0,0,0,0|2,0,0]=4 2890 B9R1.1 NCc1cnc(O)nc1 Amb18832819 [0,2,0,0,0,0|2,0,0]=4 2891 B9R1.1 NNC1=CNC(=O)C=C1 Amb23559894 [0,2,0,0,0,0|1,0,1]=4 2892 B9R1.1 NNc1cc[n+]([O-])cc1 Amb26390927 [0,2,0,0,0,0|1,0,1]=4 2893 B9R1.1 NNc1ccc(Br)cc1 Amb1043740 [0,2,0,0,0,0|1,0,0]=3 2894 B9R1.1 NNc1ccc(Br)cc1 Amb2031916 [0,2,0,0,0,0|1,0,0]=3 2895 B9R1.1 NNc1ccc(Br)cc1 Amb22489508 [0,2,0,0,0,0|1,0,0]=3 2896 B9R1.1 NNc1ccc(Br)cn1 Amb2447565 [0,2,0,0,0,0|2,0,0]=4 2897 B9R1.1 NNc1ccc(Br)nc1 Amb19514660 [0,2,0,0,0,0|2,0,0]=4 2898 B9R1.1 NNc1ccc(Cl)cc1 Amb1043742 [0,2,0,0,0,0|1,0,0]=3 2899 B9R1.1 NNc1ccc(Cl)cc1 Amb1150309 [0,2,0,0,0,0|1,0,0]=3 2900 B9R1.1 NNc1ccc(Cl)cc1 Amb22276157 [0,2,0,0,0,0|1,0,0]=3 2901 B9R1.1 NNc1ccc(Cl)cn1 Amb2786663 [0,2,0,0,0,0|2,0,0]=4 2902 B9R1.1 NNc1ccc(Cl)nc1 Amb19651369 [0,2,0,0,0,0|2,0,0]=4 2903 B9R1.1 NNc1ccc(F)cc1 Amb1039460 [0,2,0,0,0,0|1,0,0]=3 2904 B9R1.1 NNc1ccc(F)cc1 Amb2592630 [0,2,0,0,0,0|1,0,0]=3 2905 B9R1.1 NNc1ccc(F)cn1 Amb17208907 [0,2,0,0,0,0|2,0,0]=4 2906 B9R1.1 NNc1ccc(F)cn1 Amb21961497 [0,2,0,0,0,0|2,0,0]=4 2907 B9R1.1 NNc1ccc(F)nc1 Amb20621273 [0,2,0,0,0,0|2,0,0]=4 2908 B9R1.1 NNc1ccc(F)nc1 Amb28989561 [0,2,0,0,0,0|2,0,0]=4 2909 B9R1.1 NNc1ccc(F)nc1 Amb35789362 [0,2,0,0,0,0|2,0,0]=4 2910 B9R1.1 NNc1ccc(I)cc1 Amb1043738 [0,2,0,0,0,0|1,0,0]=3 2911 B9R1.1 NNc1ccc(I)cc1 Amb2236558 [0,2,0,0,0,0|1,0,0]=3 2912 B9R1.1 NNc1ccc(I)cn1 Amb23399618 [0,2,0,0,0,0|2,0,0]=4 2913 B9R1.1 NNc1ccc(N)cc1 Amb18642124 [0,2,0,0,0,0|1,0,0]=3 2914 B9R1.1 NNc1ccc(O)cc1 Amb22899155 [0,2,0,0,0,0|0,0,0]=2 2915 B9R1.1 NNc1ccc(O)cc1 Amb6248006 [0,2,0,0,0,0|0,0,0]=2 2916 B9R1.1 NNc1ccc(O)cn1 Amb18832837 [0,2,0,0,0,0|1,0,0]=3 2917 B9R1.1 NNc1ccc(S)cc1 Amb27670232 [0,2,0,0,0,0|0,1,0]=3 2918 B9R1.1 NOc1cc[n+]([O-])cc1 Amb8386474 [0,2,0,0,0,0|1,0,0]=3 2919 B9R1.1 NOc1ccc(Br)cc1 Amb18649721 [0,2,0,0,0,0|0,0,0]=2 2920 B9R1.1 NOc1ccc(Br)cc1 Amb32683285 [0,2,0,0,0,0|0,0,0]=2 2921 B9R1.1 NOc1ccc(Cl)cc1 Amb18644043 [0,2,0,0,0,0|0,0,0]=2 2922 B9R1.1 NOc1ccc(Cl)cc1 Amb32667495 [0,2,0,0,0,0|0,0,0]=2 2923 B9R1.1 NOc1ccc(Cl)cn1 Amb24101174 [0,2,0,0,0,0|1,0,0]=3 2924 B9R1.1 NOc1ccc(F)cc1 Amb18642489 [0,2,0,0,0,0|0,0,0]=2 2925 B9R1.1 NOc1ccc(F)cc1 Amb32662914 [0,2,0,0,0,0|0,0,0]=2 2926 B9R1.1 N[n+]1ccc(C[O-])cc1 Amb27601372 [0,2,0,0,0,0|1,0,1]=4 2927 B9R1.1 Nc1ccc(C=O)cc1 Amb17842945 [0,2,0,0,0,0|0,0,1]=3 2928 B9R1.1 Nc1ccc(C=O)cn1 Amb20247831 [0,2,0,0,0,0|1,0,1]=4 2929 B9R1.1 Nc1ccc(C=O)cn1 Amb22436785 [0,2,0,0,0,0|1,0,1]=4 2930 B9R1.1 Nc1ccc(CBr)cc1 Amb18649220 [0,2,0,0,0,0|1,0,0]=3 2931 B9R1.1 Nc1ccc(CBr)cn1 Amb33329365 [0,2,0,0,0,0|2,0,0]=4 2932 B9R1.1 Nc1ccc(CCl)cc1 Amb17477836 [0,2,0,0,0,0|1,0,0]=3 2933 B9R1.1 Nc1ccc(CCl)cn1 Amb20247806 [0,2,0,0,0,0|2,0,0]=4 2934 B9R1.1 Nc1ccc(CCl)cn1 Amb33483593 [0,2,0,0,0,0|2,0,0]=4 2935 B9R1.1 Nc1ccc(CCl)nc1 Amb20242740 [0,2,0,0,0,0|2,0,0]=4 2936 B9R1.1 Nc1ccc(CI)cn1 Amb27859236 [0,2,0,0,0,0|2,0,0]=4 2937 B9R1.1 Nc1ccc(CO)cc1 Amb4605845 [0,2,0,0,0,0|0,0,0]=2 2938 B9R1.1 Nc1ccc(CO)cn1 Amb2699139 [0,2,0,0,0,0|1,0,0]=3 2939 B9R1.1 Nc1ccc(CO)nc1 Amb8386685 [0,2,0,0,0,0|1,0,0]=3 2940 B9R1.1 Nc1ccc(CO)nn1 Amb27440764 [0,2,0,0,0,0|2,0,0]=4 2941 B9R1.1 Nc1ccc(CO)nn1 Amb30585184 [0,2,0,0,0,0|2,0,0]=4 2942 B9R1.1 Nc1ccc(CS)cc1 Amb17498635 [0,2,0,0,0,0|0,1,0]=3 2943 B9R1.1 Nc1ccc(N=O)cc1 Amb17593244 [0,2,0,0,0,0|0,0,1]=3 2944 B9R1.1 Nc1ccc(NCl)cc1 Amb28314102 [0,2,0,0,0,0|1,0,0]=3 2945 B9R1.1 Nc1ccc(NO)cc1 Amb27413828 [0,2,0,0,0,0|0,0,0]=2 2946 B9R1.1 Nc1ccc(SO)cc1 Amb27644780 [0,2,0,0,0,0|0,0,0]=2 2947 B9R1.1 Nc1ccc([As]=O)cc1 Amb17608246 [0,2,0,0,0,0|0,0,1]=3 2948 B9R1.1 Nc1cnc(CO)cn1 Amb20668964 [0,2,0,0,0,0|2,0,0]=4 2949 B9R1.1 Nc1cnc(CO)nc1 Amb23412490 [0,2,0,0,0,0|2,0,0]=4 2950 B9R1.1 Nc1ncc(CO)cn1 Amb8630061 [0,2,0,0,0,0|2,0,0]=4 2951 B9R1.1 O=C1C=CC(=NCl)C=C1 Amb22732649 [0,2,0,0,0,0|0,0,1]=3 2952 B9R1.1 O=C1C=CC(=NO)C=C1 Amb17608819 [0,2,0,0,0,0|0,0,0]=2 2953 B9R1.1 O=C1C=CC(CO)=CN1 Amb20243253 [0,2,0,0,0,0|1,0,0]=3 2954 B9R1.1 O=C1C=CC(CO)=CO1 Amb25835811 [0,2,0,0,0,0|1,0,0]=3 2955 B9R1.1 O=C1C=CC(CO)=NN1 Amb18848567 [0,2,0,0,0,0|2,0,0]=4 2956 B9R1.1 O=CC1=CNC(=O)C=C1 Amb18642085 [0,2,0,0,0,0|1,0,1]=4 2957 B9R1.1 O=CC1C=CC(=O)C=C1 Amb28126595 [0,2,0,0,0,0|0,0,2]=4 2958 B9R1.1 O=CN1C=CC(=O)C=C1 Amb28198319 [0,2,0,0,0,0|1,0,1]=4 2959 B9R1.1 O=Cc1cc[n+]([O-])cc1 Amb22338213 [0,2,0,0,0,0|1,0,1]=4 2960 B9R1.1 O=Cc1ccc(Br)cc1 Amb1880872 [0,2,0,0,0,0|0,0,1]=3 2961 B9R1.1 O=Cc1ccc(Br)cn1 Amb2447415 [0,2,0,0,0,0|1,0,1]=4 2962 B9R1.1 O=Cc1ccc(Br)nc1 Amb2447414 [0,2,0,0,0,0|1,0,1]=4 2963 B9R1.1 O=Cc1ccc(Cl)cc1 Amb1881691 [0,2,0,0,0,0|0,0,1]=3 2964 B9R1.1 O=Cc1ccc(Cl)cn1 Amb10975428 [0,2,0,0,0,0|1,0,1]=4 2965 B9R1.1 O=Cc1ccc(Cl)nc1 Amb3428033 [0,2,0,0,0,0|1,0,1]=4 2966 B9R1.1 O=Cc1ccc(F)cc1 Amb535148 [0,2,0,0,0,0|0,0,1]=3 2967 B9R1.1 O=Cc1ccc(F)cn1 Amb2447570 [0,2,0,0,0,0|1,0,1]=4 2968 B9R1.1 O=Cc1ccc(F)nc1 Amb2447589 [0,2,0,0,0,0|1,0,1]=4 2969 B9R1.1 O=Cc1ccc(I)cc1 Amb3599093 [0,2,0,0,0,0|0,0,1]=3 2970 B9R1.1 O=Cc1ccc(I)cn1 Amb4561047 [0,2,0,0,0,0|1,0,1]=4 2971 B9R1.1 O=Cc1ccc(O)cc1 Amb1873769 [0,2,0,0,0,0|0,0,0]=2 2972 B9R1.1 O=Cc1ccc(O)cn1 Amb4561049 [0,2,0,0,0,0|1,0,0]=3 2973 B9R1.1 O=Cc1ccc(O)nc1 Amb6384363 [0,2,0,0,0,0|1,0,0]=3 2974 B9R1.1 O=Cc1ccc(S)cc1 Amb18643289 [0,2,0,0,0,0|0,0,1]=3 2975 B9R1.1 O=Cc1ncc(O)cn1 Amb27393439 [0,2,0,0,0,0|2,0,0]=4 2976 B9R1.1 O=Nc1ccc(Br)cc1 Amb17779258 [0,2,0,0,0,0|0,0,1]=3 2977 B9R1.1 O=Nc1ccc(O)cc1 Amb10071749 [0,2,0,0,0,0|0,0,0]=2 2978 B9R1.1 O=[IH2]c1ccc(Cl)nc1 Amb27667225 [0,2,0,0,0,0|1,0,1]=4 2979 B9R1.1 OCC1C=C=C(O)C=C1 Amb27206728 [0,2,0,0,0,0|0,0,2]=4 2980 B9R1.1 OCc1ccc(Br)cc1 Amb3939087 [0,2,0,0,0,0|0,0,0]=2 2981 B9R1.1 OCc1ccc(Br)cn1 Amb20241980 [0,2,0,0,0,0|1,0,0]=3 2982 B9R1.1 OCc1ccc(Br)cn1 Amb2725040 [0,2,0,0,0,0|1,0,0]=3 2983 B9R1.1 OCc1ccc(Br)nc1 Amb8396845 [0,2,0,0,0,0|1,0,0]=3 2984 B9R1.1 OCc1ccc(Cl)cc1 Amb837320 [0,2,0,0,0,0|0,0,0]=2 2985 B9R1.1 OCc1ccc(Cl)cn1 Amb10975423 [0,2,0,0,0,0|1,0,0]=3 2986 B9R1.1 OCc1ccc(Cl)nc1 Amb3428032 [0,2,0,0,0,0|1,0,0]=3 2987 B9R1.1 OCc1ccc(Cl)nn1 Amb21857536 [0,2,0,0,0,0|2,0,0]=4 2988 B9R1.1 OCc1ccc(Cl)nn1 Amb32990138 [0,2,0,0,0,0|2,0,0]=4 2989 B9R1.1 OCc1ccc(F)cc1 Amb837490 [0,2,0,0,0,0|0,0,0]=2 2990 B9R1.1 OCc1ccc(F)cn1 Amb6308297 [0,2,0,0,0,0|1,0,0]=3 2991 B9R1.1 OCc1ccc(F)nc1 Amb8394588 [0,2,0,0,0,0|1,0,0]=3 2992 B9R1.1 OCc1ccc(I)cc1 Amb837382 [0,2,0,0,0,0|0,0,0]=2 2993 B9R1.1 OCc1ccc(I)cn1 Amb23441249 [0,2,0,0,0,0|1,0,0]=3 2994 B9R1.1 OCc1ccc(I)nc1 Amb23446974 [0,2,0,0,0,0|1,0,0]=3 2995 B9R1.1 OCc1ccc(O)cc1 Amb6365572 [0,2,0,0,0,0|0,0,0]=2 2996 B9R1.1 OCc1ccc(O)cn1 Amb18642263 [0,2,0,0,0,0|1,0,0]=3 2997 B9R1.1 OCc1ccc(O)nc1 Amb8397234 [0,2,0,0,0,0|1,0,0]=3 2998 B9R1.1 OCc1ccc(S)cc1 Amb16192940 [0,2,0,0,0,0|0,0,0]=2 2999 B9R1.1 OCc1cnc(Br)cn1 Amb18190294 [0,2,0,0,0,0|2,0,0]=4 3000 B9R1.1 OCc1cnc(Br)nc1 Amb24678339 [0,2,0,0,0,0|2,0,0]=4 3001 B9R1.1 OCc1cnc(Cl)cn1 Amb10067216 [0,2,0,0,0,0|2,0,0]=4 3002 B9R1.1 OCc1cnc(Cl)nc1 Amb21963487 [0,2,0,0,0,0|2,0,0]=4 3003 B9R1.1 OCc1ncc(Br)cn1 Amb21963588 [0,2,0,0,0,0|2,0,0]=4 3004 B9R1.1 OCc1ncc(Cl)cn1 Amb22388585 [0,2,0,0,0,0|2,0,0]=4 3005 B9R1.1 OCc1ncc(F)cn1 Amb22898963 [0,2,0,0,0,0|2,0,0]=4 3006 B9R1.1 ONc1ccc(Cl)cn1 Amb28206696 [0,2,0,0,0,0|1,0,0]=3 3007 B9R1.1 ONc1ccc(F)cc1 Amb27221702 [0,2,0,0,0,0|0,0,0]=2 3008 B9R1.1 ONc1cnc(Cl)cn1 Amb28343557 [0,2,0,0,0,0|2,0,0]=4 3009 B9R1.1 ONc1ncc(Br)cn1 Amb27975729 [0,2,0,0,0,0|2,0,0]=4 3010 B9R1.1 ONc1ncc(Cl)cn1 Amb28040840 [0,2,0,0,0,0|2,0,0]=4 3011 B9R1.1 ONc1ncc(I)cn1 Amb28453513 [0,2,0,0,0,0|2,0,0]=4 3012 B9R1.1 Oc1ccc(CBr)cn1 Amb24400551 [0,2,0,0,0,0|1,0,0]=3 3013 B9R1.1 Oc1ccc(CBr)nc1 Amb22751419 [0,2,0,0,0,0|1,0,0]=3 3014 B9R1.1 Oc1ccc(CCl)nc1 Amb25295363 [0,2,0,0,0,0|1,0,0]=3 3015 B9R1.1 Oc1ccc(CCl)nn1 Amb33484391 [0,2,0,0,0,0|2,0,0]=4 3016 B9R1.1 Oc1ccc(CI)cc1 Amb24400412 [0,2,0,0,0,0|0,0,0]=2 3017 B9R1.1 Oc1ccc(CS)cc1 Amb25782030 [0,2,0,0,0,0|0,0,0]=2 3018 B9R1.1 Oc1ccc(CS)nc1 Amb32788230 [0,2,0,0,0,0|1,0,0]=3 3019 B9R1.1 Oc1ncc(CCl)cn1 Amb25918826 [0,2,0,0,0,0|2,0,0]=4 3020 B9R1.1 SCc1ccc(Br)cc1 Amb2691868 [0,2,0,0,0,0|0,1,0]=3 3021 B9R1.1 SCc1ccc(Br)cn1 Amb27452173 [0,2,0,0,0,0|1,1,0]=4 3022 B9R1.1 SCc1ccc(Br)nc1 Amb33389186 [0,2,0,0,0,0|1,1,0]=4 3023 B9R1.1 SCc1ccc(Cl)cc1 Amb6608715 [0,2,0,0,0,0|0,1,0]=3 3024 B9R1.1 SCc1ccc(Cl)cn1 Amb32788148 [0,2,0,0,0,0|1,1,0]=4 3025 B9R1.1 SCc1ccc(Cl)nc1 Amb21984719 [0,2,0,0,0,0|1,1,0]=4 3026 B9R1.1 SCc1ccc(I)cc1 Amb26867779 [0,2,0,0,0,0|0,1,0]=3 3027 B9R1.1 [15N]#[13C]c1ccc(Br)cn1 Amb13884630 [0,2,0,0,0,0|2,0,0]=4 3028 B9R1.1 [C-]#[N+]c1ccc(Br)cc1 Amb1981039 [0,2,0,0,0,0|1,0,0]=3 3029 B9R1.1 [C-]#[N+]c1ccc(Br)cn1 Amb2610800 [0,2,0,0,0,0|2,0,0]=4 3030 B9R1.1 [C-]#[N+]c1ccc(Br)nc1 Amb24627219 [0,2,0,0,0,0|2,0,0]=4 3031 B9R1.1 [C-]#[N+]c1ccc(C)cc1 Amb2689614 [0,2,0,0,0,0|1,0,0]=3 3032 B9R1.1 [C-]#[N+]c1ccc(C)cn1 Amb27240264 [0,2,0,0,0,0|2,0,0]=4 3033 B9R1.1 [C-]#[N+]c1ccc(C)nc1 Amb24519077 [0,2,0,0,0,0|2,0,0]=4 3034 B9R1.1 [C-]#[N+]c1ccc(Cl)cc1 Amb1981076 [0,2,0,0,0,0|1,0,0]=3 3035 B9R1.1 [C-]#[N+]c1ccc(Cl)cn1 Amb2610805 [0,2,0,0,0,0|2,0,0]=4 3036 B9R1.1 [C-]#[N+]c1ccc(Cl)nc1 Amb24519078 [0,2,0,0,0,0|2,0,0]=4 3037 B9R1.1 [C-]#[N+]c1ccc(F)cc1 Amb1107336 [0,2,0,0,0,0|1,0,0]=3 3038 B9R1.1 [C-]#[N+]c1ccc(F)cn1 Amb27433628 [0,2,0,0,0,0|2,0,0]=4 3039 B9R1.1 [C-]#[N+]c1ccc(F)nc1 Amb33067957 [0,2,0,0,0,0|2,0,0]=4 3040 B9R1.1 [C-]#[N+]c1ccc(I)cc1 Amb26929141 [0,2,0,0,0,0|1,0,0]=3 3041 B9R1.1 [C-]#[N+]c1ccc(I)cn1 Amb33745955 [0,2,0,0,0,0|2,0,0]=4 3042 B9R1.1 [NH3+]Cc1ccc(Br)cc1 Amb24113883 [0,2,0,0,0,0|1,0,0]=3 3043 B9R1.1 [NH3+]Cc1ccc(I)cc1 Amb9826939 [0,2,0,0,0,0|1,0,0]=3 3044 B9R1.1 [NH3+]Cc1ccc(O)cc1 Amb17943004 [0,2,0,0,0,0|0,0,0]=2 3045 B9R1.1 [NH3+]Nc1ccc(Br)cc1 Amb24113867 [0,2,0,0,0,0|1,0,0]=3 3046 B9R1.1 [NH3+]Nc1ccc(Cl)cc1 Amb24113813 [0,2,0,0,0,0|1,0,0]=3 3047 B9R1.1 [O-][NH2+]c1ccc(O)nc1 Amb27447593 [0,2,0,0,0,0|1,0,0]=3 3048 B9R1.1 [O-][n+]1ccc(CCl)cc1 Amb27247876 [0,2,0,0,0,0|1,0,1]=4 3049 B9R1.1 [O-][n+]1ccc(CO)cc1 Amb8513302 [0,2,0,0,0,0|1,0,0]=3 3050 B9R1.1 [Zn+]Cc1ccc(I)cc1 Amb22367204 [0,2,0,0,0,0|1,0,0]=3 3051 B9R1.2 BrCc1cccc(Br)c1 Amb2684959 [0,2,0,0,0,0|1,0,0]=3 3052 B9R1.2 BrCc1cccc(Br)n1 Amb23437267 [0,2,0,0,0,0|2,0,0]=4 3053 B9R1.2 BrCc1cccc(Br)n1 Amb8386705 [0,2,0,0,0,0|2,0,0]=4 3054 B9R1.2 BrCc1cccc(I)c1 Amb2688843 [0,2,0,0,0,0|1,0,0]=3 3055 B9R1.2 BrCc1ccnc(Br)c1 Amb20618622 [0,2,0,0,0,0|2,0,0]=4 3056 B9R1.2 BrCc1ccnc(Br)c1 Amb22233776 [0,2,0,0,0,0|2,0,0]=4 3057 B9R1.2 BrCc1ccnc(Br)c1 Amb22497616 [0,2,0,0,0,0|2,0,0]=4 3058 B9R1.2 BrCc1cncc(Br)c1 Amb32718790 [0,2,0,0,0,0|2,0,0]=4 3059 B9R1.2 Brc1cc(CI)ccn1 Amb27193894 [0,2,0,0,0,0|2,0,0]=4 3060 B9R1.2 Brc1cccc(CI)n1 Amb20248558 [0,2,0,0,0,0|2,0,0]=4 3061 B9R1.2 Brc1cccc([Zn]I)c1 Amb22000438 [0,2,0,0,0,0|1,0,0]=3 3062 B9R1.2 C#CC1=CC=CC(=O)N1 Amb22499428 [0,2,0,0,0,0|1,0,1]=4 3063 B9R1.2 C#Cc1cc(Br)ccn1 Amb22235369 [0,2,0,0,0,0|2,0,0]=4 3064 B9R1.2 C#Cc1cc(C)ccn1 Amb15701306 [0,2,0,0,0,0|2,0,0]=4 3065 B9R1.2 C#Cc1cc(Cl)ccn1 Amb20248253 [0,2,0,0,0,0|2,0,0]=4 3066 B9R1.2 C#Cc1cc(F)ccn1 Amb33171956 [0,2,0,0,0,0|2,0,0]=4 3067 B9R1.2 C#Cc1cc(N)ccn1 Amb21964146 [0,2,0,0,0,0|2,0,0]=4 3068 B9R1.2 C#Cc1cc(N)ccn1 Amb22886502 [0,2,0,0,0,0|2,0,0]=4 3069 B9R1.2 C#Cc1cc(O)ccn1 Amb25707704 [0,2,0,0,0,0|1,0,0]=3 3070 B9R1.2 C#Cc1cccc(Br)c1 Amb6296492 [0,2,0,0,0,0|1,0,0]=3 3071 B9R1.2 C#Cc1cccc(Br)n1 Amb19516426 [0,2,0,0,0,0|2,0,0]=4 3072 B9R1.2 C#Cc1cccc(C)c1 Amb8394568 [0,2,0,0,0,0|1,0,0]=3 3073 B9R1.2 C#Cc1cccc(C)n1 Amb19516788 [0,2,0,0,0,0|2,0,0]=4 3074 B9R1.2 C#Cc1cccc(Cl)c1 Amb6296493 [0,2,0,0,0,0|1,0,0]=3 3075 B9R1.2 C#Cc1cccc(Cl)n1 Amb19895148 [0,2,0,0,0,0|2,0,0]=4 3076 B9R1.2 C#Cc1cccc(F)c1 Amb2688307 [0,2,0,0,0,0|1,0,0]=3 3077 B9R1.2 C#Cc1cccc(F)n1 Amb21857323 [0,2,0,0,0,0|2,0,0]=4 3078 B9R1.2 C#Cc1cccc(I)c1 Amb4477218 [0,2,0,0,0,0|1,0,0]=3 3079 B9R1.2 C#Cc1cccc(N)c1 Amb20248172 [0,2,0,0,0,0|1,0,0]=3 3080 B9R1.2 C#Cc1cccc(N)c1 Amb2371807 [0,2,0,0,0,0|1,0,0]=3 3081 B9R1.2 C#Cc1cccc(N)n1 Amb23401311 [0,2,0,0,0,0|2,0,0]=4 3082 B9R1.2 C#Cc1cccc(O)c1 Amb2720491 [0,2,0,0,0,0|0,0,0]=2 3083 B9R1.2 C#Cc1cccc(S)c1 Amb32875590 [0,2,0,0,0,0|0,1,0]=3 3084 B9R1.2 C#Cc1ccnc(C)c1 Amb19895147 [0,2,0,0,0,0|2,0,0]=4 3085 B9R1.2 C#Cc1ccnc(Cl)c1 Amb19957761 [0,2,0,0,0,0|2,0,0]=4 3086 B9R1.2 C#Cc1ccnc(F)c1 Amb24077537 [0,2,0,0,0,0|2,0,0]=4 3087 B9R1.2 C#Cc1ccnc(N)c1 Amb23401306 [0,2,0,0,0,0|2,0,0]=4 3088 B9R1.2 C#Cc1cncc(Br)c1 Amb19895143 [0,2,0,0,0,0|2,0,0]=4 3089 B9R1.2 C#Cc1cncc(C)c1 Amb19895142 [0,2,0,0,0,0|2,0,0]=4 3090 B9R1.2 C#Cc1cncc(Cl)c1 Amb8395981 [0,2,0,0,0,0|2,0,0]=4 3091 B9R1.2 C#Cc1cncc(F)c1 Amb19894453 [0,2,0,0,0,0|2,0,0]=4 3092 B9R1.2 C#Cc1cncc(N)c1 Amb23400169 [0,2,0,0,0,0|2,0,0]=4 3093 B9R1.2 C=CC1=CC=CC(=O)N1 Amb24740217 [0,2,0,0,0,0|1,0,1]=4 3094 B9R1.2 C=Cc1cc(Br)ccn1 Amb8384238 [0,2,0,0,0,0|2,0,0]=4 3095 B9R1.2 C=Cc1cc(Cl)ccn1 Amb20248254 [0,2,0,0,0,0|2,0,0]=4 3096 B9R1.2 C=Cc1cc(F)ccn1 Amb33449852 [0,2,0,0,0,0|2,0,0]=4 3097 B9R1.2 C=Cc1cc(O)ccn1 Amb26981946 [0,2,0,0,0,0|1,0,0]=3 3098 B9R1.2 C=Cc1ccc[n+](C)c1 Amb10553005 [0,2,0,0,0,0|2,0,0]=4 3099 B9R1.2 C=Cc1ccc[n+]([O-])c1 Amb25077954 [0,2,0,0,0,0|1,0,1]=4 3100 B9R1.2 C=Cc1cccc(Br)c1 Amb2685487 [0,2,0,0,0,0|1,0,0]=3 3101 B9R1.2 C=Cc1cccc(Br)n1 Amb21857281 [0,2,0,0,0,0|2,0,0]=4 3102 B9R1.2 C=Cc1cccc(C)c1 Amb3940473 [0,2,0,0,0,0|1,0,0]=3 3103 B9R1.2 C=Cc1cccc(C)n1 Amb2695276 [0,2,0,0,0,0|2,0,0]=4 3104 B9R1.2 C=Cc1cccc(Cl)c1 Amb3941483 [0,2,0,0,0,0|1,0,0]=3 3105 B9R1.2 C=Cc1cccc(Cl)n1 Amb22276062 [0,2,0,0,0,0|2,0,0]=4 3106 B9R1.2 C=Cc1cccc(F)c1 Amb3940225 [0,2,0,0,0,0|1,0,0]=3 3107 B9R1.2 C=Cc1cccc(I)c1 Amb22295906 [0,2,0,0,0,0|1,0,0]=3 3108 B9R1.2 C=Cc1cccc(N)c1 Amb21857034 [0,2,0,0,0,0|1,0,0]=3 3109 B9R1.2 C=Cc1cccc(N)n1 Amb25727477 [0,2,0,0,0,0|2,0,0]=4 3110 B9R1.2 C=Cc1cccc(O)c1 Amb17593228 [0,2,0,0,0,0|0,0,0]=2 3111 B9R1.2 C=Cc1ccnc(Br)c1 Amb21857300 [0,2,0,0,0,0|2,0,0]=4 3112 B9R1.2 C=Cc1ccnc(C)c1 Amb24340158 [0,2,0,0,0,0|2,0,0]=4 3113 B9R1.2 C=Cc1ccnc(Cl)c1 Amb25085912 [0,2,0,0,0,0|2,0,0]=4 3114 B9R1.2 C=Cc1cncc(Br)c1 Amb21964484 [0,2,0,0,0,0|2,0,0]=4 3115 B9R1.2 C=Cc1cncc(C)c1 Amb2695473 [0,2,0,0,0,0|2,0,0]=4 3116 B9R1.2 C=Cc1cncc(Cl)c1 Amb26936177 [0,2,0,0,0,0|2,0,0]=4 3117 B9R1.2 C=Cc1cncc(F)c1 Amb27201346 [0,2,0,0,0,0|2,0,0]=4 3118 B9R1.2 C=Cc1cncc(N)c1 Amb25713325 [0,2,0,0,0,0|2,0,0]=4 3119 B9R1.2 C=Cc1cncc(O)c1 Amb26899030 [0,2,0,0,0,0|1,0,0]=3 3120 B9R1.2 C=Cc1cncc(S)c1 Amb27812077 [0,2,0,0,0,0|1,1,0]=4 3121 B9R1.2 C=Nc1cccc(C)c1 Amb24481887 [0,2,0,0,0,0|1,0,0]=3 3122 B9R1.2 CC1=CC=C\C(=N/N)N1 Amb21963540 [0,2,0,0,0,0|2,0,0]=4 3123 B9R1.2 CCC1=CC=CC(=S)N1 Amb35707039 [0,2,0,0,0,0|1,1,0]=4 3124 B9R1.2 CC[n+]1cccc(C)c1 Amb22411565 [0,2,0,0,0,0|2,0,0]=4 3125 B9R1.2 CC[n+]1cccc(N)c1 Amb28068833 [0,2,0,0,0,0|2,0,0]=4 3126 B9R1.2 CC[n+]1cccc(O)c1 Amb27437117 [0,2,0,0,0,0|1,0,0]=3 3127 B9R1.2 CC[n+]1cccc(O)c1 Amb28555590 [0,2,0,0,0,0|1,0,0]=3 3128 B9R1.2 CC[n+]1cccc(O)c1 Amb9793321 [0,2,0,0,0,0|1,0,0]=3 3129 B9R1.2 CCc1cc(Br)ccn1 Amb10599855 [0,2,0,0,0,0|2,0,0]=4 3130 B9R1.2 CCc1cc(Cl)ccn1 Amb10599875 [0,2,0,0,0,0|2,0,0]=4 3131 B9R1.2 CCc1cc(I)ccn1 Amb25876593 [0,2,0,0,0,0|2,0,0]=4 3132 B9R1.2 CCc1cc(N)ccn1 Amb10599877 [0,2,0,0,0,0|2,0,0]=4 3133 B9R1.2 CCc1cc(O)ccn1 Amb10599878 [0,2,0,0,0,0|1,0,0]=3 3134 B9R1.2 CCc1cc(O)ncn1 Amb9174444 [0,2,0,0,0,0|2,0,0]=4 3135 B9R1.2 CCc1cc(S)ccn1 Amb24334345 [0,2,0,0,0,0|1,1,0]=4 3136 B9R1.2 CCc1ccc[n+]([O-])c1 Amb21963682 [0,2,0,0,0,0|1,0,1]=4 3137 B9R1.2 CCc1cccc(Br)c1 Amb2691840 [0,2,0,0,0,0|1,0,0]=3 3138 B9R1.2 CCc1cccc(Br)n1 Amb10599852 [0,2,0,0,0,0|2,0,0]=4 3139 B9R1.2 CCc1cccc(C)c1 Amb9787670 [0,2,0,0,0,0|1,0,0]=3 3140 B9R1.2 CCc1cccc(C)n1 Amb2722908 [0,2,0,0,0,0|2,0,0]=4 3141 B9R1.2 CCc1cccc(Cl)c1 Amb20620699 [0,2,0,0,0,0|1,0,0]=3 3142 B9R1.2 CCc1cccc(F)c1 Amb22235099 [0,2,0,0,0,0|1,0,0]=3 3143 B9R1.2 CCc1cccc(F)n1 Amb24319184 [0,2,0,0,0,0|2,0,0]=4 3144 B9R1.2 CCc1cccc(N)c1 Amb3939774 [0,2,0,0,0,0|1,0,0]=3 3145 B9R1.2 CCc1cccc(N)n1 Amb3428616 [0,2,0,0,0,0|2,0,0]=4 3146 B9R1.2 CCc1cccc(O)c1 Amb3938975 [0,2,0,0,0,0|0,0,0]=2 3147 B9R1.2 CCc1cccc(O)n1 Amb10599854 [0,2,0,0,0,0|1,0,0]=3 3148 B9R1.2 CCc1cccc(S)c1 Amb26627381 [0,2,0,0,0,0|0,1,0]=3 3149 B9R1.2 CCc1ccnc(Br)c1 Amb8394836 [0,2,0,0,0,0|2,0,0]=4 3150 B9R1.2 CCc1ccnc(Cl)c1 Amb17610909 [0,2,0,0,0,0|2,0,0]=4 3151 B9R1.2 CCc1ccnc(N)c1 Amb3428615 [0,2,0,0,0,0|2,0,0]=4 3152 B9R1.2 CCc1ccnc(O)c1 Amb10600168 [0,2,0,0,0,0|1,0,0]=3 3153 B9R1.2 CCc1ccnc(O)n1 Amb13884390 [0,2,0,0,0,0|2,0,0]=4 3154 B9R1.2 CCc1cncc(Br)c1 Amb16230979 [0,2,0,0,0,0|2,0,0]=4 3155 B9R1.2 CCc1cncc(Cl)c1 Amb24644636 [0,2,0,0,0,0|2,0,0]=4 3156 B9R1.2 CCc1cncc(N)c1 Amb18832981 [0,2,0,0,0,0|2,0,0]=4 3157 B9R1.2 CCc1cncc(O)c1 Amb20617462 [0,2,0,0,0,0|1,0,0]=3 3158 B9R1.2 CCc1cncc(O)n1 Amb10600312 [0,2,0,0,0,0|2,0,0]=4 3159 B9R1.2 CCc1cncc(S)c1 Amb33276294 [0,2,0,0,0,0|1,1,0]=4 3160 B9R1.2 CCc1nccc(O)n1 Amb10599362 [0,2,0,0,0,0|2,0,0]=4 3161 B9R1.2 CNc1cc(Br)ccn1 Amb22495466 [0,2,0,0,0,0|2,0,0]=4 3162 B9R1.2 CNc1cc(C)ccn1 Amb10552832 [0,2,0,0,0,0|2,0,0]=4 3163 B9R1.2 CNc1cc(C)ccn1 Amb19148737 [0,2,0,0,0,0|2,0,0]=4 3164 B9R1.2 CNc1cc(Cl)ccn1 Amb3319264 [0,2,0,0,0,0|2,0,0]=4 3165 B9R1.2 CNc1cc(I)ccn1 Amb28185855 [0,2,0,0,0,0|2,0,0]=4 3166 B9R1.2 CNc1cc(N)ccn1 Amb17334077 [0,2,0,0,0,0|2,0,0]=4 3167 B9R1.2 CNc1cc(N)ccn1 Amb22233583 [0,2,0,0,0,0|2,0,0]=4 3168 B9R1.2 CNc1cc(O)ncn1 Amb22000953 [0,2,0,0,0,0|2,0,0]=4 3169 B9R1.2 CNc1ccc[n+]([O-])c1 Amb20620294 [0,2,0,0,0,0|1,0,1]=4 3170 B9R1.2 CNc1cccc(Br)c1 Amb19959447 [0,2,0,0,0,0|1,0,0]=3 3171 B9R1.2 CNc1cccc(Br)c1 Amb6712226 [0,2,0,0,0,0|1,0,0]=3 3172 B9R1.2 CNc1cccc(Br)c1 Amb8631460 [0,2,0,0,0,0|1,0,0]=3 3173 B9R1.2 CNc1cccc(Br)n1 Amb10766325 [0,2,0,0,0,0|2,0,0]=4 3174 B9R1.2 CNc1cccc(C)c1 Amb2099497 [0,2,0,0,0,0|1,0,0]=3 3175 B9R1.2 CNc1cccc(C)c1 Amb6374332 [0,2,0,0,0,0|1,0,0]=3 3176 B9R1.2 CNc1cccc(C)n1 Amb18944230 [0,2,0,0,0,0|2,0,0]=4 3177 B9R1.2 CNc1cccc(Cl)c1 Amb21961616 [0,2,0,0,0,0|1,0,0]=3 3178 B9R1.2 CNc1cccc(Cl)c1 Amb2686181 [0,2,0,0,0,0|1,0,0]=3 3179 B9R1.2 CNc1cccc(Cl)n1 Amb8438926 [0,2,0,0,0,0|2,0,0]=4 3180 B9R1.2 CNc1cccc(F)c1 Amb22274072 [0,2,0,0,0,0|1,0,0]=3 3181 B9R1.2 CNc1cccc(F)c1 Amb2688175 [0,2,0,0,0,0|1,0,0]=3 3182 B9R1.2 CNc1cccc(F)n1 Amb18944651 [0,2,0,0,0,0|2,0,0]=4 3183 B9R1.2 CNc1cccc(I)c1 Amb7760184 [0,2,0,0,0,0|1,0,0]=3 3184 B9R1.2 CNc1cccc(N)c1 Amb8825437 [0,2,0,0,0,0|1,0,0]=3 3185 B9R1.2 CNc1cccc(O)c1 Amb18281003 [0,2,0,0,0,0|0,0,0]=2 3186 B9R1.2 CNc1cccc(O)n1 Amb18642182 [0,2,0,0,0,0|1,0,0]=3 3187 B9R1.2 CNc1ccnc(Br)c1 Amb22728617 [0,2,0,0,0,0|2,0,0]=4 3188 B9R1.2 CNc1ccnc(Br)c1 Amb33484319 [0,2,0,0,0,0|2,0,0]=4 3189 B9R1.2 CNc1ccnc(C)c1 Amb22728115 [0,2,0,0,0,0|2,0,0]=4 3190 B9R1.2 CNc1ccnc(Cl)c1 Amb22396042 [0,2,0,0,0,0|2,0,0]=4 3191 B9R1.2 CNc1ccnc(F)c1 Amb27234414 [0,2,0,0,0,0|2,0,0]=4 3192 B9R1.2 CNc1ccnc(O)n1 Amb21959234 [0,2,0,0,0,0|2,0,0]=4 3193 B9R1.2 CNc1cncc(Br)c1 Amb22276733 [0,2,0,0,0,0|2,0,0]=4 3194 B9R1.2 CNc1cncc(F)c1 Amb22751228 [0,2,0,0,0,0|2,0,0]=4 3195 B9R1.2 CNc1cncc(O)n1 Amb27838462 [0,2,0,0,0,0|2,0,0]=4 3196 B9R1.2 CNc1cnnc(O)c1 Amb20623665 [0,2,0,0,0,0|2,0,0]=4 3197 B9R1.2 COC1=CC(=O)C=CO1 Amb28245112 [0,2,0,0,0,0|1,0,0]=3 3198 B9R1.2 COC1=CC(=O)NC=C1 Amb19958213 [0,2,0,0,0,0|1,0,0]=3 3199 B9R1.2 COC1=CC(=O)NN=C1 Amb19958120 [0,2,0,0,0,0|2,0,0]=4 3200 B9R1.2 COC1=CCC=C(C)C1 Amb24080593 [0,2,0,0,0,0|0,0,2]=4 3201 B9R1.2 COC1=CN=CC(=O)N1 Amb22498307 [0,2,0,0,0,0|2,0,0]=4 3202 B9R1.2 COC1=CN=CC(=S)N1 Amb27633697 [0,2,0,0,0,0|2,0,0]=4 3203 B9R1.2 COC1=NC(=O)C=CN1 Amb19958053 [0,2,0,0,0,0|2,0,0]=4 3204 B9R1.2 COC1=NC(=O)NC=C1 Amb24077352 [0,2,0,0,0,0|2,0,0]=4 3205 B9R1.2 COC1C=CC=C(Br)N1 Amb28041337 [0,2,0,0,0,0|1,0,1]=4 3206 B9R1.2 COc1cc(Br)ccn1 Amb10067392 [0,2,0,0,0,0|1,0,0]=3 3207 B9R1.2 COc1cc(Br)ncn1 Amb21963506 [0,2,0,0,0,0|2,0,0]=4 3208 B9R1.2 COc1cc(C)ccn1 Amb10070281 [0,2,0,0,0,0|1,0,0]=3 3209 B9R1.2 COc1cc(C)cnn1 Amb23401890 [0,2,0,0,0,0|2,0,0]=4 3210 B9R1.2 COc1cc(C)ncn1 Amb8439532 [0,2,0,0,0,0|2,0,0]=4 3211 B9R1.2 COc1cc(Cl)ccn1 Amb3319269 [0,2,0,0,0,0|1,0,0]=3 3212 B9R1.2 COc1cc(Cl)ncn1 Amb2455808 [0,2,0,0,0,0|2,0,0]=4 3213 B9R1.2 COc1cc(F)ccn1 Amb13882823 [0,2,0,0,0,0|1,0,0]=3 3214 B9R1.2 COc1cc(I)ccn1 Amb8394589 [0,2,0,0,0,0|1,0,0]=3 3215 B9R1.2 COc1cc(I)ncn1 Amb2455809 [0,2,0,0,0,0|2,0,0]=4 3216 B9R1.2 COc1cc(N)ccn1 Amb6565093 [0,2,0,0,0,0|1,0,0]=3 3217 B9R1.2 COc1cc(N)ncn1 Amb2611024 [0,2,0,0,0,0|2,0,0]=4 3218 B9R1.2 COc1cc(O)ccn1 Amb19958118 [0,2,0,0,0,0|1,0,0]=3 3219 B9R1.2 COc1cc(O)cnn1 Amb8439727 [0,2,0,0,0,0|2,0,0]=4 3220 B9R1.2 COc1cc(O)ncn1 Amb10552491 [0,2,0,0,0,0|2,0,0]=4 3221 B9R1.2 COc1cc(S)ccn1 Amb27657985 [0,2,0,0,0,0|1,0,0]=3 3222 B9R1.2 COc1ccc[n+]([O-])n1 Amb2609515 [0,2,0,0,0,0|2,0,0]=4 3223 B9R1.2 COc1cccc(Br)c1 Amb2684947 [0,2,0,0,0,0|0,0,0]=2 3224 B9R1.2 COc1cccc(Br)n1 Amb4009357 [0,2,0,0,0,0|1,0,0]=3 3225 B9R1.2 COc1cccc(C)c1 Amb6296622 [0,2,0,0,0,0|0,0,0]=2 3226 B9R1.2 COc1cccc(C)n1 Amb8386214 [0,2,0,0,0,0|1,0,0]=3 3227 B9R1.2 COc1cccc(Cl)c1 Amb10067914 [0,2,0,0,0,0|0,0,0]=2 3228 B9R1.2 COc1cccc(Cl)n1 Amb3939996 [0,2,0,0,0,0|1,0,0]=3 3229 B9R1.2 COc1cccc(F)c1 Amb2688015 [0,2,0,0,0,0|0,0,0]=2 3230 B9R1.2 COc1cccc(F)n1 Amb33529317 [0,2,0,0,0,0|1,0,0]=3 3231 B9R1.2 COc1cccc(I)c1 Amb4605820 [0,2,0,0,0,0|0,0,0]=2 3232 B9R1.2 COc1cccc(I)n1 Amb6565074 [0,2,0,0,0,0|1,0,0]=3 3233 B9R1.2 COc1cccc(N)c1 Amb18800323 [0,2,0,0,0,0|0,0,0]=2 3234 B9R1.2 COc1cccc(N)c1 Amb2725525 [0,2,0,0,0,0|0,0,0]=2 3235 B9R1.2 COc1cccc(N)n1 Amb18642177 [0,2,0,0,0,0|1,0,0]=3 3236 B9R1.2 COc1cccc(N)n1 Amb6307645 [0,2,0,0,0,0|1,0,0]=3 3237 B9R1.2 COc1cccc(O)c1 Amb3939549 [0,2,0,0,0,0|0,0,0]=2 3238 B9R1.2 COc1cccc(S)c1 Amb2689087 [0,2,0,0,0,0|0,0,0]=2 3239 B9R1.2 COc1cccc(S)n1 Amb26407889 [0,2,0,0,0,0|1,0,0]=3 3240 B9R1.2 COc1ccnc(Br)c1 Amb33543497 [0,2,0,0,0,0|1,0,0]=3 3241 B9R1.2 COc1ccnc(Br)n1 Amb10602030 [0,2,0,0,0,0|2,0,0]=4 3242 B9R1.2 COc1ccnc(C)c1 Amb2794412 [0,2,0,0,0,0|1,0,0]=3 3243 B9R1.2 COc1ccnc(C)n1 Amb20241588 [0,2,0,0,0,0|2,0,0]=4 3244 B9R1.2 COc1ccnc(Cl)c1 Amb2795243 [0,2,0,0,0,0|1,0,0]=3 3245 B9R1.2 COc1ccnc(Cl)n1 Amb1145730 [0,2,0,0,0,0|2,0,0]=4 3246 B9R1.2 COc1ccnc(F)c1 Amb13883469 [0,2,0,0,0,0|1,0,0]=3 3247 B9R1.2 COc1ccnc(I)c1 Amb26349858 [0,2,0,0,0,0|1,0,0]=3 3248 B9R1.2 COc1ccnc(I)n1 Amb10601974 [0,2,0,0,0,0|2,0,0]=4 3249 B9R1.2 COc1ccnc(N)c1 Amb6565092 [0,2,0,0,0,0|1,0,0]=3 3250 B9R1.2 COc1ccnc(N)n1 Amb2610114 [0,2,0,0,0,0|2,0,0]=4 3251 B9R1.2 COc1ccnc(S)c1 Amb33319807 [0,2,0,0,0,0|1,0,0]=3 3252 B9R1.2 COc1ccnc(S)n1 Amb25839786 [0,2,0,0,0,0|2,0,0]=4 3253 B9R1.2 COc1cnc[n+]([O-])c1 Amb25147036 [0,2,0,0,0,0|2,0,0]=4 3254 B9R1.2 COc1cncc(Br)c1 Amb2447233 [0,2,0,0,0,0|1,0,0]=3 3255 B9R1.2 COc1cncc(Br)n1 Amb10599296 [0,2,0,0,0,0|2,0,0]=4 3256 B9R1.2 COc1cncc(C)c1 Amb10602326 [0,2,0,0,0,0|1,0,0]=3 3257 B9R1.2 COc1cncc(Cl)c1 Amb8426274 [0,2,0,0,0,0|1,0,0]=3 3258 B9R1.2 COc1cncc(Cl)n1 Amb2455849 [0,2,0,0,0,0|2,0,0]=4 3259 B9R1.2 COc1cncc(F)c1 Amb21959397 [0,2,0,0,0,0|1,0,0]=3 3260 B9R1.2 COc1cncc(F)n1 Amb22388302 [0,2,0,0,0,0|2,0,0]=4 3261 B9R1.2 COc1cncc(I)c1 Amb6565109 [0,2,0,0,0,0|1,0,0]=3 3262 B9R1.2 COc1cncc(I)n1 Amb2455940 [0,2,0,0,0,0|2,0,0]=4 3263 B9R1.2 COc1cncc(N)c1 Amb22498300 [0,2,0,0,0,0|1,0,0]=3 3264 B9R1.2 COc1cncc(N)c1 Amb8629612 [0,2,0,0,0,0|1,0,0]=3 3265 B9R1.2 COc1cncc(N)n1 Amb18642283 [0,2,0,0,0,0|2,0,0]=4 3266 B9R1.2 COc1cncc(O)c1 Amb6565122 [0,2,0,0,0,0|1,0,0]=3 3267 B9R1.2 COc1cncc(S)c1 Amb24585573 [0,2,0,0,0,0|1,0,0]=3 3268 B9R1.2 COc1cnnc(Br)c1 Amb24555505 [0,2,0,0,0,0|2,0,0]=4 3269 B9R1.2 COc1cnnc(Cl)c1 Amb10603683 [0,2,0,0,0,0|2,0,0]=4 3270 B9R1.2 COc1cnnc(N)c1 Amb28197141 [0,2,0,0,0,0|2,0,0]=4 3271 B9R1.2 COc1nccc(Br)n1 Amb10070394 [0,2,0,0,0,0|2,0,0]=4 3272 B9R1.2 COc1nccc(Cl)n1 Amb2455860 [0,2,0,0,0,0|2,0,0]=4 3273 B9R1.2 COc1nccc(I)n1 Amb25122006 [0,2,0,0,0,0|2,0,0]=4 3274 B9R1.2 COc1nccc(N)n1 Amb33542403 [0,2,0,0,0,0|2,0,0]=4 3275 B9R1.2 CSC1=CC=CC(=O)N1 Amb26934248 [0,2,0,0,0,0|1,0,1]=4 3276 B9R1.2 CSc1cc(Cl)ccn1 Amb10602654 [0,2,0,0,0,0|1,1,0]=4 3277 B9R1.2 CSc1cc(N)ccn1 Amb18946048 [0,2,0,0,0,0|1,1,0]=4 3278 B9R1.2 CSc1cc(N)ccn1 Amb32668169 [0,2,0,0,0,0|1,1,0]=4 3279 B9R1.2 CSc1cc(O)ccn1 Amb25982693 [0,2,0,0,0,0|1,0,0]=3 3280 B9R1.2 CSc1cccc(Br)c1 Amb2685501 [0,2,0,0,0,0|0,1,0]=3 3281 B9R1.2 CSc1cccc(Br)n1 Amb8383358 [0,2,0,0,0,0|1,1,0]=4 3282 B9R1.2 CSc1cccc(Cl)c1 Amb2686478 [0,2,0,0,0,0|0,1,0]=3 3283 B9R1.2 CSc1cccc(Cl)n1 Amb2405701 [0,2,0,0,0,0|1,1,0]=4 3284 B9R1.2 CSc1cccc(F)c1 Amb2688421 [0,2,0,0,0,0|0,1,0]=3 3285 B9R1.2 CSc1cccc(N)c1 Amb932834 [0,2,0,0,0,0|0,1,0]=3 3286 B9R1.2 CSc1cccc(N)n1 Amb33532679 [0,2,0,0,0,0|1,1,0]=4 3287 B9R1.2 CSc1cccc(O)c1 Amb8845207 [0,2,0,0,0,0|0,0,0]=2 3288 B9R1.2 CSc1cccc(S)c1 Amb19887953 [0,2,0,0,0,0|0,1,0]=3 3289 B9R1.2 CSc1ccnc(Cl)c1 Amb10602056 [0,2,0,0,0,0|1,1,0]=4 3290 B9R1.2 CSc1ccnc(F)c1 Amb28285184 [0,2,0,0,0,0|1,1,0]=4 3291 B9R1.2 CSc1ccnc(N)c1 Amb33544874 [0,2,0,0,0,0|1,1,0]=4 3292 B9R1.2 CSc1ccnc(O)n1 Amb22490743 [0,2,0,0,0,0|2,0,0]=4 3293 B9R1.2 CSc1cncc(Br)c1 Amb10070326 [0,2,0,0,0,0|1,1,0]=4 3294 B9R1.2 CSc1cncc(Cl)c1 Amb24742758 [0,2,0,0,0,0|1,1,0]=4 3295 B9R1.2 CSc1cncc(F)c1 Amb27638304 [0,2,0,0,0,0|1,1,0]=4 3296 B9R1.2 CSc1cncc(N)c1 Amb28124236 [0,2,0,0,0,0|1,1,0]=4 3297 B9R1.2 CSc1cncc(N)c1 Amb28934996 [0,2,0,0,0,0|1,1,0]=4 3298 B9R1.2 CSc1cncc(O)c1 Amb27205422 [0,2,0,0,0,0|1,0,0]=3 3299 B9R1.2 CSc1nccc(O)n1 Amb33544310 [0,2,0,0,0,0|2,0,0]=4 3300 B9R1.2 C[n+]1cccc(C#N)c1 Amb10573245 [0,2,0,0,0,0|2,0,0]=4 3301 B9R1.2 C[n+]1cccc(C#N)c1 Amb6892794 [0,2,0,0,0,0|2,0,0]=4 3302 B9R1.2 C[n+]1cccc(CO)c1 Amb10573217 [0,2,0,0,0,0|1,0,0]=3 3303 B9R1.2 Cc1cc(C#N)ccn1 Amb33313532 [0,2,0,0,0,0|2,0,0]=4 3304 B9R1.2 Cc1cc(C#N)ccn1 Amb8439479 [0,2,0,0,0,0|2,0,0]=4 3305 B9R1.2 Cc1cc(C=O)ccn1 Amb16231936 [0,2,0,0,0,0|1,0,1]=4 3306 B9R1.2 Cc1cc(C=O)ccn1 Amb9701813 [0,2,0,0,0,0|1,0,1]=4 3307 B9R1.2 Cc1cc(CBr)ccn1 Amb20671017 [0,2,0,0,0,0|2,0,0]=4 3308 B9R1.2 Cc1cc(CBr)ccn1 Amb22386862 [0,2,0,0,0,0|2,0,0]=4 3309 B9R1.2 Cc1cc(CCl)ccn1 Amb22304816 [0,2,0,0,0,0|2,0,0]=4 3310 B9R1.2 Cc1cc(CCl)ccn1 Amb22587514 [0,2,0,0,0,0|2,0,0]=4 3311 B9R1.2 Cc1cc(CI)ccn1 Amb27612897 [0,2,0,0,0,0|2,0,0]=4 3312 B9R1.2 Cc1cc(CN)ccn1 Amb22235873 [0,2,0,0,0,0|2,0,0]=4 3313 B9R1.2 Cc1cc(CN)ccn1 Amb33542706 [0,2,0,0,0,0|2,0,0]=4 3314 B9R1.2 Cc1cc(CO)ccn1 Amb10067646 [0,2,0,0,0,0|1,0,0]=3 3315 B9R1.2 Cc1cc(CO)ncn1 Amb22059114 [0,2,0,0,0,0|2,0,0]=4 3316 B9R1.2 Cc1cc(CS)ccn1 Amb32788053 [0,2,0,0,0,0|1,1,0]=4 3317 B9R1.2 Cc1cc(NN)ccn1 Amb10607839 [0,2,0,0,0,0|2,0,0]=4 3318 B9R1.2 Cc1cc(NN)ccn1 Amb19890131 [0,2,0,0,0,0|2,0,0]=4 3319 B9R1.2 Cc1cc(NN)ccn1 Amb22490766 [0,2,0,0,0,0|2,0,0]=4 3320 B9R1.2 Cc1cc(NO)ncn1 Amb27394979 [0,2,0,0,0,0|2,0,0]=4 3321 B9R1.2 Cc1cccc(C#N)c1 Amb6608930 [0,2,0,0,0,0|1,0,0]=3 3322 B9R1.2 Cc1cccc(C#N)n1 Amb2384036 [0,2,0,0,0,0|2,0,0]=4 3323 B9R1.2 Cc1cccc(C=O)c1 Amb2690615 [0,2,0,0,0,0|0,0,1]=3 3324 B9R1.2 Cc1cccc(C=O)n1 Amb2689678 [0,2,0,0,0,0|1,0,1]=4 3325 B9R1.2 Cc1cccc(CBr)c1 Amb2601054 [0,2,0,0,0,0|1,0,0]=3 3326 B9R1.2 Cc1cccc(CBr)n1 Amb21857068 [0,2,0,0,0,0|2,0,0]=4 3327 B9R1.2 Cc1cccc(CBr)n1 Amb9769234 [0,2,0,0,0,0|2,0,0]=4 3328 B9R1.2 Cc1cccc(CCl)c1 Amb2792915 [0,2,0,0,0,0|1,0,0]=3 3329 B9R1.2 Cc1cccc(CCl)n1 Amb16234122 [0,2,0,0,0,0|2,0,0]=4 3330 B9R1.2 Cc1cccc(CCl)n1 Amb2592508 [0,2,0,0,0,0|2,0,0]=4 3331 B9R1.2 Cc1cccc(CF)c1 Amb22232791 [0,2,0,0,0,0|1,0,0]=3 3332 B9R1.2 Cc1cccc(CF)n1 Amb27590322 [0,2,0,0,0,0|2,0,0]=4 3333 B9R1.2 Cc1cccc(CN)c1 Amb1116222 [0,2,0,0,0,0|1,0,0]=3 3334 B9R1.2 Cc1cccc(CN)n1 Amb20669074 [0,2,0,0,0,0|2,0,0]=4 3335 B9R1.2 Cc1cccc(CN)n1 Amb21857709 [0,2,0,0,0,0|2,0,0]=4 3336 B9R1.2 Cc1cccc(CN)n1 Amb2592509 [0,2,0,0,0,0|2,0,0]=4 3337 B9R1.2 Cc1cccc(CO)c1 Amb837250 [0,2,0,0,0,0|0,0,0]=2 3338 B9R1.2 Cc1cccc(CO)n1 Amb24063802 [0,2,0,0,0,0|1,0,0]=3 3339 B9R1.2 Cc1cccc(CO)n1 Amb2725366 [0,2,0,0,0,0|1,0,0]=3 3340 B9R1.2 Cc1cccc(CS)c1 Amb2726200 [0,2,0,0,0,0|0,1,0]=3 3341 B9R1.2 Cc1cccc(CS)n1 Amb25140122 [0,2,0,0,0,0|1,1,0]=4 3342 B9R1.2 Cc1cccc(N=O)c1 Amb25843313 [0,2,0,0,0,0|0,0,1]=3 3343 B9R1.2 Cc1cccc(NN)c1 Amb1209233 [0,2,0,0,0,0|1,0,0]=3 3344 B9R1.2 Cc1cccc(NN)c1 Amb3942541 [0,2,0,0,0,0|1,0,0]=3 3345 B9R1.2 Cc1cccc(NN)n1 Amb19888167 [0,2,0,0,0,0|2,0,0]=4 3346 B9R1.2 Cc1cccc(NN)n1 Amb19890162 [0,2,0,0,0,0|2,0,0]=4 3347 B9R1.2 Cc1cccc(NN)n1 Amb22587211 [0,2,0,0,0,0|2,0,0]=4 3348 B9R1.2 Cc1cccc(NN)n1 Amb5730483 [0,2,0,0,0,0|2,0,0]=4 3349 B9R1.2 Cc1cccc(N[NH3+])c1 Amb24113759 [0,2,0,0,0,0|1,0,0]=3 3350 B9R1.2 Cc1cccc([IH2]=O)c1 Amb25312202 [0,2,0,0,0,0|0,0,1]=3 3351 B9R1.2 Cc1cccc([Mg]Br)c1 Amb22000361 [0,2,0,0,0,0|1,0,0]=3 3352 B9R1.2 Cc1cccc([Zn]I)c1 Amb22000446 [0,2,0,0,0,0|1,0,0]=3 3353 B9R1.2 Cc1ccnc(C#N)c1 Amb2384038 [0,2,0,0,0,0|2,0,0]=4 3354 B9R1.2 Cc1ccnc(C=O)c1 Amb6307702 [0,2,0,0,0,0|1,0,1]=4 3355 B9R1.2 Cc1ccnc(CBr)c1 Amb22298607 [0,2,0,0,0,0|2,0,0]=4 3356 B9R1.2 Cc1ccnc(CBr)c1 Amb22498570 [0,2,0,0,0,0|2,0,0]=4 3357 B9R1.2 Cc1ccnc(CCl)c1 Amb19958924 [0,2,0,0,0,0|2,0,0]=4 3358 B9R1.2 Cc1ccnc(CCl)c1 Amb8386834 [0,2,0,0,0,0|2,0,0]=4 3359 B9R1.2 Cc1ccnc(CN)c1 Amb16185808 [0,2,0,0,0,0|2,0,0]=4 3360 B9R1.2 Cc1ccnc(CN)c1 Amb22587020 [0,2,0,0,0,0|2,0,0]=4 3361 B9R1.2 Cc1ccnc(CN)c1 Amb8010866 [0,2,0,0,0,0|2,0,0]=4 3362 B9R1.2 Cc1ccnc(CO)c1 Amb22495046 [0,2,0,0,0,0|1,0,0]=3 3363 B9R1.2 Cc1ccnc(CO)c1 Amb8386835 [0,2,0,0,0,0|1,0,0]=3 3364 B9R1.2 Cc1ccnc(CO)n1 Amb22276544 [0,2,0,0,0,0|2,0,0]=4 3365 B9R1.2 Cc1ccnc(CS)c1 Amb33317783 [0,2,0,0,0,0|1,1,0]=4 3366 B9R1.2 Cc1ccnc(NN)c1 Amb22587604 [0,2,0,0,0,0|2,0,0]=4 3367 B9R1.2 Cc1ccnc(NN)c1 Amb5730482 [0,2,0,0,0,0|2,0,0]=4 3368 B9R1.2 Cc1ccnc(NO)n1 Amb27485301 [0,2,0,0,0,0|2,0,0]=4 3369 B9R1.2 Cc1ccnc([Zn]Br)c1 Amb22000358 [0,2,0,0,0,0|2,0,0]=4 3370 B9R1.2 Cc1cncc(C#N)c1 Amb2694193 [0,2,0,0,0,0|2,0,0]=4 3371 B9R1.2 Cc1cncc(C=O)c1 Amb8396131 [0,2,0,0,0,0|1,0,1]=4 3372 B9R1.2 Cc1cncc(CBr)c1 Amb15694776 [0,2,0,0,0,0|2,0,0]=4 3373 B9R1.2 Cc1cncc(CBr)c1 Amb22498080 [0,2,0,0,0,0|2,0,0]=4 3374 B9R1.2 Cc1cncc(CCl)c1 Amb10068351 [0,2,0,0,0,0|2,0,0]=4 3375 B9R1.2 Cc1cncc(CCl)c1 Amb16234123 [0,2,0,0,0,0|2,0,0]=4 3376 B9R1.2 Cc1cncc(CN)c1 Amb20247922 [0,2,0,0,0,0|2,0,0]=4 3377 B9R1.2 Cc1cncc(CN)c1 Amb22886409 [0,2,0,0,0,0|2,0,0]=4 3378 B9R1.2 Cc1cncc(CO)c1 Amb16231977 [0,2,0,0,0,0|1,0,0]=3 3379 B9R1.2 Cc1cncc(CS)c1 Amb26412315 [0,2,0,0,0,0|1,1,0]=4 3380 B9R1.2 Cc1cncc(NN)c1 Amb23454421 [0,2,0,0,0,0|2,0,0]=4 3381 B9R1.2 Cc1cncc([N+]#N)c1 Amb28201388 [0,2,0,0,0,0|2,0,0]=4 3382 B9R1.2 Cc1cnnc(CO)c1 Amb24183285 [0,2,0,0,0,0|2,0,0]=4 3383 B9R1.2 Cc1nccc(CO)n1 Amb33540113 [0,2,0,0,0,0|2,0,0]=4 3384 B9R1.2 Cc1nccc(NO)n1 Amb27662154 [0,2,0,0,0,0|2,0,0]=4 3385 B9R1.2 ClCc1cc(Br)ccn1 Amb22490723 [0,2,0,0,0,0|2,0,0]=4 3386 B9R1.2 ClCc1cc(Cl)ccn1 Amb21864843 [0,2,0,0,0,0|2,0,0]=4 3387 B9R1.2 ClCc1cc(Cl)ccn1 Amb8386829 [0,2,0,0,0,0|2,0,0]=4 3388 B9R1.2 ClCc1cccc(Br)c1 Amb3939726 [0,2,0,0,0,0|1,0,0]=3 3389 B9R1.2 ClCc1cccc(Br)n1 Amb20247745 [0,2,0,0,0,0|2,0,0]=4 3390 B9R1.2 ClCc1cccc(Br)n1 Amb23437266 [0,2,0,0,0,0|2,0,0]=4 3391 B9R1.2 ClCc1cccc(Cl)c1 Amb6364755 [0,2,0,0,0,0|1,0,0]=3 3392 B9R1.2 ClCc1cccc(Cl)n1 Amb8386843 [0,2,0,0,0,0|2,0,0]=4 3393 B9R1.2 ClCc1cccc(I)c1 Amb21964340 [0,2,0,0,0,0|1,0,0]=3 3394 B9R1.2 ClCc1ccnc(Br)c1 Amb22495176 [0,2,0,0,0,0|2,0,0]=4 3395 B9R1.2 ClCc1ccnc(Br)c1 Amb22497641 [0,2,0,0,0,0|2,0,0]=4 3396 B9R1.2 ClCc1ccnc(Cl)c1 Amb19375413 [0,2,0,0,0,0|2,0,0]=4 3397 B9R1.2 ClCc1ccnc(Cl)c1 Amb6893890 [0,2,0,0,0,0|2,0,0]=4 3398 B9R1.2 ClCc1cncc(Br)c1 Amb6572389 [0,2,0,0,0,0|2,0,0]=4 3399 B9R1.2 ClCc1cncc(Br)c1 Amb8999149 [0,2,0,0,0,0|2,0,0]=4 3400 B9R1.2 ClCc1cncc(Cl)c1 Amb19895015 [0,2,0,0,0,0|2,0,0]=4 3401 B9R1.2 ClCc1cncc(Cl)c1 Amb22295968 [0,2,0,0,0,0|2,0,0]=4 3402 B9R1.2 ClCc1cncc(I)c1 Amb28245399 [0,2,0,0,0,0|2,0,0]=4 3403 B9R1.2 ClCc1cncc(I)c1 Amb6565112 [0,2,0,0,0,0|2,0,0]=4 3404 B9R1.2 ClSc1cccc(Cl)c1 Amb28286580 [0,2,0,0,0,0|0,1,0]=3 3405 B9R1.2 Clc1cc(CBr)ccn1 Amb20620505 [0,2,0,0,0,0|2,0,0]=4 3406 B9R1.2 Clc1cc(CBr)ccn1 Amb22757508 [0,2,0,0,0,0|2,0,0]=4 3407 B9R1.2 Clc1cccc(CBr)c1 Amb1651063 [0,2,0,0,0,0|1,0,0]=3 3408 B9R1.2 Clc1cccc(CBr)n1 Amb24101199 [0,2,0,0,0,0|2,0,0]=4 3409 B9R1.2 Clc1cccc(CBr)n1 Amb32661811 [0,2,0,0,0,0|2,0,0]=4 3410 B9R1.2 Clc1cccc(CI)c1 Amb23571284 [0,2,0,0,0,0|1,0,0]=3 3411 B9R1.2 Clc1cccc(CI)n1 Amb26943784 [0,2,0,0,0,0|2,0,0]=4 3412 B9R1.2 Clc1cccc([Zn]I)c1 Amb22000419 [0,2,0,0,0,0|1,0,0]=3 3413 B9R1.2 Clc1ccnc(CBr)c1 Amb26940248 [0,2,0,0,0,0|2,0,0]=4 3414 B9R1.2 Clc1ccnc(CBr)c1 Amb32683328 [0,2,0,0,0,0|2,0,0]=4 3415 B9R1.2 Clc1cncc(CBr)c1 Amb24085331 [0,2,0,0,0,0|2,0,0]=4 3416 B9R1.2 Clc1cncc(CBr)c1 Amb32667567 [0,2,0,0,0,0|2,0,0]=4 3417 B9R1.2 FCc1cc(Br)ccn1 Amb28195984 [0,2,0,0,0,0|2,0,0]=4 3418 B9R1.2 FCc1cccc(Br)c1 Amb27247407 [0,2,0,0,0,0|1,0,0]=3 3419 B9R1.2 FCc1cccc(Br)n1 Amb27603388 [0,2,0,0,0,0|2,0,0]=4 3420 B9R1.2 FCc1cccc(Cl)n1 Amb27795270 [0,2,0,0,0,0|2,0,0]=4 3421 B9R1.2 FCc1cccc(F)c1 Amb22232792 [0,2,0,0,0,0|1,0,0]=3 3422 B9R1.2 FCc1cccc(I)c1 Amb26923780 [0,2,0,0,0,0|1,0,0]=3 3423 B9R1.2 FCc1ccnc(Br)c1 Amb28195983 [0,2,0,0,0,0|2,0,0]=4 3424 B9R1.2 FCc1cncc(Br)c1 Amb26516205 [0,2,0,0,0,0|2,0,0]=4 3425 B9R1.2 FCc1cncc(Cl)c1 Amb27185547 [0,2,0,0,0,0|2,0,0]=4 3426 B9R1.2 Fc1cc(CBr)ccn1 Amb20248119 [0,2,0,0,0,0|2,0,0]=4 3427 B9R1.2 Fc1cc(CCl)ccn1 Amb24102944 [0,2,0,0,0,0|2,0,0]=4 3428 B9R1.2 Fc1cccc(CBr)c1 Amb2688043 [0,2,0,0,0,0|1,0,0]=3 3429 B9R1.2 Fc1cccc(CBr)n1 Amb21964613 [0,2,0,0,0,0|2,0,0]=4 3430 B9R1.2 Fc1cccc(CBr)n1 Amb32662943 [0,2,0,0,0,0|2,0,0]=4 3431 B9R1.2 Fc1cccc(CCl)c1 Amb6364746 [0,2,0,0,0,0|1,0,0]=3 3432 B9R1.2 Fc1cccc(CCl)n1 Amb8386859 [0,2,0,0,0,0|2,0,0]=4 3433 B9R1.2 Fc1cccc(CI)c1 Amb23590695 [0,2,0,0,0,0|1,0,0]=3 3434 B9R1.2 Fc1cccc(CS)c1 Amb2691867 [0,2,0,0,0,0|0,1,0]=3 3435 B9R1.2 Fc1ccnc(CBr)c1 Amb24726125 [0,2,0,0,0,0|2,0,0]=4 3436 B9R1.2 Fc1ccnc(CCl)c1 Amb25060143 [0,2,0,0,0,0|2,0,0]=4 3437 B9R1.2 Fc1ccnc(CCl)c1 Amb32676629 [0,2,0,0,0,0|2,0,0]=4 3438 B9R1.2 Fc1ccnc(CS)c1 Amb33325067 [0,2,0,0,0,0|1,1,0]=4 3439 B9R1.2 Fc1cncc(CBr)c1 Amb24085333 [0,2,0,0,0,0|2,0,0]=4 3440 B9R1.2 Fc1cncc(CBr)c1 Amb33540413 [0,2,0,0,0,0|2,0,0]=4 3441 B9R1.2 Fc1cncc(CCl)c1 Amb19894486 [0,2,0,0,0,0|2,0,0]=4 3442 B9R1.2 Fc1cncc(CCl)c1 Amb25887202 [0,2,0,0,0,0|2,0,0]=4 3443 B9R1.2 Fc1cncc(CS)c1 Amb27946754 [0,2,0,0,0,0|1,1,0]=4 3444 B9R1.2 N#CC1=CC(=O)C=CN1 Amb22495086 [0,2,0,0,0,0|1,0,1]=4 3445 B9R1.2 N#CC1=CC(=O)NC=C1 Amb19959645 [0,2,0,0,0,0|1,0,1]=4 3446 B9R1.2 N#CC1=CC=CC(=O)N1 Amb33544081 [0,2,0,0,0,0|1,0,1]=4 3447 B9R1.2 N#Cc1cc(Br)ccn1 Amb2567163 [0,2,0,0,0,0|2,0,0]=4 3448 B9R1.2 N#Cc1cc(Cl)ccn1 Amb2568253 [0,2,0,0,0,0|2,0,0]=4 3449 B9R1.2 N#Cc1cc(F)ccn1 Amb10602733 [0,2,0,0,0,0|2,0,0]=4 3450 B9R1.2 N#Cc1cc(I)ccn1 Amb10070315 [0,2,0,0,0,0|2,0,0]=4 3451 B9R1.2 N#Cc1cc(N)ccn1 Amb16231249 [0,2,0,0,0,0|2,0,0]=4 3452 B9R1.2 N#Cc1cc(O)ccn1 Amb33540634 [0,2,0,0,0,0|1,0,0]=3 3453 B9R1.2 N#Cc1cc(O)ncn1 Amb25032332 [0,2,0,0,0,0|2,0,0]=4 3454 B9R1.2 N#Cc1ccc[n+]([O-])c1 Amb4477427 [0,2,0,0,0,0|1,0,1]=4 3455 B9R1.2 N#Cc1cccc(Br)c1 Amb3939304 [0,2,0,0,0,0|1,0,0]=3 3456 B9R1.2 N#Cc1cccc(Br)n1 Amb8386298 [0,2,0,0,0,0|2,0,0]=4 3457 B9R1.2 N#Cc1cccc(Cl)c1 Amb1649394 [0,2,0,0,0,0|1,0,0]=3 3458 B9R1.2 N#Cc1cccc(Cl)n1 Amb2794113 [0,2,0,0,0,0|2,0,0]=4 3459 B9R1.2 N#Cc1cccc(F)c1 Amb1651064 [0,2,0,0,0,0|1,0,0]=3 3460 B9R1.2 N#Cc1cccc(F)n1 Amb8396945 [0,2,0,0,0,0|2,0,0]=4 3461 B9R1.2 N#Cc1cccc(I)c1 Amb2688836 [0,2,0,0,0,0|1,0,0]=3 3462 B9R1.2 N#Cc1cccc(N)c1 Amb2684321 [0,2,0,0,0,0|1,0,0]=3 3463 B9R1.2 N#Cc1cccc(N)n1 Amb33542528 [0,2,0,0,0,0|2,0,0]=4 3464 B9R1.2 N#Cc1cccc(O)c1 Amb1649098 [0,2,0,0,0,0|0,0,0]=2 3465 B9R1.2 N#Cc1cccc(O)n1 Amb22387273 [0,2,0,0,0,0|1,0,0]=3 3466 B9R1.2 N#Cc1cccc(S)c1 Amb20622832 [0,2,0,0,0,0|0,1,0]=3 3467 B9R1.2 N#Cc1cccn(=O)c1 Amb20621965 [0,2,0,0,0,0|1,0,1]=4 3468 B9R1.2 N#Cc1ccnc(Br)c1 Amb8386246 [0,2,0,0,0,0|2,0,0]=4 3469 B9R1.2 N#Cc1ccnc(Cl)c1 Amb2371806 [0,2,0,0,0,0|2,0,0]=4 3470 B9R1.2 N#Cc1ccnc(F)c1 Amb10067286 [0,2,0,0,0,0|2,0,0]=4 3471 B9R1.2 N#Cc1ccnc(I)c1 Amb10070316 [0,2,0,0,0,0|2,0,0]=4 3472 B9R1.2 N#Cc1ccnc(N)c1 Amb6257211 [0,2,0,0,0,0|2,0,0]=4 3473 B9R1.2 N#Cc1ccnc(O)c1 Amb2691399 [0,2,0,0,0,0|1,0,0]=3 3474 B9R1.2 N#Cc1ccnc(S)c1 Amb1127767 [0,2,0,0,0,0|1,1,0]=4 3475 B9R1.2 N#Cc1cncc(Br)c1 Amb2447500 [0,2,0,0,0,0|2,0,0]=4 3476 B9R1.2 N#Cc1cncc(Cl)c1 Amb10605793 [0,2,0,0,0,0|2,0,0]=4 3477 B9R1.2 N#Cc1cncc(F)c1 Amb8397297 [0,2,0,0,0,0|2,0,0]=4 3478 B9R1.2 N#Cc1cncc(I)c1 Amb24759344 [0,2,0,0,0,0|2,0,0]=4 3479 B9R1.2 N#Cc1cncc(N)c1 Amb8386276 [0,2,0,0,0,0|2,0,0]=4 3480 B9R1.2 N#Cc1cncc(O)c1 Amb10602301 [0,2,0,0,0,0|1,0,0]=3 3481 B9R1.2 N#Cc1cncc(O)n1 Amb10599242 [0,2,0,0,0,0|2,0,0]=4 3482 B9R1.2 N#Cc1cnnc(O)c1 Amb26067370 [0,2,0,0,0,0|2,0,0]=4 3483 B9R1.2 N#Cc1nccc(O)n1 Amb26362251 [0,2,0,0,0,0|2,0,0]=4 3484 B9R1.2 N#[N+]c1cccc(Cl)c1 Amb17940917 [0,2,0,0,0,0|1,0,0]=3 3485 B9R1.2 N#[N+]c1cccc(F)c1 Amb28318522 [0,2,0,0,0,0|1,0,0]=3 3486 B9R1.2 N#[N+]c1cccc(N)c1 Amb27469752 [0,2,0,0,0,0|1,0,0]=3 3487 B9R1.2 N#[N+]c1cccc(O)c1 Amb27768731 [0,2,0,0,0,0|0,0,0]=2 3488 B9R1.2 N#[N+]c1cncc(Cl)c1 Amb35671383 [0,2,0,0,0,0|2,0,0]=4 3489 B9R1.2 N#[N+]c1cncc(F)c1 Amb27647889 [0,2,0,0,0,0|2,0,0]=4 3490 B9R1.2 NCC1=CC(=O)C=CN1 Amb33535896 [0,2,0,0,0,0|1,0,1]=4 3491 B9R1.2 NCC1=CC(=O)NC=C1 Amb21963528 [0,2,0,0,0,0|1,0,1]=4 3492 B9R1.2 NCC1=CC(=O)NC=C1 Amb21963542 [0,2,0,0,0,0|1,0,1]=4 3493 B9R1.2 NCC1=CC=CC(=O)N1 Amb22490648 [0,2,0,0,0,0|1,0,1]=4 3494 B9R1.2 NCC1=CC=CC(=O)N1 Amb33291340 [0,2,0,0,0,0|1,0,1]=4 3495 B9R1.2 NCc1cc(Br)ccn1 Amb18251919 [0,2,0,0,0,0|2,0,0]=4 3496 B9R1.2 NCc1cc(Br)ccn1 Amb21858993 [0,2,0,0,0,0|2,0,0]=4 3497 B9R1.2 NCc1cc(Br)ccn1 Amb24117549 [0,2,0,0,0,0|2,0,0]=4 3498 B9R1.2 NCc1cc(Cl)ccn1 Amb16233762 [0,2,0,0,0,0|2,0,0]=4 3499 B9R1.2 NCc1cc(Cl)ccn1 Amb19515814 [0,2,0,0,0,0|2,0,0]=4 3500 B9R1.2 NCc1cc(Cl)ccn1 Amb22899206 [0,2,0,0,0,0|2,0,0]=4 3501 B9R1.2 NCc1cc(F)ccn1 Amb13890627 [0,2,0,0,0,0|2,0,0]=4 3502 B9R1.2 NCc1cc(F)ccn1 Amb16186031 [0,2,0,0,0,0|2,0,0]=4 3503 B9R1.2 NCc1cc(F)ccn1 Amb22304300 [0,2,0,0,0,0|2,0,0]=4 3504 B9R1.2 NCc1cc(I)ccn1 Amb25689125 [0,2,0,0,0,0|2,0,0]=4 3505 B9R1.2 NCc1cc(N)ccn1 Amb18280762 [0,2,0,0,0,0|2,0,0]=4 3506 B9R1.2 NCc1cc(N)ccn1 Amb24117548 [0,2,0,0,0,0|2,0,0]=4 3507 B9R1.2 NCc1cc(N)ccn1 Amb30585160 [0,2,0,0,0,0|2,0,0]=4 3508 B9R1.2 NCc1cc(O)ccn1 Amb23399915 [0,2,0,0,0,0|1,0,0]=3 3509 B9R1.2 NCc1cc(O)ccn1 Amb8010311 [0,2,0,0,0,0|1,0,0]=3 3510 B9R1.2 NCc1cc(O)ncn1 Amb10608377 [0,2,0,0,0,0|2,0,0]=4 3511 B9R1.2 NCc1cc(O)ncn1 Amb17622204 [0,2,0,0,0,0|2,0,0]=4 3512 B9R1.2 NCc1ccc[n+]([O-])c1 Amb33496123 [0,2,0,0,0,0|1,0,1]=4 3513 B9R1.2 NCc1cccc(Br)c1 Amb1114593 [0,2,0,0,0,0|1,0,0]=3 3514 B9R1.2 NCc1cccc(Br)c1 Amb4036811 [0,2,0,0,0,0|1,0,0]=3 3515 B9R1.2 NCc1cccc(Br)n1 Amb22899554 [0,2,0,0,0,0|2,0,0]=4 3516 B9R1.2 NCc1cccc(Br)n1 Amb33330973 [0,2,0,0,0,0|2,0,0]=4 3517 B9R1.2 NCc1cccc(Br)n1 Amb8386300 [0,2,0,0,0,0|2,0,0]=4 3518 B9R1.2 NCc1cccc(Cl)c1 Amb535711 [0,2,0,0,0,0|1,0,0]=3 3519 B9R1.2 NCc1cccc(Cl)n1 Amb20621543 [0,2,0,0,0,0|2,0,0]=4 3520 B9R1.2 NCc1cccc(Cl)n1 Amb21964888 [0,2,0,0,0,0|2,0,0]=4 3521 B9R1.2 NCc1cccc(Cl)n1 Amb23437268 [0,2,0,0,0,0|2,0,0]=4 3522 B9R1.2 NCc1cccc(F)c1 Amb1119747 [0,2,0,0,0,0|1,0,0]=3 3523 B9R1.2 NCc1cccc(F)c1 Amb30876891 [0,2,0,0,0,0|1,0,0]=3 3524 B9R1.2 NCc1cccc(F)n1 Amb13890637 [0,2,0,0,0,0|2,0,0]=4 3525 B9R1.2 NCc1cccc(F)n1 Amb16186029 [0,2,0,0,0,0|2,0,0]=4 3526 B9R1.2 NCc1cccc(F)n1 Amb22491793 [0,2,0,0,0,0|2,0,0]=4 3527 B9R1.2 NCc1cccc(I)c1 Amb3940187 [0,2,0,0,0,0|1,0,0]=3 3528 B9R1.2 NCc1cccc(I)c1 Amb4036800 [0,2,0,0,0,0|1,0,0]=3 3529 B9R1.2 NCc1cccc(I)n1 Amb26489136 [0,2,0,0,0,0|2,0,0]=4 3530 B9R1.2 NCc1cccc(N)c1 Amb4079367 [0,2,0,0,0,0|1,0,0]=3 3531 B9R1.2 NCc1cccc(N)c1 Amb6297110 [0,2,0,0,0,0|1,0,0]=3 3532 B9R1.2 NCc1cccc(N)n1 Amb13951384 [0,2,0,0,0,0|2,0,0]=4 3533 B9R1.2 NCc1cccc(N)n1 Amb29083362 [0,2,0,0,0,0|2,0,0]=4 3534 B9R1.2 NCc1cccc(O)c1 Amb10609577 [0,2,0,0,0,0|0,0,0]=2 3535 B9R1.2 NCc1cccc(O)c1 Amb1133156 [0,2,0,0,0,0|0,0,0]=2 3536 B9R1.2 NCc1cccc(O)n1 Amb22059467 [0,2,0,0,0,0|1,0,0]=3 3537 B9R1.2 NCc1cccn(=O)c1 Amb17771581 [0,2,0,0,0,0|1,0,1]=4 3538 B9R1.2 NCc1ccnc(Br)c1 Amb32668890 [0,2,0,0,0,0|2,0,0]=4 3539 B9R1.2 NCc1ccnc(Br)c1 Amb8386247 [0,2,0,0,0,0|2,0,0]=4 3540 B9R1.2 NCc1ccnc(Cl)c1 Amb10608317 [0,2,0,0,0,0|2,0,0]=4 3541 B9R1.2 NCc1ccnc(Cl)c1 Amb19959306 [0,2,0,0,0,0|2,0,0]=4 3542 B9R1.2 NCc1ccnc(Cl)c1 Amb32663653 [0,2,0,0,0,0|2,0,0]=4 3543 B9R1.2 NCc1ccnc(F)c1 Amb13890639 [0,2,0,0,0,0|2,0,0]=4 3544 B9R1.2 NCc1ccnc(F)c1 Amb16186028 [0,2,0,0,0,0|2,0,0]=4 3545 B9R1.2 NCc1ccnc(F)c1 Amb20247883 [0,2,0,0,0,0|2,0,0]=4 3546 B9R1.2 NCc1ccnc(N)c1 Amb22490576 [0,2,0,0,0,0|2,0,0]=4 3547 B9R1.2 NCc1ccnc(N)c1 Amb8630211 [0,2,0,0,0,0|2,0,0]=4 3548 B9R1.2 NCc1ccnc(O)c1 Amb13952113 [0,2,0,0,0,0|1,0,0]=3 3549 B9R1.2 NCc1ccnc(O)n1 Amb18832833 [0,2,0,0,0,0|2,0,0]=4 3550 B9R1.2 NCc1cncc(Br)c1 Amb31156519 [0,2,0,0,0,0|2,0,0]=4 3551 B9R1.2 NCc1cncc(Br)c1 Amb6572387 [0,2,0,0,0,0|2,0,0]=4 3552 B9R1.2 NCc1cncc(Cl)c1 Amb20247915 [0,2,0,0,0,0|2,0,0]=4 3553 B9R1.2 NCc1cncc(F)c1 Amb13890643 [0,2,0,0,0,0|2,0,0]=4 3554 B9R1.2 NCc1cncc(F)c1 Amb30585163 [0,2,0,0,0,0|2,0,0]=4 3555 B9R1.2 NCc1cncc(I)c1 Amb24329335 [0,2,0,0,0,0|2,0,0]=4 3556 B9R1.2 NCc1cncc(N)c1 Amb23401799 [0,2,0,0,0,0|2,0,0]=4 3557 B9R1.2 NCc1cncc(N)c1 Amb8386279 [0,2,0,0,0,0|2,0,0]=4 3558 B9R1.2 NCc1cncc(O)c1 Amb22899436 [0,2,0,0,0,0|1,0,0]=3 3559 B9R1.2 NCc1nccc(O)n1 Amb18222083 [0,2,0,0,0,0|2,0,0]=4 3560 B9R1.2 NNC1=CC(=O)NC=C1 Amb18642286 [0,2,0,0,0,0|1,0,1]=4 3561 B9R1.2 NNc1cc(Br)ccn1 Amb21857058 [0,2,0,0,0,0|2,0,0]=4 3562 B9R1.2 NNc1cc(Cl)ccn1 Amb22002288 [0,2,0,0,0,0|2,0,0]=4 3563 B9R1.2 NNc1cc(F)ccn1 Amb35788823 [0,2,0,0,0,0|2,0,0]=4 3564 B9R1.2 NNc1cc(I)ccn1 Amb22886987 [0,2,0,0,0,0|2,0,0]=4 3565 B9R1.2 NNc1cc(O)cnn1 Amb28323584 [0,2,0,0,0,0|2,0,0]=4 3566 B9R1.2 NNc1cc(O)ncn1 Amb2591558 [0,2,0,0,0,0|2,0,0]=4 3567 B9R1.2 NNc1ccc[n+]([O-])c1 Amb25951839 [0,2,0,0,0,0|1,0,1]=4 3568 B9R1.2 NNc1cccc(Br)c1 Amb1156067 [0,2,0,0,0,0|1,0,0]=3 3569 B9R1.2 NNc1cccc(Br)c1 Amb22489455 [0,2,0,0,0,0|1,0,0]=3 3570 B9R1.2 NNc1cccc(Br)c1 Amb2371371 [0,2,0,0,0,0|1,0,0]=3 3571 B9R1.2 NNc1cccc(Br)n1 Amb10068417 [0,2,0,0,0,0|2,0,0]=4 3572 B9R1.2 NNc1cccc(Br)n1 Amb22587434 [0,2,0,0,0,0|2,0,0]=4 3573 B9R1.2 NNc1cccc(Cl)c1 Amb1039459 [0,2,0,0,0,0|1,0,0]=3 3574 B9R1.2 NNc1cccc(Cl)c1 Amb2234667 [0,2,0,0,0,0|1,0,0]=3 3575 B9R1.2 NNc1cccc(Cl)c1 Amb22489457 [0,2,0,0,0,0|1,0,0]=3 3576 B9R1.2 NNc1cccc(Cl)n1 Amb23401085 [0,2,0,0,0,0|2,0,0]=4 3577 B9R1.2 NNc1cccc(Cl)n1 Amb2420328 [0,2,0,0,0,0|2,0,0]=4 3578 B9R1.2 NNc1cccc(F)c1 Amb22489458 [0,2,0,0,0,0|1,0,0]=3 3579 B9R1.2 NNc1cccc(F)c1 Amb33531158 [0,2,0,0,0,0|1,0,0]=3 3580 B9R1.2 NNc1cccc(F)c1 Amb3940541 [0,2,0,0,0,0|1,0,0]=3 3581 B9R1.2 NNc1cccc(F)n1 Amb22495332 [0,2,0,0,0,0|2,0,0]=4 3582 B9R1.2 NNc1cccc(I)c1 Amb7764642 [0,2,0,0,0,0|1,0,0]=3 3583 B9R1.2 NNc1cccc(N)c1 Amb25786964 [0,2,0,0,0,0|1,0,0]=3 3584 B9R1.2 NNc1cccc(O)c1 Amb25327903 [0,2,0,0,0,0|0,0,0]=2 3585 B9R1.2 NNc1cccc(O)c1 Amb32661662 [0,2,0,0,0,0|0,0,0]=2 3586 B9R1.2 NNc1cccc(O)c1 Amb32667594 [0,2,0,0,0,0|0,0,0]=2 3587 B9R1.2 NNc1cccc(S)c1 Amb26966067 [0,2,0,0,0,0|0,1,0]=3 3588 B9R1.2 NNc1ccnc(Br)c1 Amb8438921 [0,2,0,0,0,0|2,0,0]=4 3589 B9R1.2 NNc1ccnc(Cl)c1 Amb19895220 [0,2,0,0,0,0|2,0,0]=4 3590 B9R1.2 NNc1ccnc(Cl)c1 Amb32666794 [0,2,0,0,0,0|2,0,0]=4 3591 B9R1.2 NNc1ccnc(F)c1 Amb8388365 [0,2,0,0,0,0|2,0,0]=4 3592 B9R1.2 NNc1ccnc(O)n1 Amb8393312 [0,2,0,0,0,0|2,0,0]=4 3593 B9R1.2 NNc1cncc(Br)c1 Amb24495145 [0,2,0,0,0,0|2,0,0]=4 3594 B9R1.2 NNc1cncc(Br)c1 Amb32652065 [0,2,0,0,0,0|2,0,0]=4 3595 B9R1.2 NNc1cncc(Br)c1 Amb33362343 [0,2,0,0,0,0|2,0,0]=4 3596 B9R1.2 NNc1cncc(Cl)c1 Amb23559888 [0,2,0,0,0,0|2,0,0]=4 3597 B9R1.2 NNc1cncc(F)c1 Amb23559887 [0,2,0,0,0,0|2,0,0]=4 3598 B9R1.2 NOc1cccc(Br)c1 Amb22900915 [0,2,0,0,0,0|0,0,0]=2 3599 B9R1.2 NOc1cccc(Cl)c1 Amb18644044 [0,2,0,0,0,0|0,0,0]=2 3600 B9R1.2 NOc1cccc(F)c1 Amb26633845 [0,2,0,0,0,0|0,0,0]=2 3601 B9R1.2 N\N=C1/C=C(F)C=CN1 Amb20621274 [0,2,0,0,0,0|2,0,0]=4 3602 B9R1.2 N\N=C1/C=CC=C(F)N1 Amb22495259 [0,2,0,0,0,0|2,0,0]=4 3603 B9R1.2 Nc1cc(C=O)ccn1 Amb16231973 [0,2,0,0,0,0|1,0,1]=4 3604 B9R1.2 Nc1cc(CBr)ccn1 Amb27827916 [0,2,0,0,0,0|2,0,0]=4 3605 B9R1.2 Nc1cc(CBr)ccn1 Amb30594401 [0,2,0,0,0,0|2,0,0]=4 3606 B9R1.2 Nc1cc(CCl)ccn1 Amb17739840 [0,2,0,0,0,0|2,0,0]=4 3607 B9R1.2 Nc1cc(CF)ccn1 Amb28052915 [0,2,0,0,0,0|2,0,0]=4 3608 B9R1.2 Nc1cc(CI)ccn1 Amb20247701 [0,2,0,0,0,0|2,0,0]=4 3609 B9R1.2 Nc1cc(CO)ccn1 Amb33530514 [0,2,0,0,0,0|1,0,0]=3 3610 B9R1.2 Nc1cc(CO)ncn1 Amb22728448 [0,2,0,0,0,0|2,0,0]=4 3611 B9R1.2 Nc1cccc(C=O)c1 Amb2697309 [0,2,0,0,0,0|0,0,1]=3 3612 B9R1.2 Nc1cccc(C=O)c1 Amb2697312 [0,2,0,0,0,0|0,0,1]=3 3613 B9R1.2 Nc1cccc(C=O)n1 Amb16231443 [0,2,0,0,0,0|1,0,1]=4 3614 B9R1.2 Nc1cccc(CBr)c1 Amb22728096 [0,2,0,0,0,0|1,0,0]=3 3615 B9R1.2 Nc1cccc(CBr)n1 Amb33329373 [0,2,0,0,0,0|2,0,0]=4 3616 B9R1.2 Nc1cccc(CCl)c1 Amb17477837 [0,2,0,0,0,0|1,0,0]=3 3617 B9R1.2 Nc1cccc(CCl)c1 Amb32661034 [0,2,0,0,0,0|1,0,0]=3 3618 B9R1.2 Nc1cccc(CF)c1 Amb23556448 [0,2,0,0,0,0|1,0,0]=3 3619 B9R1.2 Nc1cccc(CO)c1 Amb2099649 [0,2,0,0,0,0|0,0,0]=2 3620 B9R1.2 Nc1cccc(CO)n1 Amb21857102 [0,2,0,0,0,0|1,0,0]=3 3621 B9R1.2 Nc1cccc(CS)n1 Amb27862989 [0,2,0,0,0,0|1,1,0]=4 3622 B9R1.2 Nc1cccc(NF)c1 Amb27771502 [0,2,0,0,0,0|1,0,0]=3 3623 B9R1.2 Nc1ccnc(C=O)c1 Amb25072810 [0,2,0,0,0,0|1,0,1]=4 3624 B9R1.2 Nc1ccnc(CBr)c1 Amb20247769 [0,2,0,0,0,0|2,0,0]=4 3625 B9R1.2 Nc1ccnc(CCl)c1 Amb27647112 [0,2,0,0,0,0|2,0,0]=4 3626 B9R1.2 Nc1ccnc(CF)c1 Amb25092860 [0,2,0,0,0,0|2,0,0]=4 3627 B9R1.2 Nc1ccnc(CO)c1 Amb22899638 [0,2,0,0,0,0|1,0,0]=3 3628 B9R1.2 Nc1ccnc(CO)c1 Amb33544126 [0,2,0,0,0,0|1,0,0]=3 3629 B9R1.2 Nc1cncc(C=O)c1 Amb26600938 [0,2,0,0,0,0|1,0,1]=4 3630 B9R1.2 Nc1cncc(CBr)c1 Amb20247636 [0,2,0,0,0,0|2,0,0]=4 3631 B9R1.2 Nc1cncc(CCl)c1 Amb24425769 [0,2,0,0,0,0|2,0,0]=4 3632 B9R1.2 Nc1cncc(CO)c1 Amb24102573 [0,2,0,0,0,0|1,0,0]=3 3633 B9R1.2 Nc1cncc(CO)c1 Amb33172805 [0,2,0,0,0,0|1,0,0]=3 3634 B9R1.2 Nc1cncc(CO)c1 Amb8386489 [0,2,0,0,0,0|1,0,0]=3 3635 B9R1.2 Nc1cncc(CO)n1 Amb28060259 [0,2,0,0,0,0|2,0,0]=4 3636 B9R1.2 Nc1nccc(CO)n1 Amb20248683 [0,2,0,0,0,0|2,0,0]=4 3637 B9R1.2 O=C1C=C(CCl)C=CN1 Amb25959595 [0,2,0,0,0,0|1,0,1]=4 3638 B9R1.2 O=C1C=C(CO)C=CN1 Amb21960732 [0,2,0,0,0,0|1,0,0]=3 3639 B9R1.2 O=C1C=C(CO)N=CN1 Amb28346878 [0,2,0,0,0,0|2,0,0]=4 3640 B9R1.2 O=C1C=C(NO)C=CN1 Amb27215484 [0,2,0,0,0,0|1,0,0]=3 3641 B9R1.2 O=C1C=CC=C(CBr)N1 Amb25957289 [0,2,0,0,0,0|1,0,1]=4 3642 B9R1.2 O=C1C=CN=C(NO)N1 Amb24580355 [0,2,0,0,0,0|2,0,0]=4 3643 B9R1.2 O=C1C=CNC(CBr)=C1 Amb24369351 [0,2,0,0,0,0|1,0,1]=4 3644 B9R1.2 O=C1NC=C\C(=N\O)N1 Amb25062604 [0,2,0,0,0,0|2,0,0]=4 3645 B9R1.2 O=CC1=CC=CC(=O)N1 Amb19882313 [0,2,0,0,0,0|1,0,1]=4 3646 B9R1.2 O=CC1=CC=CC(=O)O1 Amb27481476 [0,2,0,0,0,0|1,0,1]=4 3647 B9R1.2 O=Cc1cc(Br)ccn1 Amb10602645 [0,2,0,0,0,0|1,0,1]=4 3648 B9R1.2 O=Cc1cc(Cl)ccn1 Amb6752031 [0,2,0,0,0,0|1,0,1]=4 3649 B9R1.2 O=Cc1cc(F)ccn1 Amb21963126 [0,2,0,0,0,0|1,0,1]=4 3650 B9R1.2 O=Cc1cc(O)ccn1 Amb30982669 [0,2,0,0,0,0|1,0,0]=3 3651 B9R1.2 O=Cc1ccc[n+]([O-])c1 Amb22263067 [0,2,0,0,0,0|1,0,1]=4 3652 B9R1.2 O=Cc1cccc(Br)c1 Amb1232086 [0,2,0,0,0,0|0,0,1]=3 3653 B9R1.2 O=Cc1cccc(Br)n1 Amb535786 [0,2,0,0,0,0|1,0,1]=4 3654 B9R1.2 O=Cc1cccc(Cl)c1 Amb2725499 [0,2,0,0,0,0|0,0,1]=3 3655 B9R1.2 O=Cc1cccc(Cl)n1 Amb8383544 [0,2,0,0,0,0|1,0,1]=4 3656 B9R1.2 O=Cc1cccc(F)c1 Amb535197 [0,2,0,0,0,0|0,0,1]=3 3657 B9R1.2 O=Cc1cccc(F)n1 Amb8386828 [0,2,0,0,0,0|1,0,1]=4 3658 B9R1.2 O=Cc1cccc(I)c1 Amb1033003 [0,2,0,0,0,0|0,0,1]=3 3659 B9R1.2 O=Cc1cccc(O)c1 Amb1880871 [0,2,0,0,0,0|0,0,0]=2 3660 B9R1.2 O=Cc1cccc(O)n1 Amb20247934 [0,2,0,0,0,0|1,0,0]=3 3661 B9R1.2 O=Cc1cccc(S)c1 Amb13952077 [0,2,0,0,0,0|0,0,1]=3 3662 B9R1.2 O=Cc1ccnc(Br)c1 Amb2455911 [0,2,0,0,0,0|1,0,1]=4 3663 B9R1.2 O=Cc1ccnc(Cl)c1 Amb22831477 [0,2,0,0,0,0|1,0,1]=4 3664 B9R1.2 O=Cc1ccnc(Cl)c1 Amb2447585 [0,2,0,0,0,0|1,0,1]=4 3665 B9R1.2 O=Cc1ccnc(F)c1 Amb8396130 [0,2,0,0,0,0|1,0,1]=4 3666 B9R1.2 O=Cc1ccnc(O)c1 Amb2695333 [0,2,0,0,0,0|1,0,0]=3 3667 B9R1.2 O=Cc1cncc(Br)c1 Amb2447305 [0,2,0,0,0,0|1,0,1]=4 3668 B9R1.2 O=Cc1cncc(Cl)c1 Amb6565107 [0,2,0,0,0,0|1,0,1]=4 3669 B9R1.2 O=Cc1cncc(F)c1 Amb2447593 [0,2,0,0,0,0|1,0,1]=4 3670 B9R1.2 O=Cc1cncc(F)c1 Amb33292547 [0,2,0,0,0,0|1,0,1]=4 3671 B9R1.2 O=Cc1cncc(I)c1 Amb6565106 [0,2,0,0,0,0|1,0,1]=4 3672 B9R1.2 O=Cc1cncc(O)c1 Amb19895145 [0,2,0,0,0,0|1,0,0]=3 3673 B9R1.2 O=Cc1cncc(O)n1 Amb28077078 [0,2,0,0,0,0|2,0,0]=4 3674 B9R1.2 O=Nc1cccc(Br)c1 Amb28061595 [0,2,0,0,0,0|0,0,1]=3 3675 B9R1.2 O=Nc1cccc(Cl)c1 Amb28429156 [0,2,0,0,0,0|0,0,1]=3 3676 B9R1.2 OCc1cc(Br)ccn1 Amb8394822 [0,2,0,0,0,0|1,0,0]=3 3677 B9R1.2 OCc1cc(Br)ncn1 Amb25255522 [0,2,0,0,0,0|2,0,0]=4 3678 B9R1.2 OCc1cc(Cl)ccn1 Amb6565083 [0,2,0,0,0,0|1,0,0]=3 3679 B9R1.2 OCc1cc(Cl)ccn1 Amb8503386 [0,2,0,0,0,0|1,0,0]=3 3680 B9R1.2 OCc1cc(Cl)ncn1 Amb23399657 [0,2,0,0,0,0|2,0,0]=4 3681 B9R1.2 OCc1cc(F)ccn1 Amb26599902 [0,2,0,0,0,0|1,0,0]=3 3682 B9R1.2 OCc1cc(F)ncn1 Amb28192079 [0,2,0,0,0,0|2,0,0]=4 3683 B9R1.2 OCc1cc(I)ccn1 Amb24439513 [0,2,0,0,0,0|1,0,0]=3 3684 B9R1.2 OCc1cc(O)ccn1 Amb22292446 [0,2,0,0,0,0|1,0,0]=3 3685 B9R1.2 OCc1cccc(Br)c1 Amb3939091 [0,2,0,0,0,0|0,0,0]=2 3686 B9R1.2 OCc1cccc(Br)n1 Amb8386704 [0,2,0,0,0,0|1,0,0]=3 3687 B9R1.2 OCc1cccc(Cl)c1 Amb1232082 [0,2,0,0,0,0|0,0,0]=2 3688 B9R1.2 OCc1cccc(Cl)n1 Amb6308086 [0,2,0,0,0,0|1,0,0]=3 3689 B9R1.2 OCc1cccc(Cl)n1 Amb8386844 [0,2,0,0,0,0|1,0,0]=3 3690 B9R1.2 OCc1cccc(F)c1 Amb837438 [0,2,0,0,0,0|0,0,0]=2 3691 B9R1.2 OCc1cccc(F)n1 Amb8386821 [0,2,0,0,0,0|1,0,0]=3 3692 B9R1.2 OCc1cccc(I)c1 Amb4605978 [0,2,0,0,0,0|0,0,0]=2 3693 B9R1.2 OCc1cccc(O)c1 Amb2688734 [0,2,0,0,0,0|0,0,0]=2 3694 B9R1.2 OCc1cccc(O)n1 Amb9902171 [0,2,0,0,0,0|1,0,0]=3 3695 B9R1.2 OCc1cccc(S)c1 Amb16231056 [0,2,0,0,0,0|0,0,0]=2 3696 B9R1.2 OCc1ccnc(Br)c1 Amb6306637 [0,2,0,0,0,0|1,0,0]=3 3697 B9R1.2 OCc1ccnc(Br)n1 Amb25320419 [0,2,0,0,0,0|2,0,0]=4 3698 B9R1.2 OCc1ccnc(Cl)c1 Amb6384056 [0,2,0,0,0,0|1,0,0]=3 3699 B9R1.2 OCc1ccnc(Cl)n1 Amb24099659 [0,2,0,0,0,0|2,0,0]=4 3700 B9R1.2 OCc1ccnc(F)c1 Amb20247913 [0,2,0,0,0,0|1,0,0]=3 3701 B9R1.2 OCc1ccnc(F)n1 Amb26424377 [0,2,0,0,0,0|2,0,0]=4 3702 B9R1.2 OCc1ccnc(O)c1 Amb10600384 [0,2,0,0,0,0|1,0,0]=3 3703 B9R1.2 OCc1cncc(Br)c1 Amb6572386 [0,2,0,0,0,0|1,0,0]=3 3704 B9R1.2 OCc1cncc(Br)c1 Amb8285896 [0,2,0,0,0,0|1,0,0]=3 3705 B9R1.2 OCc1cncc(Br)n1 Amb21964568 [0,2,0,0,0,0|2,0,0]=4 3706 B9R1.2 OCc1cncc(Cl)c1 Amb10975945 [0,2,0,0,0,0|1,0,0]=3 3707 B9R1.2 OCc1cncc(Cl)n1 Amb21856133 [0,2,0,0,0,0|2,0,0]=4 3708 B9R1.2 OCc1cncc(F)c1 Amb10603180 [0,2,0,0,0,0|1,0,0]=3 3709 B9R1.2 OCc1cncc(F)n1 Amb28323505 [0,2,0,0,0,0|2,0,0]=4 3710 B9R1.2 OCc1cncc(O)c1 Amb23401211 [0,2,0,0,0,0|1,0,0]=3 3711 B9R1.2 OCc1nccc(Br)n1 Amb26464048 [0,2,0,0,0,0|2,0,0]=4 3712 B9R1.2 OCc1nccc(Cl)n1 Amb22235687 [0,2,0,0,0,0|2,0,0]=4 3713 B9R1.2 OCc1nccc(O)n1 Amb22737475 [0,2,0,0,0,0|2,0,0]=4 3714 B9R1.2 OCc1nccc(O)n1 Amb35750765 [0,2,0,0,0,0|2,0,0]=4 3715 B9R1.2 ONc1cccc(O)c1 Amb28144169 [0,2,0,0,0,0|0,0,0]=2 3716 B9R1.2 Oc1cc(CBr)ncn1 Amb22494518 [0,2,0,0,0,0|2,0,0]=4 3717 B9R1.2 Oc1cc(CF)ccn1 Amb28053195 [0,2,0,0,0,0|1,0,0]=3 3718 B9R1.2 Oc1cccc(CBr)c1 Amb5719379 [0,2,0,0,0,0|0,0,0]=2 3719 B9R1.2 Oc1cccc(CCl)c1 Amb8391842 [0,2,0,0,0,0|0,0,0]=2 3720 B9R1.2 Oc1cccc(CF)n1 Amb25195006 [0,2,0,0,0,0|1,0,0]=3 3721 B9R1.2 Oc1cccc(CS)c1 Amb18643580 [0,2,0,0,0,0|0,0,0]=2 3722 B9R1.2 Oc1ccnc(CI)n1 Amb28317908 [0,2,0,0,0,0|2,0,0]=4 3723 B9R1.2 Oc1ccnc(CS)n1 Amb24553855 [0,2,0,0,0,0|2,0,0]=4 3724 B9R1.2 Oc1cncc(CBr)c1 Amb28383974 [0,2,0,0,0,0|1,0,0]=3 3725 B9R1.2 SCc1cc(Cl)ccn1 Amb26561713 [0,2,0,0,0,0|1,1,0]=4 3726 B9R1.2 SCc1cccc(Br)c1 Amb2691874 [0,2,0,0,0,0|0,1,0]=3 3727 B9R1.2 SCc1cccc(Br)n1 Amb25212807 [0,2,0,0,0,0|1,1,0]=4 3728 B9R1.2 SCc1cccc(Cl)c1 Amb6255953 [0,2,0,0,0,0|0,1,0]=3 3729 B9R1.2 SCc1cccc(Cl)n1 Amb24726180 [0,2,0,0,0,0|1,1,0]=4 3730 B9R1.2 SCc1cccc(I)c1 Amb26546229 [0,2,0,0,0,0|0,1,0]=3 3731 B9R1.2 SCc1ccnc(Cl)c1 Amb22396233 [0,2,0,0,0,0|1,1,0]=4 3732 B9R1.2 SCc1cncc(Br)c1 Amb26918390 [0,2,0,0,0,0|1,1,0]=4 3733 B9R1.2 SCc1cncc(Cl)c1 Amb32788379 [0,2,0,0,0,0|1,1,0]=4 3734 B9R1.2 Sc1cccc(CCl)c1 Amb25793601 [0,2,0,0,0,0|0,1,0]=3 3735 B9R1.2 [15N]#[13C]c1cc(Br)ccn1 Amb13884625 [0,2,0,0,0,0|2,0,0]=4 3736 B9R1.2 [15N]#[13C]c1cccc(Br)n1 Amb13884626 [0,2,0,0,0,0|2,0,0]=4 3737 B9R1.2 [C-]#[N+]c1cc(C)ccn1 Amb26952848 [0,2,0,0,0,0|2,0,0]=4 3738 B9R1.2 [C-]#[N+]c1cc(Cl)ccn1 Amb24574174 [0,2,0,0,0,0|2,0,0]=4 3739 B9R1.2 [C-]#[N+]c1cc(F)ccn1 Amb33414563 [0,2,0,0,0,0|2,0,0]=4 3740 B9R1.2 [C-]#[N+]c1cccc(Br)c1 Amb2685424 [0,2,0,0,0,0|1,0,0]=3 3741 B9R1.2 [C-]#[N+]c1cccc(Br)n1 Amb24121267 [0,2,0,0,0,0|2,0,0]=4 3742 B9R1.2 [C-]#[N+]c1cccc(C)c1 Amb24640797 [0,2,0,0,0,0|1,0,0]=3 3743 B9R1.2 [C-]#[N+]c1cccc(C)n1 Amb28326230 [0,2,0,0,0,0|2,0,0]=4 3744 B9R1.2 [C-]#[N+]c1cccc(Cl)c1 Amb1981077 [0,2,0,0,0,0|1,0,0]=3 3745 B9R1.2 [C-]#[N+]c1cccc(Cl)n1 Amb24121268 [0,2,0,0,0,0|2,0,0]=4 3746 B9R1.2 [C-]#[N+]c1cccc(F)c1 Amb2688353 [0,2,0,0,0,0|1,0,0]=3 3747 B9R1.2 [C-]#[N+]c1cccc(I)c1 Amb2592732 [0,2,0,0,0,0|1,0,0]=3 3748 B9R1.2 [C-]#[N+]c1ccnc(Br)c1 Amb26568065 [0,2,0,0,0,0|2,0,0]=4 3749 B9R1.2 [C-]#[N+]c1ccnc(C)c1 Amb33268166 [0,2,0,0,0,0|2,0,0]=4 3750 B9R1.2 [C-]#[N+]c1ccnc(Cl)c1 Amb27240241 [0,2,0,0,0,0|2,0,0]=4 3751 B9R1.2 [C-]#[N+]c1cncc(Br)c1 Amb28062408 [0,2,0,0,0,0|2,0,0]=4 3752 B9R1.2 [C-]#[N+]c1cncc(C)c1 Amb24665977 [0,2,0,0,0,0|2,0,0]=4 3753 B9R1.2 [C-]#[N+]c1cncc(F)c1 Amb27851641 [0,2,0,0,0,0|2,0,0]=4 3754 B9R1.2 [NH3+]Cc1cccc(Br)c1 Amb24113872 [0,2,0,0,0,0|1,0,0]=3 3755 B9R1.2 [NH3+]Cc1cccc(Cl)c1 Amb22641594 [0,2,0,0,0,0|1,0,0]=3 3756 B9R1.2 [NH3+]Cc1cccc(O)c1 Amb22547663 [0,2,0,0,0,0|0,0,0]=2 3757 B9R1.2 [NH3+]Nc1cccc(Cl)c1 Amb24113863 [0,2,0,0,0,0|1,0,0]=3 3758 B9R1.2 [NH3+]Nc1cccc(F)c1 Amb24113847 [0,2,0,0,0,0|1,0,0]=3 3759 B9R1.2 [O-][n+]1cccc(CCl)c1 Amb26960298 [0,2,0,0,0,0|1,0,1]=4 3760 B9R1.2 [O-][n+]1cccc(CO)c1 Amb10552691 [0,2,0,0,0,0|1,0,0]=3 3761 B9R1.2 [O-][n+]1cccc(NF)c1 Amb27974575 [0,2,0,0,0,0|1,0,1]=4 3762 B9R1.2 [SiH3]Oc1ccnc(Br)n1 Amb27462109 [0,2,0,0,0,0|2,0,0]=4 3763 B9R1.2 [Zn+]Cc1cccc(I)c1 Amb22337135 [0,2,0,0,0,0|1,0,0]=3 3764 B9R1.6 BrC(Br)c1ccccc1 Amb8513496 [0,2,0,0,0,0|1,0,0]=3 3765 B9R1.6 C=C(Br)c1ccccc1 Amb8516473 [0,2,0,0,0,0|1,0,0]=3 3766 B9R1.6 C=C(Br)c1ccccn1 Amb2447497 [0,2,0,0,0,0|2,0,0]=4 3767 B9R1.6 C=C(Br)c1ccncc1 Amb24710590 [0,2,0,0,0,0|2,0,0]=4 3768 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [0,2,0,0,0,0|1,0,0]=3 3769 B9R1.6 C=C(C)c1ccccn1 Amb25077592 [0,2,0,0,0,0|2,0,0]=4 3770 B9R1.6 C=C(C)c1cccnc1 Amb26389581 [0,2,0,0,0,0|2,0,0]=4 3771 B9R1.6 C=C(C)c1ccncc1 Amb25126374 [0,2,0,0,0,0|2,0,0]=4 3772 B9R1.6 C=C(Cl)c1ccccc1 Amb27775278 [0,2,0,0,0,0|1,0,0]=3 3773 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [0,2,0,0,0,0|1,0,0]=3 3774 B9R1.6 C=C(F)c1ccccn1 Amb20248373 [0,2,0,0,0,0|2,0,0]=4 3775 B9R1.6 C=C(F)c1ccncc1 Amb20248442 [0,2,0,0,0,0|2,0,0]=4 3776 B9R1.6 CC(=N)c1cccnc1 Amb22170296 [0,2,0,0,0,0|2,0,0]=4 3777 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [0,2,0,0,0,0|0,0,1]=3 3778 B9R1.6 CC(=O)c1ccccn1 Amb932786 [0,2,0,0,0,0|1,0,1]=4 3779 B9R1.6 CC(=O)c1cccnc1 Amb2610530 [0,2,0,0,0,0|1,0,1]=4 3780 B9R1.6 CC(=O)c1ccncc1 Amb2792762 [0,2,0,0,0,0|1,0,1]=4 3781 B9R1.6 CC(Br)c1ccccc1 Amb5716854 [0,2,0,0,0,0|1,0,0]=3 3782 B9R1.6 CC(Br)c1ccccn1 Amb6770323 [0,2,0,0,0,0|2,0,0]=4 3783 B9R1.6 CC(Br)c1ccccn1 Amb8835436 [0,2,0,0,0,0|2,0,0]=4 3784 B9R1.6 CC(Br)c1cccnc1 Amb33552368 [0,2,0,0,0,0|2,0,0]=4 3785 B9R1.6 CC(Br)c1cccnc1 Amb8835401 [0,2,0,0,0,0|2,0,0]=4 3786 B9R1.6 CC(Br)c1ccncc1 Amb10610143 [0,2,0,0,0,0|2,0,0]=4 3787 B9R1.6 CC(Br)c1ccncc1 Amb9210657 [0,2,0,0,0,0|2,0,0]=4 3788 B9R1.6 CC(C)c1ccccc1 Amb2793016 [0,2,0,0,0,0|1,0,0]=3 3789 B9R1.6 CC(C)c1ccccc1 Amb33524021 [0,2,0,0,0,0|1,0,0]=3 3790 B9R1.6 CC(C)c1ccccn1 Amb8438962 [0,2,0,0,0,0|2,0,0]=4 3791 B9R1.6 CC(C)c1cccnc1 Amb24320774 [0,2,0,0,0,0|2,0,0]=4 3792 B9R1.6 CC(C)c1ccncc1 Amb2694187 [0,2,0,0,0,0|2,0,0]=4 3793 B9R1.6 CC(Cl)c1ccccc1 Amb5716855 [0,2,0,0,0,0|1,0,0]=3 3794 B9R1.6 CC(Cl)c1ccccn1 Amb10610197 [0,2,0,0,0,0|2,0,0]=4 3795 B9R1.6 CC(Cl)c1ccccn1 Amb9205056 [0,2,0,0,0,0|2,0,0]=4 3796 B9R1.6 CC(Cl)c1cccnc1 Amb13952205 [0,2,0,0,0,0|2,0,0]=4 3797 B9R1.6 CC(Cl)c1cccnc1 Amb9205037 [0,2,0,0,0,0|2,0,0]=4 3798 B9R1.6 CC(Cl)c1ccncc1 Amb19514972 [0,2,0,0,0,0|2,0,0]=4 3799 B9R1.6 CC(Cl)c1ccncc1 Amb9205038 [0,2,0,0,0,0|2,0,0]=4 3800 B9R1.6 CC(N)c1ccccc1 Amb5716844 [0,2,0,0,0,0|1,0,0]=3 3801 B9R1.6 CC(N)c1ccccn1 Amb1102610 [0,2,0,0,0,0|2,0,0]=4 3802 B9R1.6 CC(N)c1ccccn1 Amb22265614 [0,2,0,0,0,0|2,0,0]=4 3803 B9R1.6 CC(N)c1ccccn1 Amb24064899 [0,2,0,0,0,0|2,0,0]=4 3804 B9R1.6 CC(N)c1ccccn1 Amb31206895 [0,2,0,0,0,0|2,0,0]=4 3805 B9R1.6 CC(N)c1cccnc1 Amb1214297 [0,2,0,0,0,0|2,0,0]=4 3806 B9R1.6 CC(N)c1cccnc1 Amb22754521 [0,2,0,0,0,0|2,0,0]=4 3807 B9R1.6 CC(N)c1ccncc1 Amb19958395 [0,2,0,0,0,0|2,0,0]=4 3808 B9R1.6 CC(N)c1ccncc1 Amb32662788 [0,2,0,0,0,0|2,0,0]=4 3809 B9R1.6 CC(N)c1ccncc1 Amb9745700 [0,2,0,0,0,0|2,0,0]=4 3810 B9R1.6 CC(O)C1C=C=CC=C1 Amb27197983 [0,2,0,0,0,0|0,0,2]=4 3811 B9R1.6 CC(O)c1ccccc1 Amb3940114 [0,2,0,0,0,0|0,0,0]=2 3812 B9R1.6 CC(O)c1ccccn1 Amb32666055 [0,2,0,0,0,0|1,0,0]=3 3813 B9R1.6 CC(O)c1ccccn1 Amb9748230 [0,2,0,0,0,0|1,0,0]=3 3814 B9R1.6 CC(O)c1cccnc1 Amb9748268 [0,2,0,0,0,0|1,0,0]=3 3815 B9R1.6 CC(O)c1cccnn1 Amb26346035 [0,2,0,0,0,0|2,0,0]=4 3816 B9R1.6 CC(O)c1ccncc1 Amb6705768 [0,2,0,0,0,0|1,0,0]=3 3817 B9R1.6 CC(O)c1ccncn1 Amb24477841 [0,2,0,0,0,0|2,0,0]=4 3818 B9R1.6 CC(O)c1cnccn1 Amb13952214 [0,2,0,0,0,0|2,0,0]=4 3819 B9R1.6 CC(O)c1cncnc1 Amb22055840 [0,2,0,0,0,0|2,0,0]=4 3820 B9R1.6 CC(O)c1ncccn1 Amb22284841 [0,2,0,0,0,0|2,0,0]=4 3821 B9R1.6 CC(S)c1ccccc1 Amb6256013 [0,2,0,0,0,0|0,1,0]=3 3822 B9R1.6 CC(S)c1ccccn1 Amb9208044 [0,2,0,0,0,0|1,1,0]=4 3823 B9R1.6 CC(S)c1cccnc1 Amb9208030 [0,2,0,0,0,0|1,1,0]=4 3824 B9R1.6 CC(S)c1ccncc1 Amb9208031 [0,2,0,0,0,0|1,1,0]=4 3825 B9R1.6 CN(C)c1ccccc1 Amb2793014 [0,2,0,0,0,0|1,0,0]=3 3826 B9R1.6 CN(C)c1ccccn1 Amb9825822 [0,2,0,0,0,0|2,0,0]=4 3827 B9R1.6 CN(C)c1cccnc1 Amb2622130 [0,2,0,0,0,0|2,0,0]=4 3828 B9R1.6 CN(C)c1ccncc1 Amb2613773 [0,2,0,0,0,0|2,0,0]=4 3829 B9R1.6 CN(N)c1ccccc1 Amb1153615 [0,2,0,0,0,0|1,0,0]=3 3830 B9R1.6 CN(N)c1ccccc1 Amb22754142 [0,2,0,0,0,0|1,0,0]=3 3831 B9R1.6 CN(N)c1ccccc1 Amb33172726 [0,2,0,0,0,0|1,0,0]=3 3832 B9R1.6 CN(N)c1ccccc1 Amb9677307 [0,2,0,0,0,0|1,0,0]=3 3833 B9R1.6 CN(N)c1ccccn1 Amb18642128 [0,2,0,0,0,0|2,0,0]=4 3834 B9R1.6 CN(N)c1cccnc1 Amb24085137 [0,2,0,0,0,0|2,0,0]=4 3835 B9R1.6 CN(N)c1ccncc1 Amb26494358 [0,2,0,0,0,0|2,0,0]=4 3836 B9R1.6 CN(O)c1ccccc1 Amb28245898 [0,2,0,0,0,0|0,0,0]=2 3837 B9R1.6 CP(C)c1ccncc1 Amb35750173 [0,2,0,0,0,0|2,0,0]=4 3838 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [0,2,0,0,0,0|1,0,0]=3 3839 B9R1.6 CS(=O)c1ccccc1 Amb8516154 [0,2,0,0,0,0|0,0,1]=3 3840 B9R1.6 CS(=O)c1ccccn1 Amb24562247 [0,2,0,0,0,0|1,0,1]=4 3841 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [0,2,0,0,0,0|1,0,0]=3 3842 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [0,2,0,0,0,0|1,0,0]=3 3843 B9R1.6 C[C@@H](N)c1ccccc1 Amb3940166 [0,2,0,0,0,0|1,0,0]=3 3844 B9R1.6 C[C@@H](N)c1ccccn1 Amb19514583 [0,2,0,0,0,0|2,0,0]=4 3845 B9R1.6 C[C@@H](N)c1ccccn1 Amb2695967 [0,2,0,0,0,0|2,0,0]=4 3846 B9R1.6 C[C@@H](N)c1ccccn1 Amb30526699 [0,2,0,0,0,0|2,0,0]=4 3847 B9R1.6 C[C@@H](N)c1cccnc1 Amb13951181 [0,2,0,0,0,0|2,0,0]=4 3848 B9R1.6 C[C@@H](N)c1cccnc1 Amb6893473 [0,2,0,0,0,0|2,0,0]=4 3849 B9R1.6 C[C@@H](N)c1ccncc1 Amb13952719 [0,2,0,0,0,0|2,0,0]=4 3850 B9R1.6 C[C@@H](N)c1ccncc1 Amb6893468 [0,2,0,0,0,0|2,0,0]=4 3851 B9R1.6 C[C@@H](O)c1ccccc1 Amb6366772 [0,2,0,0,0,0|0,0,0]=2 3852 B9R1.6 C[C@@H](O)c1ccccn1 Amb24087444 [0,2,0,0,0,0|1,0,0]=3 3853 B9R1.6 C[C@@H](O)c1ccccn1 Amb4166327 [0,2,0,0,0,0|1,0,0]=3 3854 B9R1.6 C[C@@H](O)c1cccnc1 Amb6893471 [0,2,0,0,0,0|1,0,0]=3 3855 B9R1.6 C[C@@H](O)c1ccncc1 Amb6893466 [0,2,0,0,0,0|1,0,0]=3 3856 B9R1.6 C[C@@H](O)c1ccncn1 Amb27235358 [0,2,0,0,0,0|2,0,0]=4 3857 B9R1.6 C[C@@H](O)c1cnccn1 Amb19514758 [0,2,0,0,0,0|2,0,0]=4 3858 B9R1.6 C[C@@H](O)c1cncnc1 Amb27265907 [0,2,0,0,0,0|2,0,0]=4 3859 B9R1.6 C[C@@H](O)c1ncccn1 Amb25313724 [0,2,0,0,0,0|2,0,0]=4 3860 B9R1.6 C[C@@H](S)c1ccccc1 Amb28069838 [0,2,0,0,0,0|0,1,0]=3 3861 B9R1.6 C[C@H](Br)c1ccccn1 Amb28123940 [0,2,0,0,0,0|2,0,0]=4 3862 B9R1.6 C[C@H](Cl)c1ccccn1 Amb33068907 [0,2,0,0,0,0|2,0,0]=4 3863 B9R1.6 C[C@H](N)c1ccccc1 Amb2725550 [0,2,0,0,0,0|1,0,0]=3 3864 B9R1.6 C[C@H](N)c1ccccn1 Amb13951343 [0,2,0,0,0,0|2,0,0]=4 3865 B9R1.6 C[C@H](N)c1ccccn1 Amb33871554 [0,2,0,0,0,0|2,0,0]=4 3866 B9R1.6 C[C@H](N)c1ccccn1 Amb6893465 [0,2,0,0,0,0|2,0,0]=4 3867 B9R1.6 C[C@H](N)c1cccnc1 Amb30647445 [0,2,0,0,0,0|2,0,0]=4 3868 B9R1.6 C[C@H](N)c1cccnc1 Amb6893472 [0,2,0,0,0,0|2,0,0]=4 3869 B9R1.6 C[C@H](N)c1ccncc1 Amb28895917 [0,2,0,0,0,0|2,0,0]=4 3870 B9R1.6 C[C@H](N)c1ccncc1 Amb6893469 [0,2,0,0,0,0|2,0,0]=4 3871 B9R1.6 C[C@H](O)c1ccccc1 Amb4021849 [0,2,0,0,0,0|0,0,0]=2 3872 B9R1.6 C[C@H](O)c1ccccn1 Amb30526838 [0,2,0,0,0,0|1,0,0]=3 3873 B9R1.6 C[C@H](O)c1cccnc1 Amb6893470 [0,2,0,0,0,0|1,0,0]=3 3874 B9R1.6 C[C@H](O)c1ccncc1 Amb6893467 [0,2,0,0,0,0|1,0,0]=3 3875 B9R1.6 C[C@H](O)c1ccncn1 Amb26019235 [0,2,0,0,0,0|2,0,0]=4 3876 B9R1.6 C[C@H](O)c1cnccn1 Amb26977321 [0,2,0,0,0,0|2,0,0]=4 3877 B9R1.6 C[C@H](O)c1cncnc1 Amb25259575 [0,2,0,0,0,0|2,0,0]=4 3878 B9R1.6 C[C@H](O)c1ncccn1 Amb24428544 [0,2,0,0,0,0|2,0,0]=4 3879 B9R1.6 C[C@H](S)c1ccccc1 Amb25935694 [0,2,0,0,0,0|0,1,0]=3 3880 B9R1.6 C[S+](C)c1ccccc1 Amb27958149 [0,2,0,0,0,0|0,1,0]=3 3881 B9R1.6 C[SiH](C)c1ccccn1 Amb22336977 [0,2,0,0,0,0|2,0,0]=4 3882 B9R1.6 C[Si](C)c1ccccc1 Amb33781101 [0,2,0,0,0,0|1,0,0]=3 3883 B9R1.6 ClB(Cl)c1ccccc1 Amb8515558 [0,2,0,0,0,0|1,0,0]=3 3884 B9R1.6 ClC(Cl)c1ccccn1 Amb22295832 [0,2,0,0,0,0|2,0,0]=4 3885 B9R1.6 ClP(Cl)c1ccccc1 Amb6365769 [0,2,0,0,0,0|1,0,0]=3 3886 B9R1.6 Cl[IH2](Cl)c1ccccc1 Amb10071738 [0,2,0,0,0,0|1,0,0]=3 3887 B9R1.6 FC(Cl)c1ccccc1 Amb10838337 [0,2,0,0,0,0|1,0,0]=3 3888 B9R1.6 FC(F)c1ccccc1 Amb10606272 [0,2,0,0,0,0|1,0,0]=3 3889 B9R1.6 FC(F)c1ccccn1 Amb19894454 [0,2,0,0,0,0|2,0,0]=4 3890 B9R1.6 FC(F)c1cccnc1 Amb10605994 [0,2,0,0,0,0|2,0,0]=4 3891 B9R1.6 FC(F)c1ccncc1 Amb19894457 [0,2,0,0,0,0|2,0,0]=4 3892 B9R1.6 N=C(/N)c1ccncc1 Amb20243353 [0,2,0,0,0,0|2,0,0]=4 3893 B9R1.6 N=C(Cl)c1ccccc1 Amb28285285 [0,2,0,0,0,0|1,0,0]=3 3894 B9R1.6 N=C(N)c1cc[nH+]cc1 Amb22734887 [0,2,0,0,0,0|2,0,0]=4 3895 B9R1.6 N=C(N)c1ccc[nH+]c1 Amb22166890 [0,2,0,0,0,0|2,0,0]=4 3896 B9R1.6 N=C(N)c1cccc[nH+]1 Amb4004574 [0,2,0,0,0,0|2,0,0]=4 3897 B9R1.6 N=C(N)c1ccccc1 Amb10068704 [0,2,0,0,0,0|1,0,0]=3 3898 B9R1.6 N=C(N)c1ccccc1 Amb2371546 [0,2,0,0,0,0|1,0,0]=3 3899 B9R1.6 N=C(N)c1ccccc1 Amb6337518 [0,2,0,0,0,0|1,0,0]=3 3900 B9R1.6 N=C(N)c1ccccn1 Amb2696370 [0,2,0,0,0,0|2,0,0]=4 3901 B9R1.6 N=C(N)c1ccccn1 Amb2725149 [0,2,0,0,0,0|2,0,0]=4 3902 B9R1.6 N=C(N)c1cccnc1 Amb2695043 [0,2,0,0,0,0|2,0,0]=4 3903 B9R1.6 N=C(N)c1cccnc1 Amb2782187 [0,2,0,0,0,0|2,0,0]=4 3904 B9R1.6 N=C(N)c1ccncc1 Amb2695050 [0,2,0,0,0,0|2,0,0]=4 3905 B9R1.6 N=C(N)c1ccncc1 Amb2724144 [0,2,0,0,0,0|2,0,0]=4 3906 B9R1.6 N=C(N)c1ccncc1 Amb34916282 [0,2,0,0,0,0|2,0,0]=4 3907 B9R1.6 N=C(N)c1ccncc1 Amb8630084 [0,2,0,0,0,0|2,0,0]=4 3908 B9R1.6 N=C(O)c1cnccn1 Amb22166847 [0,2,0,0,0,0|2,0,0]=4 3909 B9R1.6 NC(=O)[n+]1ccccc1 Amb27806689 [0,2,0,0,0,0|1,0,1]=4 3910 B9R1.6 NC(=O)c1ccc[nH+]c1 Amb8465811 [0,2,0,0,0,0|1,0,1]=4 3911 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [0,2,0,0,0,0|0,0,1]=3 3912 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [0,2,0,0,0,0|1,0,1]=4 3913 B9R1.6 NC(=O)c1cccnc1 Amb2609940 [0,2,0,0,0,0|1,0,1]=4 3914 B9R1.6 NC(=O)c1ccncc1 Amb5721989 [0,2,0,0,0,0|1,0,1]=4 3915 B9R1.6 NC(=S)c1ccccc1 Amb6338789 [0,2,0,0,0,0|0,1,0]=3 3916 B9R1.6 NC(=S)c1ccccn1 Amb6316123 [0,2,0,0,0,0|1,1,0]=4 3917 B9R1.6 NC(=S)c1cccnc1 Amb1152408 [0,2,0,0,0,0|1,1,0]=4 3918 B9R1.6 NC(=S)c1ccncc1 Amb1397718 [0,2,0,0,0,0|1,1,0]=4 3919 B9R1.6 NC(=[NH2+])c1ccccn1 Amb16233715 [0,2,0,0,0,0|2,0,0]=4 3920 B9R1.6 NC(F)c1ccncc1 Amb27844854 [0,2,0,0,0,0|2,0,0]=4 3921 B9R1.6 NC(N)c1ccccc1 Amb28069502 [0,2,0,0,0,0|1,0,0]=3 3922 B9R1.6 NC(N)c1ccncc1 Amb24079161 [0,2,0,0,0,0|2,0,0]=4 3923 B9R1.6 NS(=O)c1ccccc1 Amb26487323 [0,2,0,0,0,0|0,0,1]=3 3924 B9R1.6 O=C(Br)c1ccccc1 Amb8513573 [0,2,0,0,0,0|0,0,1]=3 3925 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [0,2,0,0,0,0|1,0,1]=4 3926 B9R1.6 O=C(Cl)c1ccccc1 Amb3939302 [0,2,0,0,0,0|0,0,1]=3 3927 B9R1.6 O=C(Cl)c1ccccn1 Amb22492448 [0,2,0,0,0,0|1,0,1]=4 3928 B9R1.6 O=C(Cl)c1ccccn1 Amb2690341 [0,2,0,0,0,0|1,0,1]=4 3929 B9R1.6 O=C(Cl)c1ccccn1 Amb3939534 [0,2,0,0,0,0|1,0,1]=4 3930 B9R1.6 O=C(Cl)c1cccnc1 Amb33531191 [0,2,0,0,0,0|1,0,1]=4 3931 B9R1.6 O=C(Cl)c1cccnc1 Amb839669 [0,2,0,0,0,0|1,0,1]=4 3932 B9R1.6 O=C(Cl)c1ccncc1 Amb2707217 [0,2,0,0,0,0|1,0,1]=4 3933 B9R1.6 O=C(Cl)c1ccncc1 Amb2720189 [0,2,0,0,0,0|1,0,1]=4 3934 B9R1.6 O=C(F)c1ccccc1 Amb10607152 [0,2,0,0,0,0|0,0,1]=3 3935 B9R1.6 O=C(O)C1=CCOC=C1 Amb27860440 [0,2,0,0,0,0|1,0,1]=4 3936 B9R1.6 O=C(O)C1C=CCC=C1 Amb17593268 [0,2,0,0,0,0|0,0,2]=4 3937 B9R1.6 O=C(O)c1ccccc1 Amb1935196 [0,2,0,0,0,0|0,0,0]=2 3938 B9R1.6 O=C(O)c1ccccc1 Amb22002523 [0,2,0,0,0,0|0,0,0]=2 3939 B9R1.6 O=C(O)c1ccccc1 Amb22336602 [0,2,0,0,0,0|0,0,0]=2 3940 B9R1.6 O=C(O)c1ccccc1 Amb22351742 [0,2,0,0,0,0|0,0,0]=2 3941 B9R1.6 O=C(O)c1ccccn1 Amb1227737 [0,2,0,0,0,0|1,0,0]=3 3942 B9R1.6 O=C(O)c1ccccn1 Amb4035065 [0,2,0,0,0,0|1,0,0]=3 3943 B9R1.6 O=C(O)c1cccnc1 Amb1195995 [0,2,0,0,0,0|1,0,0]=3 3944 B9R1.6 O=C(O)c1cccnn1 Amb33544461 [0,2,0,0,0,0|2,0,0]=4 3945 B9R1.6 O=C(O)c1ccncc1 Amb2609990 [0,2,0,0,0,0|1,0,0]=3 3946 B9R1.6 O=C(O)c1ccncn1 Amb1102414 [0,2,0,0,0,0|2,0,0]=4 3947 B9R1.6 O=C(O)c1ccnnc1 Amb2691390 [0,2,0,0,0,0|2,0,0]=4 3948 B9R1.6 O=C(O)c1cnccn1 Amb2455963 [0,2,0,0,0,0|2,0,0]=4 3949 B9R1.6 O=C(O)c1cncnc1 Amb24099331 [0,2,0,0,0,0|2,0,0]=4 3950 B9R1.6 O=C(O)c1cncnc1 Amb33527289 [0,2,0,0,0,0|2,0,0]=4 3951 B9R1.6 O=C(O)c1ncccn1 Amb19330380 [0,2,0,0,0,0|2,0,0]=4 3952 B9R1.6 O=C(O)c1ncccn1 Amb2720395 [0,2,0,0,0,0|2,0,0]=4 3953 B9R1.6 O=C(S)c1ccccc1 Amb8513358 [0,2,0,0,0,0|0,0,1]=3 3954 B9R1.6 O=C([O-])c1ccccc1 Amb22053472 [0,2,0,0,0,0|0,0,1]=3 3955 B9R1.6 O=C([O-])c1ccccc1 Amb22168438 [0,2,0,0,0,0|0,0,1]=3 3956 B9R1.6 O=C([O-])c1ccccc1 Amb8387740 [0,2,0,0,0,0|0,0,1]=3 3957 B9R1.6 O=C([O-])c1ccccc1 Amb8513916 [0,2,0,0,0,0|0,0,1]=3 3958 B9R1.6 O=C([O-])c1ccccc1 Amb8517378 [0,2,0,0,0,0|0,0,1]=3 3959 B9R1.6 O=C([O-])c1ccccn1 Amb22058087 [0,2,0,0,0,0|1,0,1]=4 3960 B9R1.6 O=C([O-])c1ccccn1 Amb22734923 [0,2,0,0,0,0|1,0,1]=4 3961 B9R1.6 O=C([O-])c1ccccn1 Amb8393579 [0,2,0,0,0,0|1,0,1]=4 3962 B9R1.6 O=C([O-])c1ccccn1 Amb8393582 [0,2,0,0,0,0|1,0,1]=4 3963 B9R1.6 O=C([O-])c1ccncc1 Amb22730239 [0,2,0,0,0,0|1,0,1]=4 3964 B9R1.6 O=I(=O)c1ccccc1 Amb9679129 [0,2,0,0,0,0|0,0,1]=3 3965 B9R1.6 O=N(=O)c1ccncc1 Amb20621911 [0,2,0,0,0,0|1,0,1]=4 3966 B9R1.6 O=S(Cl)c1ccccc1 Amb13881360 [0,2,0,0,0,0|0,0,1]=3 3967 B9R1.6 O=S(O)c1ccccc1 Amb17939345 [0,2,0,0,0,0|0,0,0]=2 3968 B9R1.6 O=S(O)c1cccnc1 Amb24062548 [0,2,0,0,0,0|1,0,0]=3 3969 B9R1.6 O=S(O)c1cccnc1 Amb32674890 [0,2,0,0,0,0|1,0,0]=3 3970 B9R1.6 O=S([O-])c1ccccc1 Amb2684569 [0,2,0,0,0,0|0,0,1]=3 3971 B9R1.6 O=S([O-])c1ccccc1 Amb28536248 [0,2,0,0,0,0|0,0,1]=3 3972 B9R1.6 O=S([O-])c1ccccn1 Amb22751253 [0,2,0,0,0,0|1,0,1]=4 3973 B9R1.6 O=S([O-])c1ccccn1 Amb33212385 [0,2,0,0,0,0|1,0,1]=4 3974 B9R1.6 O=S([O-])c1cccnc1 Amb27872709 [0,2,0,0,0,0|1,0,1]=4 3975 B9R1.6 O=S([O-])c1ccncc1 Amb30982202 [0,2,0,0,0,0|1,0,1]=4 3976 B9R1.6 O=[N+]([O-])c1ccccc1 Amb2793077 [0,2,0,0,0,0|0,0,1]=3 3977 B9R1.6 O=[N+]([O-])c1ccccn1 Amb7774175 [0,2,0,0,0,0|1,0,1]=4 3978 B9R1.6 O=[N+]([O-])c1cccnc1 Amb8516101 [0,2,0,0,0,0|1,0,1]=4 3979 B9R1.6 O=[N+]([O-])c1ccncc1 Amb2610532 [0,2,0,0,0,0|1,0,1]=4 3980 B9R1.6 O=[PH](O)c1ccccc1 Amb3371978 [0,2,0,0,0,0|0,0,0]=2 3981 B9R1.6 O=[Se](O)c1ccccc1 Amb4138617 [0,2,0,0,0,0|0,0,0]=2 3982 B9R1.6 OB(O)c1ccccc1 Amb22587706 [0,2,0,0,0,0|0,0,0]=2 3983 B9R1.6 OB(O)c1ccccc1 Amb6365485 [0,2,0,0,0,0|0,0,0]=2 3984 B9R1.6 OB(O)c1ccccn1 Amb2383498 [0,2,0,0,0,0|1,0,0]=3 3985 B9R1.6 OB(O)c1cccnc1 Amb1353193 [0,2,0,0,0,0|1,0,0]=3 3986 B9R1.6 OB(O)c1cccnc1 Amb21954295 [0,2,0,0,0,0|1,0,0]=3 3987 B9R1.6 OB(O)c1cccnn1 Amb23403685 [0,2,0,0,0,0|2,0,0]=4 3988 B9R1.6 OB(O)c1ccncc1 Amb13887063 [0,2,0,0,0,0|1,0,0]=3 3989 B9R1.6 OB(O)c1ccncc1 Amb2383497 [0,2,0,0,0,0|1,0,0]=3 3990 B9R1.6 OB(O)c1ccncc1 Amb2690422 [0,2,0,0,0,0|1,0,0]=3 3991 B9R1.6 OB(O)c1ccncn1 Amb8631042 [0,2,0,0,0,0|2,0,0]=4 3992 B9R1.6 OB(O)c1ccnnc1 Amb27256964 [0,2,0,0,0,0|2,0,0]=4 3993 B9R1.6 OB(O)c1cnccn1 Amb22000964 [0,2,0,0,0,0|2,0,0]=4 3994 B9R1.6 OB(O)c1cncnc1 Amb22490716 [0,2,0,0,0,0|2,0,0]=4 3995 B9R1.6 OB(O)c1cncnc1 Amb31207015 [0,2,0,0,0,0|2,0,0]=4 3996 B9R1.6 OB(O)c1cncnc1 Amb32409516 [0,2,0,0,0,0|2,0,0]=4 3997 B9R1.6 OB(O)c1cncnc1 Amb33530643 [0,2,0,0,0,0|2,0,0]=4 3998 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [0,2,0,0,0,0|0,0,0]=2 3999 B9R1.6 OC(=S)c1cccnc1 Amb22731908 [0,2,0,0,0,0|1,0,0]=3 4000 B9R1.6 OC(O)c1ncccn1 Amb27853203 [0,2,0,0,0,0|2,0,0]=4 4001 B9R1.6 ON(O)c1ccncc1 Amb24572621 [0,2,0,0,0,0|1,0,0]=3 4002 B9R1.6 OP(O)c1ccccc1 Amb2684568 [0,2,0,0,0,0|0,0,0]=2 4003 B9R1.6 O[C@@H](Br)c1ccccc1 Amb27233551 [0,2,0,0,0,0|0,0,0]=2 4004 B9R1.6 O[C@@H](Cl)c1ccccc1 Amb28119929 [0,2,0,0,0,0|0,0,0]=2 4005 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [0,2,0,0,0,0|0,1,0]=3 4006 B9R1.6 S=C(S)c1ccccc1 Amb22051683 [0,2,0,0,0,0|0,1,0]=3 4007 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [0,2,0,0,0,0|1,0,0]=3 4008 B9R1.8 BrCC[n+]1ccccc1 Amb2617784 [0,2,0,0,0,0|2,0,0]=4 4009 B9R1.8 BrCC[n+]1ccccc1 Amb26365793 [0,2,0,0,0,0|2,0,0]=4 4010 B9R1.8 BrCCc1ccccn1 Amb1102303 [0,2,0,0,0,0|2,0,0]=4 4011 B9R1.8 BrCCc1ccccn1 Amb17935743 [0,2,0,0,0,0|2,0,0]=4 4012 B9R1.8 BrCCc1cccnc1 Amb19069960 [0,2,0,0,0,0|2,0,0]=4 4013 B9R1.8 BrCCc1cccnc1 Amb19372982 [0,2,0,0,0,0|2,0,0]=4 4014 B9R1.8 BrCCc1ccncc1 Amb18326675 [0,2,0,0,0,0|2,0,0]=4 4015 B9R1.8 BrCCc1ccncc1 Amb33313562 [0,2,0,0,0,0|2,0,0]=4 4016 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [0,2,0,0,0,0|1,0,0]=3 4017 B9R1.8 Br\C=C/c1ccccn1 Amb25200984 [0,2,0,0,0,0|2,0,0]=4 4018 B9R1.8 Br\C=C/c1cccnc1 Amb24085678 [0,2,0,0,0,0|2,0,0]=4 4019 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [0,2,0,0,0,0|1,0,0]=3 4020 B9R1.8 Br\C=C\c1ccccn1 Amb33134753 [0,2,0,0,0,0|2,0,0]=4 4021 B9R1.8 Br\C=C\c1cccnc1 Amb33134788 [0,2,0,0,0,0|2,0,0]=4 4022 B9R1.8 Br\C=C\c1ccncc1 Amb27756767 [0,2,0,0,0,0|2,0,0]=4 4023 B9R1.8 C#CCc1ccccn1 Amb25759001 [0,2,0,0,0,0|2,0,0]=4 4024 B9R1.8 C#CCc1cccnc1 Amb27219897 [0,2,0,0,0,0|2,0,0]=4 4025 B9R1.8 C#CCc1ccncc1 Amb24478677 [0,2,0,0,0,0|2,0,0]=4 4026 B9R1.8 C#COc1ccccc1 Amb27194589 [0,2,0,0,0,0|0,0,0]=2 4027 B9R1.8 C#CSc1ccccc1 Amb17940373 [0,2,0,0,0,0|0,1,0]=3 4028 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [0,2,0,0,0,0|1,0,0]=3 4029 B9R1.8 C#NCc1ccccc1 Amb31132452 [0,2,0,0,0,0|1,0,0]=3 4030 B9R1.8 C#NCc1ccccn1 Amb31132453 [0,2,0,0,0,0|2,0,0]=4 4031 B9R1.8 C#NCc1cccnc1 Amb31132454 [0,2,0,0,0,0|2,0,0]=4 4032 B9R1.8 C#NCc1ccncc1 Amb31132455 [0,2,0,0,0,0|2,0,0]=4 4033 B9R1.8 C=CC[n+]1ccccc1 Amb27838939 [0,2,0,0,0,0|2,0,0]=4 4034 B9R1.8 C=CCc1ccccc1 Amb2599341 [0,2,0,0,0,0|1,0,0]=3 4035 B9R1.8 C=CCc1cccnc1 Amb24477831 [0,2,0,0,0,0|2,0,0]=4 4036 B9R1.8 C=COc1ccccc1 Amb10564213 [0,2,0,0,0,0|0,0,0]=2 4037 B9R1.8 C=COc1cccnc1 Amb24085952 [0,2,0,0,0,0|1,0,0]=3 4038 B9R1.8 C=CSc1ccccc1 Amb8387516 [0,2,0,0,0,0|0,1,0]=3 4039 B9R1.8 C=NCc1ccccc1 Amb28256747 [0,2,0,0,0,0|1,0,0]=3 4040 B9R1.8 C=NCc1ccncc1 Amb27758185 [0,2,0,0,0,0|2,0,0]=4 4041 B9R1.8 CC#Cc1ccccc1 Amb8513696 [0,2,0,0,0,0|1,0,0]=3 4042 B9R1.8 CC#Cc1ccccn1 Amb25147069 [0,2,0,0,0,0|2,0,0]=4 4043 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [0,2,0,0,0,0|2,0,0]=4 4044 B9R1.8 CCCc1ccccc1 Amb2447143 [0,2,0,0,0,0|1,0,0]=3 4045 B9R1.8 CCCc1ccccn1 Amb6366812 [0,2,0,0,0,0|2,0,0]=4 4046 B9R1.8 CCCc1cccnc1 Amb2613018 [0,2,0,0,0,0|2,0,0]=4 4047 B9R1.8 CCCc1ccncc1 Amb4017941 [0,2,0,0,0,0|2,0,0]=4 4048 B9R1.8 CCNc1ccccc1 Amb3940127 [0,2,0,0,0,0|1,0,0]=3 4049 B9R1.8 CCNc1ccccn1 Amb6640743 [0,2,0,0,0,0|2,0,0]=4 4050 B9R1.8 CCNc1cccnc1 Amb6686634 [0,2,0,0,0,0|2,0,0]=4 4051 B9R1.8 CCNc1ccncc1 Amb33545749 [0,2,0,0,0,0|2,0,0]=4 4052 B9R1.8 CCOc1ccccc1 Amb2842270 [0,2,0,0,0,0|0,0,0]=2 4053 B9R1.8 CCOc1ccccn1 Amb2609960 [0,2,0,0,0,0|1,0,0]=3 4054 B9R1.8 CCOc1cccnc1 Amb10573342 [0,2,0,0,0,0|1,0,0]=3 4055 B9R1.8 CCOc1cccnn1 Amb19958352 [0,2,0,0,0,0|2,0,0]=4 4056 B9R1.8 CCOc1ccncc1 Amb8396897 [0,2,0,0,0,0|1,0,0]=3 4057 B9R1.8 CCOc1cnccn1 Amb8387604 [0,2,0,0,0,0|2,0,0]=4 4058 B9R1.8 CCSc1ccccc1 Amb2687929 [0,2,0,0,0,0|0,1,0]=3 4059 B9R1.8 CCSc1ccccn1 Amb26656831 [0,2,0,0,0,0|1,1,0]=4 4060 B9R1.8 CCSc1ccncc1 Amb27766422 [0,2,0,0,0,0|1,1,0]=4 4061 B9R1.8 CNCc1ccccc1 Amb3699562 [0,2,0,0,0,0|1,0,0]=3 4062 B9R1.8 CNCc1ccccn1 Amb10068750 [0,2,0,0,0,0|2,0,0]=4 4063 B9R1.8 CNCc1ccccn1 Amb10576408 [0,2,0,0,0,0|2,0,0]=4 4064 B9R1.8 CNCc1ccccn1 Amb3941148 [0,2,0,0,0,0|2,0,0]=4 4065 B9R1.8 CNCc1cccnc1 Amb10066918 [0,2,0,0,0,0|2,0,0]=4 4066 B9R1.8 CNCc1cccnc1 Amb10576409 [0,2,0,0,0,0|2,0,0]=4 4067 B9R1.8 CNCc1cccnc1 Amb1648828 [0,2,0,0,0,0|2,0,0]=4 4068 B9R1.8 CNCc1ccncc1 Amb10068773 [0,2,0,0,0,0|2,0,0]=4 4069 B9R1.8 CNCc1ccncc1 Amb1115812 [0,2,0,0,0,0|2,0,0]=4 4070 B9R1.8 CNNc1ccccc1 Amb20242875 [0,2,0,0,0,0|1,0,0]=3 4071 B9R1.8 CNNc1ccccc1 Amb27969267 [0,2,0,0,0,0|1,0,0]=3 4072 B9R1.8 COCc1ccccc1 Amb2782562 [0,2,0,0,0,0|0,0,0]=2 4073 B9R1.8 COCc1ccccn1 Amb4017561 [0,2,0,0,0,0|1,0,0]=3 4074 B9R1.8 COCc1ccnnc1 Amb27224297 [0,2,0,0,0,0|2,0,0]=4 4075 B9R1.8 COCc1cnccn1 Amb24656513 [0,2,0,0,0,0|2,0,0]=4 4076 B9R1.8 CSCc1ccccn1 Amb27837576 [0,2,0,0,0,0|1,1,0]=4 4077 B9R1.8 CSCc1cccnc1 Amb24523080 [0,2,0,0,0,0|1,1,0]=4 4078 B9R1.8 CSSc1ccccc1 Amb4008371 [0,2,0,0,0,0|0,1,0]=3 4079 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [0,2,0,0,0,0|1,0,0]=3 4080 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [0,2,0,0,0,0|1,0,0]=3 4081 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [0,2,0,0,0,0|1,0,0]=3 4082 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [0,2,0,0,0,0|1,0,0]=3 4083 B9R1.8 C\C=N\c1cccnc1 Amb27787691 [0,2,0,0,0,0|2,0,0]=4 4084 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [0,2,0,0,0,0|1,0,0]=3 4085 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [0,2,0,0,0,0|2,0,0]=4 4086 B9R1.8 ClCC[n+]1ccccc1 Amb28195087 [0,2,0,0,0,0|2,0,0]=4 4087 B9R1.8 ClCCc1ccccc1 Amb535682 [0,2,0,0,0,0|1,0,0]=3 4088 B9R1.8 ClCCc1ccccn1 Amb1102254 [0,2,0,0,0,0|2,0,0]=4 4089 B9R1.8 ClCCc1ccccn1 Amb19892295 [0,2,0,0,0,0|2,0,0]=4 4090 B9R1.8 ClCCc1cccnc1 Amb24061504 [0,2,0,0,0,0|2,0,0]=4 4091 B9R1.8 ClCCc1ccncc1 Amb23400891 [0,2,0,0,0,0|2,0,0]=4 4092 B9R1.8 ClCCc1ccncc1 Amb9004339 [0,2,0,0,0,0|2,0,0]=4 4093 B9R1.8 ClCOc1ccccc1 Amb22059503 [0,2,0,0,0,0|0,0,0]=2 4094 B9R1.8 ClCSc1ccccn1 Amb27603302 [0,2,0,0,0,0|1,1,0]=4 4095 B9R1.8 ClCSc1ccncc1 Amb27185726 [0,2,0,0,0,0|1,1,0]=4 4096 B9R1.8 ClNCc1cccnc1 Amb27951574 [0,2,0,0,0,0|2,0,0]=4 4097 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [0,2,0,0,0,0|1,0,0]=3 4098 B9R1.8 Cl\C=C\c1cccnc1 Amb27435566 [0,2,0,0,0,0|2,0,0]=4 4099 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [0,2,0,0,0,0|1,0,0]=3 4100 B9R1.8 F\C=C\c1ccccn1 Amb27258216 [0,2,0,0,0,0|2,0,0]=4 4101 B9R1.8 IC#Cc1ccccc1 Amb26442219 [0,2,0,0,0,0|1,0,0]=3 4102 B9R1.8 IC#Cc1ccccn1 Amb25282871 [0,2,0,0,0,0|2,0,0]=4 4103 B9R1.8 ICCc1ccccc1 Amb8515353 [0,2,0,0,0,0|1,0,0]=3 4104 B9R1.8 ICCc1cccnc1 Amb33534604 [0,2,0,0,0,0|2,0,0]=4 4105 B9R1.8 ICCc1ccncc1 Amb28383331 [0,2,0,0,0,0|2,0,0]=4 4106 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [0,2,0,0,0,0|1,0,0]=3 4107 B9R1.8 N#CC[n+]1ccccc1 Amb2608894 [0,2,0,0,0,0|2,0,0]=4 4108 B9R1.8 N#CCc1ccccc1 Amb3598087 [0,2,0,0,0,0|1,0,0]=3 4109 B9R1.8 N#CCc1ccccn1 Amb845695 [0,2,0,0,0,0|2,0,0]=4 4110 B9R1.8 N#CCc1cccnc1 Amb2695344 [0,2,0,0,0,0|2,0,0]=4 4111 B9R1.8 N#CCc1ccncc1 Amb6661799 [0,2,0,0,0,0|2,0,0]=4 4112 B9R1.8 N#CCc1ccncc1 Amb8516296 [0,2,0,0,0,0|2,0,0]=4 4113 B9R1.8 N#CNc1ccccc1 Amb9783273 [0,2,0,0,0,0|1,0,0]=3 4114 B9R1.8 N#CNc1ccncc1 Amb25319718 [0,2,0,0,0,0|2,0,0]=4 4115 B9R1.8 N#COc1ccccc1 Amb15692860 [0,2,0,0,0,0|0,0,0]=2 4116 B9R1.8 N#COc1ccccn1 Amb24364723 [0,2,0,0,0,0|1,0,0]=3 4117 B9R1.8 N#CSc1ccccc1 Amb6892469 [0,2,0,0,0,0|0,1,0]=3 4118 B9R1.8 N#C[Se]c1ccccc1 Amb2690321 [0,2,0,0,0,0|0,1,0]=3 4119 B9R1.8 NCC[n+]1ccccc1 Amb27246156 [0,2,0,0,0,0|2,0,0]=4 4120 B9R1.8 NCCc1ccccc1 Amb17843439 [0,2,0,0,0,0|1,0,0]=3 4121 B9R1.8 NCCc1ccccc1 Amb2792829 [0,2,0,0,0,0|1,0,0]=3 4122 B9R1.8 NCCc1ccccn1 Amb1156071 [0,2,0,0,0,0|2,0,0]=4 4123 B9R1.8 NCCc1ccccn1 Amb24066975 [0,2,0,0,0,0|2,0,0]=4 4124 B9R1.8 NCCc1cccnc1 Amb1134784 [0,2,0,0,0,0|2,0,0]=4 4125 B9R1.8 NCCc1cccnc1 Amb16230500 [0,2,0,0,0,0|2,0,0]=4 4126 B9R1.8 NCCc1cccnc1 Amb20241523 [0,2,0,0,0,0|2,0,0]=4 4127 B9R1.8 NCCc1cccnc1 Amb8631307 [0,2,0,0,0,0|2,0,0]=4 4128 B9R1.8 NCCc1ccncc1 Amb1102164 [0,2,0,0,0,0|2,0,0]=4 4129 B9R1.8 NCCc1ccncc1 Amb8631358 [0,2,0,0,0,0|2,0,0]=4 4130 B9R1.8 NCNc1ccccc1 Amb17117015 [0,2,0,0,0,0|1,0,0]=3 4131 B9R1.8 NCOc1ccccc1 Amb25128781 [0,2,0,0,0,0|0,0,0]=2 4132 B9R1.8 NNCc1ccccc1 Amb1105200 [0,2,0,0,0,0|1,0,0]=3 4133 B9R1.8 NNCc1ccccc1 Amb16231890 [0,2,0,0,0,0|1,0,0]=3 4134 B9R1.8 NNCc1ccccc1 Amb22492438 [0,2,0,0,0,0|1,0,0]=3 4135 B9R1.8 NNCc1ccccc1 Amb8513062 [0,2,0,0,0,0|1,0,0]=3 4136 B9R1.8 NNCc1ccccc1 Amb9826089 [0,2,0,0,0,0|1,0,0]=3 4137 B9R1.8 NNCc1ccccn1 Amb1117330 [0,2,0,0,0,0|2,0,0]=4 4138 B9R1.8 NNCc1ccccn1 Amb28984160 [0,2,0,0,0,0|2,0,0]=4 4139 B9R1.8 NNCc1ccccn1 Amb6892424 [0,2,0,0,0,0|2,0,0]=4 4140 B9R1.8 NNCc1cccnc1 Amb1121062 [0,2,0,0,0,0|2,0,0]=4 4141 B9R1.8 NNCc1cccnc1 Amb22491471 [0,2,0,0,0,0|2,0,0]=4 4142 B9R1.8 NNCc1cccnc1 Amb33551495 [0,2,0,0,0,0|2,0,0]=4 4143 B9R1.8 NNCc1ccncc1 Amb1118337 [0,2,0,0,0,0|2,0,0]=4 4144 B9R1.8 NNCc1ccncc1 Amb19893255 [0,2,0,0,0,0|2,0,0]=4 4145 B9R1.8 NNCc1ccncc1 Amb2691315 [0,2,0,0,0,0|2,0,0]=4 4146 B9R1.8 NNCc1ccncc1 Amb28984138 [0,2,0,0,0,0|2,0,0]=4 4147 B9R1.8 NOCc1ccccc1 Amb1154307 [0,2,0,0,0,0|0,0,0]=2 4148 B9R1.8 NOCc1ccccc1 Amb22489499 [0,2,0,0,0,0|0,0,0]=2 4149 B9R1.8 NOCc1ccccc1 Amb6600539 [0,2,0,0,0,0|0,0,0]=2 4150 B9R1.8 NOCc1ccccn1 Amb18642195 [0,2,0,0,0,0|1,0,0]=3 4151 B9R1.8 NOCc1ccccn1 Amb32663271 [0,2,0,0,0,0|1,0,0]=3 4152 B9R1.8 NOCc1cccnc1 Amb24074265 [0,2,0,0,0,0|1,0,0]=3 4153 B9R1.8 NOCc1cccnc1 Amb33546939 [0,2,0,0,0,0|1,0,0]=3 4154 B9R1.8 NOCc1ccncc1 Amb22397036 [0,2,0,0,0,0|1,0,0]=3 4155 B9R1.8 NOCc1ccncn1 Amb26557423 [0,2,0,0,0,0|2,0,0]=4 4156 B9R1.8 NOCc1cnccn1 Amb27642916 [0,2,0,0,0,0|2,0,0]=4 4157 B9R1.8 NOCc1cncnc1 Amb33149200 [0,2,0,0,0,0|2,0,0]=4 4158 B9R1.8 NOCc1ncccn1 Amb25702287 [0,2,0,0,0,0|2,0,0]=4 4159 B9R1.8 N\C=C/c1ccccn1 Amb27443779 [0,2,0,0,0,0|2,0,0]=4 4160 B9R1.8 N\C=C/c1cccnc1 Amb28137814 [0,2,0,0,0,0|2,0,0]=4 4161 B9R1.8 N\C=C/c1ccncc1 Amb24068867 [0,2,0,0,0,0|2,0,0]=4 4162 B9R1.8 N\C=C\c1cccnc1 Amb27776892 [0,2,0,0,0,0|2,0,0]=4 4163 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [0,2,0,0,0,0|1,0,0]=3 4164 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [0,2,0,0,0,0|1,0,0]=3 4165 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [0,2,0,0,0,0|1,0,0]=3 4166 B9R1.8 N\N=C\c1cccnc1 Amb8485037 [0,2,0,0,0,0|2,0,0]=4 4167 B9R1.8 N\N=C\c1ccncc1 Amb27837636 [0,2,0,0,0,0|2,0,0]=4 4168 B9R1.8 O=C=Cc1cccnc1 Amb27425121 [0,2,0,0,0,0|1,0,1]=4 4169 B9R1.8 O=C=Nc1ccccc1 Amb3939417 [0,2,0,0,0,0|0,0,1]=3 4170 B9R1.8 O=C=Nc1ccccn1 Amb9780818 [0,2,0,0,0,0|1,0,1]=4 4171 B9R1.8 O=C=Nc1cccnc1 Amb33532890 [0,2,0,0,0,0|1,0,1]=4 4172 B9R1.8 O=C=Nc1ccncc1 Amb9780817 [0,2,0,0,0,0|1,0,1]=4 4173 B9R1.8 O=CCc1ccccc1 Amb3939950 [0,2,0,0,0,0|0,0,1]=3 4174 B9R1.8 O=CCc1ccccn1 Amb17089528 [0,2,0,0,0,0|1,0,1]=4 4175 B9R1.8 O=CCc1cccnc1 Amb8011002 [0,2,0,0,0,0|1,0,1]=4 4176 B9R1.8 O=CCc1ccncc1 Amb17089529 [0,2,0,0,0,0|1,0,1]=4 4177 B9R1.8 O=CNc1ccccc1 Amb2613772 [0,2,0,0,0,0|0,0,1]=3 4178 B9R1.8 O=CNc1ccccn1 Amb3319168 [0,2,0,0,0,0|1,0,1]=4 4179 B9R1.8 O=CNc1cccnc1 Amb4019648 [0,2,0,0,0,0|1,0,1]=4 4180 B9R1.8 O=COc1ccccc1 Amb22002710 [0,2,0,0,0,0|0,0,0]=2 4181 B9R1.8 O=C\C=C1\C=CC=CN1 Amb24068319 [0,2,0,0,0,0|1,0,1]=4 4182 B9R1.8 O=S=Nc1ccccc1 Amb2720783 [0,2,0,0,0,0|0,0,1]=3 4183 B9R1.8 OCC[n+]1ccccc1 Amb27839429 [0,2,0,0,0,0|1,0,0]=3 4184 B9R1.8 OCCc1ccccc1 Amb2793058 [0,2,0,0,0,0|0,0,0]=2 4185 B9R1.8 OCCc1ccccn1 Amb3939045 [0,2,0,0,0,0|1,0,0]=3 4186 B9R1.8 OCCc1cccnc1 Amb2688750 [0,2,0,0,0,0|1,0,0]=3 4187 B9R1.8 OCCc1cccnn1 Amb25086060 [0,2,0,0,0,0|2,0,0]=4 4188 B9R1.8 OCCc1ccncc1 Amb3939219 [0,2,0,0,0,0|1,0,0]=3 4189 B9R1.8 OCCc1ccncn1 Amb17593271 [0,2,0,0,0,0|2,0,0]=4 4190 B9R1.8 OCCc1ccnnc1 Amb23559765 [0,2,0,0,0,0|2,0,0]=4 4191 B9R1.8 OCCc1cnccn1 Amb2695474 [0,2,0,0,0,0|2,0,0]=4 4192 B9R1.8 OCCc1cncnc1 Amb20240921 [0,2,0,0,0,0|2,0,0]=4 4193 B9R1.8 OCCc1ncccn1 Amb22896758 [0,2,0,0,0,0|2,0,0]=4 4194 B9R1.8 OCSc1ccccc1 Amb27776457 [0,2,0,0,0,0|0,0,0]=2 4195 B9R1.8 ONCc1ccccc1 Amb22001943 [0,2,0,0,0,0|0,0,0]=2 4196 B9R1.8 ONCc1ccccc1 Amb9825936 [0,2,0,0,0,0|0,0,0]=2 4197 B9R1.8 ONCc1ccccn1 Amb28457793 [0,2,0,0,0,0|1,0,0]=3 4198 B9R1.8 ONCc1ccccn1 Amb32680372 [0,2,0,0,0,0|1,0,0]=3 4199 B9R1.8 ONCc1cccnc1 Amb25147084 [0,2,0,0,0,0|1,0,0]=3 4200 B9R1.8 ONCc1ccncc1 Amb25851052 [0,2,0,0,0,0|1,0,0]=3 4201 B9R1.8 ONCc1ccncn1 Amb23586394 [0,2,0,0,0,0|2,0,0]=4 4202 B9R1.8 ONCc1cnccn1 Amb25936839 [0,2,0,0,0,0|2,0,0]=4 4203 B9R1.8 ONCc1cncnc1 Amb28066281 [0,2,0,0,0,0|2,0,0]=4 4204 B9R1.8 ONCc1ncccn1 Amb23586395 [0,2,0,0,0,0|2,0,0]=4 4205 B9R1.8 O\N=C/C1=CNC=CC1 Amb27862035 [0,2,0,0,0,0|1,0,1]=4 4206 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [0,2,0,0,0,0|0,0,0]=2 4207 B9R1.8 O\N=C/c1ccncc1 Amb9821776 [0,2,0,0,0,0|1,0,0]=3 4208 B9R1.8 O\N=C/c1ccnnc1 Amb8439020 [0,2,0,0,0,0|2,0,0]=4 4209 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [0,2,0,0,0,0|0,0,0]=2 4210 B9R1.8 O\N=C\c1ccccn1 Amb719680 [0,2,0,0,0,0|1,0,0]=3 4211 B9R1.8 O\N=C\c1cccnc1 Amb3427823 [0,2,0,0,0,0|1,0,0]=3 4212 B9R1.8 O\N=C\c1cccnn1 Amb23539035 [0,2,0,0,0,0|2,0,0]=4 4213 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [0,2,0,0,0,0|1,0,0]=3 4214 B9R1.8 O\N=C\c1ccncn1 Amb20668794 [0,2,0,0,0,0|2,0,0]=4 4215 B9R1.8 O\N=C\c1ccnnc1 Amb23539003 [0,2,0,0,0,0|2,0,0]=4 4216 B9R1.8 O\N=C\c1cnccn1 Amb27185837 [0,2,0,0,0,0|2,0,0]=4 4217 B9R1.8 O\N=C\c1cncnc1 Amb25943293 [0,2,0,0,0,0|2,0,0]=4 4218 B9R1.8 O\N=N\c1ccccn1 Amb17940654 [0,2,0,0,0,0|1,0,0]=3 4219 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [0,2,0,0,0,0|0,1,0]=3 4220 B9R1.8 S=C=Nc1ccccn1 Amb399611 [0,2,0,0,0,0|1,1,0]=4 4221 B9R1.8 S=C=Nc1cccnc1 Amb6335258 [0,2,0,0,0,0|1,1,0]=4 4222 B9R1.8 S=C=Nc1ccncc1 Amb2371966 [0,2,0,0,0,0|1,1,0]=4 4223 B9R1.8 S=CNc1ccccc1 Amb25788857 [0,2,0,0,0,0|0,1,0]=3 4224 B9R1.8 S=CNc1cccnc1 Amb27492962 [0,2,0,0,0,0|1,1,0]=4 4225 B9R1.8 SCCc1ccccc1 Amb6255605 [0,2,0,0,0,0|0,1,0]=3 4226 B9R1.8 SCCc1ccccn1 Amb17619707 [0,2,0,0,0,0|1,1,0]=4 4227 B9R1.8 SCCc1cccnc1 Amb22008806 [0,2,0,0,0,0|1,1,0]=4 4228 B9R1.8 SCCc1ccncc1 Amb10552830 [0,2,0,0,0,0|1,1,0]=4 4229 B9R1.8 SCCc1ccncc1 Amb9800962 [0,2,0,0,0,0|1,1,0]=4 4230 B9R1.8 SSCc1ccccc1 Amb27646980 [0,2,0,0,0,0|0,1,0]=3 4231 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [0,2,0,0,0,0|1,0,0]=3 4232 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [0,2,0,0,0,0|2,0,0]=4 4233 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [0,2,0,0,0,0|2,0,0]=4 4234 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [0,2,0,0,0,0|2,0,0]=4 4235 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [0,2,0,0,0,0|1,0,0]=3 4236 B9R1.8 [N-]=[N+]=Cc1ccccn1 Amb27945596 [0,2,0,0,0,0|2,0,0]=4 4237 B9R1.8 [N-]=[N+]=Nc1ccccc1 Amb6892570 [0,2,0,0,0,0|1,0,0]=3 4238 B9R1.8 [N-]=[N+]=Nc1ccccn1 Amb28366428 [0,2,0,0,0,0|2,0,0]=4 4239 B9R1.8 [N-]=[N+]=Nc1cccnc1 Amb19514769 [0,2,0,0,0,0|2,0,0]=4 4240 B9R1.8 [N-]=[N+]=Nc1ccncc1 Amb33547216 [0,2,0,0,0,0|2,0,0]=4 4241 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [0,2,0,0,0,0|1,0,0]=3 4242 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [0,2,0,0,0,0|0,0,0]=2 4243 B9R1.8 [O-][N+]#Cc1ccccc1 Amb25951967 [0,2,0,0,0,0|0,0,1]=3 4244 B9R1.8 [O-][N+]#Cc1ccccn1 Amb25178011 [0,2,0,0,0,0|1,0,1]=4 4245 B9R1.15 Bc1ccccc1CN Amb27463133 [0,2,0,0,0,0|1,0,0]=3 4246 B9R1.15 BrCc1ccccc1Br Amb1152530 [0,2,0,0,0,0|1,0,0]=3 4247 B9R1.15 BrCc1ccccc1I Amb8397039 [0,2,0,0,0,0|1,0,0]=3 4248 B9R1.15 BrCc1cccnc1Br Amb10071486 [0,2,0,0,0,0|2,0,0]=4 4249 B9R1.15 BrCc1cccnc1Br Amb10608824 [0,2,0,0,0,0|2,0,0]=4 4250 B9R1.15 BrCc1ccncc1Br Amb22898756 [0,2,0,0,0,0|2,0,0]=4 4251 B9R1.15 BrCc1ccncc1Br Amb32671433 [0,2,0,0,0,0|2,0,0]=4 4252 B9R1.15 BrCc1cnccc1Br Amb25921109 [0,2,0,0,0,0|2,0,0]=4 4253 B9R1.15 BrCc1ncccc1Br Amb22728103 [0,2,0,0,0,0|2,0,0]=4 4254 B9R1.15 BrCc1ncccc1Br Amb33527603 [0,2,0,0,0,0|2,0,0]=4 4255 B9R1.15 C#Cc1ccccc1Br Amb3939383 [0,2,0,0,0,0|1,0,0]=3 4256 B9R1.15 C#Cc1ccccc1C Amb8394567 [0,2,0,0,0,0|1,0,0]=3 4257 B9R1.15 C#Cc1ccccc1Cl Amb6297966 [0,2,0,0,0,0|1,0,0]=3 4258 B9R1.15 C#Cc1ccccc1F Amb2688306 [0,2,0,0,0,0|1,0,0]=3 4259 B9R1.15 C#Cc1ccccc1I Amb10068418 [0,2,0,0,0,0|1,0,0]=3 4260 B9R1.15 C#Cc1ccccc1N Amb10606816 [0,2,0,0,0,0|1,0,0]=3 4261 B9R1.15 C#Cc1ccccc1O Amb10603592 [0,2,0,0,0,0|0,0,0]=2 4262 B9R1.15 C#Cc1ccccc1S Amb33373845 [0,2,0,0,0,0|0,1,0]=3 4263 B9R1.15 C#Cc1cccnc1Br Amb24057369 [0,2,0,0,0,0|2,0,0]=4 4264 B9R1.15 C#Cc1cccnc1C Amb25147184 [0,2,0,0,0,0|2,0,0]=4 4265 B9R1.15 C#Cc1cccnc1Cl Amb27662426 [0,2,0,0,0,0|2,0,0]=4 4266 B9R1.15 C#Cc1cccnc1F Amb22233928 [0,2,0,0,0,0|2,0,0]=4 4267 B9R1.15 C#Cc1cccnc1N Amb22001497 [0,2,0,0,0,0|2,0,0]=4 4268 B9R1.15 C#Cc1cccnc1O Amb22292240 [0,2,0,0,0,0|1,0,0]=3 4269 B9R1.15 C#Cc1cccnc1S Amb25335639 [0,2,0,0,0,0|1,1,0]=4 4270 B9R1.15 C#Cc1ccncc1Br Amb25077034 [0,2,0,0,0,0|2,0,0]=4 4271 B9R1.15 C#Cc1ccncc1C Amb25839775 [0,2,0,0,0,0|2,0,0]=4 4272 B9R1.15 C#Cc1ccncc1Cl Amb19895149 [0,2,0,0,0,0|2,0,0]=4 4273 B9R1.15 C#Cc1ccncc1F Amb24077538 [0,2,0,0,0,0|2,0,0]=4 4274 B9R1.15 C#Cc1ccncc1I Amb27796473 [0,2,0,0,0,0|2,0,0]=4 4275 B9R1.15 C#Cc1ccncc1N Amb23400166 [0,2,0,0,0,0|2,0,0]=4 4276 B9R1.15 C#Cc1cnccc1C Amb26600012 [0,2,0,0,0,0|2,0,0]=4 4277 B9R1.15 C#Cc1cnccc1Cl Amb25336931 [0,2,0,0,0,0|2,0,0]=4 4278 B9R1.15 C#Cc1cnccc1F Amb26936104 [0,2,0,0,0,0|2,0,0]=4 4279 B9R1.15 C#Cc1cnccc1N Amb23400161 [0,2,0,0,0,0|2,0,0]=4 4280 B9R1.15 C#Cc1cnccc1O Amb25887221 [0,2,0,0,0,0|1,0,0]=3 4281 B9R1.15 C#Cc1ncccc1Br Amb24056331 [0,2,0,0,0,0|2,0,0]=4 4282 B9R1.15 C#Cc1ncccc1C Amb19895144 [0,2,0,0,0,0|2,0,0]=4 4283 B9R1.15 C#Cc1ncccc1F Amb23598958 [0,2,0,0,0,0|2,0,0]=4 4284 B9R1.15 C#Cc1ncccc1N Amb23400156 [0,2,0,0,0,0|2,0,0]=4 4285 B9R1.15 C#Cc1ncccc1O Amb22234412 [0,2,0,0,0,0|1,0,0]=3 4286 B9R1.15 C=CC1=CC=CNC1=O Amb22001879 [0,2,0,0,0,0|1,0,1]=4 4287 B9R1.15 C=Cc1cccc[n+]1[O-] Amb25852532 [0,2,0,0,0,0|1,0,1]=4 4288 B9R1.15 C=Cc1ccccc1Br Amb6365618 [0,2,0,0,0,0|1,0,0]=3 4289 B9R1.15 C=Cc1ccccc1C Amb2695476 [0,2,0,0,0,0|1,0,0]=3 4290 B9R1.15 C=Cc1ccccc1Cl Amb3940227 [0,2,0,0,0,0|1,0,0]=3 4291 B9R1.15 C=Cc1ccccc1F Amb3940550 [0,2,0,0,0,0|1,0,0]=3 4292 B9R1.15 C=Cc1ccccc1I Amb8384620 [0,2,0,0,0,0|1,0,0]=3 4293 B9R1.15 C=Cc1ccccc1N Amb17593221 [0,2,0,0,0,0|1,0,0]=3 4294 B9R1.15 C=Cc1ccccc1N Amb21857764 [0,2,0,0,0,0|1,0,0]=3 4295 B9R1.15 C=Cc1ccccc1O Amb17593227 [0,2,0,0,0,0|0,0,0]=2 4296 B9R1.15 C=Cc1cccnc1Br Amb24709309 [0,2,0,0,0,0|2,0,0]=4 4297 B9R1.15 C=Cc1cccnc1C Amb24432711 [0,2,0,0,0,0|2,0,0]=4 4298 B9R1.15 C=Cc1cccnc1Cl Amb25861398 [0,2,0,0,0,0|2,0,0]=4 4299 B9R1.15 C=Cc1cccnc1F Amb25355017 [0,2,0,0,0,0|2,0,0]=4 4300 B9R1.15 C=Cc1cccnc1N Amb25831150 [0,2,0,0,0,0|2,0,0]=4 4301 B9R1.15 C=Cc1ccncc1Br Amb25889459 [0,2,0,0,0,0|2,0,0]=4 4302 B9R1.15 C=Cc1ccncc1C Amb26856969 [0,2,0,0,0,0|2,0,0]=4 4303 B9R1.15 C=Cc1ccncc1Cl Amb25776658 [0,2,0,0,0,0|2,0,0]=4 4304 B9R1.15 C=Cc1ccncc1F Amb24481861 [0,2,0,0,0,0|2,0,0]=4 4305 B9R1.15 C=Cc1ccncc1O Amb25358569 [0,2,0,0,0,0|1,0,0]=3 4306 B9R1.15 C=Cc1cnccc1C Amb27860156 [0,2,0,0,0,0|2,0,0]=4 4307 B9R1.15 C=Cc1cnccc1F Amb25992933 [0,2,0,0,0,0|2,0,0]=4 4308 B9R1.15 C=Cc1ncccc1C Amb28120463 [0,2,0,0,0,0|2,0,0]=4 4309 B9R1.15 C=Cc1ncccc1F Amb26991382 [0,2,0,0,0,0|2,0,0]=4 4310 B9R1.15 C=Nc1ccccc1N Amb27661043 [0,2,0,0,0,0|1,0,0]=3 4311 B9R1.15 CCC1=CNC=CC1=N Amb22126003 [0,2,0,0,0,0|2,0,0]=4 4312 B9R1.15 CCC1=CNC=CC1=O Amb24062648 [0,2,0,0,0,0|1,0,1]=4 4313 B9R1.15 CCN1C=CC=CC1=O Amb22359913 [0,2,0,0,0,0|1,0,1]=4 4314 B9R1.15 CC[n+]1ccccc1Br Amb2685167 [0,2,0,0,0,0|2,0,0]=4 4315 B9R1.15 CC[n+]1ccccc1Br Amb28049734 [0,2,0,0,0,0|2,0,0]=4 4316 B9R1.15 CC[n+]1ccccc1C Amb27966049 [0,2,0,0,0,0|2,0,0]=4 4317 B9R1.15 CC[n+]1ccccc1Cl Amb5794570 [0,2,0,0,0,0|2,0,0]=4 4318 B9R1.15 CCc1cccc[n+]1N Amb27424792 [0,2,0,0,0,0|2,0,0]=4 4319 B9R1.15 CCc1cccc[n+]1[O-] Amb2694608 [0,2,0,0,0,0|1,0,1]=4 4320 B9R1.15 CCc1ccccc1Br Amb3939183 [0,2,0,0,0,0|1,0,0]=3 4321 B9R1.15 CCc1ccccc1C Amb8397274 [0,2,0,0,0,0|1,0,0]=3 4322 B9R1.15 CCc1ccccc1Cl Amb2685897 [0,2,0,0,0,0|1,0,0]=3 4323 B9R1.15 CCc1ccccc1F Amb10840487 [0,2,0,0,0,0|1,0,0]=3 4324 B9R1.15 CCc1ccccc1I Amb2688848 [0,2,0,0,0,0|1,0,0]=3 4325 B9R1.15 CCc1ccccc1N Amb2792823 [0,2,0,0,0,0|1,0,0]=3 4326 B9R1.15 CCc1ccccc1O Amb3939546 [0,2,0,0,0,0|0,0,0]=2 4327 B9R1.15 CCc1ccccc1S Amb2687958 [0,2,0,0,0,0|0,1,0]=3 4328 B9R1.15 CCc1cccnc1Br Amb24319268 [0,2,0,0,0,0|2,0,0]=4 4329 B9R1.15 CCc1cccnc1C Amb22169849 [0,2,0,0,0,0|2,0,0]=4 4330 B9R1.15 CCc1cccnc1Cl Amb19516800 [0,2,0,0,0,0|2,0,0]=4 4331 B9R1.15 CCc1cccnc1F Amb8396947 [0,2,0,0,0,0|2,0,0]=4 4332 B9R1.15 CCc1cccnc1I Amb27156636 [0,2,0,0,0,0|2,0,0]=4 4333 B9R1.15 CCc1cccnc1N Amb31291141 [0,2,0,0,0,0|2,0,0]=4 4334 B9R1.15 CCc1cccnc1N Amb8386854 [0,2,0,0,0,0|2,0,0]=4 4335 B9R1.15 CCc1cccnc1O Amb21864629 [0,2,0,0,0,0|1,0,0]=3 4336 B9R1.15 CCc1ccncc1Br Amb21857366 [0,2,0,0,0,0|2,0,0]=4 4337 B9R1.15 CCc1ccncc1Cl Amb22748741 [0,2,0,0,0,0|2,0,0]=4 4338 B9R1.15 CCc1ccncc1F Amb19959241 [0,2,0,0,0,0|2,0,0]=4 4339 B9R1.15 CCc1ccncc1N Amb18832983 [0,2,0,0,0,0|2,0,0]=4 4340 B9R1.15 CCc1ccncc1O Amb18642098 [0,2,0,0,0,0|1,0,0]=3 4341 B9R1.15 CCc1cnccc1Br Amb20617488 [0,2,0,0,0,0|2,0,0]=4 4342 B9R1.15 CCc1cnccc1Br Amb30633552 [0,2,0,0,0,0|2,0,0]=4 4343 B9R1.15 CCc1cnccc1Br Amb31307736 [0,2,0,0,0,0|2,0,0]=4 4344 B9R1.15 CCc1cnccc1Cl Amb25188972 [0,2,0,0,0,0|2,0,0]=4 4345 B9R1.15 CCc1cnccc1N Amb19514793 [0,2,0,0,0,0|2,0,0]=4 4346 B9R1.15 CCc1cncnc1O Amb15692081 [0,2,0,0,0,0|2,0,0]=4 4347 B9R1.15 CCc1ncccc1Br Amb22233901 [0,2,0,0,0,0|2,0,0]=4 4348 B9R1.15 CCc1ncccc1Cl Amb22497670 [0,2,0,0,0,0|2,0,0]=4 4349 B9R1.15 CCc1ncccc1F Amb27836980 [0,2,0,0,0,0|2,0,0]=4 4350 B9R1.15 CCc1ncccc1N Amb18832982 [0,2,0,0,0,0|2,0,0]=4 4351 B9R1.15 CCc1ncccc1O Amb6468133 [0,2,0,0,0,0|1,0,0]=3 4352 B9R1.15 CCc1ncncc1O Amb27852447 [0,2,0,0,0,0|2,0,0]=4 4353 B9R1.15 CNc1ccccc1Br Amb10068173 [0,2,0,0,0,0|1,0,0]=3 4354 B9R1.15 CNc1ccccc1Br Amb6712117 [0,2,0,0,0,0|1,0,0]=3 4355 B9R1.15 CNc1ccccc1C Amb22236040 [0,2,0,0,0,0|1,0,0]=3 4356 B9R1.15 CNc1ccccc1C Amb2689512 [0,2,0,0,0,0|1,0,0]=3 4357 B9R1.15 CNc1ccccc1Cl Amb20620844 [0,2,0,0,0,0|1,0,0]=3 4358 B9R1.15 CNc1ccccc1Cl Amb2686180 [0,2,0,0,0,0|1,0,0]=3 4359 B9R1.15 CNc1ccccc1F Amb2688174 [0,2,0,0,0,0|1,0,0]=3 4360 B9R1.15 CNc1ccccc1I Amb10610348 [0,2,0,0,0,0|1,0,0]=3 4361 B9R1.15 CNc1ccccc1I Amb7759816 [0,2,0,0,0,0|1,0,0]=3 4362 B9R1.15 CNc1ccccc1N Amb22489478 [0,2,0,0,0,0|1,0,0]=3 4363 B9R1.15 CNc1ccccc1N Amb3997180 [0,2,0,0,0,0|1,0,0]=3 4364 B9R1.15 CNc1ccccc1N Amb6854101 [0,2,0,0,0,0|1,0,0]=3 4365 B9R1.15 CNc1ccccc1N Amb8386940 [0,2,0,0,0,0|1,0,0]=3 4366 B9R1.15 CNc1ccccc1O Amb6336644 [0,2,0,0,0,0|0,0,0]=2 4367 B9R1.15 CNc1ccccc1P Amb27459031 [0,2,0,0,0,0|1,0,0]=3 4368 B9R1.15 CNc1cccnc1Br Amb22276193 [0,2,0,0,0,0|2,0,0]=4 4369 B9R1.15 CNc1cccnc1C Amb24062314 [0,2,0,0,0,0|2,0,0]=4 4370 B9R1.15 CNc1cccnc1C Amb33338773 [0,2,0,0,0,0|2,0,0]=4 4371 B9R1.15 CNc1cccnc1C Amb33537130 [0,2,0,0,0,0|2,0,0]=4 4372 B9R1.15 CNc1cccnc1Cl Amb8438980 [0,2,0,0,0,0|2,0,0]=4 4373 B9R1.15 CNc1cccnc1F Amb26576985 [0,2,0,0,0,0|2,0,0]=4 4374 B9R1.15 CNc1cccnc1I Amb27463154 [0,2,0,0,0,0|2,0,0]=4 4375 B9R1.15 CNc1cccnc1N Amb18642122 [0,2,0,0,0,0|2,0,0]=4 4376 B9R1.15 CNc1cccsc1=O Amb3375564 [0,2,0,0,0,0|1,0,1]=4 4377 B9R1.15 CNc1ccncc1Br Amb22728835 [0,2,0,0,0,0|2,0,0]=4 4378 B9R1.15 CNc1ccncc1C Amb27466851 [0,2,0,0,0,0|2,0,0]=4 4379 B9R1.15 CNc1ccncc1F Amb27859669 [0,2,0,0,0,0|2,0,0]=4 4380 B9R1.15 CNc1ccncc1N Amb33528510 [0,2,0,0,0,0|2,0,0]=4 4381 B9R1.15 CNc1ccncc1S Amb28455334 [0,2,0,0,0,0|1,1,0]=4 4382 B9R1.15 CNc1cnccc1C Amb15690613 [0,2,0,0,0,0|2,0,0]=4 4383 B9R1.15 CNc1cnccc1Cl Amb27793415 [0,2,0,0,0,0|2,0,0]=4 4384 B9R1.15 CNc1cnccc1I Amb27756345 [0,2,0,0,0,0|2,0,0]=4 4385 B9R1.15 CNc1cnccc1N Amb17933837 [0,2,0,0,0,0|2,0,0]=4 4386 B9R1.15 CNc1ncccc1Br Amb18279191 [0,2,0,0,0,0|2,0,0]=4 4387 B9R1.15 CNc1ncccc1C Amb18279778 [0,2,0,0,0,0|2,0,0]=4 4388 B9R1.15 CNc1ncccc1Cl Amb6643711 [0,2,0,0,0,0|2,0,0]=4 4389 B9R1.15 CNc1ncccc1F Amb18948166 [0,2,0,0,0,0|2,0,0]=4 4390 B9R1.15 CNc1ncccc1I Amb24524201 [0,2,0,0,0,0|2,0,0]=4 4391 B9R1.15 CNc1ncccc1N Amb10610030 [0,2,0,0,0,0|2,0,0]=4 4392 B9R1.15 CNc1ncccc1N Amb7172739 [0,2,0,0,0,0|2,0,0]=4 4393 B9R1.15 CNc1ncncc1O Amb23598450 [0,2,0,0,0,0|2,0,0]=4 4394 B9R1.15 COC1=CC=CNC1=O Amb18364335 [0,2,0,0,0,0|1,0,0]=3 4395 B9R1.15 COC1=CC=CNC1=O Amb28934991 [0,2,0,0,0,0|1,0,0]=3 4396 B9R1.15 COC1=CC=CNC1=S Amb21520451 [0,2,0,0,0,0|1,0,0]=3 4397 B9R1.15 COC1=CC=NNC1=O Amb24309185 [0,2,0,0,0,0|2,0,0]=4 4398 B9R1.15 COC1=CCNC=C1Br Amb28068159 [0,2,0,0,0,0|1,0,1]=4 4399 B9R1.15 COC1=CN=CNC1=O Amb21963503 [0,2,0,0,0,0|2,0,0]=4 4400 B9R1.15 COC1=COC=CC1=O Amb25735758 [0,2,0,0,0,0|1,0,0]=3 4401 B9R1.15 COc1cccc[n+]1[O-] Amb10552588 [0,2,0,0,0,0|1,0,0]=3 4402 B9R1.15 COc1ccccc1Br Amb2684946 [0,2,0,0,0,0|0,0,0]=2 4403 B9R1.15 COc1ccccc1C Amb8513241 [0,2,0,0,0,0|0,0,0]=2 4404 B9R1.15 COc1ccccc1Cl Amb6297184 [0,2,0,0,0,0|0,0,0]=2 4405 B9R1.15 COc1ccccc1F Amb2688014 [0,2,0,0,0,0|0,0,0]=2 4406 B9R1.15 COc1ccccc1I Amb2688832 [0,2,0,0,0,0|0,0,0]=2 4407 B9R1.15 COc1ccccc1N Amb19929908 [0,2,0,0,0,0|0,0,0]=2 4408 B9R1.15 COc1ccccc1N Amb840071 [0,2,0,0,0,0|0,0,0]=2 4409 B9R1.15 COc1ccccc1O Amb3939629 [0,2,0,0,0,0|0,0,0]=2 4410 B9R1.15 COc1ccccc1P Amb22228914 [0,2,0,0,0,0|0,0,0]=2 4411 B9R1.15 COc1ccccc1S Amb2689086 [0,2,0,0,0,0|0,0,0]=2 4412 B9R1.15 COc1cccnc1Br Amb2715581 [0,2,0,0,0,0|1,0,0]=3 4413 B9R1.15 COc1cccnc1C Amb15691038 [0,2,0,0,0,0|1,0,0]=3 4414 B9R1.15 COc1cccnc1Cl Amb8383862 [0,2,0,0,0,0|1,0,0]=3 4415 B9R1.15 COc1cccnc1F Amb10606589 [0,2,0,0,0,0|1,0,0]=3 4416 B9R1.15 COc1cccnc1I Amb2609537 [0,2,0,0,0,0|1,0,0]=3 4417 B9R1.15 COc1cccnc1N Amb9208364 [0,2,0,0,0,0|1,0,0]=3 4418 B9R1.15 COc1cccnc1O Amb8428106 [0,2,0,0,0,0|1,0,0]=3 4419 B9R1.15 COc1ccncc1Br Amb10602259 [0,2,0,0,0,0|1,0,0]=3 4420 B9R1.15 COc1ccncc1C Amb2794420 [0,2,0,0,0,0|1,0,0]=3 4421 B9R1.15 COc1ccncc1Cl Amb20242757 [0,2,0,0,0,0|1,0,0]=3 4422 B9R1.15 COc1ccncc1Cl Amb22275969 [0,2,0,0,0,0|1,0,0]=3 4423 B9R1.15 COc1ccncc1I Amb8447621 [0,2,0,0,0,0|1,0,0]=3 4424 B9R1.15 COc1ccncc1N Amb1091865 [0,2,0,0,0,0|1,0,0]=3 4425 B9R1.15 COc1ccncc1O Amb10067115 [0,2,0,0,0,0|1,0,0]=3 4426 B9R1.15 COc1ccnnc1Cl Amb26515894 [0,2,0,0,0,0|2,0,0]=4 4427 B9R1.15 COc1ccnnc1N Amb33537671 [0,2,0,0,0,0|2,0,0]=4 4428 B9R1.15 COc1cnccc1Br Amb10602632 [0,2,0,0,0,0|1,0,0]=3 4429 B9R1.15 COc1cnccc1Br Amb19957814 [0,2,0,0,0,0|1,0,0]=3 4430 B9R1.15 COc1cnccc1F Amb26842590 [0,2,0,0,0,0|1,0,0]=3 4431 B9R1.15 COc1cnccc1I Amb23412301 [0,2,0,0,0,0|1,0,0]=3 4432 B9R1.15 COc1cnccc1N Amb33543969 [0,2,0,0,0,0|1,0,0]=3 4433 B9R1.15 COc1cnccc1O Amb19895108 [0,2,0,0,0,0|1,0,0]=3 4434 B9R1.15 COc1cncnc1C Amb23412497 [0,2,0,0,0,0|2,0,0]=4 4435 B9R1.15 COc1cncnc1Cl Amb33543965 [0,2,0,0,0,0|2,0,0]=4 4436 B9R1.15 COc1cncnc1F Amb26915540 [0,2,0,0,0,0|2,0,0]=4 4437 B9R1.15 COc1cncnc1I Amb25353418 [0,2,0,0,0,0|2,0,0]=4 4438 B9R1.15 COc1cncnc1N Amb17933833 [0,2,0,0,0,0|2,0,0]=4 4439 B9R1.15 COc1cncnc1O Amb21937045 [0,2,0,0,0,0|2,0,0]=4 4440 B9R1.15 COc1cncnc1S Amb21937046 [0,2,0,0,0,0|2,0,0]=4 4441 B9R1.15 COc1cnncc1Br Amb24727495 [0,2,0,0,0,0|2,0,0]=4 4442 B9R1.15 COc1ncccc1Br Amb24065697 [0,2,0,0,0,0|1,0,0]=3 4443 B9R1.15 COc1ncccc1Br Amb33538379 [0,2,0,0,0,0|1,0,0]=3 4444 B9R1.15 COc1ncccc1C Amb8386287 [0,2,0,0,0,0|1,0,0]=3 4445 B9R1.15 COc1ncccc1Cl Amb8396903 [0,2,0,0,0,0|1,0,0]=3 4446 B9R1.15 COc1ncccc1F Amb19895349 [0,2,0,0,0,0|1,0,0]=3 4447 B9R1.15 COc1ncccc1F Amb19959758 [0,2,0,0,0,0|1,0,0]=3 4448 B9R1.15 COc1ncccc1I Amb4560952 [0,2,0,0,0,0|1,0,0]=3 4449 B9R1.15 COc1ncccc1N Amb1125539 [0,2,0,0,0,0|1,0,0]=3 4450 B9R1.15 COc1ncccc1O Amb9792642 [0,2,0,0,0,0|1,0,0]=3 4451 B9R1.15 COc1ncccc1S Amb33378280 [0,2,0,0,0,0|1,0,0]=3 4452 B9R1.15 COc1nccnc1Br Amb10603556 [0,2,0,0,0,0|2,0,0]=4 4453 B9R1.15 COc1nccnc1C Amb4037066 [0,2,0,0,0,0|2,0,0]=4 4454 B9R1.15 COc1nccnc1Cl Amb8387496 [0,2,0,0,0,0|2,0,0]=4 4455 B9R1.15 COc1nccnc1F Amb25889559 [0,2,0,0,0,0|2,0,0]=4 4456 B9R1.15 COc1nccnc1I Amb10067347 [0,2,0,0,0,0|2,0,0]=4 4457 B9R1.15 COc1nccnc1N Amb13883737 [0,2,0,0,0,0|2,0,0]=4 4458 B9R1.15 COc1nccnc1O Amb24601749 [0,2,0,0,0,0|2,0,0]=4 4459 B9R1.15 COc1ncncc1Br Amb33539180 [0,2,0,0,0,0|2,0,0]=4 4460 B9R1.15 COc1ncncc1C Amb24070445 [0,2,0,0,0,0|2,0,0]=4 4461 B9R1.15 COc1ncncc1Cl Amb22728923 [0,2,0,0,0,0|2,0,0]=4 4462 B9R1.15 COc1ncncc1F Amb24071392 [0,2,0,0,0,0|2,0,0]=4 4463 B9R1.15 COc1ncncc1I Amb22498845 [0,2,0,0,0,0|2,0,0]=4 4464 B9R1.15 COc1ncncc1N Amb16185751 [0,2,0,0,0,0|2,0,0]=4 4465 B9R1.15 COc1ncncc1N Amb21927706 [0,2,0,0,0,0|2,0,0]=4 4466 B9R1.15 COc1nnccc1N Amb24428403 [0,2,0,0,0,0|2,0,0]=4 4467 B9R1.15 COc1nnccc1N Amb28935026 [0,2,0,0,0,0|2,0,0]=4 4468 B9R1.15 CPc1ccccc1N Amb27862120 [0,2,0,0,0,0|1,0,0]=3 4469 B9R1.15 CSC1=CC=CNC1=O Amb27424642 [0,2,0,0,0,0|1,0,1]=4 4470 B9R1.15 CSc1cccc[n+]1[O-] Amb27837608 [0,2,0,0,0,0|1,0,1]=4 4471 B9R1.15 CSc1ccccc1Br Amb2685500 [0,2,0,0,0,0|0,1,0]=3 4472 B9R1.15 CSc1ccccc1C Amb10571827 [0,2,0,0,0,0|0,1,0]=3 4473 B9R1.15 CSc1ccccc1F Amb2688420 [0,2,0,0,0,0|0,1,0]=3 4474 B9R1.15 CSc1ccccc1I Amb2688886 [0,2,0,0,0,0|0,1,0]=3 4475 B9R1.15 CSc1ccccc1N Amb2689720 [0,2,0,0,0,0|0,1,0]=3 4476 B9R1.15 CSc1ccccc1O Amb2688795 [0,2,0,0,0,0|0,0,0]=2 4477 B9R1.15 CSc1ccccc1S Amb19887951 [0,2,0,0,0,0|0,1,0]=3 4478 B9R1.15 CSc1cccnc1Br Amb22232104 [0,2,0,0,0,0|1,1,0]=4 4479 B9R1.15 CSc1cccnc1Cl Amb27838615 [0,2,0,0,0,0|1,1,0]=4 4480 B9R1.15 CSc1cccnc1F Amb24104392 [0,2,0,0,0,0|1,1,0]=4 4481 B9R1.15 CSc1cccnc1I Amb25069548 [0,2,0,0,0,0|1,1,0]=4 4482 B9R1.15 CSc1cccnc1N Amb26967637 [0,2,0,0,0,0|1,1,0]=4 4483 B9R1.15 CSc1ccncc1F Amb26436653 [0,2,0,0,0,0|1,1,0]=4 4484 B9R1.15 CSc1ccncc1N Amb8931085 [0,2,0,0,0,0|1,1,0]=4 4485 B9R1.15 CSc1ccncc1O Amb25918829 [0,2,0,0,0,0|1,0,0]=3 4486 B9R1.15 CSc1cnccc1Br Amb25727456 [0,2,0,0,0,0|1,1,0]=4 4487 B9R1.15 CSc1ncccc1Br Amb22301525 [0,2,0,0,0,0|1,1,0]=4 4488 B9R1.15 CSc1ncccc1C Amb24702638 [0,2,0,0,0,0|1,1,0]=4 4489 B9R1.15 CSc1ncccc1Cl Amb24647275 [0,2,0,0,0,0|1,1,0]=4 4490 B9R1.15 CSc1ncccc1F Amb24546532 [0,2,0,0,0,0|1,1,0]=4 4491 B9R1.15 CSc1ncccc1N Amb22288910 [0,2,0,0,0,0|1,1,0]=4 4492 B9R1.15 CSc1ncccc1N Amb8931789 [0,2,0,0,0,0|1,1,0]=4 4493 B9R1.15 CSc1ncccc1O Amb10552587 [0,2,0,0,0,0|1,0,0]=3 4494 B9R1.15 C[NH2+]c1ccccc1[NH3+] Amb30876911 [0,2,0,0,0,0|1,0,0]=3 4495 B9R1.15 C[n+]1ccccc1C#N Amb3429609 [0,2,0,0,0,0|2,0,0]=4 4496 B9R1.15 C[n+]1ccccc1C=O Amb27862804 [0,2,0,0,0,0|1,0,1]=4 4497 B9R1.15 Cc1ccccc1C#N Amb4123103 [0,2,0,0,0,0|1,0,0]=3 4498 B9R1.15 Cc1ccccc1C=O Amb2725485 [0,2,0,0,0,0|0,0,1]=3 4499 B9R1.15 Cc1ccccc1CBr Amb3939708 [0,2,0,0,0,0|1,0,0]=3 4500 B9R1.15 Cc1ccccc1CCl Amb2792896 [0,2,0,0,0,0|1,0,0]=3 4501 B9R1.15 Cc1ccccc1CN Amb1651810 [0,2,0,0,0,0|1,0,0]=3 4502 B9R1.15 Cc1ccccc1CN Amb24065797 [0,2,0,0,0,0|1,0,0]=3 4503 B9R1.15 Cc1ccccc1CO Amb837463 [0,2,0,0,0,0|0,0,0]=2 4504 B9R1.15 Cc1ccccc1CS Amb2726199 [0,2,0,0,0,0|0,1,0]=3 4505 B9R1.15 Cc1ccccc1N=O Amb22233124 [0,2,0,0,0,0|0,0,1]=3 4506 B9R1.15 Cc1ccccc1NN Amb1039461 [0,2,0,0,0,0|1,0,0]=3 4507 B9R1.15 Cc1ccccc1NN Amb1208830 [0,2,0,0,0,0|1,0,0]=3 4508 B9R1.15 Cc1ccccc1NN Amb22489459 [0,2,0,0,0,0|1,0,0]=3 4509 B9R1.15 Cc1ccccc1NO Amb21961958 [0,2,0,0,0,0|0,0,0]=2 4510 B9R1.15 Cc1ccccc1[Mg]Cl Amb22338469 [0,2,0,0,0,0|1,0,0]=3 4511 B9R1.15 Cc1ccccc1[N+]#N Amb27170151 [0,2,0,0,0,0|1,0,0]=3 4512 B9R1.15 Cc1ccccc1[NH2+]O Amb24113085 [0,2,0,0,0,0|0,0,0]=2 4513 B9R1.15 Cc1ccccc1[Ni]Cl Amb33611502 [0,2,0,0,0,0|1,0,0]=3 4514 B9R1.15 Cc1cccnc1C#N Amb2612446 [0,2,0,0,0,0|2,0,0]=4 4515 B9R1.15 Cc1cccnc1C=O Amb2447573 [0,2,0,0,0,0|1,0,1]=4 4516 B9R1.15 Cc1cccnc1CBr Amb1935083 [0,2,0,0,0,0|2,0,0]=4 4517 B9R1.15 Cc1cccnc1CBr Amb2692416 [0,2,0,0,0,0|2,0,0]=4 4518 B9R1.15 Cc1cccnc1CCl Amb21964607 [0,2,0,0,0,0|2,0,0]=4 4519 B9R1.15 Cc1cccnc1CCl Amb3941355 [0,2,0,0,0,0|2,0,0]=4 4520 B9R1.15 Cc1cccnc1CN Amb22233790 [0,2,0,0,0,0|2,0,0]=4 4521 B9R1.15 Cc1cccnc1CN Amb2684467 [0,2,0,0,0,0|2,0,0]=4 4522 B9R1.15 Cc1cccnc1CO Amb22233995 [0,2,0,0,0,0|1,0,0]=3 4523 B9R1.15 Cc1cccnc1CO Amb2695614 [0,2,0,0,0,0|1,0,0]=3 4524 B9R1.15 Cc1cccnc1CS Amb25284674 [0,2,0,0,0,0|1,1,0]=4 4525 B9R1.15 Cc1cccnc1NN Amb5730481 [0,2,0,0,0,0|2,0,0]=4 4526 B9R1.15 Cc1cccnc1[Zn]Br Amb22000377 [0,2,0,0,0,0|2,0,0]=4 4527 B9R1.15 Cc1ccncc1C#N Amb2609576 [0,2,0,0,0,0|2,0,0]=4 4528 B9R1.15 Cc1ccncc1C=O Amb2447575 [0,2,0,0,0,0|1,0,1]=4 4529 B9R1.15 Cc1ccncc1CBr Amb21964366 [0,2,0,0,0,0|2,0,0]=4 4530 B9R1.15 Cc1ccncc1CBr Amb22436775 [0,2,0,0,0,0|2,0,0]=4 4531 B9R1.15 Cc1ccncc1CCl Amb20668411 [0,2,0,0,0,0|2,0,0]=4 4532 B9R1.15 Cc1ccncc1CN Amb22500751 [0,2,0,0,0,0|2,0,0]=4 4533 B9R1.15 Cc1ccncc1CN Amb22747290 [0,2,0,0,0,0|2,0,0]=4 4534 B9R1.15 Cc1ccncc1CN Amb8010867 [0,2,0,0,0,0|2,0,0]=4 4535 B9R1.15 Cc1ccncc1CO Amb19892286 [0,2,0,0,0,0|1,0,0]=3 4536 B9R1.15 Cc1ccncc1CS Amb25839891 [0,2,0,0,0,0|1,1,0]=4 4537 B9R1.15 Cc1ccncc1NN Amb10603705 [0,2,0,0,0,0|2,0,0]=4 4538 B9R1.15 Cc1cnccc1C#N Amb8439529 [0,2,0,0,0,0|2,0,0]=4 4539 B9R1.15 Cc1cnccc1C=O Amb2694741 [0,2,0,0,0,0|1,0,1]=4 4540 B9R1.15 Cc1cnccc1CBr Amb24752357 [0,2,0,0,0,0|2,0,0]=4 4541 B9R1.15 Cc1cnccc1CCl Amb19516653 [0,2,0,0,0,0|2,0,0]=4 4542 B9R1.15 Cc1cnccc1CCl Amb30526965 [0,2,0,0,0,0|2,0,0]=4 4543 B9R1.15 Cc1cnccc1CN Amb2695617 [0,2,0,0,0,0|2,0,0]=4 4544 B9R1.15 Cc1cnccc1CN Amb8630132 [0,2,0,0,0,0|2,0,0]=4 4545 B9R1.15 Cc1cnccc1CO Amb2695451 [0,2,0,0,0,0|1,0,0]=3 4546 B9R1.15 Cc1cnccc1CS Amb26925948 [0,2,0,0,0,0|1,1,0]=4 4547 B9R1.15 Cc1cnccc1NN Amb10607653 [0,2,0,0,0,0|2,0,0]=4 4548 B9R1.15 Cc1cnccc1NN Amb19890099 [0,2,0,0,0,0|2,0,0]=4 4549 B9R1.15 Cc1cnccc1NO Amb27652342 [0,2,0,0,0,0|1,0,0]=3 4550 B9R1.15 Cc1cncnc1CO Amb26331108 [0,2,0,0,0,0|2,0,0]=4 4551 B9R1.15 Cc1ncccc1C#N Amb33542630 [0,2,0,0,0,0|2,0,0]=4 4552 B9R1.15 Cc1ncccc1C=O Amb10602118 [0,2,0,0,0,0|1,0,1]=4 4553 B9R1.15 Cc1ncccc1CBr Amb18850480 [0,2,0,0,0,0|2,0,0]=4 4554 B9R1.15 Cc1ncccc1CBr Amb20671009 [0,2,0,0,0,0|2,0,0]=4 4555 B9R1.15 Cc1ncccc1CCl Amb18851725 [0,2,0,0,0,0|2,0,0]=4 4556 B9R1.15 Cc1ncccc1CCl Amb20171422 [0,2,0,0,0,0|2,0,0]=4 4557 B9R1.15 Cc1ncccc1CN Amb22747289 [0,2,0,0,0,0|2,0,0]=4 4558 B9R1.15 Cc1ncccc1CN Amb33542974 [0,2,0,0,0,0|2,0,0]=4 4559 B9R1.15 Cc1ncccc1CO Amb33533075 [0,2,0,0,0,0|1,0,0]=3 4560 B9R1.15 Cc1ncccc1CS Amb18852312 [0,2,0,0,0,0|1,1,0]=4 4561 B9R1.15 Cc1ncccc1NN Amb22001559 [0,2,0,0,0,0|2,0,0]=4 4562 B9R1.15 Cc1ncccc1NN Amb30640044 [0,2,0,0,0,0|2,0,0]=4 4563 B9R1.15 Cc1ncccc1[N+]#N Amb27750977 [0,2,0,0,0,0|2,0,0]=4 4564 B9R1.15 Cc1nccnc1CO Amb19516781 [0,2,0,0,0,0|2,0,0]=4 4565 B9R1.15 Cc1ncncc1CO Amb23401791 [0,2,0,0,0,0|2,0,0]=4 4566 B9R1.15 Cc1nnccc1CO Amb30594092 [0,2,0,0,0,0|2,0,0]=4 4567 B9R1.15 ClCc1ccccc1Br Amb5395415 [0,2,0,0,0,0|1,0,0]=3 4568 B9R1.15 ClCc1ccccc1Cl Amb1691713 [0,2,0,0,0,0|1,0,0]=3 4569 B9R1.15 ClCc1cccnc1Br Amb22044048 [0,2,0,0,0,0|2,0,0]=4 4570 B9R1.15 ClCc1cccnc1Cl Amb13952360 [0,2,0,0,0,0|2,0,0]=4 4571 B9R1.15 ClCc1cccnc1Cl Amb13953079 [0,2,0,0,0,0|2,0,0]=4 4572 B9R1.15 ClCc1ccncc1Br Amb27424026 [0,2,0,0,0,0|2,0,0]=4 4573 B9R1.15 ClCc1ccncc1Br Amb30588572 [0,2,0,0,0,0|2,0,0]=4 4574 B9R1.15 ClCc1ccncc1Cl Amb19148857 [0,2,0,0,0,0|2,0,0]=4 4575 B9R1.15 ClCc1cnccc1Br Amb28189615 [0,2,0,0,0,0|2,0,0]=4 4576 B9R1.15 ClCc1cnccc1Cl Amb24091385 [0,2,0,0,0,0|2,0,0]=4 4577 B9R1.15 ClCc1ncccc1Br Amb21926821 [0,2,0,0,0,0|2,0,0]=4 4578 B9R1.15 ClCc1ncccc1Br Amb32674865 [0,2,0,0,0,0|2,0,0]=4 4579 B9R1.15 ClCc1ncccc1Cl Amb20671208 [0,2,0,0,0,0|2,0,0]=4 4580 B9R1.15 ClCc1ncccc1Cl Amb22494746 [0,2,0,0,0,0|2,0,0]=4 4581 B9R1.15 Clc1ccccc1CBr Amb2685772 [0,2,0,0,0,0|1,0,0]=3 4582 B9R1.15 Clc1ccccc1CI Amb33546475 [0,2,0,0,0,0|1,0,0]=3 4583 B9R1.15 Clc1ccccc1[Zn]I Amb6300217 [0,2,0,0,0,0|1,0,0]=3 4584 B9R1.15 Clc1cccnc1CBr Amb22494738 [0,2,0,0,0,0|2,0,0]=4 4585 B9R1.15 Clc1cccnc1CBr Amb30867940 [0,2,0,0,0,0|2,0,0]=4 4586 B9R1.15 Clc1ccncc1CBr Amb27876045 [0,2,0,0,0,0|2,0,0]=4 4587 B9R1.15 Clc1cnccc1CBr Amb25032117 [0,2,0,0,0,0|2,0,0]=4 4588 B9R1.15 Clc1cnccc1CBr Amb33038304 [0,2,0,0,0,0|2,0,0]=4 4589 B9R1.15 Clc1cnccc1CI Amb27412071 [0,2,0,0,0,0|2,0,0]=4 4590 B9R1.15 Clc1ncccc1CBr Amb22753739 [0,2,0,0,0,0|2,0,0]=4 4591 B9R1.15 Clc1ncccc1CBr Amb32662885 [0,2,0,0,0,0|2,0,0]=4 4592 B9R1.15 FCc1ccccc1Br Amb25762101 [0,2,0,0,0,0|1,0,0]=3 4593 B9R1.15 FCc1ncccc1Br Amb35744428 [0,2,0,0,0,0|2,0,0]=4 4594 B9R1.15 Fc1ccccc1CBr Amb2688042 [0,2,0,0,0,0|1,0,0]=3 4595 B9R1.15 Fc1ccccc1CCl Amb6364744 [0,2,0,0,0,0|1,0,0]=3 4596 B9R1.15 Fc1ccccc1CS Amb2691866 [0,2,0,0,0,0|0,1,0]=3 4597 B9R1.15 Fc1cccnc1C=S Amb27808136 [0,2,0,0,0,0|1,1,0]=4 4598 B9R1.15 Fc1cccnc1CBr Amb21964584 [0,2,0,0,0,0|2,0,0]=4 4599 B9R1.15 Fc1cccnc1CBr Amb22491310 [0,2,0,0,0,0|2,0,0]=4 4600 B9R1.15 Fc1cccnc1CBr Amb32409347 [0,2,0,0,0,0|2,0,0]=4 4601 B9R1.15 Fc1cccnc1CCl Amb19515818 [0,2,0,0,0,0|2,0,0]=4 4602 B9R1.15 Fc1cccnc1CCl Amb21963959 [0,2,0,0,0,0|2,0,0]=4 4603 B9R1.15 Fc1cccnc1CS Amb33419586 [0,2,0,0,0,0|1,1,0]=4 4604 B9R1.15 Fc1ccncc1CBr Amb27645182 [0,2,0,0,0,0|2,0,0]=4 4605 B9R1.15 Fc1ccncc1CCl Amb32682509 [0,2,0,0,0,0|2,0,0]=4 4606 B9R1.15 Fc1cnccc1CBr Amb22011572 [0,2,0,0,0,0|2,0,0]=4 4607 B9R1.15 Fc1cnccc1CCl Amb22886714 [0,2,0,0,0,0|2,0,0]=4 4608 B9R1.15 Fc1cnccc1CCl Amb25147215 [0,2,0,0,0,0|2,0,0]=4 4609 B9R1.15 Fc1cnccc1CS Amb33317412 [0,2,0,0,0,0|1,1,0]=4 4610 B9R1.15 Fc1ncccc1CBr Amb22490568 [0,2,0,0,0,0|2,0,0]=4 4611 B9R1.15 Fc1ncccc1CCl Amb22490569 [0,2,0,0,0,0|2,0,0]=4 4612 B9R1.15 Fc1ncccc1CS Amb33376785 [0,2,0,0,0,0|1,1,0]=4 4613 B9R1.15 N#CC1=CC=CNC1=O Amb19267114 [0,2,0,0,0,0|1,0,1]=4 4614 B9R1.15 N#CC1=CC=CNC1=S Amb19887168 [0,2,0,0,0,0|1,1,0]=4 4615 B9R1.15 N#CC1=CNC=CC1=O Amb19958252 [0,2,0,0,0,0|1,0,1]=4 4616 B9R1.15 N#CC1=CNC=CC1O Amb28285126 [0,2,0,0,0,0|1,0,1]=4 4617 B9R1.15 N#Cc1cccc[n+]1[O-] Amb3429112 [0,2,0,0,0,0|1,0,1]=4 4618 B9R1.15 N#Cc1ccccc1Br Amb2609951 [0,2,0,0,0,0|1,0,0]=3 4619 B9R1.15 N#Cc1ccccc1Cl Amb4314506 [0,2,0,0,0,0|1,0,0]=3 4620 B9R1.15 N#Cc1ccccc1F Amb1665980 [0,2,0,0,0,0|1,0,0]=3 4621 B9R1.15 N#Cc1ccccc1I Amb2688835 [0,2,0,0,0,0|1,0,0]=3 4622 B9R1.15 N#Cc1ccccc1N Amb535677 [0,2,0,0,0,0|1,0,0]=3 4623 B9R1.15 N#Cc1ccccc1O Amb1803244 [0,2,0,0,0,0|0,0,0]=2 4624 B9R1.15 N#Cc1ccccc1S Amb6716165 [0,2,0,0,0,0|0,1,0]=3 4625 B9R1.15 N#Cc1cccnc1Br Amb1273319 [0,2,0,0,0,0|2,0,0]=4 4626 B9R1.15 N#Cc1cccnc1Cl Amb1047842 [0,2,0,0,0,0|2,0,0]=4 4627 B9R1.15 N#Cc1cccnc1F Amb8393562 [0,2,0,0,0,0|2,0,0]=4 4628 B9R1.15 N#Cc1cccnc1I Amb10070701 [0,2,0,0,0,0|2,0,0]=4 4629 B9R1.15 N#Cc1cccnc1N Amb2610804 [0,2,0,0,0,0|2,0,0]=4 4630 B9R1.15 N#Cc1cccnc1O Amb8397289 [0,2,0,0,0,0|1,0,0]=3 4631 B9R1.15 N#Cc1cccnc1S Amb2092262 [0,2,0,0,0,0|1,1,0]=4 4632 B9R1.15 N#Cc1ccncc1Br Amb33544398 [0,2,0,0,0,0|2,0,0]=4 4633 B9R1.15 N#Cc1ccncc1Cl Amb33528898 [0,2,0,0,0,0|2,0,0]=4 4634 B9R1.15 N#Cc1ccncc1F Amb16231214 [0,2,0,0,0,0|2,0,0]=4 4635 B9R1.15 N#Cc1ccncc1I Amb21964437 [0,2,0,0,0,0|2,0,0]=4 4636 B9R1.15 N#Cc1ccncc1N Amb8386718 [0,2,0,0,0,0|2,0,0]=4 4637 B9R1.15 N#Cc1ccncc1O Amb18124274 [0,2,0,0,0,0|1,0,0]=3 4638 B9R1.15 N#Cc1ccnnc1O Amb22642160 [0,2,0,0,0,0|2,0,0]=4 4639 B9R1.15 N#Cc1cnccc1Br Amb8397298 [0,2,0,0,0,0|2,0,0]=4 4640 B9R1.15 N#Cc1cnccc1Cl Amb17942821 [0,2,0,0,0,0|2,0,0]=4 4641 B9R1.15 N#Cc1cnccc1I Amb19516079 [0,2,0,0,0,0|2,0,0]=4 4642 B9R1.15 N#Cc1cnccc1N Amb16231562 [0,2,0,0,0,0|2,0,0]=4 4643 B9R1.15 N#Cc1cnccc1S Amb23452756 [0,2,0,0,0,0|1,1,0]=4 4644 B9R1.15 N#Cc1cncnc1O Amb8394847 [0,2,0,0,0,0|2,0,0]=4 4645 B9R1.15 N#Cc1ncccc1Br Amb33528479 [0,2,0,0,0,0|2,0,0]=4 4646 B9R1.15 N#Cc1ncccc1Cl Amb2610803 [0,2,0,0,0,0|2,0,0]=4 4647 B9R1.15 N#Cc1ncccc1F Amb2724995 [0,2,0,0,0,0|2,0,0]=4 4648 B9R1.15 N#Cc1ncccc1I Amb19957710 [0,2,0,0,0,0|2,0,0]=4 4649 B9R1.15 N#Cc1ncccc1N Amb2695302 [0,2,0,0,0,0|2,0,0]=4 4650 B9R1.15 N#Cc1ncccc1O Amb8384428 [0,2,0,0,0,0|1,0,0]=3 4651 B9R1.15 N#Cc1ncccc1S Amb24415246 [0,2,0,0,0,0|1,1,0]=4 4652 B9R1.15 N#Cc1nccnc1O Amb22292433 [0,2,0,0,0,0|2,0,0]=4 4653 B9R1.15 N#Cc1ncncc1O Amb25253217 [0,2,0,0,0,0|2,0,0]=4 4654 B9R1.15 N#[N+]c1ccccc1I Amb27163628 [0,2,0,0,0,0|1,0,0]=3 4655 B9R1.15 N#[N+]c1ccccc1O Amb28125164 [0,2,0,0,0,0|0,0,0]=2 4656 B9R1.15 N=C1C=CC=C\C1=C\Br Amb27607660 [0,2,0,0,0,0|1,0,0]=3 4657 B9R1.15 N=Cc1ccccc1Cl Amb26046361 [0,2,0,0,0,0|1,0,0]=3 4658 B9R1.15 N=Cc1ccccc1O Amb28382612 [0,2,0,0,0,0|0,0,0]=2 4659 B9R1.15 N=Cc1cnncc1O Amb28052824 [0,2,0,0,0,0|2,0,0]=4 4660 B9R1.15 NCC1=CC=CNC1=O Amb18043158 [0,2,0,0,0,0|1,0,1]=4 4661 B9R1.15 NCC1=CC=CNC1=O Amb22054312 [0,2,0,0,0,0|1,0,1]=4 4662 B9R1.15 NCc1cccc[n+]1[O-] Amb27196290 [0,2,0,0,0,0|1,0,1]=4 4663 B9R1.15 NCc1ccccc1Br Amb4037050 [0,2,0,0,0,0|1,0,0]=3 4664 B9R1.15 NCc1ccccc1Br Amb6365738 [0,2,0,0,0,0|1,0,0]=3 4665 B9R1.15 NCc1ccccc1Cl Amb19958655 [0,2,0,0,0,0|1,0,0]=3 4666 B9R1.15 NCc1ccccc1Cl Amb932820 [0,2,0,0,0,0|1,0,0]=3 4667 B9R1.15 NCc1ccccc1F Amb2780405 [0,2,0,0,0,0|1,0,0]=3 4668 B9R1.15 NCc1ccccc1F Amb535712 [0,2,0,0,0,0|1,0,0]=3 4669 B9R1.15 NCc1ccccc1I Amb8397048 [0,2,0,0,0,0|1,0,0]=3 4670 B9R1.15 NCc1ccccc1N Amb3941688 [0,2,0,0,0,0|1,0,0]=3 4671 B9R1.15 NCc1ccccc1N Amb8631266 [0,2,0,0,0,0|1,0,0]=3 4672 B9R1.15 NCc1ccccc1O Amb1111172 [0,2,0,0,0,0|0,0,0]=2 4673 B9R1.15 NCc1ccccc1O Amb13951900 [0,2,0,0,0,0|0,0,0]=2 4674 B9R1.15 NCc1ccccc1O Amb30594500 [0,2,0,0,0,0|0,0,0]=2 4675 B9R1.15 NCc1ccccc1S Amb27487957 [0,2,0,0,0,0|0,1,0]=3 4676 B9R1.15 NCc1cccnc1Br Amb20247921 [0,2,0,0,0,0|2,0,0]=4 4677 B9R1.15 NCc1cccnc1Cl Amb19929364 [0,2,0,0,0,0|2,0,0]=4 4678 B9R1.15 NCc1cccnc1Cl Amb22498734 [0,2,0,0,0,0|2,0,0]=4 4679 B9R1.15 NCc1cccnc1Cl Amb8631118 [0,2,0,0,0,0|2,0,0]=4 4680 B9R1.15 NCc1cccnc1F Amb10603597 [0,2,0,0,0,0|2,0,0]=4 4681 B9R1.15 NCc1cccnc1F Amb21857815 [0,2,0,0,0,0|2,0,0]=4 4682 B9R1.15 NCc1cccnc1I Amb25889424 [0,2,0,0,0,0|2,0,0]=4 4683 B9R1.15 NCc1cccnc1N Amb15701368 [0,2,0,0,0,0|2,0,0]=4 4684 B9R1.15 NCc1cccnc1O Amb32409635 [0,2,0,0,0,0|1,0,0]=3 4685 B9R1.15 NCc1cccnc1O Amb33611602 [0,2,0,0,0,0|1,0,0]=3 4686 B9R1.15 NCc1cccnc1O Amb8855139 [0,2,0,0,0,0|1,0,0]=3 4687 B9R1.15 NCc1ccncc1Br Amb18252030 [0,2,0,0,0,0|2,0,0]=4 4688 B9R1.15 NCc1ccncc1Br Amb30585169 [0,2,0,0,0,0|2,0,0]=4 4689 B9R1.15 NCc1ccncc1Cl Amb18831608 [0,2,0,0,0,0|2,0,0]=4 4690 B9R1.15 NCc1ccncc1Cl Amb21927836 [0,2,0,0,0,0|2,0,0]=4 4691 B9R1.15 NCc1ccncc1F Amb13890638 [0,2,0,0,0,0|2,0,0]=4 4692 B9R1.15 NCc1ccncc1F Amb16186030 [0,2,0,0,0,0|2,0,0]=4 4693 B9R1.15 NCc1ccncc1I Amb24554252 [0,2,0,0,0,0|2,0,0]=4 4694 B9R1.15 NCc1ccncc1N Amb16230501 [0,2,0,0,0,0|2,0,0]=4 4695 B9R1.15 NCc1ccncc1N Amb22755075 [0,2,0,0,0,0|2,0,0]=4 4696 B9R1.15 NCc1ccncc1O Amb20247896 [0,2,0,0,0,0|1,0,0]=3 4697 B9R1.15 NCc1ccnnc1O Amb27809785 [0,2,0,0,0,0|2,0,0]=4 4698 B9R1.15 NCc1cnccc1Br Amb22292211 [0,2,0,0,0,0|2,0,0]=4 4699 B9R1.15 NCc1cnccc1Cl Amb18831607 [0,2,0,0,0,0|2,0,0]=4 4700 B9R1.15 NCc1cnccc1Cl Amb22886403 [0,2,0,0,0,0|2,0,0]=4 4701 B9R1.15 NCc1cnccc1Cl Amb33715871 [0,2,0,0,0,0|2,0,0]=4 4702 B9R1.15 NCc1cnccc1N Amb33552971 [0,2,0,0,0,0|2,0,0]=4 4703 B9R1.15 NCc1cnccc1O Amb18908274 [0,2,0,0,0,0|1,0,0]=3 4704 B9R1.15 NCc1ncccc1Br Amb22501100 [0,2,0,0,0,0|2,0,0]=4 4705 B9R1.15 NCc1ncccc1Br Amb22756452 [0,2,0,0,0,0|2,0,0]=4 4706 B9R1.15 NCc1ncccc1Br Amb32667089 [0,2,0,0,0,0|2,0,0]=4 4707 B9R1.15 NCc1ncccc1Cl Amb19929608 [0,2,0,0,0,0|2,0,0]=4 4708 B9R1.15 NCc1ncccc1Cl Amb21857817 [0,2,0,0,0,0|2,0,0]=4 4709 B9R1.15 NCc1ncccc1F Amb21962659 [0,2,0,0,0,0|2,0,0]=4 4710 B9R1.15 NCc1ncccc1F Amb22754755 [0,2,0,0,0,0|2,0,0]=4 4711 B9R1.15 NCc1ncccc1F Amb8629674 [0,2,0,0,0,0|2,0,0]=4 4712 B9R1.15 NCc1ncccc1N Amb18908273 [0,2,0,0,0,0|2,0,0]=4 4713 B9R1.15 NCc1ncccc1N Amb23401213 [0,2,0,0,0,0|2,0,0]=4 4714 B9R1.15 NCc1ncccc1O Amb22501146 [0,2,0,0,0,0|1,0,0]=3 4715 B9R1.15 NCc1ncccc1O Amb2697349 [0,2,0,0,0,0|1,0,0]=3 4716 B9R1.15 NCc1ncccc1O Amb33482924 [0,2,0,0,0,0|1,0,0]=3 4717 B9R1.15 NCc1ncccc1S Amb24427279 [0,2,0,0,0,0|1,1,0]=4 4718 B9R1.15 NCc1nccnc1O Amb18279588 [0,2,0,0,0,0|2,0,0]=4 4719 B9R1.15 NCc1nccnc1O Amb32665366 [0,2,0,0,0,0|2,0,0]=4 4720 B9R1.15 NCc1ncncc1O Amb27256926 [0,2,0,0,0,0|2,0,0]=4 4721 B9R1.15 NNc1ccccc1Br Amb1043737 [0,2,0,0,0,0|1,0,0]=3 4722 B9R1.15 NNc1ccccc1Br Amb1158939 [0,2,0,0,0,0|1,0,0]=3 4723 B9R1.15 NNc1ccccc1Br Amb22489456 [0,2,0,0,0,0|1,0,0]=3 4724 B9R1.15 NNc1ccccc1Cl Amb1039456 [0,2,0,0,0,0|1,0,0]=3 4725 B9R1.15 NNc1ccccc1Cl Amb1152012 [0,2,0,0,0,0|1,0,0]=3 4726 B9R1.15 NNc1ccccc1Cl Amb22432563 [0,2,0,0,0,0|1,0,0]=3 4727 B9R1.15 NNc1ccccc1F Amb1058739 [0,2,0,0,0,0|1,0,0]=3 4728 B9R1.15 NNc1ccccc1F Amb1158938 [0,2,0,0,0,0|1,0,0]=3 4729 B9R1.15 NNc1ccccc1I Amb10072000 [0,2,0,0,0,0|1,0,0]=3 4730 B9R1.15 NNc1ccccc1I Amb1055179 [0,2,0,0,0,0|1,0,0]=3 4731 B9R1.15 NNc1ccccc1N Amb28047832 [0,2,0,0,0,0|1,0,0]=3 4732 B9R1.15 NNc1ccccc1O Amb25827397 [0,2,0,0,0,0|0,0,0]=2 4733 B9R1.15 NNc1ccccc1S Amb27192454 [0,2,0,0,0,0|0,1,0]=3 4734 B9R1.15 NNc1cccnc1Br Amb23454429 [0,2,0,0,0,0|2,0,0]=4 4735 B9R1.15 NNc1cccnc1Cl Amb18644047 [0,2,0,0,0,0|2,0,0]=4 4736 B9R1.15 NNc1cccnc1F Amb23454424 [0,2,0,0,0,0|2,0,0]=4 4737 B9R1.15 NNc1cccnc1F Amb35788384 [0,2,0,0,0,0|2,0,0]=4 4738 B9R1.15 NNc1ccncc1Br Amb22458356 [0,2,0,0,0,0|2,0,0]=4 4739 B9R1.15 NNc1ccncc1Cl Amb20667651 [0,2,0,0,0,0|2,0,0]=4 4740 B9R1.15 NNc1ccncc1F Amb24102165 [0,2,0,0,0,0|2,0,0]=4 4741 B9R1.15 NNc1ccncc1F Amb32666834 [0,2,0,0,0,0|2,0,0]=4 4742 B9R1.15 NNc1cnccc1Br Amb23559469 [0,2,0,0,0,0|2,0,0]=4 4743 B9R1.15 NNc1cnccc1Cl Amb23557907 [0,2,0,0,0,0|2,0,0]=4 4744 B9R1.15 NNc1cnccc1N Amb27413166 [0,2,0,0,0,0|2,0,0]=4 4745 B9R1.15 NNc1ncccc1Br Amb19046890 [0,2,0,0,0,0|2,0,0]=4 4746 B9R1.15 NNc1ncccc1Cl Amb1120542 [0,2,0,0,0,0|2,0,0]=4 4747 B9R1.15 NNc1ncccc1Cl Amb22500210 [0,2,0,0,0,0|2,0,0]=4 4748 B9R1.15 NNc1ncccc1F Amb10839016 [0,2,0,0,0,0|2,0,0]=4 4749 B9R1.15 NNc1ncccc1I Amb23401082 [0,2,0,0,0,0|2,0,0]=4 4750 B9R1.15 NNc1ncccc1N Amb18642207 [0,2,0,0,0,0|2,0,0]=4 4751 B9R1.15 NNc1ncccc1S Amb27972023 [0,2,0,0,0,0|1,1,0]=4 4752 B9R1.15 NOc1ccccc1Br Amb24556800 [0,2,0,0,0,0|0,0,0]=2 4753 B9R1.15 NOc1ccccc1Cl Amb18124665 [0,2,0,0,0,0|0,0,0]=2 4754 B9R1.15 NOc1ccccc1Cl Amb32651980 [0,2,0,0,0,0|0,0,0]=2 4755 B9R1.15 NOc1ccccc1F Amb22900914 [0,2,0,0,0,0|0,0,0]=2 4756 B9R1.15 NOc1ccccc1F Amb26427812 [0,2,0,0,0,0|0,0,0]=2 4757 B9R1.15 NOc1ncccc1Cl Amb24101179 [0,2,0,0,0,0|1,0,0]=3 4758 B9R1.15 N[n+]1ccccc1CO Amb27839504 [0,2,0,0,0,0|1,0,0]=3 4759 B9R1.15 N\C=C1\C=CC=NC1=O Amb24710475 [0,2,0,0,0,0|1,0,1]=4 4760 B9R1.15 Nc1ccccc1C=O Amb30634288 [0,2,0,0,0,0|0,0,1]=3 4761 B9R1.15 Nc1ccccc1C=O Amb6307282 [0,2,0,0,0,0|0,0,1]=3 4762 B9R1.15 Nc1ccccc1CCl Amb6740281 [0,2,0,0,0,0|1,0,0]=3 4763 B9R1.15 Nc1ccccc1CF Amb19515970 [0,2,0,0,0,0|1,0,0]=3 4764 B9R1.15 Nc1ccccc1CO Amb1808337 [0,2,0,0,0,0|0,0,0]=2 4765 B9R1.15 Nc1ccccc1CS Amb27787743 [0,2,0,0,0,0|0,1,0]=3 4766 B9R1.15 Nc1ccccc1N=O Amb27216714 [0,2,0,0,0,0|0,0,1]=3 4767 B9R1.15 Nc1cccnc1C=O Amb2697303 [0,2,0,0,0,0|1,0,1]=4 4768 B9R1.15 Nc1cccnc1CBr Amb26425861 [0,2,0,0,0,0|2,0,0]=4 4769 B9R1.15 Nc1cccnc1CO Amb2697304 [0,2,0,0,0,0|1,0,0]=3 4770 B9R1.15 Nc1ccncc1C=O Amb1094063 [0,2,0,0,0,0|1,0,1]=4 4771 B9R1.15 Nc1ccncc1C=O Amb19929570 [0,2,0,0,0,0|1,0,1]=4 4772 B9R1.15 Nc1ccncc1C=O Amb33622703 [0,2,0,0,0,0|1,0,1]=4 4773 B9R1.15 Nc1ccncc1C=O Amb33869903 [0,2,0,0,0,0|1,0,1]=4 4774 B9R1.15 Nc1ccncc1CO Amb2697298 [0,2,0,0,0,0|1,0,0]=3 4775 B9R1.15 Nc1cnccc1C=O Amb21963531 [0,2,0,0,0,0|1,0,1]=4 4776 B9R1.15 Nc1cnccc1C=O Amb2697296 [0,2,0,0,0,0|1,0,1]=4 4777 B9R1.15 Nc1cnccc1CBr Amb22750984 [0,2,0,0,0,0|2,0,0]=4 4778 B9R1.15 Nc1cnccc1CCl Amb8386499 [0,2,0,0,0,0|2,0,0]=4 4779 B9R1.15 Nc1cnccc1CO Amb2697302 [0,2,0,0,0,0|1,0,0]=3 4780 B9R1.15 Nc1cncnc1CO Amb22755330 [0,2,0,0,0,0|2,0,0]=4 4781 B9R1.15 Nc1ncccc1C=O Amb1090876 [0,2,0,0,0,0|1,0,1]=4 4782 B9R1.15 Nc1ncccc1CBr Amb20247764 [0,2,0,0,0,0|2,0,0]=4 4783 B9R1.15 Nc1ncccc1CBr Amb33314333 [0,2,0,0,0,0|2,0,0]=4 4784 B9R1.15 Nc1ncccc1CCl Amb6307341 [0,2,0,0,0,0|2,0,0]=4 4785 B9R1.15 Nc1ncccc1CO Amb2608577 [0,2,0,0,0,0|1,0,0]=3 4786 B9R1.15 Nc1ncccc1N=O Amb27590255 [0,2,0,0,0,0|1,0,1]=4 4787 B9R1.15 Nc1nccnc1CO Amb20622522 [0,2,0,0,0,0|2,0,0]=4 4788 B9R1.15 Nc1ncncc1CO Amb20668186 [0,2,0,0,0,0|2,0,0]=4 4789 B9R1.15 O=C1C=CNC=C1CBr Amb27970389 [0,2,0,0,0,0|1,0,1]=4 4790 B9R1.15 O=C1C=CNN=C1CO Amb28351522 [0,2,0,0,0,0|2,0,0]=4 4791 B9R1.15 O=C1CCC=C\C1=C\O Amb25298436 [0,2,0,0,0,0|0,0,2]=4 4792 B9R1.15 O=C1NC=CC=C1CBr Amb18925116 [0,2,0,0,0,0|1,0,1]=4 4793 B9R1.15 O=C1NC=CC=C1CO Amb18922455 [0,2,0,0,0,0|1,0,0]=3 4794 B9R1.15 O=C1NC=NC=C1CO Amb27228831 [0,2,0,0,0,0|2,0,0]=4 4795 B9R1.15 O=CC1=CC=CNC1=O Amb18832973 [0,2,0,0,0,0|1,0,1]=4 4796 B9R1.15 O=Cc1cccc[n+]1[O-] Amb27434444 [0,2,0,0,0,0|1,0,1]=4 4797 B9R1.15 O=Cc1ccccc1Br Amb2684948 [0,2,0,0,0,0|0,0,1]=3 4798 B9R1.15 O=Cc1ccccc1Cl Amb2387351 [0,2,0,0,0,0|0,0,1]=3 4799 B9R1.15 O=Cc1ccccc1F Amb2688017 [0,2,0,0,0,0|0,0,1]=3 4800 B9R1.15 O=Cc1ccccc1I Amb1207354 [0,2,0,0,0,0|0,0,1]=3 4801 B9R1.15 O=Cc1ccccc1O Amb2792756 [0,2,0,0,0,0|0,0,0]=2 4802 B9R1.15 O=Cc1ccccc1S Amb18643290 [0,2,0,0,0,0|0,0,1]=3 4803 B9R1.15 O=Cc1cccnc1Br Amb2234596 [0,2,0,0,0,0|1,0,1]=4 4804 B9R1.15 O=Cc1cccnc1Cl Amb2418601 [0,2,0,0,0,0|1,0,1]=4 4805 B9R1.15 O=Cc1cccnc1F Amb2447351 [0,2,0,0,0,0|1,0,1]=4 4806 B9R1.15 O=Cc1cccnc1O Amb18642078 [0,2,0,0,0,0|1,0,0]=3 4807 B9R1.15 O=Cc1ccncc1Br Amb2447417 [0,2,0,0,0,0|1,0,1]=4 4808 B9R1.15 O=Cc1ccncc1Cl Amb22728978 [0,2,0,0,0,0|1,0,1]=4 4809 B9R1.15 O=Cc1ccncc1Cl Amb2797644 [0,2,0,0,0,0|1,0,1]=4 4810 B9R1.15 O=Cc1ccncc1Cl Amb34911645 [0,2,0,0,0,0|1,0,1]=4 4811 B9R1.15 O=Cc1ccncc1F Amb33544828 [0,2,0,0,0,0|1,0,1]=4 4812 B9R1.15 O=Cc1ccncc1I Amb27959180 [0,2,0,0,0,0|1,0,1]=4 4813 B9R1.15 O=Cc1ccncc1O Amb2697950 [0,2,0,0,0,0|1,0,0]=3 4814 B9R1.15 O=Cc1cnccc1Br Amb13890400 [0,2,0,0,0,0|1,0,1]=4 4815 B9R1.15 O=Cc1cnccc1Br Amb22491437 [0,2,0,0,0,0|1,0,1]=4 4816 B9R1.15 O=Cc1cnccc1Br Amb2447416 [0,2,0,0,0,0|1,0,1]=4 4817 B9R1.15 O=Cc1cnccc1Cl Amb10067841 [0,2,0,0,0,0|1,0,1]=4 4818 B9R1.15 O=Cc1cnccc1Cl Amb22491113 [0,2,0,0,0,0|1,0,1]=4 4819 B9R1.15 O=Cc1cnccc1F Amb20247834 [0,2,0,0,0,0|1,0,1]=4 4820 B9R1.15 O=Cc1cnccc1O Amb20247827 [0,2,0,0,0,0|1,0,0]=3 4821 B9R1.15 O=Cc1ncccc1Br Amb2447550 [0,2,0,0,0,0|1,0,1]=4 4822 B9R1.15 O=Cc1ncccc1Cl Amb10602299 [0,2,0,0,0,0|1,0,1]=4 4823 B9R1.15 O=Cc1ncccc1F Amb2447518 [0,2,0,0,0,0|1,0,1]=4 4824 B9R1.15 O=Cc1ncccc1O Amb22495285 [0,2,0,0,0,0|1,0,0]=3 4825 B9R1.15 O=Cc1ncccc1O Amb2691308 [0,2,0,0,0,0|1,0,0]=3 4826 B9R1.15 O=Cc1nccnc1O Amb28285120 [0,2,0,0,0,0|2,0,0]=4 4827 B9R1.15 O=Nc1ccccc1Cl Amb27252949 [0,2,0,0,0,0|0,0,1]=3 4828 B9R1.15 O=Nc1ccccc1O Amb17593255 [0,2,0,0,0,0|0,0,0]=2 4829 B9R1.15 O=Nc1cccnc1Cl Amb27204274 [0,2,0,0,0,0|1,0,1]=4 4830 B9R1.15 O=Nc1ncccc1O Amb27267943 [0,2,0,0,0,0|1,0,0]=3 4831 B9R1.15 OCC1=CC=CNC1=S Amb25210908 [0,2,0,0,0,0|1,0,0]=3 4832 B9R1.15 OCc1ccccc1Br Amb3939081 [0,2,0,0,0,0|0,0,0]=2 4833 B9R1.15 OCc1ccccc1Cl Amb837338 [0,2,0,0,0,0|0,0,0]=2 4834 B9R1.15 OCc1ccccc1F Amb837270 [0,2,0,0,0,0|0,0,0]=2 4835 B9R1.15 OCc1ccccc1I Amb6373404 [0,2,0,0,0,0|0,0,0]=2 4836 B9R1.15 OCc1ccccc1O Amb3940117 [0,2,0,0,0,0|0,0,0]=2 4837 B9R1.15 OCc1ccccc1S Amb2689068 [0,2,0,0,0,0|0,0,0]=2 4838 B9R1.15 OCc1cccnc1Br Amb4561110 [0,2,0,0,0,0|1,0,0]=3 4839 B9R1.15 OCc1cccnc1Cl Amb2722986 [0,2,0,0,0,0|1,0,0]=3 4840 B9R1.15 OCc1cccnc1F Amb10603593 [0,2,0,0,0,0|1,0,0]=3 4841 B9R1.15 OCc1cccnc1O Amb20247914 [0,2,0,0,0,0|1,0,0]=3 4842 B9R1.15 OCc1ccncc1Br Amb19958216 [0,2,0,0,0,0|1,0,0]=3 4843 B9R1.15 OCc1ccncc1Cl Amb8630898 [0,2,0,0,0,0|1,0,0]=3 4844 B9R1.15 OCc1ccncc1F Amb13887027 [0,2,0,0,0,0|1,0,0]=3 4845 B9R1.15 OCc1ccncc1I Amb23447040 [0,2,0,0,0,0|1,0,0]=3 4846 B9R1.15 OCc1ccncc1O Amb8439447 [0,2,0,0,0,0|1,0,0]=3 4847 B9R1.15 OCc1cnccc1Br Amb19958695 [0,2,0,0,0,0|1,0,0]=3 4848 B9R1.15 OCc1cnccc1Br Amb20671165 [0,2,0,0,0,0|1,0,0]=3 4849 B9R1.15 OCc1cnccc1Br Amb31205724 [0,2,0,0,0,0|1,0,0]=3 4850 B9R1.15 OCc1cnccc1Cl Amb10068416 [0,2,0,0,0,0|1,0,0]=3 4851 B9R1.15 OCc1cnccc1Cl Amb22233797 [0,2,0,0,0,0|1,0,0]=3 4852 B9R1.15 OCc1cnccc1F Amb25147035 [0,2,0,0,0,0|1,0,0]=3 4853 B9R1.15 OCc1cnccc1F Amb30633187 [0,2,0,0,0,0|1,0,0]=3 4854 B9R1.15 OCc1cnccc1I Amb27603031 [0,2,0,0,0,0|1,0,0]=3 4855 B9R1.15 OCc1cncnc1Br Amb26566315 [0,2,0,0,0,0|2,0,0]=4 4856 B9R1.15 OCc1cncnc1Cl Amb22236141 [0,2,0,0,0,0|2,0,0]=4 4857 B9R1.15 OCc1ncccc1Br Amb13882830 [0,2,0,0,0,0|1,0,0]=3 4858 B9R1.15 OCc1ncccc1Cl Amb15695291 [0,2,0,0,0,0|1,0,0]=3 4859 B9R1.15 OCc1ncccc1F Amb2723486 [0,2,0,0,0,0|1,0,0]=3 4860 B9R1.15 OCc1ncccc1I Amb23447033 [0,2,0,0,0,0|1,0,0]=3 4861 B9R1.15 OCc1ncccc1O Amb2611945 [0,2,0,0,0,0|1,0,0]=3 4862 B9R1.15 OCc1ncccc1O Amb8384342 [0,2,0,0,0,0|1,0,0]=3 4863 B9R1.15 OCc1nccnc1Cl Amb16233469 [0,2,0,0,0,0|2,0,0]=4 4864 B9R1.15 OCc1ncncc1Br Amb22497742 [0,2,0,0,0,0|2,0,0]=4 4865 B9R1.15 OCc1ncncc1F Amb27965561 [0,2,0,0,0,0|2,0,0]=4 4866 B9R1.15 ONc1ccccc1Cl Amb24093632 [0,2,0,0,0,0|0,0,0]=2 4867 B9R1.15 ONc1ccccc1I Amb22230990 [0,2,0,0,0,0|0,0,0]=2 4868 B9R1.15 ONc1cccnc1Cl Amb27185887 [0,2,0,0,0,0|1,0,0]=3 4869 B9R1.15 ONc1ccncc1F Amb30020351 [0,2,0,0,0,0|1,0,0]=3 4870 B9R1.15 ONc1ncccc1F Amb27844903 [0,2,0,0,0,0|1,0,0]=3 4871 B9R1.15 ONc1ncncc1Cl Amb27835282 [0,2,0,0,0,0|2,0,0]=4 4872 B9R1.15 ONc1ncncc1I Amb27397452 [0,2,0,0,0,0|2,0,0]=4 4873 B9R1.15 Oc1ccccc1CBr Amb18129657 [0,2,0,0,0,0|0,0,0]=2 4874 B9R1.15 Oc1ccccc1CCl Amb17477840 [0,2,0,0,0,0|0,0,0]=2 4875 B9R1.15 Oc1ccccc1CS Amb25188976 [0,2,0,0,0,0|0,0,0]=2 4876 B9R1.15 Oc1cccnc1CBr Amb8504199 [0,2,0,0,0,0|1,0,0]=3 4877 B9R1.15 Oc1cccnc1CCl Amb24062575 [0,2,0,0,0,0|1,0,0]=3 4878 B9R1.15 Oc1cccnc1CCl Amb34916680 [0,2,0,0,0,0|1,0,0]=3 4879 B9R1.15 Oc1cnccc1CBr Amb25697071 [0,2,0,0,0,0|1,0,0]=3 4880 B9R1.15 SCc1ccccc1Br Amb2691875 [0,2,0,0,0,0|0,1,0]=3 4881 B9R1.15 SCc1ccccc1Cl Amb6255353 [0,2,0,0,0,0|0,1,0]=3 4882 B9R1.15 SCc1cccnc1Br Amb33387702 [0,2,0,0,0,0|1,1,0]=4 4883 B9R1.15 SCc1cccnc1Cl Amb22396091 [0,2,0,0,0,0|1,1,0]=4 4884 B9R1.15 SCc1ccncc1Br Amb32788848 [0,2,0,0,0,0|1,1,0]=4 4885 B9R1.15 SCc1ccncc1Cl Amb24465690 [0,2,0,0,0,0|1,1,0]=4 4886 B9R1.15 SCc1ncccc1Br Amb24528797 [0,2,0,0,0,0|1,1,0]=4 4887 B9R1.15 Sc1ccccc1CBr Amb27482544 [0,2,0,0,0,0|0,1,0]=3 4888 B9R1.15 Sc1cnccc1CCl Amb27406865 [0,2,0,0,0,0|1,1,0]=4 4889 B9R1.15 [C-]#[N+]c1ccccc1Br Amb2685423 [0,2,0,0,0,0|1,0,0]=3 4890 B9R1.15 [C-]#[N+]c1ccccc1C Amb2689613 [0,2,0,0,0,0|1,0,0]=3 4891 B9R1.15 [C-]#[N+]c1ccccc1Cl Amb1981078 [0,2,0,0,0,0|1,0,0]=3 4892 B9R1.15 [C-]#[N+]c1ccccc1F Amb2688352 [0,2,0,0,0,0|1,0,0]=3 4893 B9R1.15 [C-]#[N+]c1ccccc1I Amb2234691 [0,2,0,0,0,0|1,0,0]=3 4894 B9R1.15 [C-]#[N+]c1cccnc1Br Amb24596731 [0,2,0,0,0,0|2,0,0]=4 4895 B9R1.15 [C-]#[N+]c1cccnc1C Amb25268590 [0,2,0,0,0,0|2,0,0]=4 4896 B9R1.15 [C-]#[N+]c1cccnc1Cl Amb32797375 [0,2,0,0,0,0|2,0,0]=4 4897 B9R1.15 [C-]#[N+]c1cccnc1F Amb32797444 [0,2,0,0,0,0|2,0,0]=4 4898 B9R1.15 [C-]#[N+]c1ccncc1Br Amb25937285 [0,2,0,0,0,0|2,0,0]=4 4899 B9R1.15 [C-]#[N+]c1ccncc1C Amb33414465 [0,2,0,0,0,0|2,0,0]=4 4900 B9R1.15 [C-]#[N+]c1ccncc1Cl Amb25961204 [0,2,0,0,0,0|2,0,0]=4 4901 B9R1.15 [C-]#[N+]c1ccncc1F Amb33317692 [0,2,0,0,0,0|2,0,0]=4 4902 B9R1.15 [C-]#[N+]c1cnccc1Br Amb26572044 [0,2,0,0,0,0|2,0,0]=4 4903 B9R1.15 [C-]#[N+]c1cnccc1C Amb26906581 [0,2,0,0,0,0|2,0,0]=4 4904 B9R1.15 [C-]#[N+]c1cnccc1Cl Amb33738379 [0,2,0,0,0,0|2,0,0]=4 4905 B9R1.15 [C-]#[N+]c1ncccc1Br Amb24519065 [0,2,0,0,0,0|2,0,0]=4 4906 B9R1.15 [C-]#[N+]c1ncccc1C Amb26329841 [0,2,0,0,0,0|2,0,0]=4 4907 B9R1.15 [C-]#[N+]c1ncccc1Cl Amb33747268 [0,2,0,0,0,0|2,0,0]=4 4908 B9R1.15 [C-]#[N+]c1ncccc1F Amb25352198 [0,2,0,0,0,0|2,0,0]=4 4909 B9R1.15 [N-]=[N+]=C1C=CC=NC1=O Amb27169106 [0,2,0,0,0,0|1,0,1]=4 4910 B9R1.15 [NH3+]Nc1ccccc1Cl Amb24113856 [0,2,0,0,0,0|1,0,0]=3 4911 B9R1.15 [O-][n+]1ccccc1CCl Amb26390864 [0,2,0,0,0,0|1,0,1]=4 4912 B9R1.15 [O-][n+]1ccccc1CO Amb17615558 [0,2,0,0,0,0|1,0,0]=3 4913 B9R1.15 [O-][n+]1ccccc1S[Na] Amb535011 [0,2,0,0,0,0|1,0,1]=4 4914 B9R1.118 CC1(CO)C=CCC=C1 Amb27613393 [0,2,0,0,0,0|0,0,2]=4 4915 B9R1.118 COP1(=O)C=CNC=C1 Amb27832436 [0,2,0,0,0,0|2,0,0]=4 4916 B9R1.10 CC1(Cl)C=CC(=O)C=C1 Amb28285172 [0,2,0,0,0,0|0,0,2]=4 4917 B9R1.10 CC1(N)C=CC(=O)C=C1 Amb27971345 [0,2,0,0,0,0|0,0,2]=4 4918 B9R1.10 NC1(O)C=CC(Br)=CN1 Amb27845458 [0,2,0,0,0,0|1,0,1]=4 4919 B9R1.10 O=C1C=CS(=O)(=O)C=C1 Amb22364491 [0,2,0,0,0,0|1,0,1]=4 4920 B9R1.69 Brc1cc(Br)c(Br)cn1 Amb2609482 [0,2,0,0,0,0|2,0,0]=4 4921 B9R1.69 Brc1cc(I)c(Br)cn1 Amb22490000 [0,2,0,0,0,0|2,0,0]=4 4922 B9R1.69 Brc1cc(I)ccc1I Amb26424326 [0,2,0,0,0,0|1,0,0]=3 4923 B9R1.69 Brc1cc(I)cnc1I Amb27657501 [0,2,0,0,0,0|2,0,0]=4 4924 B9R1.69 Brc1cc(I)ncc1I Amb24319031 [0,2,0,0,0,0|2,0,0]=4 4925 B9R1.69 Brc1ccc(Br)c(Br)c1 Amb6365700 [0,2,0,0,0,0|1,0,0]=3 4926 B9R1.69 Brc1ccc(Br)c(Br)n1 Amb20670249 [0,2,0,0,0,0|2,0,0]=4 4927 B9R1.69 Brc1ccc(Br)c(I)c1 Amb22001501 [0,2,0,0,0,0|1,0,0]=3 4928 B9R1.69 Brc1ccc(Br)c(I)n1 Amb22491789 [0,2,0,0,0,0|2,0,0]=4 4929 B9R1.69 Brc1ccc(I)c(Br)c1 Amb19929214 [0,2,0,0,0,0|1,0,0]=3 4930 B9R1.69 Brc1ccc(I)c(I)c1 Amb24321229 [0,2,0,0,0,0|1,0,0]=3 4931 B9R1.69 Brc1ccc(I)c(I)n1 Amb24663651 [0,2,0,0,0,0|2,0,0]=4 4932 B9R1.69 Brc1ccc(I)cc1Br Amb19929136 [0,2,0,0,0,0|1,0,0]=3 4933 B9R1.69 Brc1ccc(I)nc1Br Amb27613812 [0,2,0,0,0,0|2,0,0]=4 4934 B9R1.69 Brc1ccc(I)nc1I Amb25227167 [0,2,0,0,0,0|2,0,0]=4 4935 B9R1.69 Brc1cnc(Br)c(Br)c1 Amb1395751 [0,2,0,0,0,0|2,0,0]=4 4936 B9R1.69 Brc1cnc(Br)c(I)c1 Amb22495304 [0,2,0,0,0,0|2,0,0]=4 4937 B9R1.69 Brc1cnc(I)c(Br)c1 Amb10071776 [0,2,0,0,0,0|2,0,0]=4 4938 B9R1.69 Brc1cnc(I)c(I)c1 Amb21959438 [0,2,0,0,0,0|2,0,0]=4 4939 B9R1.69 Brc1cnc(I)cc1Br Amb24578940 [0,2,0,0,0,0|2,0,0]=4 4940 B9R1.69 Brc1nc(I)ccc1I Amb28208611 [0,2,0,0,0,0|2,0,0]=4 4941 B9R1.69 Brc1ncc(I)cc1I Amb20620453 [0,2,0,0,0,0|2,0,0]=4 4942 B9R1.69 CC1=C(Br)C=CC(=N)N1 Amb20635674 [0,2,0,0,0,0|2,0,0]=4 4943 B9R1.69 CC1=C(Br)C=CC(=O)N1 Amb18040573 [0,2,0,0,0,0|1,0,1]=4 4944 B9R1.69 CC1=C(C)NC(=O)C=C1 Amb19516765 [0,2,0,0,0,0|1,0,1]=4 4945 B9R1.69 CC1=C(C)NC(=S)C=C1 Amb27179847 [0,2,0,0,0,0|1,1,0]=4 4946 B9R1.69 CC1=C(F)C=CC(=O)N1 Amb22490584 [0,2,0,0,0,0|1,0,1]=4 4947 B9R1.69 CC1=C(I)C=CC(=O)N1 Amb22727942 [0,2,0,0,0,0|1,0,1]=4 4948 B9R1.69 CC1=C(N)C=CC(=O)N1 Amb22728633 [0,2,0,0,0,0|1,0,1]=4 4949 B9R1.69 CC1=C(N)NC(=O)C=C1 Amb22496008 [0,2,0,0,0,0|1,0,1]=4 4950 B9R1.69 CC1=C(N)NC(=O)C=C1 Amb33734853 [0,2,0,0,0,0|1,0,1]=4 4951 B9R1.69 CC1=CC(=N)C=CC1=O Amb28386642 [0,2,0,0,0,0|0,0,1]=3 4952 B9R1.69 CC1=CC(=O)C(=O)C=C1 Amb17593242 [0,2,0,0,0,0|0,0,1]=3 4953 B9R1.69 CC1=CC(=O)C(C)=CO1 Amb27256389 [0,2,0,0,0,0|1,0,1]=4 4954 B9R1.69 CC1=CC(=O)C(N)=CN1 Amb26080169 [0,2,0,0,0,0|1,0,1]=4 4955 B9R1.69 CC1=CC(=O)C(O)=CN1 Amb22552444 [0,2,0,0,0,0|1,0,0]=3 4956 B9R1.69 CC1=CC(=O)C(O)=CO1 Amb19130353 [0,2,0,0,0,0|1,0,0]=3 4957 B9R1.69 CC1=CC(=O)C=CC1=O Amb6386415 [0,2,0,0,0,0|0,0,1]=3 4958 B9R1.69 CC1=CC(=O)C=CC1O Amb27750285 [0,2,0,0,0,0|0,0,1]=3 4959 B9R1.69 CC1=CC(=O)C=CN1C Amb22522501 [0,2,0,0,0,0|1,0,1]=4 4960 B9R1.69 CC1=CC(=O)NC=C1Br Amb18040562 [0,2,0,0,0,0|1,0,1]=4 4961 B9R1.69 CC1=CC(=O)NC=C1Br Amb33266063 [0,2,0,0,0,0|1,0,1]=4 4962 B9R1.69 CC1=CC(=O)NC=C1F Amb24401662 [0,2,0,0,0,0|1,0,1]=4 4963 B9R1.69 CC1=CC(=O)NC=C1N Amb22059188 [0,2,0,0,0,0|1,0,1]=4 4964 B9R1.69 CC1=CC(=S)N(O)C=C1 Amb23592269 [0,2,0,0,0,0|1,0,0]=3 4965 B9R1.69 CC1=CC(Br)=CNC1=O Amb18040567 [0,2,0,0,0,0|1,0,1]=4 4966 B9R1.69 CC1=CC(F)=CNC1=O Amb27223987 [0,2,0,0,0,0|1,0,1]=4 4967 B9R1.69 CC1=CC(N)=CNC1=O Amb22122487 [0,2,0,0,0,0|1,0,1]=4 4968 B9R1.69 CC1=CC(O)C=CC1=O Amb27954124 [0,2,0,0,0,0|0,0,1]=3 4969 B9R1.69 CC1=CC=C(Br)NC1=O Amb27413895 [0,2,0,0,0,0|1,0,1]=4 4970 B9R1.69 CC1=CC=C(Cl)C(=O)N1 Amb23448406 [0,2,0,0,0,0|1,0,1]=4 4971 B9R1.69 CC1=CC=C(Cl)NC1=O Amb22234254 [0,2,0,0,0,0|1,0,1]=4 4972 B9R1.69 CC1=CC=C(F)C(=O)N1 Amb26321131 [0,2,0,0,0,0|1,0,1]=4 4973 B9R1.69 CC1=CC=C(N)C(=O)N1 Amb18036956 [0,2,0,0,0,0|1,0,1]=4 4974 B9R1.69 CC1=CC=C(N)C(=O)O1 Amb28399466 [0,2,0,0,0,0|1,0,1]=4 4975 B9R1.69 CC1=CC=C(O)C(=O)N1 Amb24725980 [0,2,0,0,0,0|1,0,0]=3 4976 B9R1.69 CC1=CN(C)C=CC1=O Amb26494391 [0,2,0,0,0,0|1,0,1]=4 4977 B9R1.69 CC1=CN(O)C(=O)C=N1 Amb26001681 [0,2,0,0,0,0|2,0,0]=4 4978 B9R1.69 CC1=CNC(=O)C(Br)=C1 Amb18040568 [0,2,0,0,0,0|1,0,1]=4 4979 B9R1.69 CC1=CNC(=O)C(C)=C1 Amb33544989 [0,2,0,0,0,0|1,0,1]=4 4980 B9R1.69 CC1=CNC(=O)C(F)=C1 Amb24578766 [0,2,0,0,0,0|1,0,1]=4 4981 B9R1.69 CC1=CNC(=O)C(I)=C1 Amb22500947 [0,2,0,0,0,0|1,0,1]=4 4982 B9R1.69 CC1=CNC(=O)C(N)=C1 Amb21856115 [0,2,0,0,0,0|1,0,1]=4 4983 B9R1.69 CN1C=C(Br)C=CC1=O Amb19127382 [0,2,0,0,0,0|1,0,1]=4 4984 B9R1.69 CN1C=C(Br)C=CC1=S Amb27242585 [0,2,0,0,0,0|1,1,0]=4 4985 B9R1.69 CN1C=C(Cl)C=CC1=O Amb19127719 [0,2,0,0,0,0|1,0,1]=4 4986 B9R1.69 CN1C=C(F)C=CC1=O Amb19127846 [0,2,0,0,0,0|1,0,1]=4 4987 B9R1.69 CN1C=C(I)C=CC1=O Amb25124951 [0,2,0,0,0,0|1,0,1]=4 4988 B9R1.69 CN1C=C(N)C=CC1=O Amb18030063 [0,2,0,0,0,0|1,0,1]=4 4989 B9R1.69 CN1C=C(N)C=CC1=O Amb19372742 [0,2,0,0,0,0|1,0,1]=4 4990 B9R1.69 CN1C=C(N)C=CC1=O Amb22405882 [0,2,0,0,0,0|1,0,1]=4 4991 B9R1.69 CN1C=C(O)C=CC1=O Amb22371453 [0,2,0,0,0,0|1,0,0]=3 4992 B9R1.69 CN1C=CC(=N)C=C1N Amb27482938 [0,2,0,0,0,0|2,0,0]=4 4993 B9R1.69 CN1C=CC(=O)C(Br)=C1 Amb22750543 [0,2,0,0,0,0|1,0,1]=4 4994 B9R1.69 CN1C=CC(=O)C(Cl)=C1 Amb25744517 [0,2,0,0,0,0|1,0,1]=4 4995 B9R1.69 CN1C=CC(=O)C(I)=C1 Amb28428506 [0,2,0,0,0,0|1,0,1]=4 4996 B9R1.69 CN1C=CC(=O)C(N)=C1 Amb23586003 [0,2,0,0,0,0|1,0,1]=4 4997 B9R1.69 CN1C=CC(=O)C(O)=C1 Amb21520366 [0,2,0,0,0,0|1,0,0]=3 4998 B9R1.69 CN1C=CC(=O)C=C1Br Amb23400146 [0,2,0,0,0,0|1,0,1]=4 4999 B9R1.69 CN1C=CC(=O)C=C1Cl Amb27861303 [0,2,0,0,0,0|1,0,1]=4 5000 B9R1.69 CN1C=CC(=O)C=C1N Amb24477781 [0,2,0,0,0,0|1,0,1]=4 5001 B9R1.69 CN1C=CC(=S)C=C1N Amb27398418 [0,2,0,0,0,0|1,1,0]=4 5002 B9R1.69 CN1C=CC(Br)=CC1=O Amb33544175 [0,2,0,0,0,0|1,0,1]=4 5003 B9R1.69 CN1C=CC(Cl)=CC1=O Amb26872751 [0,2,0,0,0,0|1,0,1]=4 5004 B9R1.69 CN1C=CC(I)=CC1=O Amb22498328 [0,2,0,0,0,0|1,0,1]=4 5005 B9R1.69 CN1C=CC(N)=CC1=O Amb22405865 [0,2,0,0,0,0|1,0,1]=4 5006 B9R1.69 CN1C=CC(O)=CC1=O Amb22755090 [0,2,0,0,0,0|1,0,0]=3 5007 B9R1.69 CN1C=NC(O)=CC1=O Amb24481884 [0,2,0,0,0,0|2,0,0]=4 5008 B9R1.69 CN1C=NC(O)=CC1=S Amb27209031 [0,2,0,0,0,0|2,0,0]=4 5009 B9R1.69 CN1N=C(O)C=CC1=O Amb19650751 [0,2,0,0,0,0|2,0,0]=4 5010 B9R1.69 CN1N=CC(O)=CC1=O Amb26893883 [0,2,0,0,0,0|2,0,0]=4 5011 B9R1.69 C[n+]1cc(Cl)ccc1N Amb10552848 [0,2,0,0,0,0|2,0,0]=4 5012 B9R1.69 C[n+]1ccc(N)nc1O Amb25362190 [0,2,0,0,0,0|2,0,0]=4 5013 B9R1.69 Cc1[nH+]c(N)ccc1Br Amb33513207 [0,2,0,0,0,0|2,0,0]=4 5014 B9R1.69 Cc1c[n+]([O-])ccc1Br Amb26053609 [0,2,0,0,0,0|1,0,1]=4 5015 B9R1.69 Cc1c[n+]([O-])ccc1Cl Amb17610993 [0,2,0,0,0,0|1,0,1]=4 5016 B9R1.69 Cc1c[n+]([O-])ccc1N Amb3429462 [0,2,0,0,0,0|1,0,1]=4 5017 B9R1.69 Cc1c[nH+]c(N)c(Br)c1 Amb33513205 [0,2,0,0,0,0|2,0,0]=4 5018 B9R1.69 Cc1cc(Br)c(Br)cn1 Amb20617554 [0,2,0,0,0,0|2,0,0]=4 5019 B9R1.69 Cc1cc(Br)c(C)cn1 Amb21963407 [0,2,0,0,0,0|2,0,0]=4 5020 B9R1.69 Cc1cc(Br)c(Cl)cn1 Amb24478739 [0,2,0,0,0,0|2,0,0]=4 5021 B9R1.69 Cc1cc(Br)c(F)cn1 Amb20171054 [0,2,0,0,0,0|2,0,0]=4 5022 B9R1.69 Cc1cc(Br)c(I)cn1 Amb25122890 [0,2,0,0,0,0|2,0,0]=4 5023 B9R1.69 Cc1cc(Br)c(O)cn1 Amb27860227 [0,2,0,0,0,0|1,0,0]=3 5024 B9R1.69 Cc1cc(Br)c[nH+]c1N Amb33513206 [0,2,0,0,0,0|2,0,0]=4 5025 B9R1.69 Cc1cc(Br)cc[n+]1[O-] Amb21858329 [0,2,0,0,0,0|1,0,1]=4 5026 B9R1.69 Cc1cc(Br)ccc1Br Amb2691966 [0,2,0,0,0,0|1,0,0]=3 5027 B9R1.69 Cc1cc(Br)ccc1Cl Amb2685047 [0,2,0,0,0,0|1,0,0]=3 5028 B9R1.69 Cc1cc(Br)ccc1F Amb2685256 [0,2,0,0,0,0|1,0,0]=3 5029 B9R1.69 Cc1cc(Br)ccc1I Amb2685281 [0,2,0,0,0,0|1,0,0]=3 5030 B9R1.69 Cc1cc(Br)ccc1N Amb6364731 [0,2,0,0,0,0|1,0,0]=3 5031 B9R1.69 Cc1cc(Br)ccc1N Amb6366060 [0,2,0,0,0,0|1,0,0]=3 5032 B9R1.69 Cc1cc(Br)ccc1O Amb6344704 [0,2,0,0,0,0|0,0,0]=2 5033 B9R1.69 Cc1cc(Br)ccc1S Amb19943922 [0,2,0,0,0,0|0,1,0]=3 5034 B9R1.69 Cc1cc(Br)cnc1Br Amb2610019 [0,2,0,0,0,0|2,0,0]=4 5035 B9R1.69 Cc1cc(Br)cnc1C Amb19958003 [0,2,0,0,0,0|2,0,0]=4 5036 B9R1.69 Cc1cc(Br)cnc1Cl Amb1102011 [0,2,0,0,0,0|2,0,0]=4 5037 B9R1.69 Cc1cc(Br)cnc1F Amb6298169 [0,2,0,0,0,0|2,0,0]=4 5038 B9R1.69 Cc1cc(Br)cnc1I Amb2696288 [0,2,0,0,0,0|2,0,0]=4 5039 B9R1.69 Cc1cc(Br)cnc1N Amb2610014 [0,2,0,0,0,0|2,0,0]=4 5040 B9R1.69 Cc1cc(Br)cnc1S Amb25074125 [0,2,0,0,0,0|1,1,0]=4 5041 B9R1.69 Cc1cc(Br)ncc1Br Amb2719965 [0,2,0,0,0,0|2,0,0]=4 5042 B9R1.69 Cc1cc(Br)ncc1Cl Amb2447581 [0,2,0,0,0,0|2,0,0]=4 5043 B9R1.69 Cc1cc(Br)ncc1F Amb2447339 [0,2,0,0,0,0|2,0,0]=4 5044 B9R1.69 Cc1cc(Br)ncc1I Amb22047364 [0,2,0,0,0,0|2,0,0]=4 5045 B9R1.69 Cc1cc(Br)ncc1N Amb16233914 [0,2,0,0,0,0|2,0,0]=4 5046 B9R1.69 Cc1cc(Br)ncc1O Amb23535917 [0,2,0,0,0,0|1,0,0]=3 5047 B9R1.69 Cc1cc(C)c(Br)cn1 Amb19958673 [0,2,0,0,0,0|2,0,0]=4 5048 B9R1.69 Cc1cc(C)c(C)cn1 Amb26450477 [0,2,0,0,0,0|2,0,0]=4 5049 B9R1.69 Cc1cc(C)c(Cl)cn1 Amb19866717 [0,2,0,0,0,0|2,0,0]=4 5050 B9R1.69 Cc1cc(C)c(F)cn1 Amb26532789 [0,2,0,0,0,0|2,0,0]=4 5051 B9R1.69 Cc1cc(C)c(I)cn1 Amb23554930 [0,2,0,0,0,0|2,0,0]=4 5052 B9R1.69 Cc1cc(C)c(N)cn1 Amb1421373 [0,2,0,0,0,0|2,0,0]=4 5053 B9R1.69 Cc1cc(C)c(O)cn1 Amb10072027 [0,2,0,0,0,0|1,0,0]=3 5054 B9R1.69 Cc1cc(C)c(S)cn1 Amb23440747 [0,2,0,0,0,0|1,1,0]=4 5055 B9R1.69 Cc1cc(C)c([NH3+])cn1 Amb16231232 [0,2,0,0,0,0|2,0,0]=4 5056 B9R1.69 Cc1cc(Cl)c(Br)cn1 Amb20242857 [0,2,0,0,0,0|2,0,0]=4 5057 B9R1.69 Cc1cc(Cl)c(C)cn1 Amb21963414 [0,2,0,0,0,0|2,0,0]=4 5058 B9R1.69 Cc1cc(Cl)c(F)cn1 Amb10602678 [0,2,0,0,0,0|2,0,0]=4 5059 B9R1.69 Cc1cc(Cl)c(O)cn1 Amb27658790 [0,2,0,0,0,0|1,0,0]=3 5060 B9R1.69 Cc1cc(Cl)ccc1Br Amb2685043 [0,2,0,0,0,0|1,0,0]=3 5061 B9R1.69 Cc1cc(Cl)ccc1Cl Amb4037269 [0,2,0,0,0,0|1,0,0]=3 5062 B9R1.69 Cc1cc(Cl)ccc1F Amb2686092 [0,2,0,0,0,0|1,0,0]=3 5063 B9R1.69 Cc1cc(Cl)ccc1I Amb2686142 [0,2,0,0,0,0|1,0,0]=3 5064 B9R1.69 Cc1cc(Cl)ccc1N Amb22277147 [0,2,0,0,0,0|1,0,0]=3 5065 B9R1.69 Cc1cc(Cl)ccc1N Amb2694399 [0,2,0,0,0,0|1,0,0]=3 5066 B9R1.69 Cc1cc(Cl)ccc1O Amb3939553 [0,2,0,0,0,0|0,0,0]=2 5067 B9R1.69 Cc1cc(Cl)ccc1S Amb2686260 [0,2,0,0,0,0|0,1,0]=3 5068 B9R1.69 Cc1cc(Cl)cnc1Br Amb8392997 [0,2,0,0,0,0|2,0,0]=4 5069 B9R1.69 Cc1cc(Cl)cnc1C Amb26642606 [0,2,0,0,0,0|2,0,0]=4 5070 B9R1.69 Cc1cc(Cl)cnc1Cl Amb8385149 [0,2,0,0,0,0|2,0,0]=4 5071 B9R1.69 Cc1cc(Cl)cnc1F Amb8393022 [0,2,0,0,0,0|2,0,0]=4 5072 B9R1.69 Cc1cc(Cl)cnc1N Amb8396908 [0,2,0,0,0,0|2,0,0]=4 5073 B9R1.69 Cc1cc(Cl)cnc1O Amb16230975 [0,2,0,0,0,0|1,0,0]=3 5074 B9R1.69 Cc1cc(Cl)cnc1S Amb35676626 [0,2,0,0,0,0|1,1,0]=4 5075 B9R1.69 Cc1cc(Cl)ncc1Br Amb8516311 [0,2,0,0,0,0|2,0,0]=4 5076 B9R1.69 Cc1cc(Cl)ncc1Cl Amb10602547 [0,2,0,0,0,0|2,0,0]=4 5077 B9R1.69 Cc1cc(Cl)ncc1F Amb10602067 [0,2,0,0,0,0|2,0,0]=4 5078 B9R1.69 Cc1cc(Cl)ncc1I Amb15690999 [0,2,0,0,0,0|2,0,0]=4 5079 B9R1.69 Cc1cc(Cl)ncc1N Amb6336426 [0,2,0,0,0,0|2,0,0]=4 5080 B9R1.69 Cc1cc(Cl)ncc1O Amb19895113 [0,2,0,0,0,0|1,0,0]=3 5081 B9R1.69 Cc1cc(Cl)ncc1S Amb27444765 [0,2,0,0,0,0|1,1,0]=4 5082 B9R1.69 Cc1cc(F)c(F)cn1 Amb26940301 [0,2,0,0,0,0|2,0,0]=4 5083 B9R1.69 Cc1cc(F)c(I)cn1 Amb27665768 [0,2,0,0,0,0|2,0,0]=4 5084 B9R1.69 Cc1cc(F)c(N)cn1 Amb24526752 [0,2,0,0,0,0|2,0,0]=4 5085 B9R1.69 Cc1cc(F)cc[n+]1[O-] Amb27665231 [0,2,0,0,0,0|1,0,1]=4 5086 B9R1.69 Cc1cc(F)ccc1Br Amb2685251 [0,2,0,0,0,0|1,0,0]=3 5087 B9R1.69 Cc1cc(F)ccc1Cl Amb2686089 [0,2,0,0,0,0|1,0,0]=3 5088 B9R1.69 Cc1cc(F)ccc1F Amb2687284 [0,2,0,0,0,0|1,0,0]=3 5089 B9R1.69 Cc1cc(F)ccc1I Amb2688136 [0,2,0,0,0,0|1,0,0]=3 5090 B9R1.69 Cc1cc(F)ccc1N Amb2688171 [0,2,0,0,0,0|1,0,0]=3 5091 B9R1.69 Cc1cc(F)ccc1O Amb2688208 [0,2,0,0,0,0|0,0,0]=2 5092 B9R1.69 Cc1cc(F)ccc1S Amb2688241 [0,2,0,0,0,0|0,1,0]=3 5093 B9R1.69 Cc1cc(F)cnc1Br Amb15691041 [0,2,0,0,0,0|2,0,0]=4 5094 B9R1.69 Cc1cc(F)cnc1Cl Amb8393021 [0,2,0,0,0,0|2,0,0]=4 5095 B9R1.69 Cc1cc(F)cnc1N Amb10603835 [0,2,0,0,0,0|2,0,0]=4 5096 B9R1.69 Cc1cc(F)ncc1Br Amb8396943 [0,2,0,0,0,0|2,0,0]=4 5097 B9R1.69 Cc1cc(F)ncc1Cl Amb8393023 [0,2,0,0,0,0|2,0,0]=4 5098 B9R1.69 Cc1cc(F)ncc1F Amb27982084 [0,2,0,0,0,0|2,0,0]=4 5099 B9R1.69 Cc1cc(F)ncc1I Amb15691000 [0,2,0,0,0,0|2,0,0]=4 5100 B9R1.69 Cc1cc(F)ncc1N Amb10976036 [0,2,0,0,0,0|2,0,0]=4 5101 B9R1.69 Cc1cc(F)ncc1O Amb19895481 [0,2,0,0,0,0|1,0,0]=3 5102 B9R1.69 Cc1cc(I)c(Br)cn1 Amb28280128 [0,2,0,0,0,0|2,0,0]=4 5103 B9R1.69 Cc1cc(I)c(C)cn1 Amb27445698 [0,2,0,0,0,0|2,0,0]=4 5104 B9R1.69 Cc1cc(I)c(Cl)cn1 Amb28255651 [0,2,0,0,0,0|2,0,0]=4 5105 B9R1.69 Cc1cc(I)c(F)cn1 Amb26553931 [0,2,0,0,0,0|2,0,0]=4 5106 B9R1.69 Cc1cc(I)c(I)cn1 Amb28208781 [0,2,0,0,0,0|2,0,0]=4 5107 B9R1.69 Cc1cc(I)c(O)cn1 Amb25364601 [0,2,0,0,0,0|1,0,0]=3 5108 B9R1.69 Cc1cc(I)ccc1Br Amb2685279 [0,2,0,0,0,0|1,0,0]=3 5109 B9R1.69 Cc1cc(I)ccc1Cl Amb10069330 [0,2,0,0,0,0|1,0,0]=3 5110 B9R1.69 Cc1cc(I)ccc1F Amb2688133 [0,2,0,0,0,0|1,0,0]=3 5111 B9R1.69 Cc1cc(I)ccc1N Amb1152414 [0,2,0,0,0,0|1,0,0]=3 5112 B9R1.69 Cc1cc(I)ccc1O Amb3940781 [0,2,0,0,0,0|0,0,0]=2 5113 B9R1.69 Cc1cc(I)ccc1S Amb26039439 [0,2,0,0,0,0|0,1,0]=3 5114 B9R1.69 Cc1cc(I)cnc1Br Amb20242730 [0,2,0,0,0,0|2,0,0]=4 5115 B9R1.69 Cc1cc(I)cnc1C Amb24650074 [0,2,0,0,0,0|2,0,0]=4 5116 B9R1.69 Cc1cc(I)cnc1Cl Amb20242735 [0,2,0,0,0,0|2,0,0]=4 5117 B9R1.69 Cc1cc(I)cnc1F Amb15691037 [0,2,0,0,0,0|2,0,0]=4 5118 B9R1.69 Cc1cc(I)cnc1N Amb1068338 [0,2,0,0,0,0|2,0,0]=4 5119 B9R1.69 Cc1cc(I)cnc1O Amb2758756 [0,2,0,0,0,0|1,0,0]=3 5120 B9R1.69 Cc1cc(I)ncc1Br Amb10069155 [0,2,0,0,0,0|2,0,0]=4 5121 B9R1.69 Cc1cc(I)ncc1F Amb27623671 [0,2,0,0,0,0|2,0,0]=4 5122 B9R1.69 Cc1cc(I)ncc1I Amb20247801 [0,2,0,0,0,0|2,0,0]=4 5123 B9R1.69 Cc1cc(I)ncc1O Amb26568518 [0,2,0,0,0,0|1,0,0]=3 5124 B9R1.69 Cc1cc(N)c(Br)cn1 Amb10602587 [0,2,0,0,0,0|2,0,0]=4 5125 B9R1.69 Cc1cc(N)c(C)cn1 Amb20622931 [0,2,0,0,0,0|2,0,0]=4 5126 B9R1.69 Cc1cc(N)c(Cl)cn1 Amb21857155 [0,2,0,0,0,0|2,0,0]=4 5127 B9R1.69 Cc1cc(N)c(F)cn1 Amb16185908 [0,2,0,0,0,0|2,0,0]=4 5128 B9R1.69 Cc1cc(N)c(I)cn1 Amb21857003 [0,2,0,0,0,0|2,0,0]=4 5129 B9R1.69 Cc1cc(N)c(N)cn1 Amb10603871 [0,2,0,0,0,0|2,0,0]=4 5130 B9R1.69 Cc1cc(N)c(O)cn1 Amb25974079 [0,2,0,0,0,0|1,0,0]=3 5131 B9R1.69 Cc1cc(N)cc[n+]1[O-] Amb2610074 [0,2,0,0,0,0|1,0,1]=4 5132 B9R1.69 Cc1cc(N)ccc1Br Amb2685311 [0,2,0,0,0,0|1,0,0]=3 5133 B9R1.69 Cc1cc(N)ccc1Br Amb6366085 [0,2,0,0,0,0|1,0,0]=3 5134 B9R1.69 Cc1cc(N)ccc1Cl Amb3939778 [0,2,0,0,0,0|1,0,0]=3 5135 B9R1.69 Cc1cc(N)ccc1F Amb2688172 [0,2,0,0,0,0|1,0,0]=3 5136 B9R1.69 Cc1cc(N)ccc1I Amb8516284 [0,2,0,0,0,0|1,0,0]=3 5137 B9R1.69 Cc1cc(N)ccc1N Amb2698252 [0,2,0,0,0,0|1,0,0]=3 5138 B9R1.69 Cc1cc(N)ccc1N Amb8385079 [0,2,0,0,0,0|1,0,0]=3 5139 B9R1.69 Cc1cc(N)ccc1O Amb8854975 [0,2,0,0,0,0|0,0,0]=2 5140 B9R1.69 Cc1cc(N)ccc1S Amb8929748 [0,2,0,0,0,0|0,1,0]=3 5141 B9R1.69 Cc1cc(N)cnc1Br Amb6307163 [0,2,0,0,0,0|2,0,0]=4 5142 B9R1.69 Cc1cc(N)cnc1C Amb8386719 [0,2,0,0,0,0|2,0,0]=4 5143 B9R1.69 Cc1cc(N)cnc1Cl Amb8392983 [0,2,0,0,0,0|2,0,0]=4 5144 B9R1.69 Cc1cc(N)cnc1F Amb8392986 [0,2,0,0,0,0|2,0,0]=4 5145 B9R1.69 Cc1cc(N)cnc1I Amb22749396 [0,2,0,0,0,0|2,0,0]=4 5146 B9R1.69 Cc1cc(N)cnc1O Amb18943953 [0,2,0,0,0,0|1,0,0]=3 5147 B9R1.69 Cc1cc(N)ncc1Br Amb2610046 [0,2,0,0,0,0|2,0,0]=4 5148 B9R1.69 Cc1cc(N)ncc1Cl Amb8384319 [0,2,0,0,0,0|2,0,0]=4 5149 B9R1.69 Cc1cc(N)ncc1F Amb8396913 [0,2,0,0,0,0|2,0,0]=4 5150 B9R1.69 Cc1cc(N)ncc1I Amb6565065 [0,2,0,0,0,0|2,0,0]=4 5151 B9R1.69 Cc1cc(N)ncc1N Amb24066184 [0,2,0,0,0,0|2,0,0]=4 5152 B9R1.69 Cc1cc(N)nnc1O Amb28423942 [0,2,0,0,0,0|2,0,0]=4 5153 B9R1.69 Cc1cc(O)c(Br)cn1 Amb22751361 [0,2,0,0,0,0|1,0,0]=3 5154 B9R1.69 Cc1cc(O)c(C)nn1 Amb33299462 [0,2,0,0,0,0|2,0,0]=4 5155 B9R1.69 Cc1cc(O)c(C)nn1 Amb8438927 [0,2,0,0,0,0|2,0,0]=4 5156 B9R1.69 Cc1cc(O)c(Cl)cn1 Amb27244893 [0,2,0,0,0,0|1,0,0]=3 5157 B9R1.69 Cc1cc(O)c(Cl)nn1 Amb28071892 [0,2,0,0,0,0|2,0,0]=4 5158 B9R1.69 Cc1cc(O)c(I)cn1 Amb25198726 [0,2,0,0,0,0|1,0,0]=3 5159 B9R1.69 Cc1cc(O)cc[n+]1[O-] Amb27872730 [0,2,0,0,0,0|1,0,0]=3 5160 B9R1.69 Cc1cc(O)ccc1Br Amb2554775 [0,2,0,0,0,0|0,0,0]=2 5161 B9R1.69 Cc1cc(O)ccc1Cl Amb3939554 [0,2,0,0,0,0|0,0,0]=2 5162 B9R1.69 Cc1cc(O)ccc1F Amb2688209 [0,2,0,0,0,0|0,0,0]=2 5163 B9R1.69 Cc1cc(O)ccc1I Amb8388185 [0,2,0,0,0,0|0,0,0]=2 5164 B9R1.69 Cc1cc(O)ccc1N Amb4037027 [0,2,0,0,0,0|0,0,0]=2 5165 B9R1.69 Cc1cc(O)ccc1O Amb4037056 [0,2,0,0,0,0|0,0,0]=2 5166 B9R1.69 Cc1cc(O)cnc1Br Amb15691043 [0,2,0,0,0,0|1,0,0]=3 5167 B9R1.69 Cc1cc(O)cnc1C Amb23450142 [0,2,0,0,0,0|1,0,0]=3 5168 B9R1.69 Cc1cc(O)cnc1Cl Amb10602071 [0,2,0,0,0,0|1,0,0]=3 5169 B9R1.69 Cc1cc(O)cnc1F Amb19894567 [0,2,0,0,0,0|1,0,0]=3 5170 B9R1.69 Cc1cc(O)cnc1I Amb23403511 [0,2,0,0,0,0|1,0,0]=3 5171 B9R1.69 Cc1cc(O)cnc1N Amb22886509 [0,2,0,0,0,0|1,0,0]=3 5172 B9R1.69 Cc1cc(O)cnc1O Amb23442962 [0,2,0,0,0,0|1,0,0]=3 5173 B9R1.69 Cc1cc(O)nc[n+]1[O-] Amb27238879 [0,2,0,0,0,0|2,0,0]=4 5174 B9R1.69 Cc1cc(O)ncc1Br Amb2612460 [0,2,0,0,0,0|1,0,0]=3 5175 B9R1.69 Cc1cc(O)ncc1Cl Amb22235853 [0,2,0,0,0,0|1,0,0]=3 5176 B9R1.69 Cc1cc(O)ncc1I Amb22500946 [0,2,0,0,0,0|1,0,0]=3 5177 B9R1.69 Cc1cc(O)ncc1N Amb20242681 [0,2,0,0,0,0|1,0,0]=3 5178 B9R1.69 Cc1cc(O)ncc1O Amb20247804 [0,2,0,0,0,0|1,0,0]=3 5179 B9R1.69 Cc1cc(O)nnc1N Amb24673792 [0,2,0,0,0,0|2,0,0]=4 5180 B9R1.69 Cc1cc(O)nnc1O Amb2610026 [0,2,0,0,0,0|2,0,0]=4 5181 B9R1.69 Cc1cc(S)ccc1Br Amb19944179 [0,2,0,0,0,0|0,1,0]=3 5182 B9R1.69 Cc1cc(S)ccc1Cl Amb2686261 [0,2,0,0,0,0|0,1,0]=3 5183 B9R1.69 Cc1cc(S)ccc1F Amb2688242 [0,2,0,0,0,0|0,1,0]=3 5184 B9R1.69 Cc1cc(S)ccc1I Amb27838634 [0,2,0,0,0,0|0,1,0]=3 5185 B9R1.69 Cc1cc(S)ccc1N Amb9294842 [0,2,0,0,0,0|0,1,0]=3 5186 B9R1.69 Cc1cc(S)ccc1O Amb8393835 [0,2,0,0,0,0|0,0,0]=2 5187 B9R1.69 Cc1cc(S)ccc1S Amb25862512 [0,2,0,0,0,0|0,1,0]=3 5188 B9R1.69 Cc1cc(S)cnc1Cl Amb33059266 [0,2,0,0,0,0|1,1,0]=4 5189 B9R1.69 Cc1cc(S)ncc1Br Amb25698618 [0,2,0,0,0,0|1,1,0]=4 5190 B9R1.69 Cc1cc([NH3+])ccc1Cl Amb4300537 [0,2,0,0,0,0|1,0,0]=3 5191 B9R1.69 Cc1cc[n+]([O-])c(Br)c1 Amb22235939 [0,2,0,0,0,0|1,0,1]=4 5192 B9R1.69 Cc1cc[n+]([O-])c(Cl)c1 Amb21964109 [0,2,0,0,0,0|1,0,1]=4 5193 B9R1.69 Cc1cc[n+]([O-])cc1Br Amb2609532 [0,2,0,0,0,0|1,0,1]=4 5194 B9R1.69 Cc1cc[n+]([O-])cc1Cl Amb22364470 [0,2,0,0,0,0|1,0,1]=4 5195 B9R1.69 Cc1cc[n+]([O-])cc1N Amb28048627 [0,2,0,0,0,0|1,0,1]=4 5196 B9R1.69 Cc1ccc(Br)[n+]([O-])c1 Amb8439665 [0,2,0,0,0,0|1,0,1]=4 5197 B9R1.69 Cc1ccc(Br)c(Br)c1 Amb6365597 [0,2,0,0,0,0|1,0,0]=3 5198 B9R1.69 Cc1ccc(Br)c(Br)n1 Amb8393028 [0,2,0,0,0,0|2,0,0]=4 5199 B9R1.69 Cc1ccc(Br)c(C)c1 Amb6365774 [0,2,0,0,0,0|1,0,0]=3 5200 B9R1.69 Cc1ccc(Br)c(C)n1 Amb2609908 [0,2,0,0,0,0|2,0,0]=4 5201 B9R1.69 Cc1ccc(Br)c(Cl)c1 Amb2685046 [0,2,0,0,0,0|1,0,0]=3 5202 B9R1.69 Cc1ccc(Br)c(Cl)n1 Amb8392998 [0,2,0,0,0,0|2,0,0]=4 5203 B9R1.69 Cc1ccc(Br)c(F)c1 Amb2685255 [0,2,0,0,0,0|1,0,0]=3 5204 B9R1.69 Cc1ccc(Br)c(F)n1 Amb8393011 [0,2,0,0,0,0|2,0,0]=4 5205 B9R1.69 Cc1ccc(Br)c(I)c1 Amb19516048 [0,2,0,0,0,0|1,0,0]=3 5206 B9R1.69 Cc1ccc(Br)c(N)[nH+]1 Amb33513204 [0,2,0,0,0,0|2,0,0]=4 5207 B9R1.69 Cc1ccc(Br)c(N)c1 Amb2694664 [0,2,0,0,0,0|1,0,0]=3 5208 B9R1.69 Cc1ccc(Br)c(N)n1 Amb2720383 [0,2,0,0,0,0|2,0,0]=4 5209 B9R1.69 Cc1ccc(Br)c(O)c1 Amb33544134 [0,2,0,0,0,0|0,0,0]=2 5210 B9R1.69 Cc1ccc(Br)c(O)n1 Amb8386874 [0,2,0,0,0,0|1,0,0]=3 5211 B9R1.69 Cc1ccc(Br)c(S)c1 Amb19887966 [0,2,0,0,0,0|0,1,0]=3 5212 B9R1.69 Cc1ccc(Br)c[n+]1[O-] Amb8395923 [0,2,0,0,0,0|1,0,1]=4 5213 B9R1.69 Cc1ccc(Br)cc1Br Amb8397055 [0,2,0,0,0,0|1,0,0]=3 5214 B9R1.69 Cc1ccc(Br)cc1C Amb2685558 [0,2,0,0,0,0|1,0,0]=3 5215 B9R1.69 Cc1ccc(Br)cc1Cl Amb2685049 [0,2,0,0,0,0|1,0,0]=3 5216 B9R1.69 Cc1ccc(Br)cc1F Amb2685254 [0,2,0,0,0,0|1,0,0]=3 5217 B9R1.69 Cc1ccc(Br)cc1I Amb9673097 [0,2,0,0,0,0|1,0,0]=3 5218 B9R1.69 Cc1ccc(Br)cc1N Amb844261 [0,2,0,0,0,0|1,0,0]=3 5219 B9R1.69 Cc1ccc(Br)cc1O Amb6297716 [0,2,0,0,0,0|0,0,0]=2 5220 B9R1.69 Cc1ccc(Br)cc1S Amb19888010 [0,2,0,0,0,0|0,1,0]=3 5221 B9R1.69 Cc1ccc(Br)nc1Br Amb6307286 [0,2,0,0,0,0|2,0,0]=4 5222 B9R1.69 Cc1ccc(Br)nc1C Amb10608509 [0,2,0,0,0,0|2,0,0]=4 5223 B9R1.69 Cc1ccc(Br)nc1Cl Amb24478754 [0,2,0,0,0,0|2,0,0]=4 5224 B9R1.69 Cc1ccc(Br)nc1F Amb25977464 [0,2,0,0,0,0|2,0,0]=4 5225 B9R1.69 Cc1ccc(Br)nc1I Amb27237970 [0,2,0,0,0,0|2,0,0]=4 5226 B9R1.69 Cc1ccc(Br)nc1N Amb22752539 [0,2,0,0,0,0|2,0,0]=4 5227 B9R1.69 Cc1ccc(C)[n+]([O-])c1 Amb20670709 [0,2,0,0,0,0|1,0,1]=4 5228 B9R1.69 Cc1ccc(C)c(Br)c1 Amb2685560 [0,2,0,0,0,0|1,0,0]=3 5229 B9R1.69 Cc1ccc(C)c(Br)n1 Amb27860225 [0,2,0,0,0,0|2,0,0]=4 5230 B9R1.69 Cc1ccc(C)c(C)c1 Amb2447270 [0,2,0,0,0,0|1,0,0]=3 5231 B9R1.69 Cc1ccc(C)c(C)n1 Amb2613007 [0,2,0,0,0,0|2,0,0]=4 5232 B9R1.69 Cc1ccc(C)c(Cl)c1 Amb10605719 [0,2,0,0,0,0|1,0,0]=3 5233 B9R1.69 Cc1ccc(C)c(Cl)n1 Amb23400893 [0,2,0,0,0,0|2,0,0]=4 5234 B9R1.69 Cc1ccc(C)c(F)c1 Amb10838610 [0,2,0,0,0,0|1,0,0]=3 5235 B9R1.69 Cc1ccc(C)c(F)n1 Amb2447586 [0,2,0,0,0,0|2,0,0]=4 5236 B9R1.69 Cc1ccc(C)c(I)c1 Amb2688905 [0,2,0,0,0,0|1,0,0]=3 5237 B9R1.69 Cc1ccc(C)c(N)c1 Amb2447313 [0,2,0,0,0,0|1,0,0]=3 5238 B9R1.69 Cc1ccc(C)c(N)n1 Amb2694615 [0,2,0,0,0,0|2,0,0]=4 5239 B9R1.69 Cc1ccc(C)c(O)c1 Amb3939544 [0,2,0,0,0,0|0,0,0]=2 5240 B9R1.69 Cc1ccc(C)c(O)n1 Amb25823120 [0,2,0,0,0,0|1,0,0]=3 5241 B9R1.69 Cc1ccc(C)c(S)c1 Amb2687632 [0,2,0,0,0,0|0,1,0]=3 5242 B9R1.69 Cc1ccc(Cl)[n+]([O-])c1 Amb19959525 [0,2,0,0,0,0|1,0,1]=4 5243 B9R1.69 Cc1ccc(Cl)c(Br)c1 Amb2685045 [0,2,0,0,0,0|1,0,0]=3 5244 B9R1.69 Cc1ccc(Cl)c(Br)n1 Amb22494191 [0,2,0,0,0,0|2,0,0]=4 5245 B9R1.69 Cc1ccc(Cl)c(C)c1 Amb2686556 [0,2,0,0,0,0|1,0,0]=3 5246 B9R1.69 Cc1ccc(Cl)c(Cl)c1 Amb6365823 [0,2,0,0,0,0|1,0,0]=3 5247 B9R1.69 Cc1ccc(Cl)c(Cl)n1 Amb8396961 [0,2,0,0,0,0|2,0,0]=4 5248 B9R1.69 Cc1ccc(Cl)c(F)c1 Amb8396658 [0,2,0,0,0,0|1,0,0]=3 5249 B9R1.69 Cc1ccc(Cl)c(F)n1 Amb25975875 [0,2,0,0,0,0|2,0,0]=4 5250 B9R1.69 Cc1ccc(Cl)c(I)c1 Amb19892957 [0,2,0,0,0,0|1,0,0]=3 5251 B9R1.69 Cc1ccc(Cl)c(I)n1 Amb26023929 [0,2,0,0,0,0|2,0,0]=4 5252 B9R1.69 Cc1ccc(Cl)c(N)c1 Amb3939773 [0,2,0,0,0,0|1,0,0]=3 5253 B9R1.69 Cc1ccc(Cl)c(O)c1 Amb3939069 [0,2,0,0,0,0|0,0,0]=2 5254 B9R1.69 Cc1ccc(Cl)c(S)c1 Amb19892999 [0,2,0,0,0,0|0,1,0]=3 5255 B9R1.69 Cc1ccc(Cl)cc1Br Amb2685042 [0,2,0,0,0,0|1,0,0]=3 5256 B9R1.69 Cc1ccc(Cl)cc1C Amb24325247 [0,2,0,0,0,0|1,0,0]=3 5257 B9R1.69 Cc1ccc(Cl)cc1C Amb8513559 [0,2,0,0,0,0|1,0,0]=3 5258 B9R1.69 Cc1ccc(Cl)cc1Cl Amb6365799 [0,2,0,0,0,0|1,0,0]=3 5259 B9R1.69 Cc1ccc(Cl)cc1F Amb6297758 [0,2,0,0,0,0|1,0,0]=3 5260 B9R1.69 Cc1ccc(Cl)cc1I Amb2686141 [0,2,0,0,0,0|1,0,0]=3 5261 B9R1.69 Cc1ccc(Cl)cc1N Amb2792818 [0,2,0,0,0,0|1,0,0]=3 5262 B9R1.69 Cc1ccc(Cl)cc1N Amb4017722 [0,2,0,0,0,0|1,0,0]=3 5263 B9R1.69 Cc1ccc(Cl)cc1O Amb2686224 [0,2,0,0,0,0|0,0,0]=2 5264 B9R1.69 Cc1ccc(Cl)cc1S Amb2694382 [0,2,0,0,0,0|0,1,0]=3 5265 B9R1.69 Cc1ccc(Cl)cc1[NH3+] Amb22732547 [0,2,0,0,0,0|1,0,0]=3 5266 B9R1.69 Cc1ccc(Cl)nc1Br Amb21962492 [0,2,0,0,0,0|2,0,0]=4 5267 B9R1.69 Cc1ccc(Cl)nc1C Amb10608198 [0,2,0,0,0,0|2,0,0]=4 5268 B9R1.69 Cc1ccc(Cl)nc1Cl Amb2609456 [0,2,0,0,0,0|2,0,0]=4 5269 B9R1.69 Cc1ccc(Cl)nc1F Amb25760140 [0,2,0,0,0,0|2,0,0]=4 5270 B9R1.69 Cc1ccc(Cl)nc1I Amb21961000 [0,2,0,0,0,0|2,0,0]=4 5271 B9R1.69 Cc1ccc(Cl)nc1N Amb26564254 [0,2,0,0,0,0|2,0,0]=4 5272 B9R1.69 Cc1ccc(Cl)nc1O Amb22499561 [0,2,0,0,0,0|1,0,0]=3 5273 B9R1.69 Cc1ccc(F)[n+]([O-])c1 Amb23402618 [0,2,0,0,0,0|1,0,1]=4 5274 B9R1.69 Cc1ccc(F)c(Br)c1 Amb2685252 [0,2,0,0,0,0|1,0,0]=3 5275 B9R1.69 Cc1ccc(F)c(Br)n1 Amb8393009 [0,2,0,0,0,0|2,0,0]=4 5276 B9R1.69 Cc1ccc(F)c(C)c1 Amb10839035 [0,2,0,0,0,0|1,0,0]=3 5277 B9R1.69 Cc1ccc(F)c(C)n1 Amb26360270 [0,2,0,0,0,0|2,0,0]=4 5278 B9R1.69 Cc1ccc(F)c(Cl)c1 Amb2686091 [0,2,0,0,0,0|1,0,0]=3 5279 B9R1.69 Cc1ccc(F)c(Cl)n1 Amb8393020 [0,2,0,0,0,0|2,0,0]=4 5280 B9R1.69 Cc1ccc(F)c(F)c1 Amb8386177 [0,2,0,0,0,0|1,0,0]=3 5281 B9R1.69 Cc1ccc(F)c(F)n1 Amb22496382 [0,2,0,0,0,0|2,0,0]=4 5282 B9R1.69 Cc1ccc(F)c(I)c1 Amb2688135 [0,2,0,0,0,0|1,0,0]=3 5283 B9R1.69 Cc1ccc(F)c(I)n1 Amb27638679 [0,2,0,0,0,0|2,0,0]=4 5284 B9R1.69 Cc1ccc(F)c(N)c1 Amb2688168 [0,2,0,0,0,0|1,0,0]=3 5285 B9R1.69 Cc1ccc(F)c(N)n1 Amb22496379 [0,2,0,0,0,0|2,0,0]=4 5286 B9R1.69 Cc1ccc(F)c(O)c1 Amb2688207 [0,2,0,0,0,0|0,0,0]=2 5287 B9R1.69 Cc1ccc(F)c(S)c1 Amb19929387 [0,2,0,0,0,0|0,1,0]=3 5288 B9R1.69 Cc1ccc(F)c[n+]1[O-] Amb22641880 [0,2,0,0,0,0|1,0,1]=4 5289 B9R1.69 Cc1ccc(F)cc1Br Amb2685250 [0,2,0,0,0,0|1,0,0]=3 5290 B9R1.69 Cc1ccc(F)cc1C Amb2688558 [0,2,0,0,0,0|1,0,0]=3 5291 B9R1.69 Cc1ccc(F)cc1Cl Amb2686088 [0,2,0,0,0,0|1,0,0]=3 5292 B9R1.69 Cc1ccc(F)cc1F Amb2687283 [0,2,0,0,0,0|1,0,0]=3 5293 B9R1.69 Cc1ccc(F)cc1I Amb2688134 [0,2,0,0,0,0|1,0,0]=3 5294 B9R1.69 Cc1ccc(F)cc1N Amb2688173 [0,2,0,0,0,0|1,0,0]=3 5295 B9R1.69 Cc1ccc(F)cc1O Amb2688210 [0,2,0,0,0,0|0,0,0]=2 5296 B9R1.69 Cc1ccc(F)cc1S Amb2688243 [0,2,0,0,0,0|0,1,0]=3 5297 B9R1.69 Cc1ccc(F)nc1C Amb25064737 [0,2,0,0,0,0|2,0,0]=4 5298 B9R1.69 Cc1ccc(F)nc1Cl Amb25714227 [0,2,0,0,0,0|2,0,0]=4 5299 B9R1.69 Cc1ccc(F)nc1F Amb24101785 [0,2,0,0,0,0|2,0,0]=4 5300 B9R1.69 Cc1ccc(F)nc1I Amb24559111 [0,2,0,0,0,0|2,0,0]=4 5301 B9R1.69 Cc1ccc(F)nc1N Amb25715206 [0,2,0,0,0,0|2,0,0]=4 5302 B9R1.69 Cc1ccc(F)nc1O Amb28193010 [0,2,0,0,0,0|1,0,0]=3 5303 B9R1.69 Cc1ccc(I)c(Br)c1 Amb2685280 [0,2,0,0,0,0|1,0,0]=3 5304 B9R1.69 Cc1ccc(I)c(C)c1 Amb2688903 [0,2,0,0,0,0|1,0,0]=3 5305 B9R1.69 Cc1ccc(I)c(Cl)c1 Amb2686140 [0,2,0,0,0,0|1,0,0]=3 5306 B9R1.69 Cc1ccc(I)c(Cl)n1 Amb24753132 [0,2,0,0,0,0|2,0,0]=4 5307 B9R1.69 Cc1ccc(I)c(F)c1 Amb2684172 [0,2,0,0,0,0|1,0,0]=3 5308 B9R1.69 Cc1ccc(I)c(I)c1 Amb2692029 [0,2,0,0,0,0|1,0,0]=3 5309 B9R1.69 Cc1ccc(I)c(I)n1 Amb27750909 [0,2,0,0,0,0|2,0,0]=4 5310 B9R1.69 Cc1ccc(I)c(N)c1 Amb10070049 [0,2,0,0,0,0|1,0,0]=3 5311 B9R1.69 Cc1ccc(I)c(N)n1 Amb19958141 [0,2,0,0,0,0|2,0,0]=4 5312 B9R1.69 Cc1ccc(I)c(O)c1 Amb20623529 [0,2,0,0,0,0|0,0,0]=2 5313 B9R1.69 Cc1ccc(I)cc1Br Amb15690915 [0,2,0,0,0,0|1,0,0]=3 5314 B9R1.69 Cc1ccc(I)cc1C Amb2688901 [0,2,0,0,0,0|1,0,0]=3 5315 B9R1.69 Cc1ccc(I)cc1Cl Amb2686138 [0,2,0,0,0,0|1,0,0]=3 5316 B9R1.69 Cc1ccc(I)cc1F Amb2688132 [0,2,0,0,0,0|1,0,0]=3 5317 B9R1.69 Cc1ccc(I)cc1I Amb26596326 [0,2,0,0,0,0|1,0,0]=3 5318 B9R1.69 Cc1ccc(I)cc1N Amb2716203 [0,2,0,0,0,0|1,0,0]=3 5319 B9R1.69 Cc1ccc(I)cc1O Amb20623185 [0,2,0,0,0,0|0,0,0]=2 5320 B9R1.69 Cc1ccc(I)cc1S Amb25142082 [0,2,0,0,0,0|0,1,0]=3 5321 B9R1.69 Cc1ccc(I)nc1Br Amb25695567 [0,2,0,0,0,0|2,0,0]=4 5322 B9R1.69 Cc1ccc(I)nc1Cl Amb25208701 [0,2,0,0,0,0|2,0,0]=4 5323 B9R1.69 Cc1ccc(I)nc1F Amb27851503 [0,2,0,0,0,0|2,0,0]=4 5324 B9R1.69 Cc1ccc(I)nc1I Amb26067680 [0,2,0,0,0,0|2,0,0]=4 5325 B9R1.69 Cc1ccc(I)nc1O Amb28255892 [0,2,0,0,0,0|1,0,0]=3 5326 B9R1.69 Cc1ccc(N)[n+]([O-])c1 Amb8630857 [0,2,0,0,0,0|1,0,1]=4 5327 B9R1.69 Cc1ccc(N)c(Br)c1 Amb1232843 [0,2,0,0,0,0|1,0,0]=3 5328 B9R1.69 Cc1ccc(N)c(Br)n1 Amb6306449 [0,2,0,0,0,0|2,0,0]=4 5329 B9R1.69 Cc1ccc(N)c(C)c1 Amb1239131 [0,2,0,0,0,0|1,0,0]=3 5330 B9R1.69 Cc1ccc(N)c(C)c1 Amb16233810 [0,2,0,0,0,0|1,0,0]=3 5331 B9R1.69 Cc1ccc(N)c(C)n1 Amb1084296 [0,2,0,0,0,0|2,0,0]=4 5332 B9R1.69 Cc1ccc(N)c(Cl)c1 Amb3939772 [0,2,0,0,0,0|1,0,0]=3 5333 B9R1.69 Cc1ccc(N)c(Cl)n1 Amb20668479 [0,2,0,0,0,0|2,0,0]=4 5334 B9R1.69 Cc1ccc(N)c(Cl)n1 Amb2720299 [0,2,0,0,0,0|2,0,0]=4 5335 B9R1.69 Cc1ccc(N)c(F)c1 Amb1227713 [0,2,0,0,0,0|1,0,0]=3 5336 B9R1.69 Cc1ccc(N)c(F)n1 Amb8392985 [0,2,0,0,0,0|2,0,0]=4 5337 B9R1.69 Cc1ccc(N)c(I)c1 Amb6384060 [0,2,0,0,0,0|1,0,0]=3 5338 B9R1.69 Cc1ccc(N)c(I)n1 Amb22497356 [0,2,0,0,0,0|2,0,0]=4 5339 B9R1.69 Cc1ccc(N)c(N)c1 Amb6335762 [0,2,0,0,0,0|1,0,0]=3 5340 B9R1.69 Cc1ccc(N)c(N)c1 Amb8629330 [0,2,0,0,0,0|1,0,0]=3 5341 B9R1.69 Cc1ccc(N)c(N)n1 Amb22727967 [0,2,0,0,0,0|2,0,0]=4 5342 B9R1.69 Cc1ccc(N)c(N)n1 Amb22753679 [0,2,0,0,0,0|2,0,0]=4 5343 B9R1.69 Cc1ccc(N)c(N)n1 Amb6479234 [0,2,0,0,0,0|2,0,0]=4 5344 B9R1.69 Cc1ccc(N)c(N)n1 Amb8396953 [0,2,0,0,0,0|2,0,0]=4 5345 B9R1.69 Cc1ccc(N)c(O)c1 Amb6297779 [0,2,0,0,0,0|0,0,0]=2 5346 B9R1.69 Cc1ccc(N)c(O)n1 Amb19959321 [0,2,0,0,0,0|1,0,0]=3 5347 B9R1.69 Cc1ccc(N)c(O)n1 Amb8386873 [0,2,0,0,0,0|1,0,0]=3 5348 B9R1.69 Cc1ccc(N)c(S)c1 Amb18124559 [0,2,0,0,0,0|0,1,0]=3 5349 B9R1.69 Cc1ccc(N)c(S)c1 Amb33473704 [0,2,0,0,0,0|0,1,0]=3 5350 B9R1.69 Cc1ccc(N)c(S)n1 Amb18202837 [0,2,0,0,0,0|1,1,0]=4 5351 B9R1.69 Cc1ccc(N)c[n+]1[O-] Amb2609552 [0,2,0,0,0,0|1,0,1]=4 5352 B9R1.69 Cc1ccc(N)cc1Br Amb1039019 [0,2,0,0,0,0|1,0,0]=3 5353 B9R1.69 Cc1ccc(N)cc1Br Amb22723312 [0,2,0,0,0,0|1,0,0]=3 5354 B9R1.69 Cc1ccc(N)cc1C Amb2792846 [0,2,0,0,0,0|1,0,0]=3 5355 B9R1.69 Cc1ccc(N)cc1C Amb33314329 [0,2,0,0,0,0|1,0,0]=3 5356 B9R1.69 Cc1ccc(N)cc1C Amb33379121 [0,2,0,0,0,0|1,0,0]=3 5357 B9R1.69 Cc1ccc(N)cc1Cl Amb22047461 [0,2,0,0,0,0|1,0,0]=3 5358 B9R1.69 Cc1ccc(N)cc1Cl Amb2691850 [0,2,0,0,0,0|1,0,0]=3 5359 B9R1.69 Cc1ccc(N)cc1F Amb2688170 [0,2,0,0,0,0|1,0,0]=3 5360 B9R1.69 Cc1ccc(N)cc1I Amb17774671 [0,2,0,0,0,0|1,0,0]=3 5361 B9R1.69 Cc1ccc(N)cc1N Amb35748349 [0,2,0,0,0,0|1,0,0]=3 5362 B9R1.69 Cc1ccc(N)cc1N Amb6335761 [0,2,0,0,0,0|1,0,0]=3 5363 B9R1.69 Cc1ccc(N)cc1O Amb3940727 [0,2,0,0,0,0|0,0,0]=2 5364 B9R1.69 Cc1ccc(N)cc1O Amb8629332 [0,2,0,0,0,0|0,0,0]=2 5365 B9R1.69 Cc1ccc(N)cc1S Amb18943962 [0,2,0,0,0,0|0,1,0]=3 5366 B9R1.69 Cc1ccc(N)nc1Br Amb22494685 [0,2,0,0,0,0|2,0,0]=4 5367 B9R1.69 Cc1ccc(N)nc1C Amb10070942 [0,2,0,0,0,0|2,0,0]=4 5368 B9R1.69 Cc1ccc(N)nc1Cl Amb19957759 [0,2,0,0,0,0|2,0,0]=4 5369 B9R1.69 Cc1ccc(N)nc1F Amb27838617 [0,2,0,0,0,0|2,0,0]=4 5370 B9R1.69 Cc1ccc(N)nc1I Amb28283721 [0,2,0,0,0,0|2,0,0]=4 5371 B9R1.69 Cc1ccc(N)nc1N Amb21858316 [0,2,0,0,0,0|2,0,0]=4 5372 B9R1.69 Cc1ccc(O)c(Br)c1 Amb2189157 [0,2,0,0,0,0|0,0,0]=2 5373 B9R1.69 Cc1ccc(O)c(Br)n1 Amb8439550 [0,2,0,0,0,0|1,0,0]=3 5374 B9R1.69 Cc1ccc(O)c(C)c1 Amb3939543 [0,2,0,0,0,0|0,0,0]=2 5375 B9R1.69 Cc1ccc(O)c(C)n1 Amb6315849 [0,2,0,0,0,0|1,0,0]=3 5376 B9R1.69 Cc1ccc(O)c(Cl)c1 Amb2686221 [0,2,0,0,0,0|0,0,0]=2 5377 B9R1.69 Cc1ccc(O)c(Cl)n1 Amb2612502 [0,2,0,0,0,0|1,0,0]=3 5378 B9R1.69 Cc1ccc(O)c(F)c1 Amb6298633 [0,2,0,0,0,0|0,0,0]=2 5379 B9R1.69 Cc1ccc(O)c(F)n1 Amb15690614 [0,2,0,0,0,0|1,0,0]=3 5380 B9R1.69 Cc1ccc(O)c(I)c1 Amb19149294 [0,2,0,0,0,0|0,0,0]=2 5381 B9R1.69 Cc1ccc(O)c(I)n1 Amb2612496 [0,2,0,0,0,0|1,0,0]=3 5382 B9R1.69 Cc1ccc(O)c(N)c1 Amb22228611 [0,2,0,0,0,0|0,0,0]=2 5383 B9R1.69 Cc1ccc(O)c(N)c1 Amb3940450 [0,2,0,0,0,0|0,0,0]=2 5384 B9R1.69 Cc1ccc(O)c(N)n1 Amb8439718 [0,2,0,0,0,0|1,0,0]=3 5385 B9R1.69 Cc1ccc(O)c(O)c1 Amb6297767 [0,2,0,0,0,0|0,0,0]=2 5386 B9R1.69 Cc1ccc(O)c(S)c1 Amb18643617 [0,2,0,0,0,0|0,0,0]=2 5387 B9R1.69 Cc1ccc(O)c[n+]1[O-] Amb4017970 [0,2,0,0,0,0|1,0,0]=3 5388 B9R1.69 Cc1ccc(O)cc1Br Amb16185697 [0,2,0,0,0,0|0,0,0]=2 5389 B9R1.69 Cc1ccc(O)cc1C Amb3939551 [0,2,0,0,0,0|0,0,0]=2 5390 B9R1.69 Cc1ccc(O)cc1Cl Amb2686223 [0,2,0,0,0,0|0,0,0]=2 5391 B9R1.69 Cc1ccc(O)cc1F Amb6297931 [0,2,0,0,0,0|0,0,0]=2 5392 B9R1.69 Cc1ccc(O)cc1I Amb24105676 [0,2,0,0,0,0|0,0,0]=2 5393 B9R1.69 Cc1ccc(O)cc1N Amb2697316 [0,2,0,0,0,0|0,0,0]=2 5394 B9R1.69 Cc1ccc(O)cc1O Amb9871491 [0,2,0,0,0,0|0,0,0]=2 5395 B9R1.69 Cc1ccc(O)nc1Br Amb24564038 [0,2,0,0,0,0|1,0,0]=3 5396 B9R1.69 Cc1ccc(O)nc1Cl Amb28049054 [0,2,0,0,0,0|1,0,0]=3 5397 B9R1.69 Cc1ccc(O)nc1F Amb27180045 [0,2,0,0,0,0|1,0,0]=3 5398 B9R1.69 Cc1ccc(O)nc1I Amb26417057 [0,2,0,0,0,0|1,0,0]=3 5399 B9R1.69 Cc1ccc(S)c(Br)c1 Amb8385372 [0,2,0,0,0,0|0,1,0]=3 5400 B9R1.69 Cc1ccc(S)c(C)c1 Amb2687631 [0,2,0,0,0,0|0,1,0]=3 5401 B9R1.69 Cc1ccc(S)c(Cl)c1 Amb19892967 [0,2,0,0,0,0|0,1,0]=3 5402 B9R1.69 Cc1ccc(S)c(Cl)n1 Amb33260295 [0,2,0,0,0,0|1,1,0]=4 5403 B9R1.69 Cc1ccc(S)c(F)c1 Amb19887949 [0,2,0,0,0,0|0,1,0]=3 5404 B9R1.69 Cc1ccc(S)c(I)c1 Amb25188973 [0,2,0,0,0,0|0,1,0]=3 5405 B9R1.69 Cc1ccc(S)c(N)c1 Amb8929747 [0,2,0,0,0,0|0,1,0]=3 5406 B9R1.69 Cc1ccc(S)c(O)c1 Amb18643616 [0,2,0,0,0,0|0,0,0]=2 5407 B9R1.69 Cc1ccc(S)cc1Br Amb25331610 [0,2,0,0,0,0|0,1,0]=3 5408 B9R1.69 Cc1ccc(S)cc1C Amb1207796 [0,2,0,0,0,0|0,1,0]=3 5409 B9R1.69 Cc1ccc(S)cc1Cl Amb19887968 [0,2,0,0,0,0|0,1,0]=3 5410 B9R1.69 Cc1ccc(S)cc1F Amb2688240 [0,2,0,0,0,0|0,1,0]=3 5411 B9R1.69 Cc1ccc(S)cc1I Amb25875616 [0,2,0,0,0,0|0,1,0]=3 5412 B9R1.69 Cc1ccc(S)cc1N Amb18277304 [0,2,0,0,0,0|0,1,0]=3 5413 B9R1.69 Cc1ccc(S)cc1O Amb26338323 [0,2,0,0,0,0|0,0,0]=2 5414 B9R1.69 Cc1ccc([Mg+])cc1Cl Amb30590965 [0,2,0,0,0,0|1,0,0]=3 5415 B9R1.69 Cc1ccc([Mg+])cc1F Amb22274785 [0,2,0,0,0,0|1,0,0]=3 5416 B9R1.69 Cc1ccn(=O)c(C)c1 Amb20247464 [0,2,0,0,0,0|1,0,1]=4 5417 B9R1.69 Cc1cnc(Br)c(Br)c1 Amb8393027 [0,2,0,0,0,0|2,0,0]=4 5418 B9R1.69 Cc1cnc(Br)c(C)c1 Amb10842195 [0,2,0,0,0,0|2,0,0]=4 5419 B9R1.69 Cc1cnc(Br)c(Cl)c1 Amb10602005 [0,2,0,0,0,0|2,0,0]=4 5420 B9R1.69 Cc1cnc(Br)c(F)c1 Amb15691056 [0,2,0,0,0,0|2,0,0]=4 5421 B9R1.69 Cc1cnc(Br)c(I)c1 Amb20242736 [0,2,0,0,0,0|2,0,0]=4 5422 B9R1.69 Cc1cnc(Br)c(N)c1 Amb16185784 [0,2,0,0,0,0|2,0,0]=4 5423 B9R1.69 Cc1cnc(Br)c(O)c1 Amb20242732 [0,2,0,0,0,0|1,0,0]=3 5424 B9R1.69 Cc1cnc(Br)cc1Br Amb20247805 [0,2,0,0,0,0|2,0,0]=4 5425 B9R1.69 Cc1cnc(Br)cc1C Amb24319630 [0,2,0,0,0,0|2,0,0]=4 5426 B9R1.69 Cc1cnc(Br)cc1Cl Amb20247815 [0,2,0,0,0,0|2,0,0]=4 5427 B9R1.69 Cc1cnc(Br)cc1F Amb25147046 [0,2,0,0,0,0|2,0,0]=4 5428 B9R1.69 Cc1cnc(Br)cc1I Amb27462087 [0,2,0,0,0,0|2,0,0]=4 5429 B9R1.69 Cc1cnc(Br)cc1N Amb18129653 [0,2,0,0,0,0|2,0,0]=4 5430 B9R1.69 Cc1cnc(Br)cc1O Amb24319597 [0,2,0,0,0,0|1,0,0]=3 5431 B9R1.69 Cc1cnc(Br)nc1O Amb25202174 [0,2,0,0,0,0|2,0,0]=4 5432 B9R1.69 Cc1cnc(C)c(Br)c1 Amb20248661 [0,2,0,0,0,0|2,0,0]=4 5433 B9R1.69 Cc1cnc(C)c(C)c1 Amb8383459 [0,2,0,0,0,0|2,0,0]=4 5434 B9R1.69 Cc1cnc(C)c(Cl)c1 Amb8387485 [0,2,0,0,0,0|2,0,0]=4 5435 B9R1.69 Cc1cnc(C)c(I)c1 Amb27858994 [0,2,0,0,0,0|2,0,0]=4 5436 B9R1.69 Cc1cnc(C)c(N)c1 Amb22491830 [0,2,0,0,0,0|2,0,0]=4 5437 B9R1.69 Cc1cnc(C)c(O)n1 Amb18642186 [0,2,0,0,0,0|2,0,0]=4 5438 B9R1.69 Cc1cnc(Cl)c(Br)c1 Amb2610299 [0,2,0,0,0,0|2,0,0]=4 5439 B9R1.69 Cc1cnc(Cl)c(C)c1 Amb10842194 [0,2,0,0,0,0|2,0,0]=4 5440 B9R1.69 Cc1cnc(Cl)c(Cl)c1 Amb8384590 [0,2,0,0,0,0|2,0,0]=4 5441 B9R1.69 Cc1cnc(Cl)c(F)c1 Amb16230966 [0,2,0,0,0,0|2,0,0]=4 5442 B9R1.69 Cc1cnc(Cl)c(I)c1 Amb13889962 [0,2,0,0,0,0|2,0,0]=4 5443 B9R1.69 Cc1cnc(Cl)c(N)c1 Amb2720298 [0,2,0,0,0,0|2,0,0]=4 5444 B9R1.69 Cc1cnc(Cl)c(N)c1 Amb33329360 [0,2,0,0,0,0|2,0,0]=4 5445 B9R1.69 Cc1cnc(Cl)c(O)c1 Amb33543877 [0,2,0,0,0,0|1,0,0]=3 5446 B9R1.69 Cc1cnc(Cl)cc1Br Amb19958460 [0,2,0,0,0,0|2,0,0]=4 5447 B9R1.69 Cc1cnc(Cl)cc1C Amb22054684 [0,2,0,0,0,0|2,0,0]=4 5448 B9R1.69 Cc1cnc(Cl)cc1Cl Amb8396975 [0,2,0,0,0,0|2,0,0]=4 5449 B9R1.69 Cc1cnc(Cl)cc1I Amb13889971 [0,2,0,0,0,0|2,0,0]=4 5450 B9R1.69 Cc1cnc(Cl)cc1N Amb18643979 [0,2,0,0,0,0|2,0,0]=4 5451 B9R1.69 Cc1cnc(Cl)cc1N Amb33483937 [0,2,0,0,0,0|2,0,0]=4 5452 B9R1.69 Cc1cnc(Cl)cc1O Amb25375129 [0,2,0,0,0,0|1,0,0]=3 5453 B9R1.69 Cc1cnc(Cl)nc1O Amb25063283 [0,2,0,0,0,0|2,0,0]=4 5454 B9R1.69 Cc1cnc(F)c(Br)c1 Amb33544567 [0,2,0,0,0,0|2,0,0]=4 5455 B9R1.69 Cc1cnc(F)c(C)c1 Amb10841077 [0,2,0,0,0,0|2,0,0]=4 5456 B9R1.69 Cc1cnc(F)c(Cl)c1 Amb16186003 [0,2,0,0,0,0|2,0,0]=4 5457 B9R1.69 Cc1cnc(F)c(F)c1 Amb20241834 [0,2,0,0,0,0|2,0,0]=4 5458 B9R1.69 Cc1cnc(F)c(I)c1 Amb8393031 [0,2,0,0,0,0|2,0,0]=4 5459 B9R1.69 Cc1cnc(F)c(N)c1 Amb18832762 [0,2,0,0,0,0|2,0,0]=4 5460 B9R1.69 Cc1cnc(F)c(O)c1 Amb19895480 [0,2,0,0,0,0|1,0,0]=3 5461 B9R1.69 Cc1cnc(F)cc1Br Amb22491548 [0,2,0,0,0,0|2,0,0]=4 5462 B9R1.69 Cc1cnc(F)cc1C Amb26634299 [0,2,0,0,0,0|2,0,0]=4 5463 B9R1.69 Cc1cnc(F)cc1I Amb8396924 [0,2,0,0,0,0|2,0,0]=4 5464 B9R1.69 Cc1cnc(F)cc1N Amb23412310 [0,2,0,0,0,0|2,0,0]=4 5465 B9R1.69 Cc1cnc(F)cc1O Amb24478634 [0,2,0,0,0,0|1,0,0]=3 5466 B9R1.69 Cc1cnc(F)nc1O Amb35742789 [0,2,0,0,0,0|2,0,0]=4 5467 B9R1.69 Cc1cnc(I)c(Br)c1 Amb28285129 [0,2,0,0,0,0|2,0,0]=4 5468 B9R1.69 Cc1cnc(I)c(C)c1 Amb21962951 [0,2,0,0,0,0|2,0,0]=4 5469 B9R1.69 Cc1cnc(I)c(F)c1 Amb27424715 [0,2,0,0,0,0|2,0,0]=4 5470 B9R1.69 Cc1cnc(I)c(N)c1 Amb26965141 [0,2,0,0,0,0|2,0,0]=4 5471 B9R1.69 Cc1cnc(I)c(O)c1 Amb27462110 [0,2,0,0,0,0|1,0,0]=3 5472 B9R1.69 Cc1cnc(I)cc1Br Amb24320426 [0,2,0,0,0,0|2,0,0]=4 5473 B9R1.69 Cc1cnc(I)cc1Cl Amb24320750 [0,2,0,0,0,0|2,0,0]=4 5474 B9R1.69 Cc1cnc(I)cc1I Amb24320751 [0,2,0,0,0,0|2,0,0]=4 5475 B9R1.69 Cc1cnc(I)cc1N Amb26055915 [0,2,0,0,0,0|2,0,0]=4 5476 B9R1.69 Cc1cnc(I)cc1O Amb27601608 [0,2,0,0,0,0|1,0,0]=3 5477 B9R1.69 Cc1cnc(N)c(Br)c1 Amb17621487 [0,2,0,0,0,0|2,0,0]=4 5478 B9R1.69 Cc1cnc(N)c(Br)c1 Amb2609942 [0,2,0,0,0,0|2,0,0]=4 5479 B9R1.69 Cc1cnc(N)c(C)c1 Amb22587430 [0,2,0,0,0,0|2,0,0]=4 5480 B9R1.69 Cc1cnc(N)c(C)c1 Amb3862127 [0,2,0,0,0,0|2,0,0]=4 5481 B9R1.69 Cc1cnc(N)c(Cl)c1 Amb16233765 [0,2,0,0,0,0|2,0,0]=4 5482 B9R1.69 Cc1cnc(N)c(I)c1 Amb21929206 [0,2,0,0,0,0|2,0,0]=4 5483 B9R1.69 Cc1cnc(N)c(N)c1 Amb18832935 [0,2,0,0,0,0|2,0,0]=4 5484 B9R1.69 Cc1cnc(N)c(O)c1 Amb13883496 [0,2,0,0,0,0|1,0,0]=3 5485 B9R1.69 Cc1cnc(N)c(P)c1 Amb27464464 [0,2,0,0,0,0|2,0,0]=4 5486 B9R1.69 Cc1cnc(N)cc1Br Amb20617382 [0,2,0,0,0,0|2,0,0]=4 5487 B9R1.69 Cc1cnc(N)cc1C Amb6308301 [0,2,0,0,0,0|2,0,0]=4 5488 B9R1.69 Cc1cnc(N)cc1Cl Amb21857085 [0,2,0,0,0,0|2,0,0]=4 5489 B9R1.69 Cc1cnc(N)cc1F Amb26490518 [0,2,0,0,0,0|2,0,0]=4 5490 B9R1.69 Cc1cnc(N)cc1I Amb22749478 [0,2,0,0,0,0|2,0,0]=4 5491 B9R1.69 Cc1cnc(N)cc1N Amb27598946 [0,2,0,0,0,0|2,0,0]=4 5492 B9R1.69 Cc1cnc(N)cc1O Amb24714745 [0,2,0,0,0,0|1,0,0]=3 5493 B9R1.69 Cc1cnc(N)nc1O Amb5846658 [0,2,0,0,0,0|2,0,0]=4 5494 B9R1.69 Cc1cnc(O)c(Br)c1 Amb2720159 [0,2,0,0,0,0|1,0,0]=3 5495 B9R1.69 Cc1cnc(O)c(C)c1 Amb23590107 [0,2,0,0,0,0|1,0,0]=3 5496 B9R1.69 Cc1cnc(O)c(C)n1 Amb18642181 [0,2,0,0,0,0|2,0,0]=4 5497 B9R1.69 Cc1cnc(O)c(I)c1 Amb21929109 [0,2,0,0,0,0|1,0,0]=3 5498 B9R1.69 Cc1cnc(O)c(N)c1 Amb19959320 [0,2,0,0,0,0|1,0,0]=3 5499 B9R1.69 Cc1cnc(O)c(O)c1 Amb25333882 [0,2,0,0,0,0|1,0,0]=3 5500 B9R1.69 Cc1cnc(O)cc1Br Amb20617426 [0,2,0,0,0,0|1,0,0]=3 5501 B9R1.69 Cc1cnc(O)cc1Cl Amb25359841 [0,2,0,0,0,0|1,0,0]=3 5502 B9R1.69 Cc1cnc(O)cc1I Amb24680767 [0,2,0,0,0,0|1,0,0]=3 5503 B9R1.69 Cc1cnc(O)cc1N Amb22263961 [0,2,0,0,0,0|1,0,0]=3 5504 B9R1.69 Cc1cnc(O)cc1O Amb20247814 [0,2,0,0,0,0|1,0,0]=3 5505 B9R1.69 Cc1cnc(O)nc1C Amb20182445 [0,2,0,0,0,0|2,0,0]=4 5506 B9R1.69 Cc1cnc(O)nc1C Amb22587317 [0,2,0,0,0,0|2,0,0]=4 5507 B9R1.69 Cc1cnc(O)nc1N Amb18642284 [0,2,0,0,0,0|2,0,0]=4 5508 B9R1.69 Cc1cnc(S)c(Br)c1 Amb24554461 [0,2,0,0,0,0|1,1,0]=4 5509 B9R1.69 Cc1cnc(S)c(C)c1 Amb26428339 [0,2,0,0,0,0|1,1,0]=4 5510 B9R1.69 Cc1cnc(S)c(N)c1 Amb18202836 [0,2,0,0,0,0|1,1,0]=4 5511 B9R1.69 Cc1nc(Br)ccc1Br Amb2795399 [0,2,0,0,0,0|2,0,0]=4 5512 B9R1.69 Cc1nc(Br)ccc1Cl Amb16230963 [0,2,0,0,0,0|2,0,0]=4 5513 B9R1.69 Cc1nc(Br)ccc1F Amb6297612 [0,2,0,0,0,0|2,0,0]=4 5514 B9R1.69 Cc1nc(Br)ccc1I Amb19957326 [0,2,0,0,0,0|2,0,0]=4 5515 B9R1.69 Cc1nc(Br)ccc1N Amb6306451 [0,2,0,0,0,0|2,0,0]=4 5516 B9R1.69 Cc1nc(Br)ccc1O Amb18649720 [0,2,0,0,0,0|1,0,0]=3 5517 B9R1.69 Cc1nc(Br)cnc1O Amb22493834 [0,2,0,0,0,0|2,0,0]=4 5518 B9R1.69 Cc1nc(Br)ncc1O Amb26567458 [0,2,0,0,0,0|2,0,0]=4 5519 B9R1.69 Cc1nc(Cl)ccc1Br Amb8396771 [0,2,0,0,0,0|2,0,0]=4 5520 B9R1.69 Cc1nc(Cl)ccc1Cl Amb612293 [0,2,0,0,0,0|2,0,0]=4 5521 B9R1.69 Cc1nc(Cl)ccc1F Amb8393024 [0,2,0,0,0,0|2,0,0]=4 5522 B9R1.69 Cc1nc(Cl)ccc1I Amb20241253 [0,2,0,0,0,0|2,0,0]=4 5523 B9R1.69 Cc1nc(Cl)ccc1N Amb6336427 [0,2,0,0,0,0|2,0,0]=4 5524 B9R1.69 Cc1nc(Cl)ccc1O Amb20620747 [0,2,0,0,0,0|1,0,0]=3 5525 B9R1.69 Cc1nc(Cl)ncc1O Amb24183359 [0,2,0,0,0,0|2,0,0]=4 5526 B9R1.69 Cc1nc(F)ccc1Br Amb8393012 [0,2,0,0,0,0|2,0,0]=4 5527 B9R1.69 Cc1nc(F)ccc1Cl Amb26478657 [0,2,0,0,0,0|2,0,0]=4 5528 B9R1.69 Cc1nc(F)ccc1I Amb15690997 [0,2,0,0,0,0|2,0,0]=4 5529 B9R1.69 Cc1nc(F)ccc1N Amb6308202 [0,2,0,0,0,0|2,0,0]=4 5530 B9R1.69 Cc1nc(F)ccc1O Amb28454506 [0,2,0,0,0,0|1,0,0]=3 5531 B9R1.69 Cc1nc(I)ccc1Br Amb21963683 [0,2,0,0,0,0|2,0,0]=4 5532 B9R1.69 Cc1nc(I)ccc1Cl Amb28129773 [0,2,0,0,0,0|2,0,0]=4 5533 B9R1.69 Cc1nc(I)ccc1N Amb24054698 [0,2,0,0,0,0|2,0,0]=4 5534 B9R1.69 Cc1nc(I)ccc1O Amb22371427 [0,2,0,0,0,0|1,0,0]=3 5535 B9R1.69 Cc1nc(N)ccc1Br Amb2610031 [0,2,0,0,0,0|2,0,0]=4 5536 B9R1.69 Cc1nc(N)ccc1Cl Amb2180399 [0,2,0,0,0,0|2,0,0]=4 5537 B9R1.69 Cc1nc(N)ccc1F Amb16233727 [0,2,0,0,0,0|2,0,0]=4 5538 B9R1.69 Cc1nc(N)ccc1I Amb1068339 [0,2,0,0,0,0|2,0,0]=4 5539 B9R1.69 Cc1nc(N)ccc1O Amb18642176 [0,2,0,0,0,0|1,0,0]=3 5540 B9R1.69 Cc1nc(O)ccc1Br Amb2795394 [0,2,0,0,0,0|1,0,0]=3 5541 B9R1.69 Cc1nc(O)ccc1Cl Amb19959541 [0,2,0,0,0,0|1,0,0]=3 5542 B9R1.69 Cc1nc(O)ccc1I Amb22047344 [0,2,0,0,0,0|1,0,0]=3 5543 B9R1.69 Cc1nc(O)ccc1O Amb23555592 [0,2,0,0,0,0|1,0,0]=3 5544 B9R1.69 Cc1nc(O)ncc1I Amb23400660 [0,2,0,0,0,0|2,0,0]=4 5545 B9R1.69 Cc1nc(O)ncc1N Amb18832820 [0,2,0,0,0,0|2,0,0]=4 5546 B9R1.69 Cc1nc(S)ccc1Br Amb24481812 [0,2,0,0,0,0|1,1,0]=4 5547 B9R1.69 Cc1nc(S)ccc1Cl Amb32423708 [0,2,0,0,0,0|1,1,0]=4 5548 B9R1.69 Cc1nc[n+]([O-])cc1O Amb27423454 [0,2,0,0,0,0|2,0,0]=4 5549 B9R1.69 Cc1ncc(Br)c(O)n1 Amb19957492 [0,2,0,0,0,0|2,0,0]=4 5550 B9R1.69 Cc1ncc(Br)cc1Br Amb15691060 [0,2,0,0,0,0|2,0,0]=4 5551 B9R1.69 Cc1ncc(Br)cc1Cl Amb8391179 [0,2,0,0,0,0|2,0,0]=4 5552 B9R1.69 Cc1ncc(Br)cc1F Amb20247933 [0,2,0,0,0,0|2,0,0]=4 5553 B9R1.69 Cc1ncc(Br)cc1I Amb24057202 [0,2,0,0,0,0|2,0,0]=4 5554 B9R1.69 Cc1ncc(Br)cc1N Amb8391180 [0,2,0,0,0,0|2,0,0]=4 5555 B9R1.69 Cc1ncc(Br)cc1O Amb15692872 [0,2,0,0,0,0|1,0,0]=3 5556 B9R1.69 Cc1ncc(Cl)c(O)n1 Amb22261544 [0,2,0,0,0,0|2,0,0]=4 5557 B9R1.69 Cc1ncc(Cl)cc1Br Amb21857823 [0,2,0,0,0,0|2,0,0]=4 5558 B9R1.69 Cc1ncc(Cl)cc1F Amb19959251 [0,2,0,0,0,0|2,0,0]=4 5559 B9R1.69 Cc1ncc(Cl)cc1I Amb27828576 [0,2,0,0,0,0|2,0,0]=4 5560 B9R1.69 Cc1ncc(Cl)cc1N Amb19959128 [0,2,0,0,0,0|2,0,0]=4 5561 B9R1.69 Cc1ncc(Cl)cc1O Amb18124660 [0,2,0,0,0,0|1,0,0]=3 5562 B9R1.69 Cc1ncc(F)cc1Br Amb22057824 [0,2,0,0,0,0|2,0,0]=4 5563 B9R1.69 Cc1ncc(F)cc1Cl Amb25934021 [0,2,0,0,0,0|2,0,0]=4 5564 B9R1.69 Cc1ncc(F)cc1F Amb25296181 [0,2,0,0,0,0|2,0,0]=4 5565 B9R1.69 Cc1ncc(F)cc1N Amb26495510 [0,2,0,0,0,0|2,0,0]=4 5566 B9R1.69 Cc1ncc(F)cc1O Amb24055975 [0,2,0,0,0,0|1,0,0]=3 5567 B9R1.69 Cc1ncc(I)cc1Cl Amb26541604 [0,2,0,0,0,0|2,0,0]=4 5568 B9R1.69 Cc1ncc(I)cc1F Amb24478771 [0,2,0,0,0,0|2,0,0]=4 5569 B9R1.69 Cc1ncc(I)cc1N Amb25729014 [0,2,0,0,0,0|2,0,0]=4 5570 B9R1.69 Cc1ncc(N)cc1Br Amb10602826 [0,2,0,0,0,0|2,0,0]=4 5571 B9R1.69 Cc1ncc(N)cc1Cl Amb22001824 [0,2,0,0,0,0|2,0,0]=4 5572 B9R1.69 Cc1ncc(N)cc1F Amb27424708 [0,2,0,0,0,0|2,0,0]=4 5573 B9R1.69 Cc1ncc(N)cc1I Amb20248967 [0,2,0,0,0,0|2,0,0]=4 5574 B9R1.69 Cc1ncc(N)cc1O Amb18642180 [0,2,0,0,0,0|1,0,0]=3 5575 B9R1.69 Cc1ncc(O)c(Br)n1 Amb28245467 [0,2,0,0,0,0|2,0,0]=4 5576 B9R1.69 Cc1ncc(O)c(C)n1 Amb20171085 [0,2,0,0,0,0|2,0,0]=4 5577 B9R1.69 Cc1ncc(O)c(N)n1 Amb18642281 [0,2,0,0,0,0|2,0,0]=4 5578 B9R1.69 Cc1ncc(O)cc1Br Amb20242858 [0,2,0,0,0,0|1,0,0]=3 5579 B9R1.69 Cc1ncc(O)cc1Cl Amb22751358 [0,2,0,0,0,0|1,0,0]=3 5580 B9R1.69 Cc1ncc(O)cc1F Amb25336302 [0,2,0,0,0,0|1,0,0]=3 5581 B9R1.69 Cc1ncc(O)cc1I Amb27848636 [0,2,0,0,0,0|1,0,0]=3 5582 B9R1.69 Cc1ncc(O)cc1N Amb26397483 [0,2,0,0,0,0|1,0,0]=3 5583 B9R1.69 Cc1ncc(O)nc1C Amb18124302 [0,2,0,0,0,0|2,0,0]=4 5584 B9R1.69 Clc1cc(Br)c(Br)cn1 Amb27961404 [0,2,0,0,0,0|2,0,0]=4 5585 B9R1.69 Clc1cc(Br)c(Cl)cn1 Amb15691001 [0,2,0,0,0,0|2,0,0]=4 5586 B9R1.69 Clc1cc(Br)c(I)cn1 Amb4560940 [0,2,0,0,0,0|2,0,0]=4 5587 B9R1.69 Clc1cc(Br)ccc1Br Amb2686720 [0,2,0,0,0,0|1,0,0]=3 5588 B9R1.69 Clc1cc(Br)ccc1I Amb2685023 [0,2,0,0,0,0|1,0,0]=3 5589 B9R1.69 Clc1cc(Br)cnc1Br Amb10067357 [0,2,0,0,0,0|2,0,0]=4 5590 B9R1.69 Clc1cc(Br)cnc1Cl Amb8396902 [0,2,0,0,0,0|2,0,0]=4 5591 B9R1.69 Clc1cc(Br)ncc1Br Amb20247823 [0,2,0,0,0,0|2,0,0]=4 5592 B9R1.69 Clc1cc(Br)ncc1I Amb21961207 [0,2,0,0,0,0|2,0,0]=4 5593 B9R1.69 Clc1cc(Cl)c(Br)cn1 Amb8389959 [0,2,0,0,0,0|2,0,0]=4 5594 B9R1.69 Clc1cc(Cl)c(Cl)cn1 Amb33543750 [0,2,0,0,0,0|2,0,0]=4 5595 B9R1.69 Clc1cc(Cl)c(I)cn1 Amb8394512 [0,2,0,0,0,0|2,0,0]=4 5596 B9R1.69 Clc1cc(I)c(Br)cn1 Amb6752000 [0,2,0,0,0,0|2,0,0]=4 5597 B9R1.69 Clc1cc(I)c(Cl)cn1 Amb19892711 [0,2,0,0,0,0|2,0,0]=4 5598 B9R1.69 Clc1cc(I)c(I)cn1 Amb24598318 [0,2,0,0,0,0|2,0,0]=4 5599 B9R1.69 Clc1cc(I)ccc1Br Amb2685024 [0,2,0,0,0,0|1,0,0]=3 5600 B9R1.69 Clc1cc(I)ccc1I Amb20241146 [0,2,0,0,0,0|1,0,0]=3 5601 B9R1.69 Clc1cc(I)cnc1Br Amb26316398 [0,2,0,0,0,0|2,0,0]=4 5602 B9R1.69 Clc1cc(I)cnc1Cl Amb8396959 [0,2,0,0,0,0|2,0,0]=4 5603 B9R1.69 Clc1cc(I)cnc1I Amb27441209 [0,2,0,0,0,0|2,0,0]=4 5604 B9R1.69 Clc1cc(I)ncc1Br Amb24478834 [0,2,0,0,0,0|2,0,0]=4 5605 B9R1.69 Clc1cc(I)ncc1I Amb27864458 [0,2,0,0,0,0|2,0,0]=4 5606 B9R1.69 Clc1ccc(Br)c(Br)c1 Amb19929005 [0,2,0,0,0,0|1,0,0]=3 5607 B9R1.69 Clc1ccc(Br)c(Br)n1 Amb22047314 [0,2,0,0,0,0|2,0,0]=4 5608 B9R1.69 Clc1ccc(Br)c(Cl)c1 Amb2685058 [0,2,0,0,0,0|1,0,0]=3 5609 B9R1.69 Clc1ccc(Br)c(Cl)n1 Amb10071334 [0,2,0,0,0,0|2,0,0]=4 5610 B9R1.69 Clc1ccc(Br)c(I)c1 Amb19890454 [0,2,0,0,0,0|1,0,0]=3 5611 B9R1.69 Clc1ccc(Br)c(I)n1 Amb25899700 [0,2,0,0,0,0|2,0,0]=4 5612 B9R1.69 Clc1ccc(Br)cc1Br Amb19944011 [0,2,0,0,0,0|1,0,0]=3 5613 B9R1.69 Clc1ccc(Br)cc1Cl Amb2685060 [0,2,0,0,0,0|1,0,0]=3 5614 B9R1.69 Clc1ccc(Br)cc1I Amb22008076 [0,2,0,0,0,0|1,0,0]=3 5615 B9R1.69 Clc1ccc(Br)nc1Br Amb25696600 [0,2,0,0,0,0|2,0,0]=4 5616 B9R1.69 Clc1ccc(Br)nc1Cl Amb13889821 [0,2,0,0,0,0|2,0,0]=4 5617 B9R1.69 Clc1ccc(Br)nc1I Amb27756726 [0,2,0,0,0,0|2,0,0]=4 5618 B9R1.69 Clc1ccc(Cl)c(Br)c1 Amb2685059 [0,2,0,0,0,0|1,0,0]=3 5619 B9R1.69 Clc1ccc(Cl)c(Br)n1 Amb24271113 [0,2,0,0,0,0|2,0,0]=4 5620 B9R1.69 Clc1ccc(Cl)c(Cl)c1 Amb6365801 [0,2,0,0,0,0|1,0,0]=3 5621 B9R1.69 Clc1ccc(Cl)c(Cl)n1 Amb8387631 [0,2,0,0,0,0|2,0,0]=4 5622 B9R1.69 Clc1ccc(Cl)c(I)c1 Amb2686867 [0,2,0,0,0,0|1,0,0]=3 5623 B9R1.69 Clc1ccc(Cl)c(I)n1 Amb22325220 [0,2,0,0,0,0|2,0,0]=4 5624 B9R1.69 Clc1ccc(I)c(Br)c1 Amb10068701 [0,2,0,0,0,0|1,0,0]=3 5625 B9R1.69 Clc1ccc(I)c(Br)n1 Amb28071233 [0,2,0,0,0,0|2,0,0]=4 5626 B9R1.69 Clc1ccc(I)c(Cl)c1 Amb2726158 [0,2,0,0,0,0|1,0,0]=3 5627 B9R1.69 Clc1ccc(I)c(Cl)n1 Amb8389448 [0,2,0,0,0,0|2,0,0]=4 5628 B9R1.69 Clc1ccc(I)c(I)c1 Amb26019409 [0,2,0,0,0,0|1,0,0]=3 5629 B9R1.69 Clc1ccc(I)cc1Br Amb19890035 [0,2,0,0,0,0|1,0,0]=3 5630 B9R1.69 Clc1ccc(I)cc1Cl Amb2686866 [0,2,0,0,0,0|1,0,0]=3 5631 B9R1.69 Clc1ccc(I)cc1I Amb26020108 [0,2,0,0,0,0|1,0,0]=3 5632 B9R1.69 Clc1ccc(I)nc1Br Amb26362191 [0,2,0,0,0,0|2,0,0]=4 5633 B9R1.69 Clc1ccc(I)nc1Cl Amb26608333 [0,2,0,0,0,0|2,0,0]=4 5634 B9R1.69 Clc1ccc(I)nc1I Amb27185989 [0,2,0,0,0,0|2,0,0]=4 5635 B9R1.69 Clc1cnc(Br)c(Br)c1 Amb8396956 [0,2,0,0,0,0|2,0,0]=4 5636 B9R1.69 Clc1cnc(Br)c(Cl)c1 Amb2792489 [0,2,0,0,0,0|2,0,0]=4 5637 B9R1.69 Clc1cnc(Br)c(I)c1 Amb27166689 [0,2,0,0,0,0|2,0,0]=4 5638 B9R1.69 Clc1cnc(Br)cc1Br Amb22753922 [0,2,0,0,0,0|2,0,0]=4 5639 B9R1.69 Clc1cnc(Br)cc1Cl Amb26332546 [0,2,0,0,0,0|2,0,0]=4 5640 B9R1.69 Clc1cnc(Cl)c(Br)c1 Amb8393002 [0,2,0,0,0,0|2,0,0]=4 5641 B9R1.69 Clc1cnc(Cl)c(Cl)c1 Amb1039016 [0,2,0,0,0,0|2,0,0]=4 5642 B9R1.69 Clc1cnc(Cl)c(I)c1 Amb21959390 [0,2,0,0,0,0|2,0,0]=4 5643 B9R1.69 Clc1cnc(I)c(Br)c1 Amb22546729 [0,2,0,0,0,0|2,0,0]=4 5644 B9R1.69 Clc1cnc(I)c(Cl)c1 Amb27978109 [0,2,0,0,0,0|2,0,0]=4 5645 B9R1.69 Clc1cnc(I)c(I)c1 Amb21959486 [0,2,0,0,0,0|2,0,0]=4 5646 B9R1.69 Clc1cnc(I)cc1I Amb27816819 [0,2,0,0,0,0|2,0,0]=4 5647 B9R1.69 Clc1nc(Br)ccc1Br Amb20620908 [0,2,0,0,0,0|2,0,0]=4 5648 B9R1.69 Clc1nc(Br)ccc1I Amb13889801 [0,2,0,0,0,0|2,0,0]=4 5649 B9R1.69 Clc1nc(I)ccc1Br Amb25996437 [0,2,0,0,0,0|2,0,0]=4 5650 B9R1.69 Clc1nc(I)ccc1I Amb28208612 [0,2,0,0,0,0|2,0,0]=4 5651 B9R1.69 Clc1ncc(Br)cc1Br Amb10067749 [0,2,0,0,0,0|2,0,0]=4 5652 B9R1.69 Clc1ncc(Br)cc1I Amb6565059 [0,2,0,0,0,0|2,0,0]=4 5653 B9R1.69 Clc1ncc(I)cc1Br Amb21963690 [0,2,0,0,0,0|2,0,0]=4 5654 B9R1.69 Clc1ncc(I)cc1I Amb2234912 [0,2,0,0,0,0|2,0,0]=4 5655 B9R1.69 Cn1cc(Br)ccc1=O Amb22229889 [0,2,0,0,0,0|1,0,1]=4 5656 B9R1.69 Cn1ccc(=O)c(O)c1 Amb22504110 [0,2,0,0,0,0|1,0,0]=3 5657 B9R1.69 Cn1ccc(N)cc1=O Amb22270219 [0,2,0,0,0,0|1,0,1]=4 5658 B9R1.69 Fc1cc(Br)c(Br)cn1 Amb24478759 [0,2,0,0,0,0|2,0,0]=4 5659 B9R1.69 Fc1cc(Br)c(Cl)cn1 Amb24646417 [0,2,0,0,0,0|2,0,0]=4 5660 B9R1.69 Fc1cc(Br)c(F)cn1 Amb19892464 [0,2,0,0,0,0|2,0,0]=4 5661 B9R1.69 Fc1cc(Br)c(S)cn1 Amb27646844 [0,2,0,0,0,0|1,1,0]=4 5662 B9R1.69 Fc1cc(Br)ccc1Br Amb2686729 [0,2,0,0,0,0|1,0,0]=3 5663 B9R1.69 Fc1cc(Br)ccc1Cl Amb2685010 [0,2,0,0,0,0|1,0,0]=3 5664 B9R1.69 Fc1cc(Br)ccc1I Amb2685216 [0,2,0,0,0,0|1,0,0]=3 5665 B9R1.69 Fc1cc(Br)ccc1S Amb19887445 [0,2,0,0,0,0|0,1,0]=3 5666 B9R1.69 Fc1cc(Br)cnc1Br Amb10603519 [0,2,0,0,0,0|2,0,0]=4 5667 B9R1.69 Fc1cc(Br)cnc1Cl Amb8392994 [0,2,0,0,0,0|2,0,0]=4 5668 B9R1.69 Fc1cc(Br)cnc1F Amb8396917 [0,2,0,0,0,0|2,0,0]=4 5669 B9R1.69 Fc1cc(Br)cnc1I Amb27169636 [0,2,0,0,0,0|2,0,0]=4 5670 B9R1.69 Fc1cc(Br)cnc1S Amb27493032 [0,2,0,0,0,0|1,1,0]=4 5671 B9R1.69 Fc1cc(Br)ncc1Br Amb20247822 [0,2,0,0,0,0|2,0,0]=4 5672 B9R1.69 Fc1cc(Br)ncc1I Amb26381455 [0,2,0,0,0,0|2,0,0]=4 5673 B9R1.69 Fc1cc(Br)ncc1S Amb27813495 [0,2,0,0,0,0|1,1,0]=4 5674 B9R1.69 Fc1cc(Cl)c(Cl)cn1 Amb25147045 [0,2,0,0,0,0|2,0,0]=4 5675 B9R1.69 Fc1cc(Cl)c(F)cn1 Amb8390120 [0,2,0,0,0,0|2,0,0]=4 5676 B9R1.69 Fc1cc(Cl)c(S)cn1 Amb24531408 [0,2,0,0,0,0|1,1,0]=4 5677 B9R1.69 Fc1cc(Cl)ccc1Br Amb2685009 [0,2,0,0,0,0|1,0,0]=3 5678 B9R1.69 Fc1cc(Cl)ccc1Cl Amb6365598 [0,2,0,0,0,0|1,0,0]=3 5679 B9R1.69 Fc1cc(Cl)ccc1I Amb2686004 [0,2,0,0,0,0|1,0,0]=3 5680 B9R1.69 Fc1cc(Cl)ccc1S Amb19944197 [0,2,0,0,0,0|0,1,0]=3 5681 B9R1.69 Fc1cc(Cl)cnc1Br Amb10840617 [0,2,0,0,0,0|2,0,0]=4 5682 B9R1.69 Fc1cc(Cl)cnc1Cl Amb10840777 [0,2,0,0,0,0|2,0,0]=4 5683 B9R1.69 Fc1cc(Cl)cnc1F Amb8390898 [0,2,0,0,0,0|2,0,0]=4 5684 B9R1.69 Fc1cc(Cl)ncc1Br Amb22499651 [0,2,0,0,0,0|2,0,0]=4 5685 B9R1.69 Fc1cc(Cl)ncc1Cl Amb26345126 [0,2,0,0,0,0|2,0,0]=4 5686 B9R1.69 Fc1cc(Cl)ncc1I Amb27392158 [0,2,0,0,0,0|2,0,0]=4 5687 B9R1.69 Fc1cc(Cl)ncc1S Amb25233235 [0,2,0,0,0,0|1,1,0]=4 5688 B9R1.69 Fc1cc(F)c(Br)cn1 Amb27495646 [0,2,0,0,0,0|2,0,0]=4 5689 B9R1.69 Fc1cc(F)c(Cl)cn1 Amb27494377 [0,2,0,0,0,0|2,0,0]=4 5690 B9R1.69 Fc1cc(F)c(F)cn1 Amb8388368 [0,2,0,0,0,0|2,0,0]=4 5691 B9R1.69 Fc1cc(F)c(I)cn1 Amb8388367 [0,2,0,0,0,0|2,0,0]=4 5692 B9R1.69 Fc1cc(F)c(S)cn1 Amb26893915 [0,2,0,0,0,0|1,1,0]=4 5693 B9R1.69 Fc1cc(I)c(Br)cn1 Amb26381508 [0,2,0,0,0,0|2,0,0]=4 5694 B9R1.69 Fc1cc(I)c(Cl)cn1 Amb15691061 [0,2,0,0,0,0|2,0,0]=4 5695 B9R1.69 Fc1cc(I)c(F)cn1 Amb19892516 [0,2,0,0,0,0|2,0,0]=4 5696 B9R1.69 Fc1cc(I)c(S)cn1 Amb26593477 [0,2,0,0,0,0|1,1,0]=4 5697 B9R1.69 Fc1cc(I)ccc1Br Amb2685215 [0,2,0,0,0,0|1,0,0]=3 5698 B9R1.69 Fc1cc(I)ccc1Cl Amb2686005 [0,2,0,0,0,0|1,0,0]=3 5699 B9R1.69 Fc1cc(I)ccc1I Amb2687314 [0,2,0,0,0,0|1,0,0]=3 5700 B9R1.69 Fc1cc(I)ccc1S Amb24716968 [0,2,0,0,0,0|0,1,0]=3 5701 B9R1.69 Fc1cc(I)cnc1Cl Amb22490013 [0,2,0,0,0,0|2,0,0]=4 5702 B9R1.69 Fc1cc(I)cnc1F Amb20247486 [0,2,0,0,0,0|2,0,0]=4 5703 B9R1.69 Fc1cc(I)ncc1Br Amb22499650 [0,2,0,0,0,0|2,0,0]=4 5704 B9R1.69 Fc1cc(I)ncc1Cl Amb25932053 [0,2,0,0,0,0|2,0,0]=4 5705 B9R1.69 Fc1cc(I)ncc1S Amb28367769 [0,2,0,0,0,0|1,1,0]=4 5706 B9R1.69 Fc1cc(S)c(Cl)cn1 Amb26422065 [0,2,0,0,0,0|1,1,0]=4 5707 B9R1.69 Fc1cc(S)c(I)cn1 Amb27613766 [0,2,0,0,0,0|1,1,0]=4 5708 B9R1.69 Fc1cc(S)ccc1Br Amb10606423 [0,2,0,0,0,0|0,1,0]=3 5709 B9R1.69 Fc1cc(S)ccc1Cl Amb19944225 [0,2,0,0,0,0|0,1,0]=3 5710 B9R1.69 Fc1cc(S)ccc1I Amb24410283 [0,2,0,0,0,0|0,1,0]=3 5711 B9R1.69 Fc1cc(S)ccc1S Amb24547108 [0,2,0,0,0,0|0,1,0]=3 5712 B9R1.69 Fc1cc(S)cnc1Cl Amb24741329 [0,2,0,0,0,0|1,1,0]=4 5713 B9R1.69 Fc1cc(S)cnc1F Amb26608334 [0,2,0,0,0,0|1,1,0]=4 5714 B9R1.69 Fc1cc(S)cnc1I Amb24727722 [0,2,0,0,0,0|1,1,0]=4 5715 B9R1.69 Fc1cc(S)ncc1Cl Amb27633529 [0,2,0,0,0,0|1,1,0]=4 5716 B9R1.69 Fc1cc(S)ncc1I Amb27613807 [0,2,0,0,0,0|1,1,0]=4 5717 B9R1.69 Fc1cc([Zn+])ccc1Cl Amb22336493 [0,2,0,0,0,0|1,0,0]=3 5718 B9R1.69 Fc1ccc(Br)c(Br)c1 Amb2686726 [0,2,0,0,0,0|1,0,0]=3 5719 B9R1.69 Fc1ccc(Br)c(Cl)c1 Amb2685013 [0,2,0,0,0,0|1,0,0]=3 5720 B9R1.69 Fc1ccc(Br)c(F)c1 Amb2685090 [0,2,0,0,0,0|1,0,0]=3 5721 B9R1.69 Fc1ccc(Br)c(F)n1 Amb19888852 [0,2,0,0,0,0|2,0,0]=4 5722 B9R1.69 Fc1ccc(Br)c(I)c1 Amb2685217 [0,2,0,0,0,0|1,0,0]=3 5723 B9R1.69 Fc1ccc(Br)c(I)n1 Amb24356813 [0,2,0,0,0,0|2,0,0]=4 5724 B9R1.69 Fc1ccc(Br)c(S)c1 Amb24453428 [0,2,0,0,0,0|0,1,0]=3 5725 B9R1.69 Fc1ccc(Br)c(S)n1 Amb27481976 [0,2,0,0,0,0|1,1,0]=4 5726 B9R1.69 Fc1ccc(Br)cc1Br Amb2686727 [0,2,0,0,0,0|1,0,0]=3 5727 B9R1.69 Fc1ccc(Br)cc1Cl Amb2685007 [0,2,0,0,0,0|1,0,0]=3 5728 B9R1.69 Fc1ccc(Br)cc1F Amb2685093 [0,2,0,0,0,0|1,0,0]=3 5729 B9R1.69 Fc1ccc(Br)cc1I Amb2692034 [0,2,0,0,0,0|1,0,0]=3 5730 B9R1.69 Fc1ccc(Br)cc1S Amb19944260 [0,2,0,0,0,0|0,1,0]=3 5731 B9R1.69 Fc1ccc(Br)nc1Br Amb19959796 [0,2,0,0,0,0|2,0,0]=4 5732 B9R1.69 Fc1ccc(Br)nc1Cl Amb24645039 [0,2,0,0,0,0|2,0,0]=4 5733 B9R1.69 Fc1ccc(Br)nc1F Amb22387813 [0,2,0,0,0,0|2,0,0]=4 5734 B9R1.69 Fc1ccc(Br)nc1S Amb27791286 [0,2,0,0,0,0|1,1,0]=4 5735 B9R1.69 Fc1ccc(Cl)c(Br)c1 Amb2685011 [0,2,0,0,0,0|1,0,0]=3 5736 B9R1.69 Fc1ccc(Cl)c(Br)n1 Amb22371508 [0,2,0,0,0,0|2,0,0]=4 5737 B9R1.69 Fc1ccc(Cl)c(Cl)c1 Amb2686836 [0,2,0,0,0,0|1,0,0]=3 5738 B9R1.69 Fc1ccc(Cl)c(Cl)n1 Amb26513897 [0,2,0,0,0,0|2,0,0]=4 5739 B9R1.69 Fc1ccc(Cl)c(F)c1 Amb6296694 [0,2,0,0,0,0|1,0,0]=3 5740 B9R1.69 Fc1ccc(Cl)c(F)n1 Amb21959339 [0,2,0,0,0,0|2,0,0]=4 5741 B9R1.69 Fc1ccc(Cl)c(I)c1 Amb2684141 [0,2,0,0,0,0|1,0,0]=3 5742 B9R1.69 Fc1ccc(Cl)c(S)c1 Amb19887940 [0,2,0,0,0,0|0,1,0]=3 5743 B9R1.69 Fc1ccc(Cl)c(S)n1 Amb26638194 [0,2,0,0,0,0|1,1,0]=4 5744 B9R1.69 Fc1ccc(Cl)cc1Br Amb2685012 [0,2,0,0,0,0|1,0,0]=3 5745 B9R1.69 Fc1ccc(Cl)cc1Cl Amb2686834 [0,2,0,0,0,0|1,0,0]=3 5746 B9R1.69 Fc1ccc(Cl)cc1F Amb2685827 [0,2,0,0,0,0|1,0,0]=3 5747 B9R1.69 Fc1ccc(Cl)cc1I Amb2684188 [0,2,0,0,0,0|1,0,0]=3 5748 B9R1.69 Fc1ccc(Cl)cc1S Amb19887942 [0,2,0,0,0,0|0,1,0]=3 5749 B9R1.69 Fc1ccc(Cl)nc1Br Amb25883487 [0,2,0,0,0,0|2,0,0]=4 5750 B9R1.69 Fc1ccc(Cl)nc1Cl Amb10603528 [0,2,0,0,0,0|2,0,0]=4 5751 B9R1.69 Fc1ccc(Cl)nc1F Amb27786305 [0,2,0,0,0,0|2,0,0]=4 5752 B9R1.69 Fc1ccc(Cl)nc1I Amb22898929 [0,2,0,0,0,0|2,0,0]=4 5753 B9R1.69 Fc1ccc(Cl)nc1S Amb27985835 [0,2,0,0,0,0|1,1,0]=4 5754 B9R1.69 Fc1ccc(F)c(Br)c1 Amb2685091 [0,2,0,0,0,0|1,0,0]=3 5755 B9R1.69 Fc1ccc(F)c(Br)n1 Amb22749751 [0,2,0,0,0,0|2,0,0]=4 5756 B9R1.69 Fc1ccc(F)c(Cl)c1 Amb2685826 [0,2,0,0,0,0|1,0,0]=3 5757 B9R1.69 Fc1ccc(F)c(Cl)n1 Amb26994954 [0,2,0,0,0,0|2,0,0]=4 5758 B9R1.69 Fc1ccc(F)c(F)c1 Amb2690729 [0,2,0,0,0,0|1,0,0]=3 5759 B9R1.69 Fc1ccc(F)c(F)n1 Amb8389957 [0,2,0,0,0,0|2,0,0]=4 5760 B9R1.69 Fc1ccc(F)c(I)c1 Amb6298631 [0,2,0,0,0,0|1,0,0]=3 5761 B9R1.69 Fc1ccc(F)c(I)n1 Amb24054126 [0,2,0,0,0,0|2,0,0]=4 5762 B9R1.69 Fc1ccc(F)c(S)c1 Amb2371188 [0,2,0,0,0,0|0,1,0]=3 5763 B9R1.69 Fc1ccc(I)c(Br)c1 Amb2382940 [0,2,0,0,0,0|1,0,0]=3 5764 B9R1.69 Fc1ccc(I)c(Br)n1 Amb25301871 [0,2,0,0,0,0|2,0,0]=4 5765 B9R1.69 Fc1ccc(I)c(Cl)c1 Amb2686001 [0,2,0,0,0,0|1,0,0]=3 5766 B9R1.69 Fc1ccc(I)c(Cl)n1 Amb25835861 [0,2,0,0,0,0|2,0,0]=4 5767 B9R1.69 Fc1ccc(I)c(F)c1 Amb2687142 [0,2,0,0,0,0|1,0,0]=3 5768 B9R1.69 Fc1ccc(I)c(F)n1 Amb10841441 [0,2,0,0,0,0|2,0,0]=4 5769 B9R1.69 Fc1ccc(I)c(S)c1 Amb26960307 [0,2,0,0,0,0|0,1,0]=3 5770 B9R1.69 Fc1ccc(I)c(S)n1 Amb27230306 [0,2,0,0,0,0|1,1,0]=4 5771 B9R1.69 Fc1ccc(I)cc1Br Amb2685218 [0,2,0,0,0,0|1,0,0]=3 5772 B9R1.69 Fc1ccc(I)cc1Cl Amb2686003 [0,2,0,0,0,0|1,0,0]=3 5773 B9R1.69 Fc1ccc(I)cc1F Amb2687143 [0,2,0,0,0,0|1,0,0]=3 5774 B9R1.69 Fc1ccc(I)cc1I Amb24478742 [0,2,0,0,0,0|1,0,0]=3 5775 B9R1.69 Fc1ccc(I)cc1S Amb24410177 [0,2,0,0,0,0|0,1,0]=3 5776 B9R1.69 Fc1ccc(I)nc1Cl Amb25270258 [0,2,0,0,0,0|2,0,0]=4 5777 B9R1.69 Fc1ccc(I)nc1F Amb24478652 [0,2,0,0,0,0|2,0,0]=4 5778 B9R1.69 Fc1ccc(I)nc1S Amb24573921 [0,2,0,0,0,0|1,1,0]=4 5779 B9R1.69 Fc1ccc(S)c(Br)c1 Amb19887453 [0,2,0,0,0,0|0,1,0]=3 5780 B9R1.69 Fc1ccc(S)c(Cl)c1 Amb2686085 [0,2,0,0,0,0|0,1,0]=3 5781 B9R1.69 Fc1ccc(S)c(Cl)n1 Amb26897156 [0,2,0,0,0,0|1,1,0]=4 5782 B9R1.69 Fc1ccc(S)c(F)c1 Amb2687280 [0,2,0,0,0,0|0,1,0]=3 5783 B9R1.69 Fc1ccc(S)c(F)n1 Amb26894509 [0,2,0,0,0,0|1,1,0]=4 5784 B9R1.69 Fc1ccc(S)c(I)c1 Amb26578598 [0,2,0,0,0,0|0,1,0]=3 5785 B9R1.69 Fc1ccc(S)c(I)n1 Amb27625158 [0,2,0,0,0,0|1,1,0]=4 5786 B9R1.69 Fc1ccc(S)c(S)c1 Amb26348008 [0,2,0,0,0,0|0,1,0]=3 5787 B9R1.69 Fc1ccc(S)cc1Br Amb19887443 [0,2,0,0,0,0|0,1,0]=3 5788 B9R1.69 Fc1ccc(S)cc1Cl Amb2686086 [0,2,0,0,0,0|0,1,0]=3 5789 B9R1.69 Fc1ccc(S)cc1F Amb5294932 [0,2,0,0,0,0|0,1,0]=3 5790 B9R1.69 Fc1ccc(S)nc1F Amb26893816 [0,2,0,0,0,0|1,1,0]=4 5791 B9R1.69 Fc1ccc(S)nc1I Amb27634270 [0,2,0,0,0,0|1,1,0]=4 5792 B9R1.69 Fc1ccc([S-])c(Cl)c1 Amb33513025 [0,2,0,0,0,0|0,1,0]=3 5793 B9R1.69 Fc1ccc([S-])c(F)c1 Amb33512926 [0,2,0,0,0,0|0,1,0]=3 5794 B9R1.69 Fc1ccc([S-])cc1Cl Amb33513026 [0,2,0,0,0,0|0,1,0]=3 5795 B9R1.69 Fc1ccc([S-])cc1F Amb33512925 [0,2,0,0,0,0|0,1,0]=3 5796 B9R1.69 Fc1ccc([Zn+])c(F)c1 Amb22275723 [0,2,0,0,0,0|1,0,0]=3 5797 B9R1.69 Fc1ccc([Zn+])cc1F Amb22274871 [0,2,0,0,0,0|1,0,0]=3 5798 B9R1.69 Fc1cnc(Br)c(Br)c1 Amb10602512 [0,2,0,0,0,0|2,0,0]=4 5799 B9R1.69 Fc1cnc(Br)c(Cl)c1 Amb19894417 [0,2,0,0,0,0|2,0,0]=4 5800 B9R1.69 Fc1cnc(Br)c(F)c1 Amb8396946 [0,2,0,0,0,0|2,0,0]=4 5801 B9R1.69 Fc1cnc(Br)c(I)c1 Amb21963692 [0,2,0,0,0,0|2,0,0]=4 5802 B9R1.69 Fc1cnc(Br)cc1Br Amb19892712 [0,2,0,0,0,0|2,0,0]=4 5803 B9R1.69 Fc1cnc(Br)cc1Cl Amb22235473 [0,2,0,0,0,0|2,0,0]=4 5804 B9R1.69 Fc1cnc(Br)cc1F Amb20247821 [0,2,0,0,0,0|2,0,0]=4 5805 B9R1.69 Fc1cnc(Br)cc1I Amb19892713 [0,2,0,0,0,0|2,0,0]=4 5806 B9R1.69 Fc1cnc(Cl)c(Br)c1 Amb8392992 [0,2,0,0,0,0|2,0,0]=4 5807 B9R1.69 Fc1cnc(Cl)c(Cl)c1 Amb10605765 [0,2,0,0,0,0|2,0,0]=4 5808 B9R1.69 Fc1cnc(Cl)c(I)c1 Amb6565133 [0,2,0,0,0,0|2,0,0]=4 5809 B9R1.69 Fc1cnc(Cl)c(S)c1 Amb26935037 [0,2,0,0,0,0|1,1,0]=4 5810 B9R1.69 Fc1cnc(Cl)cc1Br Amb8396914 [0,2,0,0,0,0|2,0,0]=4 5811 B9R1.69 Fc1cnc(Cl)cc1Cl Amb21857944 [0,2,0,0,0,0|2,0,0]=4 5812 B9R1.69 Fc1cnc(Cl)cc1I Amb15691053 [0,2,0,0,0,0|2,0,0]=4 5813 B9R1.69 Fc1cnc(F)c(Br)c1 Amb10840680 [0,2,0,0,0,0|2,0,0]=4 5814 B9R1.69 Fc1cnc(F)c(Cl)c1 Amb10607156 [0,2,0,0,0,0|2,0,0]=4 5815 B9R1.69 Fc1cnc(F)c(F)c1 Amb8396896 [0,2,0,0,0,0|2,0,0]=4 5816 B9R1.69 Fc1cnc(F)c(I)c1 Amb27482818 [0,2,0,0,0,0|2,0,0]=4 5817 B9R1.69 Fc1cnc(F)c(S)c1 Amb24541228 [0,2,0,0,0,0|1,1,0]=4 5818 B9R1.69 Fc1cnc(I)c(Br)c1 Amb27814905 [0,2,0,0,0,0|2,0,0]=4 5819 B9R1.69 Fc1cnc(I)c(Cl)c1 Amb22547579 [0,2,0,0,0,0|2,0,0]=4 5820 B9R1.69 Fc1cnc(I)c(F)c1 Amb24670128 [0,2,0,0,0,0|2,0,0]=4 5821 B9R1.69 Fc1cnc(I)c(S)c1 Amb26442418 [0,2,0,0,0,0|1,1,0]=4 5822 B9R1.69 Fc1cnc(I)cc1Br Amb27955068 [0,2,0,0,0,0|2,0,0]=4 5823 B9R1.69 Fc1cnc(I)cc1Cl Amb26012118 [0,2,0,0,0,0|2,0,0]=4 5824 B9R1.69 Fc1cnc(I)cc1F Amb24579068 [0,2,0,0,0,0|2,0,0]=4 5825 B9R1.69 Fc1cnc(I)cc1S Amb27230305 [0,2,0,0,0,0|1,1,0]=4 5826 B9R1.69 Fc1cnc(S)c(Cl)c1 Amb25299348 [0,2,0,0,0,0|1,1,0]=4 5827 B9R1.69 Fc1cnc(S)c(F)c1 Amb27267367 [0,2,0,0,0,0|1,1,0]=4 5828 B9R1.69 Fc1cnc(S)c(I)c1 Amb26645556 [0,2,0,0,0,0|1,1,0]=4 5829 B9R1.69 Fc1cnc(S)cc1Cl Amb26033970 [0,2,0,0,0,0|1,1,0]=4 5830 B9R1.69 Fc1cnc(S)cc1F Amb27462443 [0,2,0,0,0,0|1,1,0]=4 5831 B9R1.69 Fc1cnc(S)cc1I Amb27964403 [0,2,0,0,0,0|1,1,0]=4 5832 B9R1.69 Fc1nc(Br)ccc1Br Amb27978108 [0,2,0,0,0,0|2,0,0]=4 5833 B9R1.69 Fc1nc(Br)ccc1Cl Amb28435187 [0,2,0,0,0,0|2,0,0]=4 5834 B9R1.69 Fc1nc(Br)ccc1I Amb26070866 [0,2,0,0,0,0|2,0,0]=4 5835 B9R1.69 Fc1nc(Cl)ccc1Br Amb19892708 [0,2,0,0,0,0|2,0,0]=4 5836 B9R1.69 Fc1nc(Cl)ccc1I Amb19892709 [0,2,0,0,0,0|2,0,0]=4 5837 B9R1.69 Fc1nc(Cl)ccc1S Amb26444163 [0,2,0,0,0,0|1,1,0]=4 5838 B9R1.69 Fc1nc(I)ccc1Br Amb23401535 [0,2,0,0,0,0|2,0,0]=4 5839 B9R1.69 Fc1nc(I)ccc1Cl Amb28284429 [0,2,0,0,0,0|2,0,0]=4 5840 B9R1.69 Fc1nc(I)ccc1I Amb22751982 [0,2,0,0,0,0|2,0,0]=4 5841 B9R1.69 Fc1nc(I)ccc1S Amb27200789 [0,2,0,0,0,0|1,1,0]=4 5842 B9R1.69 Fc1ncc(Br)cc1Br Amb15690836 [0,2,0,0,0,0|2,0,0]=4 5843 B9R1.69 Fc1ncc(Br)cc1Cl Amb15691040 [0,2,0,0,0,0|2,0,0]=4 5844 B9R1.69 Fc1ncc(Br)cc1I Amb24055353 [0,2,0,0,0,0|2,0,0]=4 5845 B9R1.69 Fc1ncc(Br)cc1S Amb24653045 [0,2,0,0,0,0|1,1,0]=4 5846 B9R1.69 Fc1ncc(Cl)cc1Br Amb8392993 [0,2,0,0,0,0|2,0,0]=4 5847 B9R1.69 Fc1ncc(Cl)cc1Cl Amb6366018 [0,2,0,0,0,0|2,0,0]=4 5848 B9R1.69 Fc1ncc(Cl)cc1I Amb21857061 [0,2,0,0,0,0|2,0,0]=4 5849 B9R1.69 Fc1ncc(Cl)cc1S Amb24559844 [0,2,0,0,0,0|1,1,0]=4 5850 B9R1.69 Fc1ncc(I)cc1Cl Amb25289681 [0,2,0,0,0,0|2,0,0]=4 5851 B9R1.69 Fc1ncc(I)cc1S Amb28195401 [0,2,0,0,0,0|1,1,0]=4 5852 B9R1.69 Fc1ncc(S)cc1I Amb28133028 [0,2,0,0,0,0|1,1,0]=4 5853 B9R1.69 Ic1ccc(I)c(I)c1 Amb24385960 [0,2,0,0,0,0|1,0,0]=3 5854 B9R1.69 NC1=C(Br)C=CC(=O)N1 Amb26480597 [0,2,0,0,0,0|1,0,1]=4 5855 B9R1.69 NC1=CC(=O)C=CC1=O Amb25727299 [0,2,0,0,0,0|0,0,1]=3 5856 B9R1.69 NC1=CC(=O)NC=C1F Amb18642568 [0,2,0,0,0,0|1,0,1]=4 5857 B9R1.69 NC1=CC(Br)=CNC1=O Amb18035959 [0,2,0,0,0,0|1,0,1]=4 5858 B9R1.69 NC1=CC(Br)=CNC1=S Amb33546411 [0,2,0,0,0,0|1,1,0]=4 5859 B9R1.69 NC1=CC(Cl)=CNC1=O Amb18064985 [0,2,0,0,0,0|1,0,1]=4 5860 B9R1.69 NC1=CC=C(Br)NC1=O Amb22000912 [0,2,0,0,0,0|1,0,1]=4 5861 B9R1.69 NC1=CNC(=O)C(Br)=C1 Amb18064979 [0,2,0,0,0,0|1,0,1]=4 5862 B9R1.69 NC1=NC(=O)N(O)C=C1 Amb26341382 [0,2,0,0,0,0|2,0,0]=4 5863 B9R1.69 NN1C=C(Br)C=CC1=O Amb33330659 [0,2,0,0,0,0|1,0,1]=4 5864 B9R1.69 Nc1cc(Br)c(Br)cn1 Amb21857426 [0,2,0,0,0,0|2,0,0]=4 5865 B9R1.69 Nc1cc(Br)c(Cl)cn1 Amb33549215 [0,2,0,0,0,0|2,0,0]=4 5866 B9R1.69 Nc1cc(Br)c(F)cn1 Amb27438738 [0,2,0,0,0,0|2,0,0]=4 5867 B9R1.69 Nc1cc(Br)c(I)cn1 Amb21964764 [0,2,0,0,0,0|2,0,0]=4 5868 B9R1.69 Nc1cc(Br)c(N)cn1 Amb26423373 [0,2,0,0,0,0|2,0,0]=4 5869 B9R1.69 Nc1cc(Br)c(O)cn1 Amb26595222 [0,2,0,0,0,0|1,0,0]=3 5870 B9R1.69 Nc1cc(Br)cc[n+]1[O-] Amb27861094 [0,2,0,0,0,0|1,0,1]=4 5871 B9R1.69 Nc1cc(Br)ccc1Br Amb1131211 [0,2,0,0,0,0|1,0,0]=3 5872 B9R1.69 Nc1cc(Br)ccc1Cl Amb2694364 [0,2,0,0,0,0|1,0,0]=3 5873 B9R1.69 Nc1cc(Br)ccc1F Amb19884030 [0,2,0,0,0,0|1,0,0]=3 5874 B9R1.69 Nc1cc(Br)ccc1F Amb2685175 [0,2,0,0,0,0|1,0,0]=3 5875 B9R1.69 Nc1cc(Br)ccc1I Amb7970242 [0,2,0,0,0,0|1,0,0]=3 5876 B9R1.69 Nc1cc(Br)ccc1O Amb1033028 [0,2,0,0,0,0|0,0,0]=2 5877 B9R1.69 Nc1cc(Br)ccc1O Amb8631330 [0,2,0,0,0,0|0,0,0]=2 5878 B9R1.69 Nc1cc(Br)ccc1S Amb8929754 [0,2,0,0,0,0|0,1,0]=3 5879 B9R1.69 Nc1cc(Br)cnc1Br Amb6565144 [0,2,0,0,0,0|2,0,0]=4 5880 B9R1.69 Nc1cc(Br)cnc1Cl Amb32758749 [0,2,0,0,0,0|2,0,0]=4 5881 B9R1.69 Nc1cc(Br)cnc1Cl Amb4477432 [0,2,0,0,0,0|2,0,0]=4 5882 B9R1.69 Nc1cc(Br)cnc1F Amb8396898 [0,2,0,0,0,0|2,0,0]=4 5883 B9R1.69 Nc1cc(Br)cnc1I Amb20671168 [0,2,0,0,0,0|2,0,0]=4 5884 B9R1.69 Nc1cc(Br)cnc1N Amb10067700 [0,2,0,0,0,0|2,0,0]=4 5885 B9R1.69 Nc1cc(Br)cnc1N Amb1016806 [0,2,0,0,0,0|2,0,0]=4 5886 B9R1.69 Nc1cc(Br)cnc1O Amb10068470 [0,2,0,0,0,0|1,0,0]=3 5887 B9R1.69 Nc1cc(Br)ncc1Br Amb22497360 [0,2,0,0,0,0|2,0,0]=4 5888 B9R1.69 Nc1cc(Br)ncc1Cl Amb24478837 [0,2,0,0,0,0|2,0,0]=4 5889 B9R1.69 Nc1cc(Br)ncc1F Amb2609498 [0,2,0,0,0,0|2,0,0]=4 5890 B9R1.69 Nc1cc(Br)ncc1I Amb23560310 [0,2,0,0,0,0|2,0,0]=4 5891 B9R1.69 Nc1cc(Br)ncc1O Amb20247824 [0,2,0,0,0,0|1,0,0]=3 5892 B9R1.69 Nc1cc(Cl)c(Br)cn1 Amb16233987 [0,2,0,0,0,0|2,0,0]=4 5893 B9R1.69 Nc1cc(Cl)c(Cl)cn1 Amb10071347 [0,2,0,0,0,0|2,0,0]=4 5894 B9R1.69 Nc1cc(Cl)c(F)cn1 Amb25304483 [0,2,0,0,0,0|2,0,0]=4 5895 B9R1.69 Nc1cc(Cl)c(I)cn1 Amb20241813 [0,2,0,0,0,0|2,0,0]=4 5896 B9R1.69 Nc1cc(Cl)c(N)cn1 Amb25918825 [0,2,0,0,0,0|2,0,0]=4 5897 B9R1.69 Nc1cc(Cl)ccc1Br Amb10069016 [0,2,0,0,0,0|1,0,0]=3 5898 B9R1.69 Nc1cc(Cl)ccc1Cl Amb1152342 [0,2,0,0,0,0|1,0,0]=3 5899 B9R1.69 Nc1cc(Cl)ccc1F Amb2685926 [0,2,0,0,0,0|1,0,0]=3 5900 B9R1.69 Nc1cc(Cl)ccc1I Amb24089379 [0,2,0,0,0,0|1,0,0]=3 5901 B9R1.69 Nc1cc(Cl)ccc1I Amb7970239 [0,2,0,0,0,0|1,0,0]=3 5902 B9R1.69 Nc1cc(Cl)ccc1O Amb1810357 [0,2,0,0,0,0|0,0,0]=2 5903 B9R1.69 Nc1cc(Cl)ccc1O Amb24081047 [0,2,0,0,0,0|0,0,0]=2 5904 B9R1.69 Nc1cc(Cl)ccc1S Amb2371436 [0,2,0,0,0,0|0,1,0]=3 5905 B9R1.69 Nc1cc(Cl)cnc1Br Amb10067751 [0,2,0,0,0,0|2,0,0]=4 5906 B9R1.69 Nc1cc(Cl)cnc1Cl Amb2720382 [0,2,0,0,0,0|2,0,0]=4 5907 B9R1.69 Nc1cc(Cl)cnc1Cl Amb32661761 [0,2,0,0,0,0|2,0,0]=4 5908 B9R1.69 Nc1cc(Cl)cnc1F Amb8396900 [0,2,0,0,0,0|2,0,0]=4 5909 B9R1.69 Nc1cc(Cl)cnc1I Amb24340297 [0,2,0,0,0,0|2,0,0]=4 5910 B9R1.69 Nc1cc(Cl)cnc1N Amb534894 [0,2,0,0,0,0|2,0,0]=4 5911 B9R1.69 Nc1cc(Cl)cnc1O Amb19959064 [0,2,0,0,0,0|1,0,0]=3 5912 B9R1.69 Nc1cc(Cl)cnc1S Amb18644738 [0,2,0,0,0,0|1,1,0]=4 5913 B9R1.69 Nc1cc(Cl)ncc1Br Amb17872434 [0,2,0,0,0,0|2,0,0]=4 5914 B9R1.69 Nc1cc(Cl)ncc1Cl Amb19959763 [0,2,0,0,0,0|2,0,0]=4 5915 B9R1.69 Nc1cc(Cl)ncc1F Amb19890081 [0,2,0,0,0,0|2,0,0]=4 5916 B9R1.69 Nc1cc(Cl)ncc1I Amb10974808 [0,2,0,0,0,0|2,0,0]=4 5917 B9R1.69 Nc1cc(Cl)ncc1O Amb19515810 [0,2,0,0,0,0|1,0,0]=3 5918 B9R1.69 Nc1cc(F)c(Br)cn1 Amb21857425 [0,2,0,0,0,0|2,0,0]=4 5919 B9R1.69 Nc1cc(F)c(Br)cn1 Amb22276012 [0,2,0,0,0,0|2,0,0]=4 5920 B9R1.69 Nc1cc(F)c(Cl)cn1 Amb28367551 [0,2,0,0,0,0|2,0,0]=4 5921 B9R1.69 Nc1cc(F)c(F)cn1 Amb22749410 [0,2,0,0,0,0|2,0,0]=4 5922 B9R1.69 Nc1cc(F)c(I)cn1 Amb22495044 [0,2,0,0,0,0|2,0,0]=4 5923 B9R1.69 Nc1cc(F)c(N)cn1 Amb23400367 [0,2,0,0,0,0|2,0,0]=4 5924 B9R1.69 Nc1cc(F)c(O)cn1 Amb28251370 [0,2,0,0,0,0|1,0,0]=3 5925 B9R1.69 Nc1cc(F)ccc1Br Amb2685173 [0,2,0,0,0,0|1,0,0]=3 5926 B9R1.69 Nc1cc(F)ccc1Cl Amb2685921 [0,2,0,0,0,0|1,0,0]=3 5927 B9R1.69 Nc1cc(F)ccc1F Amb2687038 [0,2,0,0,0,0|1,0,0]=3 5928 B9R1.69 Nc1cc(F)ccc1I Amb8397124 [0,2,0,0,0,0|1,0,0]=3 5929 B9R1.69 Nc1cc(F)ccc1O Amb2684424 [0,2,0,0,0,0|0,0,0]=2 5930 B9R1.69 Nc1cc(F)ccc1S Amb8929753 [0,2,0,0,0,0|0,1,0]=3 5931 B9R1.69 Nc1cc(F)cnc1Br Amb8392981 [0,2,0,0,0,0|2,0,0]=4 5932 B9R1.69 Nc1cc(F)cnc1Cl Amb10602215 [0,2,0,0,0,0|2,0,0]=4 5933 B9R1.69 Nc1cc(F)cnc1Cl Amb33742279 [0,2,0,0,0,0|2,0,0]=4 5934 B9R1.69 Nc1cc(F)cnc1F Amb27478359 [0,2,0,0,0,0|2,0,0]=4 5935 B9R1.69 Nc1cc(F)cnc1I Amb24501487 [0,2,0,0,0,0|2,0,0]=4 5936 B9R1.69 Nc1cc(F)cnc1N Amb8396952 [0,2,0,0,0,0|2,0,0]=4 5937 B9R1.69 Nc1cc(F)cnc1O Amb18832648 [0,2,0,0,0,0|1,0,0]=3 5938 B9R1.69 Nc1cc(F)cnc1S Amb27621197 [0,2,0,0,0,0|1,1,0]=4 5939 B9R1.69 Nc1cc(F)ncc1Br Amb22292234 [0,2,0,0,0,0|2,0,0]=4 5940 B9R1.69 Nc1cc(F)ncc1Br Amb33295205 [0,2,0,0,0,0|2,0,0]=4 5941 B9R1.69 Nc1cc(F)ncc1Cl Amb24417780 [0,2,0,0,0,0|2,0,0]=4 5942 B9R1.69 Nc1cc(F)ncc1F Amb22749303 [0,2,0,0,0,0|2,0,0]=4 5943 B9R1.69 Nc1cc(F)ncc1I Amb25970815 [0,2,0,0,0,0|2,0,0]=4 5944 B9R1.69 Nc1cc(F)ncc1O Amb27847531 [0,2,0,0,0,0|1,0,0]=3 5945 B9R1.69 Nc1cc(I)c(Br)cn1 Amb26381258 [0,2,0,0,0,0|2,0,0]=4 5946 B9R1.69 Nc1cc(I)c(Cl)cn1 Amb24055057 [0,2,0,0,0,0|2,0,0]=4 5947 B9R1.69 Nc1cc(I)c(F)cn1 Amb25228101 [0,2,0,0,0,0|2,0,0]=4 5948 B9R1.69 Nc1cc(I)c(I)cn1 Amb22495045 [0,2,0,0,0,0|2,0,0]=4 5949 B9R1.69 Nc1cc(I)ccc1Br Amb13952846 [0,2,0,0,0,0|1,0,0]=3 5950 B9R1.69 Nc1cc(I)ccc1Cl Amb7970243 [0,2,0,0,0,0|1,0,0]=3 5951 B9R1.69 Nc1cc(I)ccc1F Amb10840811 [0,2,0,0,0,0|1,0,0]=3 5952 B9R1.69 Nc1cc(I)ccc1I Amb24321151 [0,2,0,0,0,0|1,0,0]=3 5953 B9R1.69 Nc1cc(I)ccc1O Amb13952862 [0,2,0,0,0,0|0,0,0]=2 5954 B9R1.69 Nc1cc(I)cnc1Cl Amb2695566 [0,2,0,0,0,0|2,0,0]=4 5955 B9R1.69 Nc1cc(I)cnc1F Amb28208567 [0,2,0,0,0,0|2,0,0]=4 5956 B9R1.69 Nc1cc(I)cnc1I Amb27967456 [0,2,0,0,0,0|2,0,0]=4 5957 B9R1.69 Nc1cc(I)cnc1N Amb6751897 [0,2,0,0,0,0|2,0,0]=4 5958 B9R1.69 Nc1cc(I)cnc1O Amb22057599 [0,2,0,0,0,0|1,0,0]=3 5959 B9R1.69 Nc1cc(I)ncc1Br Amb24505518 [0,2,0,0,0,0|2,0,0]=4 5960 B9R1.69 Nc1cc(I)ncc1Cl Amb28251369 [0,2,0,0,0,0|2,0,0]=4 5961 B9R1.69 Nc1cc(I)ncc1F Amb28071246 [0,2,0,0,0,0|2,0,0]=4 5962 B9R1.69 Nc1cc(I)ncc1I Amb26617804 [0,2,0,0,0,0|2,0,0]=4 5963 B9R1.69 Nc1cc(N)c(Br)cn1 Amb19959246 [0,2,0,0,0,0|2,0,0]=4 5964 B9R1.69 Nc1cc(N)c(F)cn1 Amb25700439 [0,2,0,0,0,0|2,0,0]=4 5965 B9R1.69 Nc1cc(N)c(N)cn1 Amb10602525 [0,2,0,0,0,0|2,0,0]=4 5966 B9R1.69 Nc1cc(O)c(Br)cn1 Amb28250098 [0,2,0,0,0,0|1,0,0]=3 5967 B9R1.69 Nc1cc(O)c(Cl)cn1 Amb19149031 [0,2,0,0,0,0|1,0,0]=3 5968 B9R1.69 Nc1cc(O)c(F)cn1 Amb25348794 [0,2,0,0,0,0|1,0,0]=3 5969 B9R1.69 Nc1cc(O)c(I)cn1 Amb25185366 [0,2,0,0,0,0|1,0,0]=3 5970 B9R1.69 Nc1cc(O)ccc1Br Amb6298305 [0,2,0,0,0,0|0,0,0]=2 5971 B9R1.69 Nc1cc(O)ccc1Cl Amb8393748 [0,2,0,0,0,0|0,0,0]=2 5972 B9R1.69 Nc1cc(O)ccc1F Amb7172534 [0,2,0,0,0,0|0,0,0]=2 5973 B9R1.69 Nc1cc(O)cnc1Br Amb24505214 [0,2,0,0,0,0|1,0,0]=3 5974 B9R1.69 Nc1cc(O)cnc1Cl Amb27214185 [0,2,0,0,0,0|1,0,0]=3 5975 B9R1.69 Nc1cc(O)cnc1N Amb23437252 [0,2,0,0,0,0|1,0,0]=3 5976 B9R1.69 Nc1cc(O)ncc1Cl Amb27795514 [0,2,0,0,0,0|1,0,0]=3 5977 B9R1.69 Nc1cc(S)ccc1Cl Amb25950100 [0,2,0,0,0,0|0,1,0]=3 5978 B9R1.69 Nc1cc(S)ccc1F Amb26502210 [0,2,0,0,0,0|0,1,0]=3 5979 B9R1.69 Nc1cc(S)ccc1I Amb26394499 [0,2,0,0,0,0|0,1,0]=3 5980 B9R1.69 Nc1cc(S)ccc1S Amb26515920 [0,2,0,0,0,0|0,1,0]=3 5981 B9R1.69 Nc1cc(S)cnc1N Amb17593574 [0,2,0,0,0,0|1,1,0]=4 5982 B9R1.69 Nc1cc[n+]([O-])c(Cl)c1 Amb28064431 [0,2,0,0,0,0|1,0,1]=4 5983 B9R1.69 Nc1cc[n+]([O-])cc1Cl Amb24563516 [0,2,0,0,0,0|1,0,1]=4 5984 B9R1.69 Nc1cc[n+]([O-])cc1N Amb27259067 [0,2,0,0,0,0|1,0,1]=4 5985 B9R1.69 Nc1ccc(Br)c(Br)c1 Amb4009337 [0,2,0,0,0,0|1,0,0]=3 5986 B9R1.69 Nc1ccc(Br)c(Br)n1 Amb20240685 [0,2,0,0,0,0|2,0,0]=4 5987 B9R1.69 Nc1ccc(Br)c(Cl)c1 Amb2684985 [0,2,0,0,0,0|1,0,0]=3 5988 B9R1.69 Nc1ccc(Br)c(Cl)n1 Amb20620202 [0,2,0,0,0,0|2,0,0]=4 5989 B9R1.69 Nc1ccc(Br)c(F)c1 Amb2614457 [0,2,0,0,0,0|1,0,0]=3 5990 B9R1.69 Nc1ccc(Br)c(F)n1 Amb20241778 [0,2,0,0,0,0|2,0,0]=4 5991 B9R1.69 Nc1ccc(Br)c(I)c1 Amb13952849 [0,2,0,0,0,0|1,0,0]=3 5992 B9R1.69 Nc1ccc(Br)c(I)n1 Amb13883472 [0,2,0,0,0,0|2,0,0]=4 5993 B9R1.69 Nc1ccc(Br)c(N)c1 Amb17594844 [0,2,0,0,0,0|1,0,0]=3 5994 B9R1.69 Nc1ccc(Br)c(N)n1 Amb2567499 [0,2,0,0,0,0|2,0,0]=4 5995 B9R1.69 Nc1ccc(Br)c(O)c1 Amb8439592 [0,2,0,0,0,0|0,0,0]=2 5996 B9R1.69 Nc1ccc(Br)c(O)n1 Amb2795424 [0,2,0,0,0,0|1,0,0]=3 5997 B9R1.69 Nc1ccc(Br)c(S)c1 Amb26630344 [0,2,0,0,0,0|0,1,0]=3 5998 B9R1.69 Nc1ccc(Br)cc1Br Amb1158880 [0,2,0,0,0,0|1,0,0]=3 5999 B9R1.69 Nc1ccc(Br)cc1Cl Amb1159078 [0,2,0,0,0,0|1,0,0]=3 6000 B9R1.69 Nc1ccc(Br)cc1Cl Amb32510264 [0,2,0,0,0,0|1,0,0]=3 6001 B9R1.69 Nc1ccc(Br)cc1F Amb10840317 [0,2,0,0,0,0|1,0,0]=3 6002 B9R1.69 Nc1ccc(Br)cc1F Amb2685174 [0,2,0,0,0,0|1,0,0]=3 6003 B9R1.69 Nc1ccc(Br)cc1F Amb2685176 [0,2,0,0,0,0|1,0,0]=3 6004 B9R1.69 Nc1ccc(Br)cc1I Amb1790056 [0,2,0,0,0,0|1,0,0]=3 6005 B9R1.69 Nc1ccc(Br)cc1N Amb33529818 [0,2,0,0,0,0|1,0,0]=3 6006 B9R1.69 Nc1ccc(Br)cc1O Amb7969648 [0,2,0,0,0,0|0,0,0]=2 6007 B9R1.69 Nc1ccc(Br)cc1S Amb33140965 [0,2,0,0,0,0|0,1,0]=3 6008 B9R1.69 Nc1ccc(Br)cc1S Amb8440571 [0,2,0,0,0,0|0,1,0]=3 6009 B9R1.69 Nc1ccc(Br)nc1Br Amb2234750 [0,2,0,0,0,0|2,0,0]=4 6010 B9R1.69 Nc1ccc(Br)nc1Cl Amb2568499 [0,2,0,0,0,0|2,0,0]=4 6011 B9R1.69 Nc1ccc(Br)nc1F Amb20671012 [0,2,0,0,0,0|2,0,0]=4 6012 B9R1.69 Nc1ccc(Br)nc1I Amb21857953 [0,2,0,0,0,0|2,0,0]=4 6013 B9R1.69 Nc1ccc(Br)nc1N Amb19958914 [0,2,0,0,0,0|2,0,0]=4 6014 B9R1.69 Nc1ccc(Br)nc1N Amb32662652 [0,2,0,0,0,0|2,0,0]=4 6015 B9R1.69 Nc1ccc(Br)nc1O Amb21937109 [0,2,0,0,0,0|1,0,0]=3 6016 B9R1.69 Nc1ccc(Br)nc1S Amb27481205 [0,2,0,0,0,0|1,1,0]=4 6017 B9R1.69 Nc1ccc(Cl)c(Br)c1 Amb4451097 [0,2,0,0,0,0|1,0,0]=3 6018 B9R1.69 Nc1ccc(Cl)c(Br)n1 Amb21857946 [0,2,0,0,0,0|2,0,0]=4 6019 B9R1.69 Nc1ccc(Cl)c(Cl)c1 Amb1151955 [0,2,0,0,0,0|1,0,0]=3 6020 B9R1.69 Nc1ccc(Cl)c(Cl)n1 Amb21963420 [0,2,0,0,0,0|2,0,0]=4 6021 B9R1.69 Nc1ccc(Cl)c(F)c1 Amb2685925 [0,2,0,0,0,0|1,0,0]=3 6022 B9R1.69 Nc1ccc(Cl)c(F)n1 Amb24408862 [0,2,0,0,0,0|2,0,0]=4 6023 B9R1.69 Nc1ccc(Cl)c(I)c1 Amb22008394 [0,2,0,0,0,0|1,0,0]=3 6024 B9R1.69 Nc1ccc(Cl)c(I)n1 Amb25863735 [0,2,0,0,0,0|2,0,0]=4 6025 B9R1.69 Nc1ccc(Cl)c(N)c1 Amb32867937 [0,2,0,0,0,0|1,0,0]=3 6026 B9R1.69 Nc1ccc(Cl)c(N)c1 Amb4036346 [0,2,0,0,0,0|1,0,0]=3 6027 B9R1.69 Nc1ccc(Cl)c(N)n1 Amb4016413 [0,2,0,0,0,0|2,0,0]=4 6028 B9R1.69 Nc1ccc(Cl)c(O)c1 Amb8389303 [0,2,0,0,0,0|0,0,0]=2 6029 B9R1.69 Nc1ccc(Cl)c(S)c1 Amb18126223 [0,2,0,0,0,0|0,1,0]=3 6030 B9R1.69 Nc1ccc(Cl)cc1Br Amb3939780 [0,2,0,0,0,0|1,0,0]=3 6031 B9R1.69 Nc1ccc(Cl)cc1Cl Amb2686786 [0,2,0,0,0,0|1,0,0]=3 6032 B9R1.69 Nc1ccc(Cl)cc1F Amb2685924 [0,2,0,0,0,0|1,0,0]=3 6033 B9R1.69 Nc1ccc(Cl)cc1I Amb2686126 [0,2,0,0,0,0|1,0,0]=3 6034 B9R1.69 Nc1ccc(Cl)cc1I Amb32411741 [0,2,0,0,0,0|1,0,0]=3 6035 B9R1.69 Nc1ccc(Cl)cc1N Amb2721563 [0,2,0,0,0,0|1,0,0]=3 6036 B9R1.69 Nc1ccc(Cl)cc1O Amb2720297 [0,2,0,0,0,0|0,0,0]=2 6037 B9R1.69 Nc1ccc(Cl)cc1S Amb8426390 [0,2,0,0,0,0|0,1,0]=3 6038 B9R1.69 Nc1ccc(Cl)nc1Br Amb21961134 [0,2,0,0,0,0|2,0,0]=4 6039 B9R1.69 Nc1ccc(Cl)nc1Cl Amb2609919 [0,2,0,0,0,0|2,0,0]=4 6040 B9R1.69 Nc1ccc(Cl)nc1F Amb23412160 [0,2,0,0,0,0|2,0,0]=4 6041 B9R1.69 Nc1ccc(Cl)nc1I Amb17621791 [0,2,0,0,0,0|2,0,0]=4 6042 B9R1.69 Nc1ccc(Cl)nc1N Amb13951505 [0,2,0,0,0,0|2,0,0]=4 6043 B9R1.69 Nc1ccc(Cl)nc1O Amb25760689 [0,2,0,0,0,0|1,0,0]=3 6044 B9R1.69 Nc1ccc(Cl)nc1S Amb18126268 [0,2,0,0,0,0|1,1,0]=4 6045 B9R1.69 Nc1ccc(F)c(Br)c1 Amb1091973 [0,2,0,0,0,0|1,0,0]=3 6046 B9R1.69 Nc1ccc(F)c(Br)c1 Amb16185880 [0,2,0,0,0,0|1,0,0]=3 6047 B9R1.69 Nc1ccc(F)c(Br)n1 Amb27180364 [0,2,0,0,0,0|2,0,0]=4 6048 B9R1.69 Nc1ccc(F)c(Cl)c1 Amb2685923 [0,2,0,0,0,0|1,0,0]=3 6049 B9R1.69 Nc1ccc(F)c(Cl)n1 Amb18644302 [0,2,0,0,0,0|2,0,0]=4 6050 B9R1.69 Nc1ccc(F)c(F)c1 Amb535731 [0,2,0,0,0,0|1,0,0]=3 6051 B9R1.69 Nc1ccc(F)c(F)n1 Amb28139624 [0,2,0,0,0,0|2,0,0]=4 6052 B9R1.69 Nc1ccc(F)c(I)c1 Amb22735594 [0,2,0,0,0,0|1,0,0]=3 6053 B9R1.69 Nc1ccc(F)c(I)n1 Amb26559202 [0,2,0,0,0,0|2,0,0]=4 6054 B9R1.69 Nc1ccc(F)c(N)c1 Amb10840194 [0,2,0,0,0,0|1,0,0]=3 6055 B9R1.69 Nc1ccc(F)c(N)c1 Amb5491600 [0,2,0,0,0,0|1,0,0]=3 6056 B9R1.69 Nc1ccc(F)c(N)n1 Amb21964883 [0,2,0,0,0,0|2,0,0]=4 6057 B9R1.69 Nc1ccc(F)c(O)c1 Amb33544596 [0,2,0,0,0,0|0,0,0]=2 6058 B9R1.69 Nc1ccc(F)cc1Br Amb10840316 [0,2,0,0,0,0|1,0,0]=3 6059 B9R1.69 Nc1ccc(F)cc1Br Amb2685172 [0,2,0,0,0,0|1,0,0]=3 6060 B9R1.69 Nc1ccc(F)cc1Cl Amb2685920 [0,2,0,0,0,0|1,0,0]=3 6061 B9R1.69 Nc1ccc(F)cc1F Amb2687037 [0,2,0,0,0,0|1,0,0]=3 6062 B9R1.69 Nc1ccc(F)cc1I Amb845605 [0,2,0,0,0,0|1,0,0]=3 6063 B9R1.69 Nc1ccc(F)cc1N Amb2686696 [0,2,0,0,0,0|1,0,0]=3 6064 B9R1.69 Nc1ccc(F)cc1O Amb6297483 [0,2,0,0,0,0|0,0,0]=2 6065 B9R1.69 Nc1ccc(F)cc1S Amb33530329 [0,2,0,0,0,0|0,1,0]=3 6066 B9R1.69 Nc1ccc(F)nc1Br Amb19516428 [0,2,0,0,0,0|2,0,0]=4 6067 B9R1.69 Nc1ccc(F)nc1Cl Amb24055330 [0,2,0,0,0,0|2,0,0]=4 6068 B9R1.69 Nc1ccc(F)nc1F Amb21857831 [0,2,0,0,0,0|2,0,0]=4 6069 B9R1.69 Nc1ccc(F)nc1I Amb19516479 [0,2,0,0,0,0|2,0,0]=4 6070 B9R1.69 Nc1ccc(F)nc1N Amb18642492 [0,2,0,0,0,0|2,0,0]=4 6071 B9R1.69 Nc1ccc(F)nc1O Amb26396043 [0,2,0,0,0,0|1,0,0]=3 6072 B9R1.69 Nc1ccc(I)c(Br)c1 Amb13952848 [0,2,0,0,0,0|1,0,0]=3 6073 B9R1.69 Nc1ccc(I)c(Br)n1 Amb25826062 [0,2,0,0,0,0|2,0,0]=4 6074 B9R1.69 Nc1ccc(I)c(Cl)c1 Amb2725389 [0,2,0,0,0,0|1,0,0]=3 6075 B9R1.69 Nc1ccc(I)c(Cl)n1 Amb21857664 [0,2,0,0,0,0|2,0,0]=4 6076 B9R1.69 Nc1ccc(I)c(F)c1 Amb8628750 [0,2,0,0,0,0|1,0,0]=3 6077 B9R1.69 Nc1ccc(I)c(F)n1 Amb8392716 [0,2,0,0,0,0|2,0,0]=4 6078 B9R1.69 Nc1ccc(I)c(I)c1 Amb24478807 [0,2,0,0,0,0|1,0,0]=3 6079 B9R1.69 Nc1ccc(I)c(I)n1 Amb27846994 [0,2,0,0,0,0|2,0,0]=4 6080 B9R1.69 Nc1ccc(I)c(N)c1 Amb24756504 [0,2,0,0,0,0|1,0,0]=3 6081 B9R1.69 Nc1ccc(I)c(N)n1 Amb6308692 [0,2,0,0,0,0|2,0,0]=4 6082 B9R1.69 Nc1ccc(I)c(O)c1 Amb28186479 [0,2,0,0,0,0|0,0,0]=2 6083 B9R1.69 Nc1ccc(I)c(S)c1 Amb27812900 [0,2,0,0,0,0|0,1,0]=3 6084 B9R1.69 Nc1ccc(I)cc1Br Amb13952845 [0,2,0,0,0,0|1,0,0]=3 6085 B9R1.69 Nc1ccc(I)cc1Cl Amb2686125 [0,2,0,0,0,0|1,0,0]=3 6086 B9R1.69 Nc1ccc(I)cc1F Amb2688120 [0,2,0,0,0,0|1,0,0]=3 6087 B9R1.69 Nc1ccc(I)cc1I Amb2687310 [0,2,0,0,0,0|1,0,0]=3 6088 B9R1.69 Nc1ccc(I)cc1N Amb10601895 [0,2,0,0,0,0|1,0,0]=3 6089 B9R1.69 Nc1ccc(I)cc1O Amb13952881 [0,2,0,0,0,0|0,0,0]=2 6090 B9R1.69 Nc1ccc(I)cc1S Amb18274035 [0,2,0,0,0,0|0,1,0]=3 6091 B9R1.69 Nc1ccc(I)nc1Cl Amb13889798 [0,2,0,0,0,0|2,0,0]=4 6092 B9R1.69 Nc1ccc(I)nc1F Amb23401534 [0,2,0,0,0,0|2,0,0]=4 6093 B9R1.69 Nc1ccc(I)nc1I Amb2609503 [0,2,0,0,0,0|2,0,0]=4 6094 B9R1.69 Nc1ccc(I)nc1N Amb25377699 [0,2,0,0,0,0|2,0,0]=4 6095 B9R1.69 Nc1ccc(N)c(Br)c1 Amb2696017 [0,2,0,0,0,0|1,0,0]=3 6096 B9R1.69 Nc1ccc(N)c(Br)n1 Amb22497830 [0,2,0,0,0,0|2,0,0]=4 6097 B9R1.69 Nc1ccc(N)c(Cl)c1 Amb2696088 [0,2,0,0,0,0|1,0,0]=3 6098 B9R1.69 Nc1ccc(N)c(Cl)c1 Amb6609041 [0,2,0,0,0,0|1,0,0]=3 6099 B9R1.69 Nc1ccc(N)c(Cl)n1 Amb26390722 [0,2,0,0,0,0|2,0,0]=4 6100 B9R1.69 Nc1ccc(N)c(F)c1 Amb9214581 [0,2,0,0,0,0|1,0,0]=3 6101 B9R1.69 Nc1ccc(N)c(F)n1 Amb27963047 [0,2,0,0,0,0|2,0,0]=4 6102 B9R1.69 Nc1ccc(N)c(I)c1 Amb5559264 [0,2,0,0,0,0|1,0,0]=3 6103 B9R1.69 Nc1ccc(N)c(N)c1 Amb1042161 [0,2,0,0,0,0|1,0,0]=3 6104 B9R1.69 Nc1ccc(N)c(N)c1 Amb6336577 [0,2,0,0,0,0|1,0,0]=3 6105 B9R1.69 Nc1ccc(N)c(N)n1 Amb1102468 [0,2,0,0,0,0|2,0,0]=4 6106 B9R1.69 Nc1ccc(N)c(N)n1 Amb22284151 [0,2,0,0,0,0|2,0,0]=4 6107 B9R1.69 Nc1ccc(N)c(O)c1 Amb18642178 [0,2,0,0,0,0|0,0,0]=2 6108 B9R1.69 Nc1ccc(O)[n+]([O-])c1 Amb27862914 [0,2,0,0,0,0|1,0,0]=3 6109 B9R1.69 Nc1ccc(O)c(Br)c1 Amb10766384 [0,2,0,0,0,0|0,0,0]=2 6110 B9R1.69 Nc1ccc(O)c(Br)n1 Amb22754694 [0,2,0,0,0,0|1,0,0]=3 6111 B9R1.69 Nc1ccc(O)c(Cl)c1 Amb2720296 [0,2,0,0,0,0|0,0,0]=2 6112 B9R1.69 Nc1ccc(O)c(Cl)n1 Amb25862587 [0,2,0,0,0,0|1,0,0]=3 6113 B9R1.69 Nc1ccc(O)c(F)c1 Amb2684425 [0,2,0,0,0,0|0,0,0]=2 6114 B9R1.69 Nc1ccc(O)c(F)n1 Amb24626911 [0,2,0,0,0,0|1,0,0]=3 6115 B9R1.69 Nc1ccc(O)c(I)c1 Amb20622256 [0,2,0,0,0,0|0,0,0]=2 6116 B9R1.69 Nc1ccc(O)c(I)n1 Amb27438439 [0,2,0,0,0,0|1,0,0]=3 6117 B9R1.69 Nc1ccc(O)c(N)c1 Amb17593274 [0,2,0,0,0,0|0,0,0]=2 6118 B9R1.69 Nc1ccc(O)c(N)c1 Amb21858521 [0,2,0,0,0,0|0,0,0]=2 6119 B9R1.69 Nc1ccc(O)c(N)c1 Amb6365865 [0,2,0,0,0,0|0,0,0]=2 6120 B9R1.69 Nc1ccc(O)c(O)c1 Amb22284780 [0,2,0,0,0,0|0,0,0]=2 6121 B9R1.69 Nc1ccc(O)c(O)c1 Amb2612383 [0,2,0,0,0,0|0,0,0]=2 6122 B9R1.69 Nc1ccc(O)c(O)c1 Amb2695996 [0,2,0,0,0,0|0,0,0]=2 6123 B9R1.69 Nc1ccc(O)c(S)c1 Amb24462450 [0,2,0,0,0,0|0,0,0]=2 6124 B9R1.69 Nc1ccc(O)cc1Br Amb8439593 [0,2,0,0,0,0|0,0,0]=2 6125 B9R1.69 Nc1ccc(O)cc1Cl Amb2720182 [0,2,0,0,0,0|0,0,0]=2 6126 B9R1.69 Nc1ccc(O)cc1Cl Amb33548106 [0,2,0,0,0,0|0,0,0]=2 6127 B9R1.69 Nc1ccc(O)cc1F Amb2684426 [0,2,0,0,0,0|0,0,0]=2 6128 B9R1.69 Nc1ccc(O)cc1F Amb33717235 [0,2,0,0,0,0|0,0,0]=2 6129 B9R1.69 Nc1ccc(O)cc1F Amb8629991 [0,2,0,0,0,0|0,0,0]=2 6130 B9R1.69 Nc1ccc(O)cc1I Amb28555354 [0,2,0,0,0,0|0,0,0]=2 6131 B9R1.69 Nc1ccc(O)cc1N Amb30585167 [0,2,0,0,0,0|0,0,0]=2 6132 B9R1.69 Nc1ccc(O)cc1N Amb5544650 [0,2,0,0,0,0|0,0,0]=2 6133 B9R1.69 Nc1ccc(O)cc1O Amb18553675 [0,2,0,0,0,0|0,0,0]=2 6134 B9R1.69 Nc1ccc(O)cc1O Amb21858039 [0,2,0,0,0,0|0,0,0]=2 6135 B9R1.69 Nc1ccc(O)nc1Br Amb25118858 [0,2,0,0,0,0|1,0,0]=3 6136 B9R1.69 Nc1ccc(O)nc1Cl Amb24606723 [0,2,0,0,0,0|1,0,0]=3 6137 B9R1.69 Nc1ccc(O)nc1N Amb24550970 [0,2,0,0,0,0|1,0,0]=3 6138 B9R1.69 Nc1ccc(O)nc1O Amb27404408 [0,2,0,0,0,0|1,0,0]=3 6139 B9R1.69 Nc1ccc(S)c(Br)c1 Amb18276709 [0,2,0,0,0,0|0,1,0]=3 6140 B9R1.69 Nc1ccc(S)c(Cl)c1 Amb8929757 [0,2,0,0,0,0|0,1,0]=3 6141 B9R1.69 Nc1ccc(S)c(F)c1 Amb8929751 [0,2,0,0,0,0|0,1,0]=3 6142 B9R1.69 Nc1ccc(S)c(N)c1 Amb25739099 [0,2,0,0,0,0|0,1,0]=3 6143 B9R1.69 Nc1ccc(S)c(O)c1 Amb27838613 [0,2,0,0,0,0|0,0,0]=2 6144 B9R1.69 Nc1ccc(S)cc1Br Amb25770571 [0,2,0,0,0,0|0,1,0]=3 6145 B9R1.69 Nc1ccc(S)cc1Cl Amb24593336 [0,2,0,0,0,0|0,1,0]=3 6146 B9R1.69 Nc1ccc(S)cc1F Amb6751939 [0,2,0,0,0,0|0,1,0]=3 6147 B9R1.69 Nc1ccc(S)cc1I Amb25315376 [0,2,0,0,0,0|0,1,0]=3 6148 B9R1.69 Nc1ccc(S)cc1O Amb28314824 [0,2,0,0,0,0|0,0,0]=2 6149 B9R1.69 Nc1cnc(Br)c(Br)c1 Amb19958109 [0,2,0,0,0,0|2,0,0]=4 6150 B9R1.69 Nc1cnc(Br)c(Cl)c1 Amb16233986 [0,2,0,0,0,0|2,0,0]=4 6151 B9R1.69 Nc1cnc(Br)c(F)c1 Amb25121516 [0,2,0,0,0,0|2,0,0]=4 6152 B9R1.69 Nc1cnc(Br)c(I)c1 Amb19958122 [0,2,0,0,0,0|2,0,0]=4 6153 B9R1.69 Nc1cnc(Br)cc1Br Amb2615410 [0,2,0,0,0,0|2,0,0]=4 6154 B9R1.69 Nc1cnc(Br)cc1Cl Amb26965705 [0,2,0,0,0,0|2,0,0]=4 6155 B9R1.69 Nc1cnc(Br)cc1F Amb27461276 [0,2,0,0,0,0|2,0,0]=4 6156 B9R1.69 Nc1cnc(Br)cc1N Amb20247820 [0,2,0,0,0,0|2,0,0]=4 6157 B9R1.69 Nc1cnc(Br)cc1O Amb26908618 [0,2,0,0,0,0|1,0,0]=3 6158 B9R1.69 Nc1cnc(Cl)c(Br)c1 Amb8392979 [0,2,0,0,0,0|2,0,0]=4 6159 B9R1.69 Nc1cnc(Cl)c(Cl)c1 Amb8396912 [0,2,0,0,0,0|2,0,0]=4 6160 B9R1.69 Nc1cnc(Cl)c(F)c1 Amb19516237 [0,2,0,0,0,0|2,0,0]=4 6161 B9R1.69 Nc1cnc(Cl)c(N)c1 Amb8630409 [0,2,0,0,0,0|2,0,0]=4 6162 B9R1.69 Nc1cnc(Cl)c(O)c1 Amb18831480 [0,2,0,0,0,0|1,0,0]=3 6163 B9R1.69 Nc1cnc(Cl)cc1Br Amb27849263 [0,2,0,0,0,0|2,0,0]=4 6164 B9R1.69 Nc1cnc(Cl)cc1Cl Amb10576586 [0,2,0,0,0,0|2,0,0]=4 6165 B9R1.69 Nc1cnc(Cl)cc1Cl Amb19943952 [0,2,0,0,0,0|2,0,0]=4 6166 B9R1.69 Nc1cnc(Cl)cc1F Amb24607288 [0,2,0,0,0,0|2,0,0]=4 6167 B9R1.69 Nc1cnc(Cl)cc1I Amb21858267 [0,2,0,0,0,0|2,0,0]=4 6168 B9R1.69 Nc1cnc(Cl)cc1N Amb10576228 [0,2,0,0,0,0|2,0,0]=4 6169 B9R1.69 Nc1cnc(Cl)cc1N Amb2609511 [0,2,0,0,0,0|2,0,0]=4 6170 B9R1.69 Nc1cnc(Cl)cc1O Amb19515811 [0,2,0,0,0,0|1,0,0]=3 6171 B9R1.69 Nc1cnc(Cl)cc1O Amb32409604 [0,2,0,0,0,0|1,0,0]=3 6172 B9R1.69 Nc1cnc(Cl)nc1O Amb25871375 [0,2,0,0,0,0|2,0,0]=4 6173 B9R1.69 Nc1cnc(F)c(Br)c1 Amb10602825 [0,2,0,0,0,0|2,0,0]=4 6174 B9R1.69 Nc1cnc(F)c(Cl)c1 Amb26626748 [0,2,0,0,0,0|2,0,0]=4 6175 B9R1.69 Nc1cnc(F)c(F)c1 Amb25856361 [0,2,0,0,0,0|2,0,0]=4 6176 B9R1.69 Nc1cnc(F)c(I)c1 Amb24615014 [0,2,0,0,0,0|2,0,0]=4 6177 B9R1.69 Nc1cnc(F)c(O)c1 Amb25766377 [0,2,0,0,0,0|1,0,0]=3 6178 B9R1.69 Nc1cnc(F)cc1Br Amb27238940 [0,2,0,0,0,0|2,0,0]=4 6179 B9R1.69 Nc1cnc(F)cc1Cl Amb27449129 [0,2,0,0,0,0|2,0,0]=4 6180 B9R1.69 Nc1cnc(F)cc1F Amb22495149 [0,2,0,0,0,0|2,0,0]=4 6181 B9R1.69 Nc1cnc(F)cc1I Amb25207925 [0,2,0,0,0,0|2,0,0]=4 6182 B9R1.69 Nc1cnc(F)cc1N Amb18642491 [0,2,0,0,0,0|2,0,0]=4 6183 B9R1.69 Nc1cnc(F)nc1O Amb33035379 [0,2,0,0,0,0|2,0,0]=4 6184 B9R1.69 Nc1cnc(I)c(Br)c1 Amb25789095 [0,2,0,0,0,0|2,0,0]=4 6185 B9R1.69 Nc1cnc(I)c(Cl)c1 Amb28422578 [0,2,0,0,0,0|2,0,0]=4 6186 B9R1.69 Nc1cnc(I)c(I)c1 Amb24482011 [0,2,0,0,0,0|2,0,0]=4 6187 B9R1.69 Nc1cnc(I)cc1Cl Amb27443095 [0,2,0,0,0,0|2,0,0]=4 6188 B9R1.69 Nc1cnc(I)cc1F Amb25300740 [0,2,0,0,0,0|2,0,0]=4 6189 B9R1.69 Nc1cnc(I)cc1I Amb25217670 [0,2,0,0,0,0|2,0,0]=4 6190 B9R1.69 Nc1cnc(N)c(Br)c1 Amb6365660 [0,2,0,0,0,0|2,0,0]=4 6191 B9R1.69 Nc1cnc(N)c(Cl)c1 Amb22900096 [0,2,0,0,0,0|2,0,0]=4 6192 B9R1.69 Nc1cnc(N)c(I)c1 Amb22047475 [0,2,0,0,0,0|2,0,0]=4 6193 B9R1.69 Nc1cnc(N)c(N)c1 Amb8386697 [0,2,0,0,0,0|2,0,0]=4 6194 B9R1.69 Nc1cnc(N)c(O)c1 Amb23437248 [0,2,0,0,0,0|1,0,0]=3 6195 B9R1.69 Nc1cnc(O)c(Cl)c1 Amb22493829 [0,2,0,0,0,0|1,0,0]=3 6196 B9R1.69 Nc1cnc(O)c(F)c1 Amb27469882 [0,2,0,0,0,0|1,0,0]=3 6197 B9R1.69 Nc1cnc(O)c(I)c1 Amb24518501 [0,2,0,0,0,0|1,0,0]=3 6198 B9R1.69 Nc1cnc(O)c(N)c1 Amb20242815 [0,2,0,0,0,0|1,0,0]=3 6199 B9R1.69 Nc1cnc(O)cc1Br Amb26380955 [0,2,0,0,0,0|1,0,0]=3 6200 B9R1.69 Nc1cnc(O)cc1Cl Amb27628390 [0,2,0,0,0,0|1,0,0]=3 6201 B9R1.69 Nc1cnc(O)cc1F Amb26567590 [0,2,0,0,0,0|1,0,0]=3 6202 B9R1.69 Nc1cnc(O)cc1N Amb24680986 [0,2,0,0,0,0|1,0,0]=3 6203 B9R1.69 Nc1cnc(S)c(Br)c1 Amb27633780 [0,2,0,0,0,0|1,1,0]=4 6204 B9R1.69 Nc1cnc(S)c(Cl)c1 Amb27602121 [0,2,0,0,0,0|1,1,0]=4 6205 B9R1.69 Nc1nc(Br)ccc1Br Amb20075681 [0,2,0,0,0,0|2,0,0]=4 6206 B9R1.69 Nc1nc(Br)ccc1Cl Amb22756081 [0,2,0,0,0,0|2,0,0]=4 6207 B9R1.69 Nc1nc(Br)ccc1F Amb28400378 [0,2,0,0,0,0|2,0,0]=4 6208 B9R1.69 Nc1nc(Br)ccc1O Amb21864649 [0,2,0,0,0,0|1,0,0]=3 6209 B9R1.69 Nc1nc(Cl)ccc1Br Amb19959877 [0,2,0,0,0,0|2,0,0]=4 6210 B9R1.69 Nc1nc(Cl)ccc1Cl Amb1775832 [0,2,0,0,0,0|2,0,0]=4 6211 B9R1.69 Nc1nc(Cl)ccc1Cl Amb33339015 [0,2,0,0,0,0|2,0,0]=4 6212 B9R1.69 Nc1nc(Cl)ccc1F Amb20668110 [0,2,0,0,0,0|2,0,0]=4 6213 B9R1.69 Nc1nc(Cl)ccc1I Amb19958904 [0,2,0,0,0,0|2,0,0]=4 6214 B9R1.69 Nc1nc(Cl)ccc1O Amb27859920 [0,2,0,0,0,0|1,0,0]=3 6215 B9R1.69 Nc1nc(Cl)cnc1O Amb25132187 [0,2,0,0,0,0|2,0,0]=4 6216 B9R1.69 Nc1nc(Cl)ncc1O Amb26515948 [0,2,0,0,0,0|2,0,0]=4 6217 B9R1.69 Nc1nc(F)ccc1Br Amb22546755 [0,2,0,0,0,0|2,0,0]=4 6218 B9R1.69 Nc1nc(F)ccc1Cl Amb22547055 [0,2,0,0,0,0|2,0,0]=4 6219 B9R1.69 Nc1nc(F)ccc1F Amb22749397 [0,2,0,0,0,0|2,0,0]=4 6220 B9R1.69 Nc1nc(F)ccc1I Amb26554424 [0,2,0,0,0,0|2,0,0]=4 6221 B9R1.69 Nc1nc(F)ccc1O Amb28434332 [0,2,0,0,0,0|1,0,0]=3 6222 B9R1.69 Nc1nc(I)ccc1Br Amb25376809 [0,2,0,0,0,0|2,0,0]=4 6223 B9R1.69 Nc1nc(I)ccc1Cl Amb26448927 [0,2,0,0,0,0|2,0,0]=4 6224 B9R1.69 Nc1nc(I)ccc1F Amb26396190 [0,2,0,0,0,0|2,0,0]=4 6225 B9R1.69 Nc1nc(O)ccc1Cl Amb28255639 [0,2,0,0,0,0|1,0,0]=3 6226 B9R1.69 Nc1nc(O)ccc1F Amb26583285 [0,2,0,0,0,0|1,0,0]=3 6227 B9R1.69 Nc1nc(O)cnc1Br Amb28066644 [0,2,0,0,0,0|2,0,0]=4 6228 B9R1.69 Nc1nc(O)ncc1Br Amb20240575 [0,2,0,0,0,0|2,0,0]=4 6229 B9R1.69 Nc1nc(O)ncc1O Amb18642482 [0,2,0,0,0,0|2,0,0]=4 6230 B9R1.69 Nc1ncc(Br)c(O)n1 Amb19957694 [0,2,0,0,0,0|2,0,0]=4 6231 B9R1.69 Nc1ncc(Br)c(O)n1 Amb9677797 [0,2,0,0,0,0|2,0,0]=4 6232 B9R1.69 Nc1ncc(Br)cc1Br Amb1840120 [0,2,0,0,0,0|2,0,0]=4 6233 B9R1.69 Nc1ncc(Br)cc1Br Amb4009147 [0,2,0,0,0,0|2,0,0]=4 6234 B9R1.69 Nc1ncc(Br)cc1Cl Amb16230960 [0,2,0,0,0,0|2,0,0]=4 6235 B9R1.69 Nc1ncc(Br)cc1F Amb19957734 [0,2,0,0,0,0|2,0,0]=4 6236 B9R1.69 Nc1ncc(Br)cc1I Amb2696236 [0,2,0,0,0,0|2,0,0]=4 6237 B9R1.69 Nc1ncc(Br)cc1O Amb10601966 [0,2,0,0,0,0|1,0,0]=3 6238 B9R1.69 Nc1ncc(Cl)c(O)n1 Amb33544893 [0,2,0,0,0,0|2,0,0]=4 6239 B9R1.69 Nc1ncc(Cl)cc1Br Amb3428027 [0,2,0,0,0,0|2,0,0]=4 6240 B9R1.69 Nc1ncc(Cl)cc1Cl Amb1283297 [0,2,0,0,0,0|2,0,0]=4 6241 B9R1.69 Nc1ncc(Cl)cc1F Amb13884062 [0,2,0,0,0,0|2,0,0]=4 6242 B9R1.69 Nc1ncc(Cl)cc1I Amb6565100 [0,2,0,0,0,0|2,0,0]=4 6243 B9R1.69 Nc1ncc(Cl)cc1O Amb18644171 [0,2,0,0,0,0|1,0,0]=3 6244 B9R1.69 Nc1ncc(Cl)cc1S Amb26444510 [0,2,0,0,0,0|1,1,0]=4 6245 B9R1.69 Nc1ncc(F)cc1Br Amb8392980 [0,2,0,0,0,0|2,0,0]=4 6246 B9R1.69 Nc1ncc(F)cc1Cl Amb22263220 [0,2,0,0,0,0|2,0,0]=4 6247 B9R1.69 Nc1ncc(F)cc1F Amb16233733 [0,2,0,0,0,0|2,0,0]=4 6248 B9R1.69 Nc1ncc(F)cc1I Amb6565127 [0,2,0,0,0,0|2,0,0]=4 6249 B9R1.69 Nc1ncc(F)cc1O Amb10606435 [0,2,0,0,0,0|1,0,0]=3 6250 B9R1.69 Nc1ncc(I)cc1Br Amb845636 [0,2,0,0,0,0|2,0,0]=4 6251 B9R1.69 Nc1ncc(I)cc1Cl Amb845637 [0,2,0,0,0,0|2,0,0]=4 6252 B9R1.69 Nc1ncc(I)cc1F Amb24594182 [0,2,0,0,0,0|2,0,0]=4 6253 B9R1.69 Nc1ncc(I)cc1I Amb2234911 [0,2,0,0,0,0|2,0,0]=4 6254 B9R1.69 Nc1ncc(I)cc1O Amb27436459 [0,2,0,0,0,0|1,0,0]=3 6255 B9R1.69 Nc1ncc(O)c(Br)n1 Amb22495948 [0,2,0,0,0,0|2,0,0]=4 6256 B9R1.69 Nc1ncc(O)c(N)n1 Amb30634311 [0,2,0,0,0,0|2,0,0]=4 6257 B9R1.69 Nc1ncc(O)cc1Br Amb16233919 [0,2,0,0,0,0|1,0,0]=3 6258 B9R1.69 Nc1ncc(O)cc1Cl Amb16233774 [0,2,0,0,0,0|1,0,0]=3 6259 B9R1.69 Nc1ncc(O)cc1F Amb25774324 [0,2,0,0,0,0|1,0,0]=3 6260 B9R1.69 Nc1ncc(O)nc1O Amb27812078 [0,2,0,0,0,0|2,0,0]=4 6261 B9R1.69 Nc1nnc(Cl)cc1O Amb26556616 [0,2,0,0,0,0|2,0,0]=4 6262 B9R1.69 O=C1C=C(Br)C(Cl)=CN1 Amb26482912 [0,2,0,0,0,0|1,0,1]=4 6263 B9R1.69 O=C1C=C(Br)C(O)=NN1 Amb19957695 [0,2,0,0,0,0|2,0,0]=4 6264 B9R1.69 O=C1C=C(Br)C=CN1O Amb28049188 [0,2,0,0,0,0|1,0,0]=3 6265 B9R1.69 O=C1C=C(Cl)C(Cl)=CN1 Amb22495551 [0,2,0,0,0,0|1,0,1]=4 6266 B9R1.69 O=C1C=C(Cl)NC=C1Cl Amb22325228 [0,2,0,0,0,0|1,0,1]=4 6267 B9R1.69 O=C1C=C(F)C(Br)=CN1 Amb25208308 [0,2,0,0,0,0|1,0,1]=4 6268 B9R1.69 O=C1C=C(F)NC=C1Cl Amb24481845 [0,2,0,0,0,0|1,0,1]=4 6269 B9R1.69 O=C1C=C(O)C(Br)=CN1 Amb24565255 [0,2,0,0,0,0|1,0,0]=3 6270 B9R1.69 O=C1C=C(O)C(Cl)=CN1 Amb19132469 [0,2,0,0,0,0|1,0,0]=3 6271 B9R1.69 O=C1C=C(O)C(F)=CN1 Amb22490485 [0,2,0,0,0,0|1,0,0]=3 6272 B9R1.69 O=C1C=C(O)C(O)=CN1 Amb28368588 [0,2,0,0,0,0|1,0,0]=3 6273 B9R1.69 O=C1C=CC(=O)C(Br)=C1 Amb6297942 [0,2,0,0,0,0|0,0,1]=3 6274 B9R1.69 O=C1C=CC(=O)C(Cl)=C1 Amb8515758 [0,2,0,0,0,0|0,0,1]=3 6275 B9R1.69 O=C1C=CC(=O)C(F)=C1 Amb10841415 [0,2,0,0,0,0|0,0,1]=3 6276 B9R1.69 O=C1C=CC(=O)C(O)=C1 Amb17593265 [0,2,0,0,0,0|0,0,0]=2 6277 B9R1.69 O=C1C=CC(=O)C(O)C1 Amb27191875 [0,2,0,0,0,0|0,0,2]=4 6278 B9R1.69 O=C1C=CC(=O)N(O)C1 Amb27227026 [0,2,0,0,0,0|1,0,1]=4 6279 B9R1.69 O=C1C=CC(Br)=CN1O Amb27964231 [0,2,0,0,0,0|1,0,0]=3 6280 B9R1.69 O=C1C=CC(F)=C(Cl)N1 Amb25090136 [0,2,0,0,0,0|1,0,1]=4 6281 B9R1.69 O=C1C=CC(F)=C(F)N1 Amb25974080 [0,2,0,0,0,0|1,0,1]=4 6282 B9R1.69 O=C1N=C(O)C(I)=CN1 Amb19932065 [0,2,0,0,0,0|2,0,0]=4 6283 B9R1.69 O=C1N=CC(F)=C(O)N1 Amb19392163 [0,2,0,0,0,0|2,0,0]=4 6284 B9R1.69 O=C1NC(Br)=CC=C1Cl Amb25335810 [0,2,0,0,0,0|1,0,1]=4 6285 B9R1.69 O=C1NC(Cl)=CC=C1O Amb26532144 [0,2,0,0,0,0|1,0,0]=3 6286 B9R1.69 O=C1NC(F)=CC=C1F Amb25109484 [0,2,0,0,0,0|1,0,1]=4 6287 B9R1.69 O=C1NC(O)=NC=C1Br Amb18819008 [0,2,0,0,0,0|2,0,0]=4 6288 B9R1.69 O=C1NC(S)=NC=C1O Amb24351140 [0,2,0,0,0,0|2,0,0]=4 6289 B9R1.69 O=C1NC=C(Br)C=C1Br Amb18040572 [0,2,0,0,0,0|1,0,1]=4 6290 B9R1.69 O=C1NC=C(Br)C=C1Cl Amb18562928 [0,2,0,0,0,0|1,0,1]=4 6291 B9R1.69 O=C1NC=C(Br)C=C1F Amb20242615 [0,2,0,0,0,0|1,0,1]=4 6292 B9R1.69 O=C1NC=C(Br)C=C1I Amb22494768 [0,2,0,0,0,0|1,0,1]=4 6293 B9R1.69 O=C1NC=C(Cl)C=C1Br Amb18562965 [0,2,0,0,0,0|1,0,1]=4 6294 B9R1.69 O=C1NC=C(Cl)C=C1Cl Amb18040569 [0,2,0,0,0,0|1,0,1]=4 6295 B9R1.69 O=C1NC=C(Cl)C=C1F Amb20618852 [0,2,0,0,0,0|1,0,1]=4 6296 B9R1.69 O=C1NC=C(Cl)C=C1I Amb22500639 [0,2,0,0,0,0|1,0,1]=4 6297 B9R1.69 O=C1NC=C(Cl)C=C1O Amb20665693 [0,2,0,0,0,0|1,0,0]=3 6298 B9R1.69 O=C1NC=C(F)C=C1Br Amb22411535 [0,2,0,0,0,0|1,0,1]=4 6299 B9R1.69 O=C1NC=C(F)C=C1I Amb21864720 [0,2,0,0,0,0|1,0,1]=4 6300 B9R1.69 O=C1NC=C(O)C(=O)N1 Amb19517092 [0,2,0,0,0,0|2,0,0]=4 6301 B9R1.69 O=c1occ(Br)cc1Br Amb10067372 [0,2,0,0,0,0|1,0,1]=4 6302 B9R1.69 Oc1cc(Br)c(Br)cn1 Amb24319565 [0,2,0,0,0,0|1,0,0]=3 6303 B9R1.69 Oc1cc(Br)c(Cl)nn1 Amb26011499 [0,2,0,0,0,0|2,0,0]=4 6304 B9R1.69 Oc1cc(Br)c(F)cn1 Amb20242584 [0,2,0,0,0,0|1,0,0]=3 6305 B9R1.69 Oc1cc(Br)c(O)nn1 Amb2634019 [0,2,0,0,0,0|2,0,0]=4 6306 B9R1.69 Oc1cc(Br)ccc1Br Amb10068737 [0,2,0,0,0,0|0,0,0]=2 6307 B9R1.69 Oc1cc(Br)ccc1Cl Amb2613016 [0,2,0,0,0,0|0,0,0]=2 6308 B9R1.69 Oc1cc(Br)ccc1F Amb6297146 [0,2,0,0,0,0|0,0,0]=2 6309 B9R1.69 Oc1cc(Br)ccc1I Amb22001827 [0,2,0,0,0,0|0,0,0]=2 6310 B9R1.69 Oc1cc(Br)ccc1S Amb24583087 [0,2,0,0,0,0|0,0,0]=2 6311 B9R1.69 Oc1cc(Br)cnc1Br Amb13889761 [0,2,0,0,0,0|1,0,0]=3 6312 B9R1.69 Oc1cc(Br)cnc1Cl Amb6565132 [0,2,0,0,0,0|1,0,0]=3 6313 B9R1.69 Oc1cc(Br)cnc1F Amb19895455 [0,2,0,0,0,0|1,0,0]=3 6314 B9R1.69 Oc1cc(Br)cnc1I Amb6565149 [0,2,0,0,0,0|1,0,0]=3 6315 B9R1.69 Oc1cc(Br)cnc1O Amb8396963 [0,2,0,0,0,0|1,0,0]=3 6316 B9R1.69 Oc1cc(Br)ncc1Br Amb20247846 [0,2,0,0,0,0|1,0,0]=3 6317 B9R1.69 Oc1cc(Br)ncc1Cl Amb19895106 [0,2,0,0,0,0|1,0,0]=3 6318 B9R1.69 Oc1cc(Br)ncc1F Amb19895475 [0,2,0,0,0,0|1,0,0]=3 6319 B9R1.69 Oc1cc(Cl)c(Br)cn1 Amb24319788 [0,2,0,0,0,0|1,0,0]=3 6320 B9R1.69 Oc1cc(Cl)c(O)cn1 Amb25121321 [0,2,0,0,0,0|1,0,0]=3 6321 B9R1.69 Oc1cc(Cl)ccc1Br Amb10071212 [0,2,0,0,0,0|0,0,0]=2 6322 B9R1.69 Oc1cc(Cl)ccc1Cl Amb3939538 [0,2,0,0,0,0|0,0,0]=2 6323 B9R1.69 Oc1cc(Cl)ccc1F Amb9297232 [0,2,0,0,0,0|0,0,0]=2 6324 B9R1.69 Oc1cc(Cl)ccc1I Amb15690913 [0,2,0,0,0,0|0,0,0]=2 6325 B9R1.69 Oc1cc(Cl)ccc1S Amb26927276 [0,2,0,0,0,0|0,0,0]=2 6326 B9R1.69 Oc1cc(Cl)cnc1Br Amb15691022 [0,2,0,0,0,0|1,0,0]=3 6327 B9R1.69 Oc1cc(Cl)cnc1Cl Amb21929214 [0,2,0,0,0,0|1,0,0]=3 6328 B9R1.69 Oc1cc(Cl)cnc1F Amb19958871 [0,2,0,0,0,0|1,0,0]=3 6329 B9R1.69 Oc1cc(Cl)cnc1I Amb24081462 [0,2,0,0,0,0|1,0,0]=3 6330 B9R1.69 Oc1cc(Cl)cnc1O Amb4035744 [0,2,0,0,0,0|1,0,0]=3 6331 B9R1.69 Oc1cc(Cl)ncc1Br Amb25103214 [0,2,0,0,0,0|1,0,0]=3 6332 B9R1.69 Oc1cc(Cl)ncc1F Amb25147135 [0,2,0,0,0,0|1,0,0]=3 6333 B9R1.69 Oc1cc(Cl)ncc1I Amb22499976 [0,2,0,0,0,0|1,0,0]=3 6334 B9R1.69 Oc1cc(Cl)nnc1Cl Amb22234753 [0,2,0,0,0,0|2,0,0]=4 6335 B9R1.69 Oc1cc(Cl)nnc1Cl Amb32662651 [0,2,0,0,0,0|2,0,0]=4 6336 B9R1.69 Oc1cc(Cl)nnc1Cl Amb8438970 [0,2,0,0,0,0|2,0,0]=4 6337 B9R1.69 Oc1cc(F)c(F)cn1 Amb25811013 [0,2,0,0,0,0|1,0,0]=3 6338 B9R1.69 Oc1cc(F)c(I)cn1 Amb27633289 [0,2,0,0,0,0|1,0,0]=3 6339 B9R1.69 Oc1cc(F)ccc1Br Amb2685233 [0,2,0,0,0,0|0,0,0]=2 6340 B9R1.69 Oc1cc(F)ccc1Cl Amb2686042 [0,2,0,0,0,0|0,0,0]=2 6341 B9R1.69 Oc1cc(F)ccc1F Amb2687211 [0,2,0,0,0,0|0,0,0]=2 6342 B9R1.69 Oc1cc(F)cnc1Br Amb20242888 [0,2,0,0,0,0|1,0,0]=3 6343 B9R1.69 Oc1cc(F)cnc1Cl Amb6565137 [0,2,0,0,0,0|1,0,0]=3 6344 B9R1.69 Oc1cc(F)cnc1F Amb25248868 [0,2,0,0,0,0|1,0,0]=3 6345 B9R1.69 Oc1cc(F)cnc1I Amb25938308 [0,2,0,0,0,0|1,0,0]=3 6346 B9R1.69 Oc1cc(F)cnc1O Amb27811130 [0,2,0,0,0,0|1,0,0]=3 6347 B9R1.69 Oc1cc(F)ncc1Br Amb22292249 [0,2,0,0,0,0|1,0,0]=3 6348 B9R1.69 Oc1cc(F)ncc1F Amb27465292 [0,2,0,0,0,0|1,0,0]=3 6349 B9R1.69 Oc1cc(I)c(Cl)cn1 Amb20241535 [0,2,0,0,0,0|1,0,0]=3 6350 B9R1.69 Oc1cc(I)c(F)cn1 Amb22495308 [0,2,0,0,0,0|1,0,0]=3 6351 B9R1.69 Oc1cc(I)ccc1Br Amb19516085 [0,2,0,0,0,0|0,0,0]=2 6352 B9R1.69 Oc1cc(I)ccc1Cl Amb8439697 [0,2,0,0,0,0|0,0,0]=2 6353 B9R1.69 Oc1cc(I)ccc1F Amb19958077 [0,2,0,0,0,0|0,0,0]=2 6354 B9R1.69 Oc1cc(I)ccc1I Amb24478786 [0,2,0,0,0,0|0,0,0]=2 6355 B9R1.69 Oc1cc(I)ccc1S Amb27838612 [0,2,0,0,0,0|0,0,0]=2 6356 B9R1.69 Oc1cc(I)cnc1Cl Amb27878908 [0,2,0,0,0,0|1,0,0]=3 6357 B9R1.69 Oc1cc(I)cnc1I Amb13889812 [0,2,0,0,0,0|1,0,0]=3 6358 B9R1.69 Oc1cc(I)ncc1F Amb26907882 [0,2,0,0,0,0|1,0,0]=3 6359 B9R1.69 Oc1cc(S)ccc1Br Amb26498929 [0,2,0,0,0,0|0,0,0]=2 6360 B9R1.69 Oc1cc(S)ccc1Cl Amb27838639 [0,2,0,0,0,0|0,0,0]=2 6361 B9R1.69 Oc1cc(S)ccc1F Amb27237114 [0,2,0,0,0,0|0,0,0]=2 6362 B9R1.69 Oc1cc(S)ccc1I Amb27411183 [0,2,0,0,0,0|0,0,0]=2 6363 B9R1.69 Oc1cc(S)ccc1S Amb25997255 [0,2,0,0,0,0|0,0,0]=2 6364 B9R1.69 Oc1ccc(Br)c(Br)c1 Amb6297318 [0,2,0,0,0,0|0,0,0]=2 6365 B9R1.69 Oc1ccc(Br)c(Br)n1 Amb25888828 [0,2,0,0,0,0|1,0,0]=3 6366 B9R1.69 Oc1ccc(Br)c(Cl)c1 Amb33548806 [0,2,0,0,0,0|0,0,0]=2 6367 B9R1.69 Oc1ccc(Br)c(Cl)n1 Amb19959501 [0,2,0,0,0,0|1,0,0]=3 6368 B9R1.69 Oc1ccc(Br)c(F)c1 Amb2685234 [0,2,0,0,0,0|0,0,0]=2 6369 B9R1.69 Oc1ccc(Br)c(F)n1 Amb22754656 [0,2,0,0,0,0|1,0,0]=3 6370 B9R1.69 Oc1ccc(Br)c(I)c1 Amb22735788 [0,2,0,0,0,0|0,0,0]=2 6371 B9R1.69 Oc1ccc(Br)c(O)c1 Amb3939307 [0,2,0,0,0,0|0,0,0]=2 6372 B9R1.69 Oc1ccc(Br)c(S)c1 Amb28369358 [0,2,0,0,0,0|0,0,0]=2 6373 B9R1.69 Oc1ccc(Br)cc1Br Amb6398095 [0,2,0,0,0,0|0,0,0]=2 6374 B9R1.69 Oc1ccc(Br)cc1Cl Amb6344864 [0,2,0,0,0,0|0,0,0]=2 6375 B9R1.69 Oc1ccc(Br)cc1F Amb1159095 [0,2,0,0,0,0|0,0,0]=2 6376 B9R1.69 Oc1ccc(Br)cc1I Amb5722318 [0,2,0,0,0,0|0,0,0]=2 6377 B9R1.69 Oc1ccc(Br)cc1O Amb10602640 [0,2,0,0,0,0|0,0,0]=2 6378 B9R1.69 Oc1ccc(Br)cc1S Amb24478836 [0,2,0,0,0,0|0,0,0]=2 6379 B9R1.69 Oc1ccc(Br)nc1Br Amb2618019 [0,2,0,0,0,0|1,0,0]=3 6380 B9R1.69 Oc1ccc(Br)nc1Cl Amb13889838 [0,2,0,0,0,0|1,0,0]=3 6381 B9R1.69 Oc1ccc(Br)nc1F Amb20248013 [0,2,0,0,0,0|1,0,0]=3 6382 B9R1.69 Oc1ccc(Br)nc1I Amb22295776 [0,2,0,0,0,0|1,0,0]=3 6383 B9R1.69 Oc1ccc(Cl)c(Br)c1 Amb6296736 [0,2,0,0,0,0|0,0,0]=2 6384 B9R1.69 Oc1ccc(Cl)c(Br)n1 Amb26610908 [0,2,0,0,0,0|1,0,0]=3 6385 B9R1.69 Oc1ccc(Cl)c(Cl)c1 Amb3939548 [0,2,0,0,0,0|0,0,0]=2 6386 B9R1.69 Oc1ccc(Cl)c(Cl)n1 Amb24379510 [0,2,0,0,0,0|1,0,0]=3 6387 B9R1.69 Oc1ccc(Cl)c(F)c1 Amb2686046 [0,2,0,0,0,0|0,0,0]=2 6388 B9R1.69 Oc1ccc(Cl)c(F)n1 Amb24582207 [0,2,0,0,0,0|1,0,0]=3 6389 B9R1.69 Oc1ccc(Cl)c(I)c1 Amb10069351 [0,2,0,0,0,0|0,0,0]=2 6390 B9R1.69 Oc1ccc(Cl)c(I)n1 Amb25996644 [0,2,0,0,0,0|1,0,0]=3 6391 B9R1.69 Oc1ccc(Cl)c(O)c1 Amb3941632 [0,2,0,0,0,0|0,0,0]=2 6392 B9R1.69 Oc1ccc(Cl)cc1Br Amb6540786 [0,2,0,0,0,0|0,0,0]=2 6393 B9R1.69 Oc1ccc(Cl)cc1Cl Amb3939628 [0,2,0,0,0,0|0,0,0]=2 6394 B9R1.69 Oc1ccc(Cl)cc1F Amb3939175 [0,2,0,0,0,0|0,0,0]=2 6395 B9R1.69 Oc1ccc(Cl)cc1I Amb10070635 [0,2,0,0,0,0|0,0,0]=2 6396 B9R1.69 Oc1ccc(Cl)cc1O Amb4035218 [0,2,0,0,0,0|0,0,0]=2 6397 B9R1.69 Oc1ccc(Cl)cc1S Amb18645432 [0,2,0,0,0,0|0,0,0]=2 6398 B9R1.69 Oc1ccc(Cl)nc1Br Amb19959578 [0,2,0,0,0,0|1,0,0]=3 6399 B9R1.69 Oc1ccc(Cl)nc1Cl Amb18126397 [0,2,0,0,0,0|1,0,0]=3 6400 B9R1.69 Oc1ccc(Cl)nc1F Amb21961955 [0,2,0,0,0,0|1,0,0]=3 6401 B9R1.69 Oc1ccc(Cl)nc1I Amb10603048 [0,2,0,0,0,0|1,0,0]=3 6402 B9R1.69 Oc1ccc(F)c(Br)c1 Amb6298647 [0,2,0,0,0,0|0,0,0]=2 6403 B9R1.69 Oc1ccc(F)c(Br)n1 Amb26642082 [0,2,0,0,0,0|1,0,0]=3 6404 B9R1.69 Oc1ccc(F)c(Cl)c1 Amb2686045 [0,2,0,0,0,0|0,0,0]=2 6405 B9R1.69 Oc1ccc(F)c(F)c1 Amb1152988 [0,2,0,0,0,0|0,0,0]=2 6406 B9R1.69 Oc1ccc(F)c(I)c1 Amb24478755 [0,2,0,0,0,0|0,0,0]=2 6407 B9R1.69 Oc1ccc(F)c(I)n1 Amb25924264 [0,2,0,0,0,0|1,0,0]=3 6408 B9R1.69 Oc1ccc(F)c(O)c1 Amb16185891 [0,2,0,0,0,0|0,0,0]=2 6409 B9R1.69 Oc1ccc(F)c(S)c1 Amb27166571 [0,2,0,0,0,0|0,0,0]=2 6410 B9R1.69 Oc1ccc(F)cc1Br Amb1159073 [0,2,0,0,0,0|0,0,0]=2 6411 B9R1.69 Oc1ccc(F)cc1Cl Amb2686041 [0,2,0,0,0,0|0,0,0]=2 6412 B9R1.69 Oc1ccc(F)cc1F Amb2371459 [0,2,0,0,0,0|0,0,0]=2 6413 B9R1.69 Oc1ccc(F)cc1I Amb16185876 [0,2,0,0,0,0|0,0,0]=2 6414 B9R1.69 Oc1ccc(F)cc1O Amb8383928 [0,2,0,0,0,0|0,0,0]=2 6415 B9R1.69 Oc1ccc(F)cc1S Amb27257095 [0,2,0,0,0,0|0,0,0]=2 6416 B9R1.69 Oc1ccc(F)nc1Br Amb22728739 [0,2,0,0,0,0|1,0,0]=3 6417 B9R1.69 Oc1ccc(F)nc1Cl Amb28284440 [0,2,0,0,0,0|1,0,0]=3 6418 B9R1.69 Oc1ccc(F)nc1F Amb19895463 [0,2,0,0,0,0|1,0,0]=3 6419 B9R1.69 Oc1ccc(F)nc1I Amb22295775 [0,2,0,0,0,0|1,0,0]=3 6420 B9R1.69 Oc1ccc(I)c(Br)c1 Amb22735960 [0,2,0,0,0,0|0,0,0]=2 6421 B9R1.69 Oc1ccc(I)c(Br)n1 Amb22900018 [0,2,0,0,0,0|1,0,0]=3 6422 B9R1.69 Oc1ccc(I)c(Cl)c1 Amb24082687 [0,2,0,0,0,0|0,0,0]=2 6423 B9R1.69 Oc1ccc(I)c(Cl)n1 Amb27962924 [0,2,0,0,0,0|1,0,0]=3 6424 B9R1.69 Oc1ccc(I)c(F)c1 Amb20670870 [0,2,0,0,0,0|0,0,0]=2 6425 B9R1.69 Oc1ccc(I)c(F)n1 Amb21963443 [0,2,0,0,0,0|1,0,0]=3 6426 B9R1.69 Oc1ccc(I)c(I)c1 Amb21963846 [0,2,0,0,0,0|0,0,0]=2 6427 B9R1.69 Oc1ccc(I)c(S)c1 Amb25692167 [0,2,0,0,0,0|0,0,0]=2 6428 B9R1.69 Oc1ccc(I)cc1Br Amb22057558 [0,2,0,0,0,0|0,0,0]=2 6429 B9R1.69 Oc1ccc(I)cc1Cl Amb22057581 [0,2,0,0,0,0|0,0,0]=2 6430 B9R1.69 Oc1ccc(I)cc1F Amb21962730 [0,2,0,0,0,0|0,0,0]=2 6431 B9R1.69 Oc1ccc(I)cc1I Amb24090057 [0,2,0,0,0,0|0,0,0]=2 6432 B9R1.69 Oc1ccc(I)cc1O Amb10606909 [0,2,0,0,0,0|0,0,0]=2 6433 B9R1.69 Oc1ccc(I)nc1Br Amb10975448 [0,2,0,0,0,0|1,0,0]=3 6434 B9R1.69 Oc1ccc(I)nc1Cl Amb10975409 [0,2,0,0,0,0|1,0,0]=3 6435 B9R1.69 Oc1ccc(I)nc1F Amb28051687 [0,2,0,0,0,0|1,0,0]=3 6436 B9R1.69 Oc1ccc(I)nc1I Amb10974792 [0,2,0,0,0,0|1,0,0]=3 6437 B9R1.69 Oc1ccc(O)c(Cl)c1 Amb6297198 [0,2,0,0,0,0|0,0,0]=2 6438 B9R1.69 Oc1ccc(O)c(Cl)n1 Amb25147070 [0,2,0,0,0,0|1,0,0]=3 6439 B9R1.69 Oc1ccc(O)c(F)c1 Amb20240579 [0,2,0,0,0,0|0,0,0]=2 6440 B9R1.69 Oc1ccc(O)c(F)n1 Amb25984913 [0,2,0,0,0,0|1,0,0]=3 6441 B9R1.69 Oc1ccc(O)c(O)c1 Amb6296031 [0,2,0,0,0,0|0,0,0]=2 6442 B9R1.69 Oc1ccc(O)c(S)c1 Amb10070964 [0,2,0,0,0,0|0,0,0]=2 6443 B9R1.69 Oc1ccc(S)c(Br)c1 Amb27851065 [0,2,0,0,0,0|0,0,0]=2 6444 B9R1.69 Oc1ccc(S)c(Cl)c1 Amb18645433 [0,2,0,0,0,0|0,0,0]=2 6445 B9R1.69 Oc1ccc(S)c(F)c1 Amb24642779 [0,2,0,0,0,0|0,0,0]=2 6446 B9R1.69 Oc1ccc(S)c(I)c1 Amb24404961 [0,2,0,0,0,0|0,0,0]=2 6447 B9R1.69 Oc1ccc(S)c(O)c1 Amb18643824 [0,2,0,0,0,0|0,0,0]=2 6448 B9R1.69 Oc1ccc(S)cc1Br Amb27879643 [0,2,0,0,0,0|0,0,0]=2 6449 B9R1.69 Oc1ccc(S)cc1Cl Amb18126267 [0,2,0,0,0,0|0,0,0]=2 6450 B9R1.69 Oc1ccc(S)cc1F Amb26063111 [0,2,0,0,0,0|0,0,0]=2 6451 B9R1.69 Oc1ccc(S)cc1O Amb24546795 [0,2,0,0,0,0|0,0,0]=2 6452 B9R1.69 Oc1cnc(Br)c(Br)c1 Amb22494217 [0,2,0,0,0,0|1,0,0]=3 6453 B9R1.69 Oc1cnc(Br)c(Cl)c1 Amb15691026 [0,2,0,0,0,0|1,0,0]=3 6454 B9R1.69 Oc1cnc(Br)c(Cl)n1 Amb26989111 [0,2,0,0,0,0|2,0,0]=4 6455 B9R1.69 Oc1cnc(Br)c(F)c1 Amb22489939 [0,2,0,0,0,0|1,0,0]=3 6456 B9R1.69 Oc1cnc(Br)cc1Br Amb24478719 [0,2,0,0,0,0|1,0,0]=3 6457 B9R1.69 Oc1cnc(Br)cc1Cl Amb27870765 [0,2,0,0,0,0|1,0,0]=3 6458 B9R1.69 Oc1cnc(Br)cc1F Amb28396827 [0,2,0,0,0,0|1,0,0]=3 6459 B9R1.69 Oc1cnc(Cl)c(Br)c1 Amb10602048 [0,2,0,0,0,0|1,0,0]=3 6460 B9R1.69 Oc1cnc(Cl)c(Cl)c1 Amb8396958 [0,2,0,0,0,0|1,0,0]=3 6461 B9R1.69 Oc1cnc(Cl)c(F)c1 Amb10602049 [0,2,0,0,0,0|1,0,0]=3 6462 B9R1.69 Oc1cnc(Cl)c(O)c1 Amb25373985 [0,2,0,0,0,0|1,0,0]=3 6463 B9R1.69 Oc1cnc(Cl)cc1Br Amb27226144 [0,2,0,0,0,0|1,0,0]=3 6464 B9R1.69 Oc1cnc(Cl)cc1Cl Amb19895107 [0,2,0,0,0,0|1,0,0]=3 6465 B9R1.69 Oc1cnc(Cl)cc1F Amb25336301 [0,2,0,0,0,0|1,0,0]=3 6466 B9R1.69 Oc1cnc(Cl)cc1I Amb22831388 [0,2,0,0,0,0|1,0,0]=3 6467 B9R1.69 Oc1cnc(Cl)nc1Cl Amb23399864 [0,2,0,0,0,0|2,0,0]=4 6468 B9R1.69 Oc1cnc(Cl)nc1F Amb24652860 [0,2,0,0,0,0|2,0,0]=4 6469 B9R1.69 Oc1cnc(F)c(Br)c1 Amb15691035 [0,2,0,0,0,0|1,0,0]=3 6470 B9R1.69 Oc1cnc(F)c(Cl)c1 Amb10602280 [0,2,0,0,0,0|1,0,0]=3 6471 B9R1.69 Oc1cnc(F)c(F)c1 Amb26512004 [0,2,0,0,0,0|1,0,0]=3 6472 B9R1.69 Oc1cnc(F)c(O)c1 Amb25147134 [0,2,0,0,0,0|1,0,0]=3 6473 B9R1.69 Oc1cnc(F)cc1Cl Amb27180476 [0,2,0,0,0,0|1,0,0]=3 6474 B9R1.69 Oc1cnc(F)cc1F Amb22292233 [0,2,0,0,0,0|1,0,0]=3 6475 B9R1.69 Oc1cnc(F)cc1I Amb22831298 [0,2,0,0,0,0|1,0,0]=3 6476 B9R1.69 Oc1cnc(I)c(Cl)c1 Amb24468854 [0,2,0,0,0,0|1,0,0]=3 6477 B9R1.69 Oc1cnc(I)c(F)c1 Amb24478697 [0,2,0,0,0,0|1,0,0]=3 6478 B9R1.69 Oc1cnc(I)cc1Cl Amb28132796 [0,2,0,0,0,0|1,0,0]=3 6479 B9R1.69 Oc1cnc(I)cc1F Amb27869989 [0,2,0,0,0,0|1,0,0]=3 6480 B9R1.69 Oc1cnc(O)c(Cl)c1 Amb27862096 [0,2,0,0,0,0|1,0,0]=3 6481 B9R1.69 Oc1cnc(O)c(F)c1 Amb25873249 [0,2,0,0,0,0|1,0,0]=3 6482 B9R1.69 Oc1nc(Br)ccc1Br Amb25761252 [0,2,0,0,0,0|1,0,0]=3 6483 B9R1.69 Oc1nc(Br)ccc1F Amb24432271 [0,2,0,0,0,0|1,0,0]=3 6484 B9R1.69 Oc1nc(Br)ccc1I Amb28280814 [0,2,0,0,0,0|1,0,0]=3 6485 B9R1.69 Oc1nc(Cl)ccc1Cl Amb10070962 [0,2,0,0,0,0|1,0,0]=3 6486 B9R1.69 Oc1nc(Cl)ccc1F Amb22728451 [0,2,0,0,0,0|1,0,0]=3 6487 B9R1.69 Oc1nc(Cl)ccc1I Amb22900057 [0,2,0,0,0,0|1,0,0]=3 6488 B9R1.69 Oc1nc(Cl)ncc1Br Amb26329485 [0,2,0,0,0,0|2,0,0]=4 6489 B9R1.69 Oc1nc(Cl)ncc1Cl Amb25777245 [0,2,0,0,0,0|2,0,0]=4 6490 B9R1.69 Oc1nc(Cl)ncc1F Amb20242402 [0,2,0,0,0,0|2,0,0]=4 6491 B9R1.69 Oc1nc(F)ccc1Br Amb25780446 [0,2,0,0,0,0|1,0,0]=3 6492 B9R1.69 Oc1nc(F)ccc1I Amb27636653 [0,2,0,0,0,0|1,0,0]=3 6493 B9R1.69 Oc1nc(F)ncc1Br Amb35648902 [0,2,0,0,0,0|2,0,0]=4 6494 B9R1.69 Oc1nc(F)ncc1Cl Amb27793540 [0,2,0,0,0,0|2,0,0]=4 6495 B9R1.69 Oc1nc(I)ccc1Cl Amb25247437 [0,2,0,0,0,0|1,0,0]=3 6496 B9R1.69 Oc1nc(I)ccc1F Amb27461671 [0,2,0,0,0,0|1,0,0]=3 6497 B9R1.69 Oc1nc(S)ncc1Br Amb24478806 [0,2,0,0,0,0|2,0,0]=4 6498 B9R1.69 Oc1ncc(Br)c(Cl)n1 Amb28072149 [0,2,0,0,0,0|2,0,0]=4 6499 B9R1.69 Oc1ncc(Br)c(O)n1 Amb2725511 [0,2,0,0,0,0|2,0,0]=4 6500 B9R1.69 Oc1ncc(Br)cc1Br Amb2792492 [0,2,0,0,0,0|1,0,0]=3 6501 B9R1.69 Oc1ncc(Br)nc1Br Amb15691088 [0,2,0,0,0,0|2,0,0]=4 6502 B9R1.69 Oc1ncc(Br)nc1Cl Amb27859644 [0,2,0,0,0,0|2,0,0]=4 6503 B9R1.69 Oc1ncc(Cl)c(F)n1 Amb27234071 [0,2,0,0,0,0|2,0,0]=4 6504 B9R1.69 Oc1ncc(Cl)cc1Br Amb33548793 [0,2,0,0,0,0|1,0,0]=3 6505 B9R1.69 Oc1ncc(Cl)cc1Cl Amb2609458 [0,2,0,0,0,0|1,0,0]=3 6506 B9R1.69 Oc1ncc(F)cc1Cl Amb24054269 [0,2,0,0,0,0|1,0,0]=3 6507 B9R1.69 Oc1ncc(F)cc1F Amb25146815 [0,2,0,0,0,0|1,0,0]=3 6508 B9R1.69 Oc1ncc(I)c(O)n1 Amb4463568 [0,2,0,0,0,0|2,0,0]=4 6509 B9R1.69 Oc1ncc(I)cc1Br Amb21864686 [0,2,0,0,0,0|1,0,0]=3 6510 B9R1.69 Oc1ncc(I)cc1Cl Amb17621518 [0,2,0,0,0,0|1,0,0]=3 6511 B9R1.69 Oc1ncc(I)cc1F Amb25924252 [0,2,0,0,0,0|1,0,0]=3 6512 B9R1.69 Oc1ncc(I)cc1I Amb2234910 [0,2,0,0,0,0|1,0,0]=3 6513 B9R1.69 Oc1nnc(Cl)cc1Cl Amb22371422 [0,2,0,0,0,0|2,0,0]=4 6514 B9R1.69 Sc1cc(Br)c(Br)cn1 Amb25981485 [0,2,0,0,0,0|1,1,0]=4 6515 B9R1.69 Sc1cc(Br)ccc1Br Amb7773578 [0,2,0,0,0,0|0,1,0]=3 6516 B9R1.69 Sc1cc(Br)ccc1Cl Amb19887980 [0,2,0,0,0,0|0,1,0]=3 6517 B9R1.69 Sc1cc(Br)cnc1Br Amb27613429 [0,2,0,0,0,0|1,1,0]=4 6518 B9R1.69 Sc1cc(Br)cnc1Cl Amb33007781 [0,2,0,0,0,0|1,1,0]=4 6519 B9R1.69 Sc1cc(Br)ncc1Br Amb27795120 [0,2,0,0,0,0|1,1,0]=4 6520 B9R1.69 Sc1cc(Cl)c(Cl)cn1 Amb27786979 [0,2,0,0,0,0|1,1,0]=4 6521 B9R1.69 Sc1cc(Cl)ccc1Br Amb19890499 [0,2,0,0,0,0|0,1,0]=3 6522 B9R1.69 Sc1cc(Cl)ccc1Cl Amb1152196 [0,2,0,0,0,0|0,1,0]=3 6523 B9R1.69 Sc1cc(Cl)ccc1I Amb26895771 [0,2,0,0,0,0|0,1,0]=3 6524 B9R1.69 Sc1cc(Cl)ncc1Br Amb33478606 [0,2,0,0,0,0|1,1,0]=4 6525 B9R1.69 Sc1cc(Cl)ncc1Cl Amb27784549 [0,2,0,0,0,0|1,1,0]=4 6526 B9R1.69 Sc1cc(I)ccc1Br Amb25956955 [0,2,0,0,0,0|0,1,0]=3 6527 B9R1.69 Sc1cc(I)ccc1I Amb26347871 [0,2,0,0,0,0|0,1,0]=3 6528 B9R1.69 Sc1ccc(Br)c(Br)c1 Amb19887991 [0,2,0,0,0,0|0,1,0]=3 6529 B9R1.69 Sc1ccc(Br)c(Br)n1 Amb26602514 [0,2,0,0,0,0|1,1,0]=4 6530 B9R1.69 Sc1ccc(Br)c(Cl)c1 Amb19944252 [0,2,0,0,0,0|0,1,0]=3 6531 B9R1.69 Sc1ccc(Br)c(I)c1 Amb24642787 [0,2,0,0,0,0|0,1,0]=3 6532 B9R1.69 Sc1ccc(Br)cc1Br Amb19887947 [0,2,0,0,0,0|0,1,0]=3 6533 B9R1.69 Sc1ccc(Br)cc1Cl Amb19944251 [0,2,0,0,0,0|0,1,0]=3 6534 B9R1.69 Sc1ccc(Br)cc1I Amb24576068 [0,2,0,0,0,0|0,1,0]=3 6535 B9R1.69 Sc1ccc(Br)nc1Br Amb25981474 [0,2,0,0,0,0|1,1,0]=4 6536 B9R1.69 Sc1ccc(Cl)c(Br)c1 Amb19890037 [0,2,0,0,0,0|0,1,0]=3 6537 B9R1.69 Sc1ccc(Cl)c(Cl)c1 Amb2686989 [0,2,0,0,0,0|0,1,0]=3 6538 B9R1.69 Sc1ccc(Cl)c(Cl)n1 Amb27475253 [0,2,0,0,0,0|1,1,0]=4 6539 B9R1.69 Sc1ccc(Cl)c(I)c1 Amb28288390 [0,2,0,0,0,0|0,1,0]=3 6540 B9R1.69 Sc1ccc(Cl)cc1Br Amb19890254 [0,2,0,0,0,0|0,1,0]=3 6541 B9R1.69 Sc1ccc(Cl)cc1Cl Amb2686988 [0,2,0,0,0,0|0,1,0]=3 6542 B9R1.69 Sc1ccc(Cl)cc1I Amb25782820 [0,2,0,0,0,0|0,1,0]=3 6543 B9R1.69 Sc1ccc(Cl)nc1Cl Amb27779733 [0,2,0,0,0,0|1,1,0]=4 6544 B9R1.69 Sc1ccc(I)c(Cl)c1 Amb24524020 [0,2,0,0,0,0|0,1,0]=3 6545 B9R1.69 Sc1ccc(I)c(I)c1 Amb28287755 [0,2,0,0,0,0|0,1,0]=3 6546 B9R1.69 Sc1ccc(I)cc1Br Amb27171244 [0,2,0,0,0,0|0,1,0]=3 6547 B9R1.69 Sc1ccc(I)cc1Cl Amb24524230 [0,2,0,0,0,0|0,1,0]=3 6548 B9R1.69 Sc1ccc(S)c(Cl)c1 Amb27838640 [0,2,0,0,0,0|0,1,0]=3 6549 B9R1.69 Sc1cnc(Br)c(Br)c1 Amb25270740 [0,2,0,0,0,0|1,1,0]=4 6550 B9R1.69 Sc1cnc(Br)cc1Br Amb27613312 [0,2,0,0,0,0|1,1,0]=4 6551 B9R1.69 Sc1cnc(Cl)c(Cl)c1 Amb27786641 [0,2,0,0,0,0|1,1,0]=4 6552 B9R1.69 Sc1cnc(Cl)cc1Cl Amb28058068 [0,2,0,0,0,0|1,1,0]=4 6553 B9R1.69 Sc1nc(Br)ccc1Br Amb27482712 [0,2,0,0,0,0|1,1,0]=4 6554 B9R1.69 Sc1nc(Cl)ccc1Cl Amb26930845 [0,2,0,0,0,0|1,1,0]=4 6555 B9R1.69 Sc1ncc(Br)cc1Br Amb25055680 [0,2,0,0,0,0|1,1,0]=4 6556 B9R1.69 Sc1ncc(Cl)cc1Cl Amb1122922 [0,2,0,0,0,0|1,1,0]=4 6557 B9R1.69 [NH3+]c1ccc(Cl)cc1O Amb24063635 [0,2,0,0,0,0|0,0,0]=2 6558 B9R1.69 [O-][n+]1cc(Br)ccc1Br Amb2609489 [0,2,0,0,0,0|1,0,1]=4 6559 B9R1.69 [O-][n+]1cc(Br)ccc1Cl Amb21964206 [0,2,0,0,0,0|1,0,1]=4 6560 B9R1.69 [O-][n+]1cc(Cl)ccc1Br Amb2612816 [0,2,0,0,0,0|1,0,1]=4 6561 B9R1.69 [O-][n+]1cc(Cl)ccc1Cl Amb22057892 [0,2,0,0,0,0|1,0,1]=4 6562 B9R1.69 [O-][n+]1cc(Cl)ccc1F Amb27465968 [0,2,0,0,0,0|1,0,1]=4 6563 B9R1.69 [O-][n+]1cc(Cl)ccc1S Amb27200328 [0,2,0,0,0,0|1,0,1]=4 6564 B9R1.69 [O-][n+]1cc(F)ccc1Br Amb21963777 [0,2,0,0,0,0|1,0,1]=4 6565 B9R1.69 [O-][n+]1cc(O)ccc1F Amb27180457 [0,2,0,0,0,0|1,0,0]=3 6566 B9R1.69 [O-][n+]1ccc(Br)c(Cl)c1 Amb27755946 [0,2,0,0,0,0|1,0,1]=4 6567 B9R1.69 [O-][n+]1ccc(Br)cc1Cl Amb27794970 [0,2,0,0,0,0|1,0,1]=4 6568 B9R1.69 [O-][n+]1ccc(Cl)c(Br)c1 Amb2609486 [0,2,0,0,0,0|1,0,1]=4 6569 B9R1.69 [O-][n+]1ccc(Cl)c(F)c1 Amb28318436 [0,2,0,0,0,0|1,0,1]=4 6570 B9R1.69 [O-][n+]1ccc(Cl)cc1S Amb27872501 [0,2,0,0,0,0|1,0,1]=4 6571 B9R1.69 [O-]c1ccc(Br)cc1F Amb21858059 [0,2,0,0,0,0|0,0,1]=3 6572 B9R1.69 [O-]c1ncc(Cl)cc1Cl Amb2609483 [0,2,0,0,0,0|1,0,1]=4 6573 B9R1.69 [S-]c1ccc(Cl)c([S-])c1 Amb33513136 [0,2,0,0,0,0|0,1,0]=3 6574 B9R1.69 [S-]c1ccc(Cl)cc1Cl Amb33513143 [0,2,0,0,0,0|0,1,0]=3 6575 B9R1.3 Brc1c(I)cncc1I Amb26575161 [0,2,0,0,0,0|2,0,0]=4 6576 B9R1.3 Brc1cccc(Br)c1Br Amb2700819 [0,2,0,0,0,0|1,0,0]=3 6577 B9R1.3 Brc1cccc(Br)c1I Amb4017038 [0,2,0,0,0,0|1,0,0]=3 6578 B9R1.3 Brc1cccc(I)c1Br Amb25762031 [0,2,0,0,0,0|1,0,0]=3 6579 B9R1.3 Brc1cccc(I)c1I Amb24436577 [0,2,0,0,0,0|1,0,0]=3 6580 B9R1.3 Brc1ccnc(Br)c1I Amb22755245 [0,2,0,0,0,0|2,0,0]=4 6581 B9R1.3 Brc1ccnc(I)c1Br Amb27613827 [0,2,0,0,0,0|2,0,0]=4 6582 B9R1.3 Brc1cncc(Br)c1I Amb28323203 [0,2,0,0,0,0|2,0,0]=4 6583 B9R1.3 Brc1cncc(I)c1Br Amb25797446 [0,2,0,0,0,0|2,0,0]=4 6584 B9R1.3 Brc1nccc(I)c1Br Amb22755239 [0,2,0,0,0,0|2,0,0]=4 6585 B9R1.3 Brc1nccc(I)c1I Amb25766682 [0,2,0,0,0,0|2,0,0]=4 6586 B9R1.3 CC1=C(Br)C(=O)C=CN1 Amb24654420 [0,2,0,0,0,0|1,0,1]=4 6587 B9R1.3 CC1=C(Br)C(=O)NC=C1 Amb20242526 [0,2,0,0,0,0|1,0,1]=4 6588 B9R1.3 CC1=C(C)C(=O)C=CO1 Amb28396477 [0,2,0,0,0,0|1,0,1]=4 6589 B9R1.3 CC1=C(Cl)C(=O)NC=C1 Amb23448400 [0,2,0,0,0,0|1,0,1]=4 6590 B9R1.3 CC1=C(Cl)C=CNC1=O Amb26461988 [0,2,0,0,0,0|1,0,1]=4 6591 B9R1.3 CC1=C(F)C(=O)NC=C1 Amb24477858 [0,2,0,0,0,0|1,0,1]=4 6592 B9R1.3 CC1=C(O)C(=O)C=CN1 Amb21856401 [0,2,0,0,0,0|1,0,0]=3 6593 B9R1.3 CC1=C(O)C(=O)C=CN1 Amb28960293 [0,2,0,0,0,0|1,0,0]=3 6594 B9R1.3 CC1=C(O)C(=O)C=CO1 Amb18511880 [0,2,0,0,0,0|1,0,0]=3 6595 B9R1.3 CC1=C(O)C(=O)NC=C1 Amb24574176 [0,2,0,0,0,0|1,0,0]=3 6596 B9R1.3 CC1=C(O)C=CNC1=O Amb21858015 [0,2,0,0,0,0|1,0,0]=3 6597 B9R1.3 CC1=C(O)NC=CC1=O Amb22496758 [0,2,0,0,0,0|1,0,0]=3 6598 B9R1.3 CC1=C(O)OC=CC1=O Amb21912546 [0,2,0,0,0,0|1,0,0]=3 6599 B9R1.3 CC1=CC=CC(=O)N1C Amb18402842 [0,2,0,0,0,0|1,0,1]=4 6600 B9R1.3 CC1=CC=CN(C)C1=O Amb19128074 [0,2,0,0,0,0|1,0,1]=4 6601 B9R1.3 CC1=CNC=C(Br)C1=O Amb27230010 [0,2,0,0,0,0|1,0,1]=4 6602 B9R1.3 CC1=CNC=C(O)C1=O Amb25247017 [0,2,0,0,0,0|1,0,0]=3 6603 B9R1.3 CC1=COC=C(C)C1=O Amb22364515 [0,2,0,0,0,0|1,0,1]=4 6604 B9R1.3 CC1=COC=C(O)C1=O Amb28253673 [0,2,0,0,0,0|1,0,0]=3 6605 B9R1.3 CC1=NC=CC(=O)C1O Amb22015135 [0,2,0,0,0,0|1,0,1]=4 6606 B9R1.3 CC1=NC=CN(O)C1=O Amb27803883 [0,2,0,0,0,0|2,0,0]=4 6607 B9R1.3 CN1C(=O)C=CC=C1Br Amb33542837 [0,2,0,0,0,0|1,0,1]=4 6608 B9R1.3 CN1C(=O)C=CC=C1Cl Amb22234339 [0,2,0,0,0,0|1,0,1]=4 6609 B9R1.3 CN1C(=O)C=CC=C1N Amb25368378 [0,2,0,0,0,0|1,0,1]=4 6610 B9R1.3 CN1C(=O)C=CC=C1N Amb33483818 [0,2,0,0,0,0|1,0,1]=4 6611 B9R1.3 CN1C(=O)C=CN=C1O Amb21846768 [0,2,0,0,0,0|2,0,0]=4 6612 B9R1.3 CN1C=CC=C(Br)C1=O Amb22751623 [0,2,0,0,0,0|1,0,1]=4 6613 B9R1.3 CN1C=CC=C(Cl)C1=O Amb23448395 [0,2,0,0,0,0|1,0,1]=4 6614 B9R1.3 CN1C=CC=C(I)C1=O Amb24381284 [0,2,0,0,0,0|1,0,1]=4 6615 B9R1.3 CN1C=CC=C(N)C1=O Amb18943835 [0,2,0,0,0,0|1,0,1]=4 6616 B9R1.3 CN1C=CC=C(N)C1=O Amb22899627 [0,2,0,0,0,0|1,0,1]=4 6617 B9R1.3 CN1C=CC=C(O)C1=O Amb20239347 [0,2,0,0,0,0|1,0,0]=3 6618 B9R1.3 CN1C=CN=C(O)C1=O Amb22059077 [0,2,0,0,0,0|2,0,0]=4 6619 B9R1.3 C[n+]1cccc([O-])c1N Amb25785614 [0,2,0,0,0,0|1,0,1]=4 6620 B9R1.3 Cc1c(Br)ccc[n+]1[O-] Amb28286116 [0,2,0,0,0,0|1,0,1]=4 6621 B9R1.3 Cc1c(Br)cccc1Br Amb6366092 [0,2,0,0,0,0|1,0,0]=3 6622 B9R1.3 Cc1c(Br)cccc1I Amb19943985 [0,2,0,0,0,0|1,0,0]=3 6623 B9R1.3 Cc1c(Br)ccnc1Br Amb21857882 [0,2,0,0,0,0|2,0,0]=4 6624 B9R1.3 Cc1c(Br)ccnc1Cl Amb15691025 [0,2,0,0,0,0|2,0,0]=4 6625 B9R1.3 Cc1c(Br)ccnc1F Amb15691024 [0,2,0,0,0,0|2,0,0]=4 6626 B9R1.3 Cc1c(Br)ccnc1I Amb25968142 [0,2,0,0,0,0|2,0,0]=4 6627 B9R1.3 Cc1c(Br)ccnc1N Amb21963768 [0,2,0,0,0,0|2,0,0]=4 6628 B9R1.3 Cc1c(Br)ccnc1O Amb24320641 [0,2,0,0,0,0|1,0,0]=3 6629 B9R1.3 Cc1c(Br)cncc1Br Amb2611949 [0,2,0,0,0,0|2,0,0]=4 6630 B9R1.3 Cc1c(Br)cncc1I Amb22642015 [0,2,0,0,0,0|2,0,0]=4 6631 B9R1.3 Cc1c(Cl)cccc1Br Amb2685044 [0,2,0,0,0,0|1,0,0]=3 6632 B9R1.3 Cc1c(Cl)cccc1Cl Amb4037270 [0,2,0,0,0,0|1,0,0]=3 6633 B9R1.3 Cc1c(Cl)cccc1I Amb2686139 [0,2,0,0,0,0|1,0,0]=3 6634 B9R1.3 Cc1c(Cl)ccnc1Br Amb22757252 [0,2,0,0,0,0|2,0,0]=4 6635 B9R1.3 Cc1c(Cl)ccnc1Cl Amb8383864 [0,2,0,0,0,0|2,0,0]=4 6636 B9R1.3 Cc1c(Cl)ccnc1F Amb23402042 [0,2,0,0,0,0|2,0,0]=4 6637 B9R1.3 Cc1c(Cl)ccnc1N Amb22235322 [0,2,0,0,0,0|2,0,0]=4 6638 B9R1.3 Cc1c(Cl)cncc1Br Amb22001997 [0,2,0,0,0,0|2,0,0]=4 6639 B9R1.3 Cc1c(Cl)cncc1Cl Amb15691020 [0,2,0,0,0,0|2,0,0]=4 6640 B9R1.3 Cc1c(Cl)cncc1I Amb25938307 [0,2,0,0,0,0|2,0,0]=4 6641 B9R1.3 Cc1c(F)ccc[n+]1[O-] Amb22263233 [0,2,0,0,0,0|1,0,1]=4 6642 B9R1.3 Cc1c(F)cccc1Br Amb2685257 [0,2,0,0,0,0|1,0,0]=3 6643 B9R1.3 Cc1c(F)cccc1Cl Amb2686090 [0,2,0,0,0,0|1,0,0]=3 6644 B9R1.3 Cc1c(F)cccc1F Amb2687285 [0,2,0,0,0,0|1,0,0]=3 6645 B9R1.3 Cc1c(F)cccc1I Amb2684163 [0,2,0,0,0,0|1,0,0]=3 6646 B9R1.3 Cc1c(F)cccc1S Amb19943906 [0,2,0,0,0,0|0,1,0]=3 6647 B9R1.3 Cc1c(F)ccnc1Br Amb27645274 [0,2,0,0,0,0|2,0,0]=4 6648 B9R1.3 Cc1c(F)ccnc1Cl Amb22496766 [0,2,0,0,0,0|2,0,0]=4 6649 B9R1.3 Cc1c(F)ccnc1F Amb23402047 [0,2,0,0,0,0|2,0,0]=4 6650 B9R1.3 Cc1c(F)ccnc1I Amb27180175 [0,2,0,0,0,0|2,0,0]=4 6651 B9R1.3 Cc1c(F)ccnc1N Amb23402045 [0,2,0,0,0,0|2,0,0]=4 6652 B9R1.3 Cc1c(F)ccnc1O Amb26872097 [0,2,0,0,0,0|1,0,0]=3 6653 B9R1.3 Cc1c(F)cncc1Br Amb22001823 [0,2,0,0,0,0|2,0,0]=4 6654 B9R1.3 Cc1c(F)cncc1F Amb27453657 [0,2,0,0,0,0|2,0,0]=4 6655 B9R1.3 Cc1c(F)cncc1I Amb27616161 [0,2,0,0,0,0|2,0,0]=4 6656 B9R1.3 Cc1c(I)ccnc1Cl Amb13889785 [0,2,0,0,0,0|2,0,0]=4 6657 B9R1.3 Cc1c(I)ccnc1F Amb10603598 [0,2,0,0,0,0|2,0,0]=4 6658 B9R1.3 Cc1c(I)ccnc1N Amb23402040 [0,2,0,0,0,0|2,0,0]=4 6659 B9R1.3 Cc1c(I)ccnc1O Amb25307601 [0,2,0,0,0,0|1,0,0]=3 6660 B9R1.3 Cc1c(I)cncc1I Amb8439994 [0,2,0,0,0,0|2,0,0]=4 6661 B9R1.3 Cc1c(N)cccc1Br Amb6366067 [0,2,0,0,0,0|1,0,0]=3 6662 B9R1.3 Cc1c(N)cccc1Cl Amb22277143 [0,2,0,0,0,0|1,0,0]=3 6663 B9R1.3 Cc1c(N)cccc1Cl Amb2686179 [0,2,0,0,0,0|1,0,0]=3 6664 B9R1.3 Cc1c(N)cccc1F Amb2688169 [0,2,0,0,0,0|1,0,0]=3 6665 B9R1.3 Cc1c(N)cccc1I Amb6306638 [0,2,0,0,0,0|1,0,0]=3 6666 B9R1.3 Cc1c(N)cccc1N Amb24065796 [0,2,0,0,0,0|1,0,0]=3 6667 B9R1.3 Cc1c(N)cccc1N Amb4037028 [0,2,0,0,0,0|1,0,0]=3 6668 B9R1.3 Cc1c(N)cccc1N Amb9787430 [0,2,0,0,0,0|1,0,0]=3 6669 B9R1.3 Cc1c(N)cccc1O Amb3941508 [0,2,0,0,0,0|0,0,0]=2 6670 B9R1.3 Cc1c(N)cccc1S Amb18278226 [0,2,0,0,0,0|0,1,0]=3 6671 B9R1.3 Cc1c(N)ccnc1Br Amb18649418 [0,2,0,0,0,0|2,0,0]=4 6672 B9R1.3 Cc1c(N)ccnc1Cl Amb18643952 [0,2,0,0,0,0|2,0,0]=4 6673 B9R1.3 Cc1c(N)ccnc1F Amb23402044 [0,2,0,0,0,0|2,0,0]=4 6674 B9R1.3 Cc1c(N)ccnc1N Amb24707755 [0,2,0,0,0,0|2,0,0]=4 6675 B9R1.3 Cc1c(N)ccnc1O Amb26420540 [0,2,0,0,0,0|1,0,0]=3 6676 B9R1.3 Cc1c(N)cncc1Br Amb2796178 [0,2,0,0,0,0|2,0,0]=4 6677 B9R1.3 Cc1c(N)cncc1Br Amb30585165 [0,2,0,0,0,0|2,0,0]=4 6678 B9R1.3 Cc1c(N)cncc1Cl Amb2796177 [0,2,0,0,0,0|2,0,0]=4 6679 B9R1.3 Cc1c(N)cncc1F Amb23399983 [0,2,0,0,0,0|2,0,0]=4 6680 B9R1.3 Cc1c(N)cncc1I Amb27876968 [0,2,0,0,0,0|2,0,0]=4 6681 B9R1.3 Cc1c(N)cncc1O Amb22498306 [0,2,0,0,0,0|1,0,0]=3 6682 B9R1.3 Cc1c(N)ncnc1O Amb6479179 [0,2,0,0,0,0|2,0,0]=4 6683 B9R1.3 Cc1c(O)ccc[n+]1[O-] Amb26047162 [0,2,0,0,0,0|1,0,0]=3 6684 B9R1.3 Cc1c(O)cccc1Br Amb18129645 [0,2,0,0,0,0|0,0,0]=2 6685 B9R1.3 Cc1c(O)cccc1Cl Amb2686222 [0,2,0,0,0,0|0,0,0]=2 6686 B9R1.3 Cc1c(O)cccc1F Amb8393656 [0,2,0,0,0,0|0,0,0]=2 6687 B9R1.3 Cc1c(O)cccc1I Amb25063898 [0,2,0,0,0,0|0,0,0]=2 6688 B9R1.3 Cc1c(O)cccc1O Amb6297190 [0,2,0,0,0,0|0,0,0]=2 6689 B9R1.3 Cc1c(O)cccc1S Amb24378209 [0,2,0,0,0,0|0,0,0]=2 6690 B9R1.3 Cc1c(O)ccnc1Br Amb24665613 [0,2,0,0,0,0|1,0,0]=3 6691 B9R1.3 Cc1c(O)ccnc1Cl Amb25231995 [0,2,0,0,0,0|1,0,0]=3 6692 B9R1.3 Cc1c(O)ccnc1F Amb24737304 [0,2,0,0,0,0|1,0,0]=3 6693 B9R1.3 Cc1c(O)ccnc1I Amb24640751 [0,2,0,0,0,0|1,0,0]=3 6694 B9R1.3 Cc1c(O)cncc1Br Amb22757361 [0,2,0,0,0,0|1,0,0]=3 6695 B9R1.3 Cc1c(O)cncc1Cl Amb25147097 [0,2,0,0,0,0|1,0,0]=3 6696 B9R1.3 Cc1c(O)cncc1F Amb26078341 [0,2,0,0,0,0|1,0,0]=3 6697 B9R1.3 Cc1c(O)ncnc1Br Amb25269683 [0,2,0,0,0,0|2,0,0]=4 6698 B9R1.3 Cc1c(O)ncnc1Cl Amb10982495 [0,2,0,0,0,0|2,0,0]=4 6699 B9R1.3 Cc1c(O)ncnc1O Amb2610025 [0,2,0,0,0,0|2,0,0]=4 6700 B9R1.3 Cc1c(O)ncnc1S Amb27470592 [0,2,0,0,0,0|2,0,0]=4 6701 B9R1.3 Cc1c(S)cccc1Cl Amb19887946 [0,2,0,0,0,0|0,1,0]=3 6702 B9R1.3 Cc1c(S)cccc1I Amb27838635 [0,2,0,0,0,0|0,1,0]=3 6703 B9R1.3 Cc1ccc[n+]([O-])c1Br Amb20075806 [0,2,0,0,0,0|1,0,1]=4 6704 B9R1.3 Cc1ccc[n+]([O-])c1C Amb8387207 [0,2,0,0,0,0|1,0,1]=4 6705 B9R1.3 Cc1ccc[n+]([O-])c1Cl Amb19959292 [0,2,0,0,0,0|1,0,1]=4 6706 B9R1.3 Cc1ccc[n+]([O-])c1Cl Amb33620592 [0,2,0,0,0,0|1,0,1]=4 6707 B9R1.3 Cc1cccc(Br)c1Br Amb19888185 [0,2,0,0,0,0|1,0,0]=3 6708 B9R1.3 Cc1cccc(Br)c1C Amb2685561 [0,2,0,0,0,0|1,0,0]=3 6709 B9R1.3 Cc1cccc(Br)c1Cl Amb2691984 [0,2,0,0,0,0|1,0,0]=3 6710 B9R1.3 Cc1cccc(Br)c1F Amb10976047 [0,2,0,0,0,0|1,0,0]=3 6711 B9R1.3 Cc1cccc(Br)c1I Amb19888186 [0,2,0,0,0,0|1,0,0]=3 6712 B9R1.3 Cc1cccc(Br)c1N Amb2684155 [0,2,0,0,0,0|1,0,0]=3 6713 B9R1.3 Cc1cccc(Br)c1O Amb18129656 [0,2,0,0,0,0|0,0,0]=2 6714 B9R1.3 Cc1cccc(Br)c1S Amb19893336 [0,2,0,0,0,0|0,1,0]=3 6715 B9R1.3 Cc1cccc(C)[n+]1[O-] Amb8386509 [0,2,0,0,0,0|1,0,1]=4 6716 B9R1.3 Cc1cccc(C)c1Br Amb3939037 [0,2,0,0,0,0|1,0,0]=3 6717 B9R1.3 Cc1cccc(C)c1C Amb9787524 [0,2,0,0,0,0|1,0,0]=3 6718 B9R1.3 Cc1cccc(C)c1Cl Amb6608839 [0,2,0,0,0,0|1,0,0]=3 6719 B9R1.3 Cc1cccc(C)c1F Amb2688559 [0,2,0,0,0,0|1,0,0]=3 6720 B9R1.3 Cc1cccc(C)c1I Amb2688902 [0,2,0,0,0,0|1,0,0]=3 6721 B9R1.3 Cc1cccc(C)c1N Amb18183184 [0,2,0,0,0,0|1,0,0]=3 6722 B9R1.3 Cc1cccc(C)c1N Amb2721025 [0,2,0,0,0,0|1,0,0]=3 6723 B9R1.3 Cc1cccc(C)c1O Amb2609019 [0,2,0,0,0,0|0,0,0]=2 6724 B9R1.3 Cc1cccc(C)c1S Amb2687633 [0,2,0,0,0,0|0,1,0]=3 6725 B9R1.3 Cc1cccc(Cl)c1Br Amb2685048 [0,2,0,0,0,0|1,0,0]=3 6726 B9R1.3 Cc1cccc(Cl)c1C Amb6296146 [0,2,0,0,0,0|1,0,0]=3 6727 B9R1.3 Cc1cccc(Cl)c1Cl Amb6365784 [0,2,0,0,0,0|1,0,0]=3 6728 B9R1.3 Cc1cccc(Cl)c1F Amb8386045 [0,2,0,0,0,0|1,0,0]=3 6729 B9R1.3 Cc1cccc(Cl)c1I Amb6297282 [0,2,0,0,0,0|1,0,0]=3 6730 B9R1.3 Cc1cccc(Cl)c1N Amb2686183 [0,2,0,0,0,0|1,0,0]=3 6731 B9R1.3 Cc1cccc(Cl)c1O Amb2725440 [0,2,0,0,0,0|0,0,0]=2 6732 B9R1.3 Cc1cccc(Cl)c1S Amb4014266 [0,2,0,0,0,0|0,1,0]=3 6733 B9R1.3 Cc1cccc(Cl)n1=O Amb20247465 [0,2,0,0,0,0|1,0,1]=4 6734 B9R1.3 Cc1cccc(F)c1Br Amb8383891 [0,2,0,0,0,0|1,0,0]=3 6735 B9R1.3 Cc1cccc(F)c1C Amb2688557 [0,2,0,0,0,0|1,0,0]=3 6736 B9R1.3 Cc1cccc(F)c1Cl Amb8387983 [0,2,0,0,0,0|1,0,0]=3 6737 B9R1.3 Cc1cccc(F)c1F Amb2687282 [0,2,0,0,0,0|1,0,0]=3 6738 B9R1.3 Cc1cccc(F)c1I Amb15690924 [0,2,0,0,0,0|1,0,0]=3 6739 B9R1.3 Cc1cccc(F)c1N Amb8387985 [0,2,0,0,0,0|1,0,0]=3 6740 B9R1.3 Cc1cccc(F)c1O Amb2447539 [0,2,0,0,0,0|0,0,0]=2 6741 B9R1.3 Cc1cccc(F)c1S Amb19888007 [0,2,0,0,0,0|0,1,0]=3 6742 B9R1.3 Cc1cccc(I)c1Br Amb19888093 [0,2,0,0,0,0|1,0,0]=3 6743 B9R1.3 Cc1cccc(I)c1C Amb2688900 [0,2,0,0,0,0|1,0,0]=3 6744 B9R1.3 Cc1cccc(I)c1Cl Amb21856924 [0,2,0,0,0,0|1,0,0]=3 6745 B9R1.3 Cc1cccc(I)c1F Amb8629415 [0,2,0,0,0,0|1,0,0]=3 6746 B9R1.3 Cc1cccc(I)c1I Amb27796320 [0,2,0,0,0,0|1,0,0]=3 6747 B9R1.3 Cc1cccc(I)c1N Amb22228854 [0,2,0,0,0,0|1,0,0]=3 6748 B9R1.3 Cc1cccc(I)c1O Amb27188957 [0,2,0,0,0,0|0,0,0]=2 6749 B9R1.3 Cc1cccc(I)c1S Amb27838653 [0,2,0,0,0,0|0,1,0]=3 6750 B9R1.3 Cc1cccc(N)[n+]1[O-] Amb2610672 [0,2,0,0,0,0|1,0,1]=4 6751 B9R1.3 Cc1cccc(N)c1Br Amb8439219 [0,2,0,0,0,0|1,0,0]=3 6752 B9R1.3 Cc1cccc(N)c1C Amb1239130 [0,2,0,0,0,0|1,0,0]=3 6753 B9R1.3 Cc1cccc(N)c1C Amb22228304 [0,2,0,0,0,0|1,0,0]=3 6754 B9R1.3 Cc1cccc(N)c1Cl Amb18643724 [0,2,0,0,0,0|1,0,0]=3 6755 B9R1.3 Cc1cccc(N)c1F Amb6297677 [0,2,0,0,0,0|1,0,0]=3 6756 B9R1.3 Cc1cccc(N)c1I Amb7970240 [0,2,0,0,0,0|1,0,0]=3 6757 B9R1.3 Cc1cccc(N)c1N Amb2696321 [0,2,0,0,0,0|1,0,0]=3 6758 B9R1.3 Cc1cccc(N)c1O Amb1931716 [0,2,0,0,0,0|0,0,0]=2 6759 B9R1.3 Cc1cccc(N)c1O Amb22587115 [0,2,0,0,0,0|0,0,0]=2 6760 B9R1.3 Cc1cccc(N)c1S Amb26549985 [0,2,0,0,0,0|0,1,0]=3 6761 B9R1.3 Cc1cccc(O)c1Br Amb16230934 [0,2,0,0,0,0|0,0,0]=2 6762 B9R1.3 Cc1cccc(O)c1C Amb2711008 [0,2,0,0,0,0|0,0,0]=2 6763 B9R1.3 Cc1cccc(O)c1Cl Amb18643978 [0,2,0,0,0,0|0,0,0]=2 6764 B9R1.3 Cc1cccc(O)c1F Amb10603594 [0,2,0,0,0,0|0,0,0]=2 6765 B9R1.3 Cc1cccc(O)c1I Amb26334781 [0,2,0,0,0,0|0,0,0]=2 6766 B9R1.3 Cc1cccc(O)c1N Amb4037081 [0,2,0,0,0,0|0,0,0]=2 6767 B9R1.3 Cc1cccc(O)c1O Amb1211946 [0,2,0,0,0,0|0,0,0]=2 6768 B9R1.3 Cc1cccc(O)c1S Amb26616924 [0,2,0,0,0,0|0,0,0]=2 6769 B9R1.3 Cc1cccc(S)c1Br Amb19890213 [0,2,0,0,0,0|0,1,0]=3 6770 B9R1.3 Cc1cccc(S)c1C Amb17672774 [0,2,0,0,0,0|0,1,0]=3 6771 B9R1.3 Cc1cccc(S)c1Cl Amb27410841 [0,2,0,0,0,0|0,1,0]=3 6772 B9R1.3 Cc1cccc(S)c1F Amb22735370 [0,2,0,0,0,0|0,1,0]=3 6773 B9R1.3 Cc1cccc(S)c1I Amb28318038 [0,2,0,0,0,0|0,1,0]=3 6774 B9R1.3 Cc1cccc(S)c1N Amb18124553 [0,2,0,0,0,0|0,1,0]=3 6775 B9R1.3 Cc1cccc(S)c1O Amb28285870 [0,2,0,0,0,0|0,0,0]=2 6776 B9R1.3 Cc1cccn(C)c1=S Amb2611999 [0,2,0,0,0,0|1,1,0]=4 6777 B9R1.3 Cc1ccnc(Br)c1Br Amb8396955 [0,2,0,0,0,0|2,0,0]=4 6778 B9R1.3 Cc1ccnc(Br)c1C Amb10573527 [0,2,0,0,0,0|2,0,0]=4 6779 B9R1.3 Cc1ccnc(Br)c1Cl Amb22304737 [0,2,0,0,0,0|2,0,0]=4 6780 B9R1.3 Cc1ccnc(Br)c1F Amb8393008 [0,2,0,0,0,0|2,0,0]=4 6781 B9R1.3 Cc1ccnc(Br)c1I Amb8393014 [0,2,0,0,0,0|2,0,0]=4 6782 B9R1.3 Cc1ccnc(Br)c1N Amb8392982 [0,2,0,0,0,0|2,0,0]=4 6783 B9R1.3 Cc1ccnc(Br)c1O Amb22494199 [0,2,0,0,0,0|1,0,0]=3 6784 B9R1.3 Cc1ccnc(C)c1Br Amb19958189 [0,2,0,0,0,0|2,0,0]=4 6785 B9R1.3 Cc1ccnc(C)c1C Amb24407700 [0,2,0,0,0,0|2,0,0]=4 6786 B9R1.3 Cc1ccnc(C)c1Cl Amb26031620 [0,2,0,0,0,0|2,0,0]=4 6787 B9R1.3 Cc1ccnc(C)c1F Amb27771896 [0,2,0,0,0,0|2,0,0]=4 6788 B9R1.3 Cc1ccnc(C)c1I Amb24647617 [0,2,0,0,0,0|2,0,0]=4 6789 B9R1.3 Cc1ccnc(C)c1N Amb10071733 [0,2,0,0,0,0|2,0,0]=4 6790 B9R1.3 Cc1ccnc(C)c1O Amb10072026 [0,2,0,0,0,0|1,0,0]=3 6791 B9R1.3 Cc1ccnc(Cl)c1Br Amb8393001 [0,2,0,0,0,0|2,0,0]=4 6792 B9R1.3 Cc1ccnc(Cl)c1C Amb22497685 [0,2,0,0,0,0|2,0,0]=4 6793 B9R1.3 Cc1ccnc(Cl)c1Cl Amb8396957 [0,2,0,0,0,0|2,0,0]=4 6794 B9R1.3 Cc1ccnc(Cl)c1F Amb8387988 [0,2,0,0,0,0|2,0,0]=4 6795 B9R1.3 Cc1ccnc(Cl)c1N Amb2684376 [0,2,0,0,0,0|2,0,0]=4 6796 B9R1.3 Cc1ccnc(Cl)c1O Amb19959010 [0,2,0,0,0,0|1,0,0]=3 6797 B9R1.3 Cc1ccnc(F)c1Br Amb10603671 [0,2,0,0,0,0|2,0,0]=4 6798 B9R1.3 Cc1ccnc(F)c1C Amb23402043 [0,2,0,0,0,0|2,0,0]=4 6799 B9R1.3 Cc1ccnc(F)c1Cl Amb26364549 [0,2,0,0,0,0|2,0,0]=4 6800 B9R1.3 Cc1ccnc(F)c1I Amb22490018 [0,2,0,0,0,0|2,0,0]=4 6801 B9R1.3 Cc1ccnc(F)c1N Amb8392984 [0,2,0,0,0,0|2,0,0]=4 6802 B9R1.3 Cc1ccnc(F)c1O Amb28145892 [0,2,0,0,0,0|1,0,0]=3 6803 B9R1.3 Cc1ccnc(I)c1Br Amb24394563 [0,2,0,0,0,0|2,0,0]=4 6804 B9R1.3 Cc1ccnc(I)c1C Amb27241058 [0,2,0,0,0,0|2,0,0]=4 6805 B9R1.3 Cc1ccnc(I)c1F Amb4560981 [0,2,0,0,0,0|2,0,0]=4 6806 B9R1.3 Cc1ccnc(I)c1I Amb27817132 [0,2,0,0,0,0|2,0,0]=4 6807 B9R1.3 Cc1ccnc(I)c1N Amb25857256 [0,2,0,0,0,0|2,0,0]=4 6808 B9R1.3 Cc1ccnc(I)c1O Amb27230438 [0,2,0,0,0,0|1,0,0]=3 6809 B9R1.3 Cc1ccnc(N)c1Br Amb10601932 [0,2,0,0,0,0|2,0,0]=4 6810 B9R1.3 Cc1ccnc(N)c1C Amb18642060 [0,2,0,0,0,0|2,0,0]=4 6811 B9R1.3 Cc1ccnc(N)c1Cl Amb16233764 [0,2,0,0,0,0|2,0,0]=4 6812 B9R1.3 Cc1ccnc(N)c1F Amb22292016 [0,2,0,0,0,0|2,0,0]=4 6813 B9R1.3 Cc1ccnc(N)c1I Amb21857591 [0,2,0,0,0,0|2,0,0]=4 6814 B9R1.3 Cc1ccnc(N)c1N Amb4037947 [0,2,0,0,0,0|2,0,0]=4 6815 B9R1.3 Cc1ccnc(O)c1Br Amb15691034 [0,2,0,0,0,0|1,0,0]=3 6816 B9R1.3 Cc1ccnc(O)c1C Amb22494729 [0,2,0,0,0,0|1,0,0]=3 6817 B9R1.3 Cc1ccnc(O)c1N Amb20242716 [0,2,0,0,0,0|1,0,0]=3 6818 B9R1.3 Cc1ccnc(S)c1N Amb18202838 [0,2,0,0,0,0|1,1,0]=4 6819 B9R1.3 Cc1cncc(Br)c1Br Amb27209904 [0,2,0,0,0,0|2,0,0]=4 6820 B9R1.3 Cc1cncc(Br)c1C Amb21864627 [0,2,0,0,0,0|2,0,0]=4 6821 B9R1.3 Cc1cncc(Br)c1Cl Amb23401809 [0,2,0,0,0,0|2,0,0]=4 6822 B9R1.3 Cc1cncc(Br)c1Cl Amb32652548 [0,2,0,0,0,0|2,0,0]=4 6823 B9R1.3 Cc1cncc(Br)c1F Amb27645181 [0,2,0,0,0,0|2,0,0]=4 6824 B9R1.3 Cc1cncc(Br)c1N Amb16233913 [0,2,0,0,0,0|2,0,0]=4 6825 B9R1.3 Cc1cncc(C)c1Br Amb15692896 [0,2,0,0,0,0|2,0,0]=4 6826 B9R1.3 Cc1cncc(C)c1Br Amb16185773 [0,2,0,0,0,0|2,0,0]=4 6827 B9R1.3 Cc1cncc(C)c1C Amb27161535 [0,2,0,0,0,0|2,0,0]=4 6828 B9R1.3 Cc1cncc(C)c1Cl Amb19889393 [0,2,0,0,0,0|2,0,0]=4 6829 B9R1.3 Cc1cncc(C)c1Cl Amb22546332 [0,2,0,0,0,0|2,0,0]=4 6830 B9R1.3 Cc1cncc(C)c1I Amb26573184 [0,2,0,0,0,0|2,0,0]=4 6831 B9R1.3 Cc1cncc(C)c1N Amb3862126 [0,2,0,0,0,0|2,0,0]=4 6832 B9R1.3 Cc1cncc(Cl)c1Br Amb24478709 [0,2,0,0,0,0|2,0,0]=4 6833 B9R1.3 Cc1cncc(Cl)c1C Amb27803946 [0,2,0,0,0,0|2,0,0]=4 6834 B9R1.3 Cc1cncc(Cl)c1Cl Amb23401808 [0,2,0,0,0,0|2,0,0]=4 6835 B9R1.3 Cc1cncc(Cl)c1F Amb27453634 [0,2,0,0,0,0|2,0,0]=4 6836 B9R1.3 Cc1cncc(Cl)c1N Amb18124616 [0,2,0,0,0,0|2,0,0]=4 6837 B9R1.3 Cc1cncc(F)c1Br Amb27607183 [0,2,0,0,0,0|2,0,0]=4 6838 B9R1.3 Cc1cncc(F)c1C Amb28130071 [0,2,0,0,0,0|2,0,0]=4 6839 B9R1.3 Cc1cncc(F)c1Cl Amb23399631 [0,2,0,0,0,0|2,0,0]=4 6840 B9R1.3 Cc1cncc(F)c1F Amb24579795 [0,2,0,0,0,0|2,0,0]=4 6841 B9R1.3 Cc1cncc(F)c1I Amb26974423 [0,2,0,0,0,0|2,0,0]=4 6842 B9R1.3 Cc1cncc(I)c1C Amb24537103 [0,2,0,0,0,0|2,0,0]=4 6843 B9R1.3 Cc1cncc(I)c1Cl Amb23401810 [0,2,0,0,0,0|2,0,0]=4 6844 B9R1.3 Cc1cncc(I)c1F Amb25239000 [0,2,0,0,0,0|2,0,0]=4 6845 B9R1.3 Cc1cncc(I)c1I Amb24697060 [0,2,0,0,0,0|2,0,0]=4 6846 B9R1.3 Cc1cncc(I)c1O Amb25222798 [0,2,0,0,0,0|1,0,0]=3 6847 B9R1.3 Cc1cncc(N)c1Br Amb27812307 [0,2,0,0,0,0|2,0,0]=4 6848 B9R1.3 Cc1cncc(N)c1C Amb25293935 [0,2,0,0,0,0|2,0,0]=4 6849 B9R1.3 Cc1cncc(N)c1Cl Amb28285260 [0,2,0,0,0,0|2,0,0]=4 6850 B9R1.3 Cc1cncc(N)c1F Amb24478588 [0,2,0,0,0,0|2,0,0]=4 6851 B9R1.3 Cc1cncc(N)c1N Amb19890101 [0,2,0,0,0,0|2,0,0]=4 6852 B9R1.3 Cc1cncc(N)c1O Amb26397482 [0,2,0,0,0,0|1,0,0]=3 6853 B9R1.3 Cc1cncc(O)c1Br Amb27842444 [0,2,0,0,0,0|1,0,0]=3 6854 B9R1.3 Cc1cncc(O)c1C Amb28140645 [0,2,0,0,0,0|1,0,0]=3 6855 B9R1.3 Cc1cncc(O)c1Cl Amb25147015 [0,2,0,0,0,0|1,0,0]=3 6856 B9R1.3 Cc1cncc(O)c1F Amb27494248 [0,2,0,0,0,0|1,0,0]=3 6857 B9R1.3 Cc1cncc(O)c1I Amb25364600 [0,2,0,0,0,0|1,0,0]=3 6858 B9R1.3 Cc1cncc(O)c1N Amb27482049 [0,2,0,0,0,0|1,0,0]=3 6859 B9R1.3 Cc1nccc(Br)c1Br Amb24320276 [0,2,0,0,0,0|2,0,0]=4 6860 B9R1.3 Cc1nccc(Br)c1C Amb21857943 [0,2,0,0,0,0|2,0,0]=4 6861 B9R1.3 Cc1nccc(Br)c1C Amb22500963 [0,2,0,0,0,0|2,0,0]=4 6862 B9R1.3 Cc1nccc(Br)c1Cl Amb25113811 [0,2,0,0,0,0|2,0,0]=4 6863 B9R1.3 Cc1nccc(Br)c1F Amb22641441 [0,2,0,0,0,0|2,0,0]=4 6864 B9R1.3 Cc1nccc(Br)c1F Amb31308506 [0,2,0,0,0,0|2,0,0]=4 6865 B9R1.3 Cc1nccc(Br)c1I Amb25048936 [0,2,0,0,0,0|2,0,0]=4 6866 B9R1.3 Cc1nccc(Br)c1N Amb18129216 [0,2,0,0,0,0|2,0,0]=4 6867 B9R1.3 Cc1nccc(Cl)c1Br Amb25982378 [0,2,0,0,0,0|2,0,0]=4 6868 B9R1.3 Cc1nccc(Cl)c1Cl Amb10602175 [0,2,0,0,0,0|2,0,0]=4 6869 B9R1.3 Cc1nccc(Cl)c1F Amb21964581 [0,2,0,0,0,0|2,0,0]=4 6870 B9R1.3 Cc1nccc(Cl)c1I Amb23455399 [0,2,0,0,0,0|2,0,0]=4 6871 B9R1.3 Cc1nccc(F)c1Br Amb28122855 [0,2,0,0,0,0|2,0,0]=4 6872 B9R1.3 Cc1nccc(F)c1C Amb27625350 [0,2,0,0,0,0|2,0,0]=4 6873 B9R1.3 Cc1nccc(F)c1F Amb27424699 [0,2,0,0,0,0|2,0,0]=4 6874 B9R1.3 Cc1nccc(F)c1I Amb27494283 [0,2,0,0,0,0|2,0,0]=4 6875 B9R1.3 Cc1nccc(F)c1N Amb25321860 [0,2,0,0,0,0|2,0,0]=4 6876 B9R1.3 Cc1nccc(F)c1O Amb25147102 [0,2,0,0,0,0|1,0,0]=3 6877 B9R1.3 Cc1nccc(I)c1Br Amb27815654 [0,2,0,0,0,0|2,0,0]=4 6878 B9R1.3 Cc1nccc(I)c1C Amb24696785 [0,2,0,0,0,0|2,0,0]=4 6879 B9R1.3 Cc1nccc(I)c1Cl Amb23455183 [0,2,0,0,0,0|2,0,0]=4 6880 B9R1.3 Cc1nccc(I)c1I Amb27947303 [0,2,0,0,0,0|2,0,0]=4 6881 B9R1.3 Cc1nccc(I)c1N Amb25349437 [0,2,0,0,0,0|2,0,0]=4 6882 B9R1.3 Cc1nccc(I)c1O Amb27424716 [0,2,0,0,0,0|1,0,0]=3 6883 B9R1.3 Cc1nccc(N)c1Br Amb18128885 [0,2,0,0,0,0|2,0,0]=4 6884 B9R1.3 Cc1nccc(N)c1C Amb2694198 [0,2,0,0,0,0|2,0,0]=4 6885 B9R1.3 Cc1nccc(N)c1Cl Amb10602282 [0,2,0,0,0,0|2,0,0]=4 6886 B9R1.3 Cc1nccc(N)c1F Amb24384079 [0,2,0,0,0,0|2,0,0]=4 6887 B9R1.3 Cc1nccc(N)c1N Amb10602120 [0,2,0,0,0,0|2,0,0]=4 6888 B9R1.3 Cc1nccc(N)c1O Amb27223013 [0,2,0,0,0,0|1,0,0]=3 6889 B9R1.3 Cc1nccc(O)c1C Amb24320651 [0,2,0,0,0,0|1,0,0]=3 6890 B9R1.3 Cc1nccc(O)c1Cl Amb26600948 [0,2,0,0,0,0|1,0,0]=3 6891 B9R1.3 Cc1nccc(O)c1F Amb25349324 [0,2,0,0,0,0|1,0,0]=3 6892 B9R1.3 Cc1nccc(O)c1I Amb27482856 [0,2,0,0,0,0|1,0,0]=3 6893 B9R1.3 Cc1nccc(O)c1N Amb24433398 [0,2,0,0,0,0|1,0,0]=3 6894 B9R1.3 Cc1nccc(O)c1O Amb3777469 [0,2,0,0,0,0|1,0,0]=3 6895 B9R1.3 Cc1ncnc(Br)c1O Amb26421916 [0,2,0,0,0,0|2,0,0]=4 6896 B9R1.3 Cc1ncnc(C)c1O Amb10602399 [0,2,0,0,0,0|2,0,0]=4 6897 B9R1.3 Cc1ncnc(O)c1Br Amb2615411 [0,2,0,0,0,0|2,0,0]=4 6898 B9R1.3 Cc1ncnc(O)c1C Amb10605233 [0,2,0,0,0,0|2,0,0]=4 6899 B9R1.3 Cc1ncnc(O)c1F Amb4016303 [0,2,0,0,0,0|2,0,0]=4 6900 B9R1.3 Cc1occc(=S)c1O Amb2612067 [0,2,0,0,0,0|1,0,0]=3 6901 B9R1.3 Clc1c(Br)cccc1Br Amb13883636 [0,2,0,0,0,0|1,0,0]=3 6902 B9R1.3 Clc1c(Br)cccc1I Amb19890923 [0,2,0,0,0,0|1,0,0]=3 6903 B9R1.3 Clc1c(Br)ccnc1Br Amb2609477 [0,2,0,0,0,0|2,0,0]=4 6904 B9R1.3 Clc1c(Br)cncc1Br Amb2609478 [0,2,0,0,0,0|2,0,0]=4 6905 B9R1.3 Clc1c(Br)cncc1I Amb26444333 [0,2,0,0,0,0|2,0,0]=4 6906 B9R1.3 Clc1c(I)ccnc1Br Amb27229421 [0,2,0,0,0,0|2,0,0]=4 6907 B9R1.3 Clc1c(I)ccnc1I Amb22753955 [0,2,0,0,0,0|2,0,0]=4 6908 B9R1.3 Clc1c(I)cncc1I Amb22388222 [0,2,0,0,0,0|2,0,0]=4 6909 B9R1.3 Clc1cccc(Br)c1Br Amb2700663 [0,2,0,0,0,0|1,0,0]=3 6910 B9R1.3 Clc1cccc(Br)c1Cl Amb3940226 [0,2,0,0,0,0|1,0,0]=3 6911 B9R1.3 Clc1cccc(Br)c1I Amb19888971 [0,2,0,0,0,0|1,0,0]=3 6912 B9R1.3 Clc1cccc(Cl)c1Br Amb3940228 [0,2,0,0,0,0|1,0,0]=3 6913 B9R1.3 Clc1cccc(Cl)c1Cl Amb6365746 [0,2,0,0,0,0|1,0,0]=3 6914 B9R1.3 Clc1cccc(Cl)c1I Amb2686868 [0,2,0,0,0,0|1,0,0]=3 6915 B9R1.3 Clc1cccc(I)c1Br Amb24088473 [0,2,0,0,0,0|1,0,0]=3 6916 B9R1.3 Clc1cccc(I)c1Cl Amb2686865 [0,2,0,0,0,0|1,0,0]=3 6917 B9R1.3 Clc1ccnc(Br)c1Br Amb24374181 [0,2,0,0,0,0|2,0,0]=4 6918 B9R1.3 Clc1ccnc(Br)c1Cl Amb27876826 [0,2,0,0,0,0|2,0,0]=4 6919 B9R1.3 Clc1ccnc(Br)c1I Amb22755190 [0,2,0,0,0,0|2,0,0]=4 6920 B9R1.3 Clc1ccnc(Cl)c1Br Amb19889380 [0,2,0,0,0,0|2,0,0]=4 6921 B9R1.3 Clc1ccnc(Cl)c1Cl Amb22263357 [0,2,0,0,0,0|2,0,0]=4 6922 B9R1.3 Clc1ccnc(Cl)c1I Amb8394513 [0,2,0,0,0,0|2,0,0]=4 6923 B9R1.3 Clc1ccnc(I)c1Br Amb27199397 [0,2,0,0,0,0|2,0,0]=4 6924 B9R1.3 Clc1ccnc(I)c1Cl Amb27199841 [0,2,0,0,0,0|2,0,0]=4 6925 B9R1.3 Clc1ccnc(I)c1I Amb25270156 [0,2,0,0,0,0|2,0,0]=4 6926 B9R1.3 Clc1cncc(Br)c1Cl Amb21858973 [0,2,0,0,0,0|2,0,0]=4 6927 B9R1.3 Clc1cncc(Br)c1I Amb23401811 [0,2,0,0,0,0|2,0,0]=4 6928 B9R1.3 Clc1cncc(Cl)c1Br Amb8629362 [0,2,0,0,0,0|2,0,0]=4 6929 B9R1.3 Clc1cncc(Cl)c1Cl Amb4477282 [0,2,0,0,0,0|2,0,0]=4 6930 B9R1.3 Clc1cncc(Cl)c1I Amb10071530 [0,2,0,0,0,0|2,0,0]=4 6931 B9R1.3 Clc1cncc(I)c1Br Amb25924271 [0,2,0,0,0,0|2,0,0]=4 6932 B9R1.3 Clc1cncc(I)c1Cl Amb23400380 [0,2,0,0,0,0|2,0,0]=4 6933 B9R1.3 Clc1nccc(Br)c1Br Amb25270660 [0,2,0,0,0,0|2,0,0]=4 6934 B9R1.3 Clc1nccc(Br)c1Cl Amb8396778 [0,2,0,0,0,0|2,0,0]=4 6935 B9R1.3 Clc1nccc(Br)c1I Amb4560939 [0,2,0,0,0,0|2,0,0]=4 6936 B9R1.3 Clc1nccc(I)c1Br Amb4560932 [0,2,0,0,0,0|2,0,0]=4 6937 B9R1.3 Clc1nccc(I)c1Cl Amb10975394 [0,2,0,0,0,0|2,0,0]=4 6938 B9R1.3 Clc1nccc(I)c1I Amb22755262 [0,2,0,0,0,0|2,0,0]=4 6939 B9R1.3 Cn1cccc(Cl)c1=S Amb2612036 [0,2,0,0,0,0|1,1,0]=4 6940 B9R1.3 F[n+]1c(Cl)cccc1Cl Amb10839747 [0,2,0,0,0,0|2,0,0]=4 6941 B9R1.3 F[n+]1c(Cl)cccc1Cl Amb2688086 [0,2,0,0,0,0|2,0,0]=4 6942 B9R1.3 Fc1c(Br)cccc1Br Amb19893110 [0,2,0,0,0,0|1,0,0]=3 6943 B9R1.3 Fc1c(Br)cccc1I Amb19893105 [0,2,0,0,0,0|1,0,0]=3 6944 B9R1.3 Fc1c(Br)ccnc1Br Amb26532800 [0,2,0,0,0,0|2,0,0]=4 6945 B9R1.3 Fc1c(Br)ccnc1Cl Amb19892641 [0,2,0,0,0,0|2,0,0]=4 6946 B9R1.3 Fc1c(Br)ccnc1S Amb27408656 [0,2,0,0,0,0|1,1,0]=4 6947 B9R1.3 Fc1c(Br)cncc1Br Amb24478772 [0,2,0,0,0,0|2,0,0]=4 6948 B9R1.3 Fc1c(Br)cncc1I Amb24441724 [0,2,0,0,0,0|2,0,0]=4 6949 B9R1.3 Fc1c(Cl)cccc1Br Amb2691961 [0,2,0,0,0,0|1,0,0]=3 6950 B9R1.3 Fc1c(Cl)cccc1Cl Amb2686835 [0,2,0,0,0,0|1,0,0]=3 6951 B9R1.3 Fc1c(Cl)cccc1I Amb2686002 [0,2,0,0,0,0|1,0,0]=3 6952 B9R1.3 Fc1c(Cl)ccnc1Br Amb22233804 [0,2,0,0,0,0|2,0,0]=4 6953 B9R1.3 Fc1c(Cl)ccnc1Cl Amb20248125 [0,2,0,0,0,0|2,0,0]=4 6954 B9R1.3 Fc1c(Cl)ccnc1I Amb25790526 [0,2,0,0,0,0|2,0,0]=4 6955 B9R1.3 Fc1c(Cl)cncc1Br Amb25132285 [0,2,0,0,0,0|2,0,0]=4 6956 B9R1.3 Fc1c(Cl)cncc1Cl Amb8629052 [0,2,0,0,0,0|2,0,0]=4 6957 B9R1.3 Fc1c(Cl)cncc1I Amb25288621 [0,2,0,0,0,0|2,0,0]=4 6958 B9R1.3 Fc1c(I)cccc1I Amb22547561 [0,2,0,0,0,0|1,0,0]=3 6959 B9R1.3 Fc1c(I)ccnc1Cl Amb15690995 [0,2,0,0,0,0|2,0,0]=4 6960 B9R1.3 Fc1c(I)ccnc1I Amb13890386 [0,2,0,0,0,0|2,0,0]=4 6961 B9R1.3 Fc1c(I)ccnc1S Amb25218644 [0,2,0,0,0,0|1,1,0]=4 6962 B9R1.3 Fc1c(S)cccc1Br Amb19893234 [0,2,0,0,0,0|0,1,0]=3 6963 B9R1.3 Fc1c(S)cccc1Cl Amb19944191 [0,2,0,0,0,0|0,1,0]=3 6964 B9R1.3 Fc1c(S)cccc1I Amb27222566 [0,2,0,0,0,0|0,1,0]=3 6965 B9R1.3 Fc1c(S)ccnc1Br Amb27597108 [0,2,0,0,0,0|1,1,0]=4 6966 B9R1.3 Fc1c(S)ccnc1Cl Amb24627298 [0,2,0,0,0,0|1,1,0]=4 6967 B9R1.3 Fc1cccc(Br)c1Br Amb2700707 [0,2,0,0,0,0|1,0,0]=3 6968 B9R1.3 Fc1cccc(Br)c1Cl Amb8397054 [0,2,0,0,0,0|1,0,0]=3 6969 B9R1.3 Fc1cccc(Br)c1F Amb2685089 [0,2,0,0,0,0|1,0,0]=3 6970 B9R1.3 Fc1cccc(Br)c1I Amb10838566 [0,2,0,0,0,0|1,0,0]=3 6971 B9R1.3 Fc1cccc(Br)c1S Amb19890193 [0,2,0,0,0,0|0,1,0]=3 6972 B9R1.3 Fc1cccc(Cl)c1Br Amb19887217 [0,2,0,0,0,0|1,0,0]=3 6973 B9R1.3 Fc1cccc(Cl)c1Cl Amb2686833 [0,2,0,0,0,0|1,0,0]=3 6974 B9R1.3 Fc1cccc(Cl)c1F Amb10607116 [0,2,0,0,0,0|1,0,0]=3 6975 B9R1.3 Fc1cccc(Cl)c1I Amb10839300 [0,2,0,0,0,0|1,0,0]=3 6976 B9R1.3 Fc1cccc(Cl)c1S Amb19943973 [0,2,0,0,0,0|0,1,0]=3 6977 B9R1.3 Fc1cccc(F)c1Br Amb2685092 [0,2,0,0,0,0|1,0,0]=3 6978 B9R1.3 Fc1cccc(F)c1Cl Amb6296215 [0,2,0,0,0,0|1,0,0]=3 6979 B9R1.3 Fc1cccc(F)c1F Amb2690728 [0,2,0,0,0,0|1,0,0]=3 6980 B9R1.3 Fc1cccc(F)c1I Amb2694489 [0,2,0,0,0,0|1,0,0]=3 6981 B9R1.3 Fc1cccc(F)c1S Amb19887936 [0,2,0,0,0,0|0,1,0]=3 6982 B9R1.3 Fc1cccc(I)c1Br Amb19888846 [0,2,0,0,0,0|1,0,0]=3 6983 B9R1.3 Fc1cccc(I)c1F Amb8395257 [0,2,0,0,0,0|1,0,0]=3 6984 B9R1.3 Fc1cccc(I)c1I Amb19888845 [0,2,0,0,0,0|1,0,0]=3 6985 B9R1.3 Fc1cccc(I)c1S Amb25188970 [0,2,0,0,0,0|0,1,0]=3 6986 B9R1.3 Fc1cccc(S)c1Br Amb27447807 [0,2,0,0,0,0|0,1,0]=3 6987 B9R1.3 Fc1cccc(S)c1Cl Amb19888011 [0,2,0,0,0,0|0,1,0]=3 6988 B9R1.3 Fc1cccc(S)c1F Amb19890249 [0,2,0,0,0,0|0,1,0]=3 6989 B9R1.3 Fc1cccc(S)c1I Amb27838641 [0,2,0,0,0,0|0,1,0]=3 6990 B9R1.3 Fc1ccnc(Br)c1Cl Amb26513039 [0,2,0,0,0,0|2,0,0]=4 6991 B9R1.3 Fc1ccnc(Br)c1F Amb25312220 [0,2,0,0,0,0|2,0,0]=4 6992 B9R1.3 Fc1ccnc(Br)c1I Amb27954955 [0,2,0,0,0,0|2,0,0]=4 6993 B9R1.3 Fc1ccnc(Cl)c1Br Amb19892704 [0,2,0,0,0,0|2,0,0]=4 6994 B9R1.3 Fc1ccnc(Cl)c1Cl Amb25114150 [0,2,0,0,0,0|2,0,0]=4 6995 B9R1.3 Fc1ccnc(Cl)c1I Amb19892517 [0,2,0,0,0,0|2,0,0]=4 6996 B9R1.3 Fc1ccnc(F)c1Br Amb19892701 [0,2,0,0,0,0|2,0,0]=4 6997 B9R1.3 Fc1ccnc(F)c1Cl Amb21857343 [0,2,0,0,0,0|2,0,0]=4 6998 B9R1.3 Fc1ccnc(F)c1F Amb22002208 [0,2,0,0,0,0|2,0,0]=4 6999 B9R1.3 Fc1ccnc(F)c1I Amb8388364 [0,2,0,0,0,0|2,0,0]=4 7000 B9R1.3 Fc1ccnc(F)c1S Amb26424601 [0,2,0,0,0,0|1,1,0]=4 7001 B9R1.3 Fc1ccnc(I)c1Br Amb25828622 [0,2,0,0,0,0|2,0,0]=4 7002 B9R1.3 Fc1ccnc(I)c1Cl Amb24559235 [0,2,0,0,0,0|2,0,0]=4 7003 B9R1.3 Fc1ccnc(I)c1F Amb27240066 [0,2,0,0,0,0|2,0,0]=4 7004 B9R1.3 Fc1ccnc(I)c1S Amb26595510 [0,2,0,0,0,0|1,1,0]=4 7005 B9R1.3 Fc1ccnc(S)c1Cl Amb25938425 [0,2,0,0,0,0|1,1,0]=4 7006 B9R1.3 Fc1ccnc(S)c1I Amb27613823 [0,2,0,0,0,0|1,1,0]=4 7007 B9R1.3 Fc1cncc(Br)c1Br Amb19892717 [0,2,0,0,0,0|2,0,0]=4 7008 B9R1.3 Fc1cncc(Br)c1Cl Amb23399834 [0,2,0,0,0,0|2,0,0]=4 7009 B9R1.3 Fc1cncc(Br)c1Cl Amb32409422 [0,2,0,0,0,0|2,0,0]=4 7010 B9R1.3 Fc1cncc(Br)c1F Amb26381564 [0,2,0,0,0,0|2,0,0]=4 7011 B9R1.3 Fc1cncc(Br)c1I Amb19892718 [0,2,0,0,0,0|2,0,0]=4 7012 B9R1.3 Fc1cncc(Cl)c1Br Amb22641430 [0,2,0,0,0,0|2,0,0]=4 7013 B9R1.3 Fc1cncc(Cl)c1Cl Amb22547225 [0,2,0,0,0,0|2,0,0]=4 7014 B9R1.3 Fc1cncc(Cl)c1F Amb10606389 [0,2,0,0,0,0|2,0,0]=4 7015 B9R1.3 Fc1cncc(Cl)c1I Amb22546692 [0,2,0,0,0,0|2,0,0]=4 7016 B9R1.3 Fc1cncc(F)c1Br Amb10067810 [0,2,0,0,0,0|2,0,0]=4 7017 B9R1.3 Fc1cncc(F)c1Cl Amb10606392 [0,2,0,0,0,0|2,0,0]=4 7018 B9R1.3 Fc1cncc(F)c1Cl Amb31205692 [0,2,0,0,0,0|2,0,0]=4 7019 B9R1.3 Fc1cncc(F)c1F Amb10603651 [0,2,0,0,0,0|2,0,0]=4 7020 B9R1.3 Fc1cncc(F)c1I Amb21959394 [0,2,0,0,0,0|2,0,0]=4 7021 B9R1.3 Fc1cncc(F)c1S Amb27209646 [0,2,0,0,0,0|1,1,0]=4 7022 B9R1.3 Fc1cncc(I)c1Br Amb28070451 [0,2,0,0,0,0|2,0,0]=4 7023 B9R1.3 Fc1cncc(I)c1Cl Amb23401807 [0,2,0,0,0,0|2,0,0]=4 7024 B9R1.3 Fc1cncc(I)c1F Amb26894980 [0,2,0,0,0,0|2,0,0]=4 7025 B9R1.3 Fc1cncc(I)c1S Amb27848606 [0,2,0,0,0,0|1,1,0]=4 7026 B9R1.3 Fc1cncc(S)c1Cl Amb26616307 [0,2,0,0,0,0|1,1,0]=4 7027 B9R1.3 Fc1cncc(S)c1F Amb27636476 [0,2,0,0,0,0|1,1,0]=4 7028 B9R1.3 Fc1cncc(S)c1I Amb24566565 [0,2,0,0,0,0|1,1,0]=4 7029 B9R1.3 Fc1nccc(Br)c1Br Amb21856429 [0,2,0,0,0,0|2,0,0]=4 7030 B9R1.3 Fc1nccc(Br)c1Cl Amb19889424 [0,2,0,0,0,0|2,0,0]=4 7031 B9R1.3 Fc1nccc(Br)c1F Amb19892686 [0,2,0,0,0,0|2,0,0]=4 7032 B9R1.3 Fc1nccc(Br)c1I Amb21927764 [0,2,0,0,0,0|2,0,0]=4 7033 B9R1.3 Fc1nccc(Br)c1S Amb28186539 [0,2,0,0,0,0|1,1,0]=4 7034 B9R1.3 Fc1nccc(Cl)c1Br Amb27647343 [0,2,0,0,0,0|2,0,0]=4 7035 B9R1.3 Fc1nccc(Cl)c1Cl Amb8390108 [0,2,0,0,0,0|2,0,0]=4 7036 B9R1.3 Fc1nccc(Cl)c1F Amb8390114 [0,2,0,0,0,0|2,0,0]=4 7037 B9R1.3 Fc1nccc(Cl)c1I Amb26850793 [0,2,0,0,0,0|2,0,0]=4 7038 B9R1.3 Fc1nccc(Cl)c1S Amb26897152 [0,2,0,0,0,0|1,1,0]=4 7039 B9R1.3 Fc1nccc(I)c1Br Amb20242547 [0,2,0,0,0,0|2,0,0]=4 7040 B9R1.3 Fc1nccc(I)c1Cl Amb19892519 [0,2,0,0,0,0|2,0,0]=4 7041 B9R1.3 Fc1nccc(I)c1F Amb15691005 [0,2,0,0,0,0|2,0,0]=4 7042 B9R1.3 Fc1nccc(I)c1I Amb15691029 [0,2,0,0,0,0|2,0,0]=4 7043 B9R1.3 Fc1nccc(S)c1Cl Amb28246010 [0,2,0,0,0,0|1,1,0]=4 7044 B9R1.3 Fc1nccc(S)c1I Amb26914847 [0,2,0,0,0,0|1,1,0]=4 7045 B9R1.3 Ic1cccc(I)c1I Amb20001070 [0,2,0,0,0,0|1,0,0]=3 7046 B9R1.3 N=C1C(N)=CNC=C1F Amb27765985 [0,2,0,0,0,0|2,0,0]=4 7047 B9R1.3 N=C1N=CC=C(N)N1O Amb26366473 [0,2,0,0,0,0|2,0,0]=4 7048 B9R1.3 NC1=C(Cl)C=CNC1=O Amb25103785 [0,2,0,0,0,0|1,0,1]=4 7049 B9R1.3 NC1=C(Cl)C=COC1=O Amb18202361 [0,2,0,0,0,0|1,0,1]=4 7050 B9R1.3 NC1=C(F)C(=O)NC=C1 Amb18642567 [0,2,0,0,0,0|1,0,1]=4 7051 B9R1.3 NC1=C(I)C(=O)NC=C1 Amb23559657 [0,2,0,0,0,0|1,0,1]=4 7052 B9R1.3 NC1=C(N)C(=O)OC=C1 Amb18832780 [0,2,0,0,0,0|1,0,1]=4 7053 B9R1.3 NC1=C(O)C(=O)C=CN1 Amb25286975 [0,2,0,0,0,0|1,0,0]=3 7054 B9R1.3 NC1=C(O)C(=O)N=CN1 Amb26450548 [0,2,0,0,0,0|2,0,0]=4 7055 B9R1.3 NC1=C(O)C=COC1=O Amb18832710 [0,2,0,0,0,0|1,0,0]=3 7056 B9R1.3 NC1=C(S)C=CNC1=O Amb35675780 [0,2,0,0,0,0|1,0,1]=4 7057 B9R1.3 NC1=CC=CC(=O)C1=O Amb28456638 [0,2,0,0,0,0|0,0,1]=3 7058 B9R1.3 NC1=CNC=C(Cl)C1=O Amb23571823 [0,2,0,0,0,0|1,0,1]=4 7059 B9R1.3 Nc1c(Br)cccc1Br Amb4014260 [0,2,0,0,0,0|1,0,0]=3 7060 B9R1.3 Nc1c(Br)cccc1I Amb22735952 [0,2,0,0,0,0|1,0,0]=3 7061 B9R1.3 Nc1c(Br)ccnc1Br Amb8396966 [0,2,0,0,0,0|2,0,0]=4 7062 B9R1.3 Nc1c(Br)ccnc1Cl Amb22494188 [0,2,0,0,0,0|2,0,0]=4 7063 B9R1.3 Nc1c(Br)ccnc1F Amb26056364 [0,2,0,0,0,0|2,0,0]=4 7064 B9R1.3 Nc1c(Br)ccnc1I Amb26012756 [0,2,0,0,0,0|2,0,0]=4 7065 B9R1.3 Nc1c(Br)ccnc1O Amb27239071 [0,2,0,0,0,0|1,0,0]=3 7066 B9R1.3 Nc1c(Br)cncc1Br Amb1808492 [0,2,0,0,0,0|2,0,0]=4 7067 B9R1.3 Nc1c(Br)cncc1I Amb4560905 [0,2,0,0,0,0|2,0,0]=4 7068 B9R1.3 Nc1c(Cl)cccc1Br Amb16231461 [0,2,0,0,0,0|1,0,0]=3 7069 B9R1.3 Nc1c(Cl)cccc1Br Amb33330592 [0,2,0,0,0,0|1,0,0]=3 7070 B9R1.3 Nc1c(Cl)cccc1Cl Amb2686787 [0,2,0,0,0,0|1,0,0]=3 7071 B9R1.3 Nc1c(Cl)cccc1I Amb3205440 [0,2,0,0,0,0|1,0,0]=3 7072 B9R1.3 Nc1c(Cl)ccnc1Br Amb22304670 [0,2,0,0,0,0|2,0,0]=4 7073 B9R1.3 Nc1c(Cl)ccnc1Cl Amb8396972 [0,2,0,0,0,0|2,0,0]=4 7074 B9R1.3 Nc1c(Cl)ccnc1F Amb26657802 [0,2,0,0,0,0|2,0,0]=4 7075 B9R1.3 Nc1c(Cl)ccnc1I Amb26397489 [0,2,0,0,0,0|2,0,0]=4 7076 B9R1.3 Nc1c(Cl)cncc1Br Amb8629994 [0,2,0,0,0,0|2,0,0]=4 7077 B9R1.3 Nc1c(Cl)cncc1Cl Amb1151634 [0,2,0,0,0,0|2,0,0]=4 7078 B9R1.3 Nc1c(Cl)cncc1I Amb22500871 [0,2,0,0,0,0|2,0,0]=4 7079 B9R1.3 Nc1c(F)cccc1Br Amb6366101 [0,2,0,0,0,0|1,0,0]=3 7080 B9R1.3 Nc1c(F)cccc1Cl Amb2685922 [0,2,0,0,0,0|1,0,0]=3 7081 B9R1.3 Nc1c(F)cccc1F Amb535717 [0,2,0,0,0,0|1,0,0]=3 7082 B9R1.3 Nc1c(F)cccc1I Amb10838595 [0,2,0,0,0,0|1,0,0]=3 7083 B9R1.3 Nc1c(F)cccc1S Amb18276798 [0,2,0,0,0,0|0,1,0]=3 7084 B9R1.3 Nc1c(F)ccnc1Br Amb24614118 [0,2,0,0,0,0|2,0,0]=4 7085 B9R1.3 Nc1c(F)ccnc1Cl Amb24663147 [0,2,0,0,0,0|2,0,0]=4 7086 B9R1.3 Nc1c(F)ccnc1F Amb26938584 [0,2,0,0,0,0|2,0,0]=4 7087 B9R1.3 Nc1c(F)ccnc1I Amb24694634 [0,2,0,0,0,0|2,0,0]=4 7088 B9R1.3 Nc1c(F)ccnc1O Amb25300745 [0,2,0,0,0,0|1,0,0]=3 7089 B9R1.3 Nc1c(F)cncc1Br Amb19957736 [0,2,0,0,0,0|2,0,0]=4 7090 B9R1.3 Nc1c(F)cncc1Cl Amb22489621 [0,2,0,0,0,0|2,0,0]=4 7091 B9R1.3 Nc1c(F)cncc1F Amb2608619 [0,2,0,0,0,0|2,0,0]=4 7092 B9R1.3 Nc1c(F)cncc1I Amb22490537 [0,2,0,0,0,0|2,0,0]=4 7093 B9R1.3 Nc1c(I)ccnc1Br Amb24441057 [0,2,0,0,0,0|2,0,0]=4 7094 B9R1.3 Nc1c(I)ccnc1F Amb27449264 [0,2,0,0,0,0|2,0,0]=4 7095 B9R1.3 Nc1c(I)ccnc1I Amb26397757 [0,2,0,0,0,0|2,0,0]=4 7096 B9R1.3 Nc1c(I)cncc1I Amb4135071 [0,2,0,0,0,0|2,0,0]=4 7097 B9R1.3 Nc1c(O)cccc1Br Amb10072023 [0,2,0,0,0,0|0,0,0]=2 7098 B9R1.3 Nc1c(O)cccc1Br Amb22755818 [0,2,0,0,0,0|0,0,0]=2 7099 B9R1.3 Nc1c(O)cccc1Cl Amb19892311 [0,2,0,0,0,0|0,0,0]=2 7100 B9R1.3 Nc1c(O)cccc1Cl Amb33527537 [0,2,0,0,0,0|0,0,0]=2 7101 B9R1.3 Nc1c(O)cccc1F Amb10839603 [0,2,0,0,0,0|0,0,0]=2 7102 B9R1.3 Nc1c(O)cccc1F Amb28934942 [0,2,0,0,0,0|0,0,0]=2 7103 B9R1.3 Nc1c(O)cccc1I Amb6298685 [0,2,0,0,0,0|0,0,0]=2 7104 B9R1.3 Nc1c(O)cccc1O Amb16233724 [0,2,0,0,0,0|0,0,0]=2 7105 B9R1.3 Nc1c(O)cccc1O Amb20240589 [0,2,0,0,0,0|0,0,0]=2 7106 B9R1.3 Nc1c(O)cccc1S Amb25120961 [0,2,0,0,0,0|0,0,0]=2 7107 B9R1.3 Nc1c(O)ccnc1Cl Amb23437188 [0,2,0,0,0,0|1,0,0]=3 7108 B9R1.3 Nc1c(O)ccnc1F Amb25964193 [0,2,0,0,0,0|1,0,0]=3 7109 B9R1.3 Nc1c(O)ccnc1O Amb16230400 [0,2,0,0,0,0|1,0,0]=3 7110 B9R1.3 Nc1c(O)cncc1Cl Amb25306042 [0,2,0,0,0,0|1,0,0]=3 7111 B9R1.3 Nc1c(O)cncc1O Amb20620237 [0,2,0,0,0,0|1,0,0]=3 7112 B9R1.3 Nc1c(O)ncnc1Br Amb18189496 [0,2,0,0,0,0|2,0,0]=4 7113 B9R1.3 Nc1c(O)ncnc1F Amb33035427 [0,2,0,0,0,0|2,0,0]=4 7114 B9R1.3 Nc1c(S)cccc1Br Amb18129620 [0,2,0,0,0,0|0,1,0]=3 7115 B9R1.3 Nc1c(S)cccc1Cl Amb8426389 [0,2,0,0,0,0|0,1,0]=3 7116 B9R1.3 Nc1c(S)cccc1I Amb27187088 [0,2,0,0,0,0|0,1,0]=3 7117 B9R1.3 Nc1cccc(Br)c1Br Amb28290893 [0,2,0,0,0,0|1,0,0]=3 7118 B9R1.3 Nc1cccc(Br)c1Cl Amb19890922 [0,2,0,0,0,0|1,0,0]=3 7119 B9R1.3 Nc1cccc(Br)c1F Amb10841476 [0,2,0,0,0,0|1,0,0]=3 7120 B9R1.3 Nc1cccc(Br)c1I Amb13952847 [0,2,0,0,0,0|1,0,0]=3 7121 B9R1.3 Nc1cccc(Br)c1I Amb28934971 [0,2,0,0,0,0|1,0,0]=3 7122 B9R1.3 Nc1cccc(Br)c1N Amb10068239 [0,2,0,0,0,0|1,0,0]=3 7123 B9R1.3 Nc1cccc(Br)c1N Amb19958467 [0,2,0,0,0,0|1,0,0]=3 7124 B9R1.3 Nc1cccc(Br)c1O Amb8395986 [0,2,0,0,0,0|0,0,0]=2 7125 B9R1.3 Nc1cccc(Br)c1S Amb27431261 [0,2,0,0,0,0|0,1,0]=3 7126 B9R1.3 Nc1cccc(Cl)c1Br Amb19957959 [0,2,0,0,0,0|1,0,0]=3 7127 B9R1.3 Nc1cccc(Cl)c1Cl Amb3939771 [0,2,0,0,0,0|1,0,0]=3 7128 B9R1.3 Nc1cccc(Cl)c1F Amb1215285 [0,2,0,0,0,0|1,0,0]=3 7129 B9R1.3 Nc1cccc(Cl)c1I Amb10603679 [0,2,0,0,0,0|1,0,0]=3 7130 B9R1.3 Nc1cccc(Cl)c1N Amb936956 [0,2,0,0,0,0|1,0,0]=3 7131 B9R1.3 Nc1cccc(Cl)c1O Amb33545782 [0,2,0,0,0,0|0,0,0]=2 7132 B9R1.3 Nc1cccc(Cl)c1O Amb9785189 [0,2,0,0,0,0|0,0,0]=2 7133 B9R1.3 Nc1cccc(Cl)c1S Amb33551072 [0,2,0,0,0,0|0,1,0]=3 7134 B9R1.3 Nc1cccc(Cl)c1S Amb8929755 [0,2,0,0,0,0|0,1,0]=3 7135 B9R1.3 Nc1cccc(F)c1Br Amb19887442 [0,2,0,0,0,0|1,0,0]=3 7136 B9R1.3 Nc1cccc(F)c1Br Amb6298247 [0,2,0,0,0,0|1,0,0]=3 7137 B9R1.3 Nc1cccc(F)c1Cl Amb8386187 [0,2,0,0,0,0|1,0,0]=3 7138 B9R1.3 Nc1cccc(F)c1F Amb2687036 [0,2,0,0,0,0|1,0,0]=3 7139 B9R1.3 Nc1cccc(F)c1I Amb19958652 [0,2,0,0,0,0|1,0,0]=3 7140 B9R1.3 Nc1cccc(F)c1I Amb8628747 [0,2,0,0,0,0|1,0,0]=3 7141 B9R1.3 Nc1cccc(F)c1N Amb10839162 [0,2,0,0,0,0|1,0,0]=3 7142 B9R1.3 Nc1cccc(F)c1N Amb34048782 [0,2,0,0,0,0|1,0,0]=3 7143 B9R1.3 Nc1cccc(F)c1O Amb16233728 [0,2,0,0,0,0|0,0,0]=2 7144 B9R1.3 Nc1cccc(F)c1S Amb24761484 [0,2,0,0,0,0|0,1,0]=3 7145 B9R1.3 Nc1cccc(I)c1Br Amb22736013 [0,2,0,0,0,0|1,0,0]=3 7146 B9R1.3 Nc1cccc(I)c1Cl Amb25195349 [0,2,0,0,0,0|1,0,0]=3 7147 B9R1.3 Nc1cccc(I)c1F Amb26445693 [0,2,0,0,0,0|1,0,0]=3 7148 B9R1.3 Nc1cccc(I)c1F Amb35788652 [0,2,0,0,0,0|1,0,0]=3 7149 B9R1.3 Nc1cccc(I)c1N Amb16191994 [0,2,0,0,0,0|1,0,0]=3 7150 B9R1.3 Nc1cccc(I)c1O Amb22735989 [0,2,0,0,0,0|0,0,0]=2 7151 B9R1.3 Nc1cccc(I)c1S Amb24395897 [0,2,0,0,0,0|0,1,0]=3 7152 B9R1.3 Nc1cccc(N)c1Br Amb23437434 [0,2,0,0,0,0|1,0,0]=3 7153 B9R1.3 Nc1cccc(N)c1Cl Amb22751465 [0,2,0,0,0,0|1,0,0]=3 7154 B9R1.3 Nc1cccc(N)c1F Amb23437435 [0,2,0,0,0,0|1,0,0]=3 7155 B9R1.3 Nc1cccc(N)c1I Amb23437440 [0,2,0,0,0,0|1,0,0]=3 7156 B9R1.3 Nc1cccc(N)c1N Amb1042160 [0,2,0,0,0,0|1,0,0]=3 7157 B9R1.3 Nc1cccc(N)c1N Amb22291687 [0,2,0,0,0,0|1,0,0]=3 7158 B9R1.3 Nc1cccc(N)c1O Amb22228359 [0,2,0,0,0,0|0,0,0]=2 7159 B9R1.3 Nc1cccc(N)c1O Amb24183288 [0,2,0,0,0,0|0,0,0]=2 7160 B9R1.3 Nc1cccc(N)c1S Amb24401660 [0,2,0,0,0,0|0,1,0]=3 7161 B9R1.3 Nc1cccc(O)c1Br Amb22490642 [0,2,0,0,0,0|0,0,0]=2 7162 B9R1.3 Nc1cccc(O)c1Cl Amb10766392 [0,2,0,0,0,0|0,0,0]=2 7163 B9R1.3 Nc1cccc(O)c1F Amb22008524 [0,2,0,0,0,0|0,0,0]=2 7164 B9R1.3 Nc1cccc(O)c1I Amb25376998 [0,2,0,0,0,0|0,0,0]=2 7165 B9R1.3 Nc1cccc(O)c1N Amb16233719 [0,2,0,0,0,0|0,0,0]=2 7166 B9R1.3 Nc1cccc(O)c1N Amb22001758 [0,2,0,0,0,0|0,0,0]=2 7167 B9R1.3 Nc1cccc(O)c1O Amb15695060 [0,2,0,0,0,0|0,0,0]=2 7168 B9R1.3 Nc1cccc(S)c1Br Amb27402052 [0,2,0,0,0,0|0,1,0]=3 7169 B9R1.3 Nc1cccc(S)c1Cl Amb27639789 [0,2,0,0,0,0|0,1,0]=3 7170 B9R1.3 Nc1cccc(S)c1I Amb25342249 [0,2,0,0,0,0|0,1,0]=3 7171 B9R1.3 Nc1cccc(S)c1N Amb26857771 [0,2,0,0,0,0|0,1,0]=3 7172 B9R1.3 Nc1ccnc(Br)c1Br Amb24320274 [0,2,0,0,0,0|2,0,0]=4 7173 B9R1.3 Nc1ccnc(Br)c1Cl Amb2795202 [0,2,0,0,0,0|2,0,0]=4 7174 B9R1.3 Nc1ccnc(Br)c1F Amb27959170 [0,2,0,0,0,0|2,0,0]=4 7175 B9R1.3 Nc1ccnc(Br)c1I Amb23560259 [0,2,0,0,0,0|2,0,0]=4 7176 B9R1.3 Nc1ccnc(Br)c1N Amb21927784 [0,2,0,0,0,0|2,0,0]=4 7177 B9R1.3 Nc1ccnc(Br)c1O Amb26352053 [0,2,0,0,0,0|1,0,0]=3 7178 B9R1.3 Nc1ccnc(Cl)c1Br Amb8396931 [0,2,0,0,0,0|2,0,0]=4 7179 B9R1.3 Nc1ccnc(Cl)c1Cl Amb10975637 [0,2,0,0,0,0|2,0,0]=4 7180 B9R1.3 Nc1ccnc(Cl)c1F Amb21963353 [0,2,0,0,0,0|2,0,0]=4 7181 B9R1.3 Nc1ccnc(Cl)c1F Amb32663352 [0,2,0,0,0,0|2,0,0]=4 7182 B9R1.3 Nc1ccnc(Cl)c1I Amb6565145 [0,2,0,0,0,0|2,0,0]=4 7183 B9R1.3 Nc1ccnc(Cl)c1N Amb2611287 [0,2,0,0,0,0|2,0,0]=4 7184 B9R1.3 Nc1ccnc(Cl)c1O Amb22587535 [0,2,0,0,0,0|1,0,0]=3 7185 B9R1.3 Nc1ccnc(Cl)c1O Amb27227866 [0,2,0,0,0,0|1,0,0]=3 7186 B9R1.3 Nc1ccnc(F)c1Br Amb23439089 [0,2,0,0,0,0|2,0,0]=4 7187 B9R1.3 Nc1ccnc(F)c1Cl Amb24424664 [0,2,0,0,0,0|2,0,0]=4 7188 B9R1.3 Nc1ccnc(F)c1Cl Amb32668986 [0,2,0,0,0,0|2,0,0]=4 7189 B9R1.3 Nc1ccnc(F)c1F Amb27492889 [0,2,0,0,0,0|2,0,0]=4 7190 B9R1.3 Nc1ccnc(F)c1F Amb32668156 [0,2,0,0,0,0|2,0,0]=4 7191 B9R1.3 Nc1ccnc(F)c1N Amb18642490 [0,2,0,0,0,0|2,0,0]=4 7192 B9R1.3 Nc1ccnc(F)c1O Amb28141847 [0,2,0,0,0,0|1,0,0]=3 7193 B9R1.3 Nc1ccnc(I)c1Br Amb24374917 [0,2,0,0,0,0|2,0,0]=4 7194 B9R1.3 Nc1ccnc(I)c1Cl Amb27445606 [0,2,0,0,0,0|2,0,0]=4 7195 B9R1.3 Nc1ccnc(I)c1I Amb25243391 [0,2,0,0,0,0|2,0,0]=4 7196 B9R1.3 Nc1ccnc(N)c1Br Amb18126222 [0,2,0,0,0,0|2,0,0]=4 7197 B9R1.3 Nc1ccnc(N)c1Cl Amb25760179 [0,2,0,0,0,0|2,0,0]=4 7198 B9R1.3 Nc1ccnc(N)c1F Amb18642493 [0,2,0,0,0,0|2,0,0]=4 7199 B9R1.3 Nc1ccnc(N)c1N Amb21858218 [0,2,0,0,0,0|2,0,0]=4 7200 B9R1.3 Nc1ccnc(O)c1N Amb20620899 [0,2,0,0,0,0|1,0,0]=3 7201 B9R1.3 Nc1cncc(Br)c1Br Amb24367672 [0,2,0,0,0,0|2,0,0]=4 7202 B9R1.3 Nc1cncc(Br)c1Cl Amb21856143 [0,2,0,0,0,0|2,0,0]=4 7203 B9R1.3 Nc1cncc(Br)c1F Amb24505637 [0,2,0,0,0,0|2,0,0]=4 7204 B9R1.3 Nc1cncc(Br)c1I Amb23559656 [0,2,0,0,0,0|2,0,0]=4 7205 B9R1.3 Nc1cncc(Br)c1N Amb10975942 [0,2,0,0,0,0|2,0,0]=4 7206 B9R1.3 Nc1cncc(Br)c1O Amb13889996 [0,2,0,0,0,0|1,0,0]=3 7207 B9R1.3 Nc1cncc(Br)c1S Amb26915318 [0,2,0,0,0,0|1,1,0]=4 7208 B9R1.3 Nc1cncc(Cl)c1Br Amb25865006 [0,2,0,0,0,0|2,0,0]=4 7209 B9R1.3 Nc1cncc(Cl)c1Cl Amb22235406 [0,2,0,0,0,0|2,0,0]=4 7210 B9R1.3 Nc1cncc(Cl)c1F Amb26937012 [0,2,0,0,0,0|2,0,0]=4 7211 B9R1.3 Nc1cncc(Cl)c1I Amb24596030 [0,2,0,0,0,0|2,0,0]=4 7212 B9R1.3 Nc1cncc(Cl)c1N Amb10975941 [0,2,0,0,0,0|2,0,0]=4 7213 B9R1.3 Nc1cncc(F)c1Br Amb24505632 [0,2,0,0,0,0|2,0,0]=4 7214 B9R1.3 Nc1cncc(F)c1Cl Amb26470894 [0,2,0,0,0,0|2,0,0]=4 7215 B9R1.3 Nc1cncc(F)c1F Amb28199090 [0,2,0,0,0,0|2,0,0]=4 7216 B9R1.3 Nc1cncc(F)c1I Amb26327216 [0,2,0,0,0,0|2,0,0]=4 7217 B9R1.3 Nc1cncc(I)c1Cl Amb23455363 [0,2,0,0,0,0|2,0,0]=4 7218 B9R1.3 Nc1cncc(I)c1F Amb27428960 [0,2,0,0,0,0|2,0,0]=4 7219 B9R1.3 Nc1cncc(I)c1I Amb25248575 [0,2,0,0,0,0|2,0,0]=4 7220 B9R1.3 Nc1cncc(I)c1N Amb27484515 [0,2,0,0,0,0|2,0,0]=4 7221 B9R1.3 Nc1cncc(I)c1O Amb19516476 [0,2,0,0,0,0|1,0,0]=3 7222 B9R1.3 Nc1cncc(I)c1O Amb19516477 [0,2,0,0,0,0|1,0,0]=3 7223 B9R1.3 Nc1cncc(N)c1Br Amb16233917 [0,2,0,0,0,0|2,0,0]=4 7224 B9R1.3 Nc1cncc(N)c1F Amb26974702 [0,2,0,0,0,0|2,0,0]=4 7225 B9R1.3 Nc1cncc(N)c1N Amb16233720 [0,2,0,0,0,0|2,0,0]=4 7226 B9R1.3 Nc1cncc(O)c1Br Amb27412050 [0,2,0,0,0,0|1,0,0]=3 7227 B9R1.3 Nc1cncc(O)c1Cl Amb24716833 [0,2,0,0,0,0|1,0,0]=3 7228 B9R1.3 Nc1cncc(O)c1F Amb27757215 [0,2,0,0,0,0|1,0,0]=3 7229 B9R1.3 Nc1cnnc(O)c1Br Amb23536028 [0,2,0,0,0,0|2,0,0]=4 7230 B9R1.3 Nc1cnnc(O)c1N Amb21963731 [0,2,0,0,0,0|2,0,0]=4 7231 B9R1.3 Nc1cnnc(O)c1O Amb23452623 [0,2,0,0,0,0|2,0,0]=4 7232 B9R1.3 Nc1nccc(Br)c1Br Amb24320275 [0,2,0,0,0,0|2,0,0]=4 7233 B9R1.3 Nc1nccc(Br)c1Cl Amb22490348 [0,2,0,0,0,0|2,0,0]=4 7234 B9R1.3 Nc1nccc(Br)c1F Amb27209378 [0,2,0,0,0,0|2,0,0]=4 7235 B9R1.3 Nc1nccc(Br)c1I Amb23559655 [0,2,0,0,0,0|2,0,0]=4 7236 B9R1.3 Nc1nccc(Br)c1N Amb21964498 [0,2,0,0,0,0|2,0,0]=4 7237 B9R1.3 Nc1nccc(Br)c1O Amb15691021 [0,2,0,0,0,0|1,0,0]=3 7238 B9R1.3 Nc1nccc(Br)c1O Amb21857060 [0,2,0,0,0,0|1,0,0]=3 7239 B9R1.3 Nc1nccc(Cl)c1Br Amb21858987 [0,2,0,0,0,0|2,0,0]=4 7240 B9R1.3 Nc1nccc(Cl)c1Cl Amb10602176 [0,2,0,0,0,0|2,0,0]=4 7241 B9R1.3 Nc1nccc(Cl)c1F Amb24520662 [0,2,0,0,0,0|2,0,0]=4 7242 B9R1.3 Nc1nccc(Cl)c1I Amb6565140 [0,2,0,0,0,0|2,0,0]=4 7243 B9R1.3 Nc1nccc(Cl)c1N Amb10603777 [0,2,0,0,0,0|2,0,0]=4 7244 B9R1.3 Nc1nccc(Cl)c1O Amb20242803 [0,2,0,0,0,0|1,0,0]=3 7245 B9R1.3 Nc1nccc(Cl)c1O Amb32667434 [0,2,0,0,0,0|1,0,0]=3 7246 B9R1.3 Nc1nccc(F)c1Cl Amb24524231 [0,2,0,0,0,0|2,0,0]=4 7247 B9R1.3 Nc1nccc(F)c1Cl Amb33330799 [0,2,0,0,0,0|2,0,0]=4 7248 B9R1.3 Nc1nccc(F)c1F Amb26965102 [0,2,0,0,0,0|2,0,0]=4 7249 B9R1.3 Nc1nccc(F)c1I Amb26065778 [0,2,0,0,0,0|2,0,0]=4 7250 B9R1.3 Nc1nccc(F)c1N Amb27634215 [0,2,0,0,0,0|2,0,0]=4 7251 B9R1.3 Nc1nccc(I)c1Br Amb24754064 [0,2,0,0,0,0|2,0,0]=4 7252 B9R1.3 Nc1nccc(I)c1Cl Amb25135141 [0,2,0,0,0,0|2,0,0]=4 7253 B9R1.3 Nc1nccc(I)c1F Amb24054045 [0,2,0,0,0,0|2,0,0]=4 7254 B9R1.3 Nc1nccc(O)c1Cl Amb28053054 [0,2,0,0,0,0|1,0,0]=3 7255 B9R1.3 Nc1nccc(O)c1N Amb25340429 [0,2,0,0,0,0|1,0,0]=3 7256 B9R1.3 Nc1ncnc(Cl)c1O Amb18644202 [0,2,0,0,0,0|2,0,0]=4 7257 B9R1.3 Nc1ncnc(N)c1O Amb18642378 [0,2,0,0,0,0|2,0,0]=4 7258 B9R1.3 Nc1ncnc(O)c1I Amb22492010 [0,2,0,0,0,0|2,0,0]=4 7259 B9R1.3 Nc1ncnc(O)c1N Amb596470 [0,2,0,0,0,0|2,0,0]=4 7260 B9R1.3 Nc1ncnc(O)c1N Amb9809939 [0,2,0,0,0,0|2,0,0]=4 7261 B9R1.3 O=C1C(Br)=CNC=C1Br Amb19895091 [0,2,0,0,0,0|1,0,1]=4 7262 B9R1.3 O=C1C(Br)=CNC=C1Br Amb33719018 [0,2,0,0,0,0|1,0,1]=4 7263 B9R1.3 O=C1C(Cl)=CNC=C1Cl Amb19895330 [0,2,0,0,0,0|1,0,1]=4 7264 B9R1.3 O=C1C(Cl)=COC=C1Cl Amb27836778 [0,2,0,0,0,0|1,0,1]=4 7265 B9R1.3 O=C1C(I)=CNC=C1I Amb18029459 [0,2,0,0,0,0|1,0,1]=4 7266 B9R1.3 O=C1C(O)=CNC=C1Br Amb24637270 [0,2,0,0,0,0|1,0,0]=3 7267 B9R1.3 O=C1C(O)=CNC=C1F Amb24183390 [0,2,0,0,0,0|1,0,0]=3 7268 B9R1.3 O=C1C(O)=COC=C1Br Amb18190846 [0,2,0,0,0,0|1,0,0]=3 7269 B9R1.3 O=C1C=CCC(Cl)=C1Cl Amb27948594 [0,2,0,0,0,0|0,0,2]=4 7270 B9R1.3 O=C1NC=CC(Br)=C1Cl Amb27768646 [0,2,0,0,0,0|1,0,1]=4 7271 B9R1.3 O=C1NC=CC(Cl)=C1O Amb24470681 [0,2,0,0,0,0|1,0,0]=3 7272 B9R1.3 O=C1NC=CC(O)=C1Br Amb19958586 [0,2,0,0,0,0|1,0,0]=3 7273 B9R1.3 O=C1NC=CC(O)=C1Cl Amb19957850 [0,2,0,0,0,0|1,0,0]=3 7274 B9R1.3 O=C1NC=CC(O)=C1I Amb23450059 [0,2,0,0,0,0|1,0,0]=3 7275 B9R1.3 O=C1NC=NC(O)=C1I Amb22000885 [0,2,0,0,0,0|2,0,0]=4 7276 B9R1.3 O=C1NC=NC(O)=C1O Amb25304460 [0,2,0,0,0,0|2,0,0]=4 7277 B9R1.3 O=C1NN=CC(O)=C1Cl Amb17933299 [0,2,0,0,0,0|2,0,0]=4 7278 B9R1.3 Oc1c(Br)cccc1Br Amb2611907 [0,2,0,0,0,0|0,0,0]=2 7279 B9R1.3 Oc1c(Br)ccnc1Cl Amb27463295 [0,2,0,0,0,0|1,0,0]=3 7280 B9R1.3 Oc1c(Br)ccnc1F Amb25807983 [0,2,0,0,0,0|1,0,0]=3 7281 B9R1.3 Oc1c(Br)cncc1I Amb25889438 [0,2,0,0,0,0|1,0,0]=3 7282 B9R1.3 Oc1c(Cl)cccc1Br Amb18131000 [0,2,0,0,0,0|0,0,0]=2 7283 B9R1.3 Oc1c(Cl)cccc1Cl Amb2725615 [0,2,0,0,0,0|0,0,0]=2 7284 B9R1.3 Oc1c(Cl)cccc1I Amb21963997 [0,2,0,0,0,0|0,0,0]=2 7285 B9R1.3 Oc1c(Cl)ccnc1Br Amb25971575 [0,2,0,0,0,0|1,0,0]=3 7286 B9R1.3 Oc1c(Cl)ccnc1Cl Amb17933343 [0,2,0,0,0,0|1,0,0]=3 7287 B9R1.3 Oc1c(Cl)ccnc1F Amb24340283 [0,2,0,0,0,0|1,0,0]=3 7288 B9R1.3 Oc1c(Cl)cncc1Br Amb23400379 [0,2,0,0,0,0|1,0,0]=3 7289 B9R1.3 Oc1c(Cl)cncc1Cl Amb2796298 [0,2,0,0,0,0|1,0,0]=3 7290 B9R1.3 Oc1c(Cl)cncc1I Amb24654160 [0,2,0,0,0,0|1,0,0]=3 7291 B9R1.3 Oc1c(Cl)cnnc1Cl Amb22496563 [0,2,0,0,0,0|2,0,0]=4 7292 B9R1.3 Oc1c(Cl)ncnc1Cl Amb22263278 [0,2,0,0,0,0|2,0,0]=4 7293 B9R1.3 Oc1c(F)cccc1Br Amb8397125 [0,2,0,0,0,0|0,0,0]=2 7294 B9R1.3 Oc1c(F)cccc1Cl Amb2686043 [0,2,0,0,0,0|0,0,0]=2 7295 B9R1.3 Oc1c(F)cccc1F Amb33531147 [0,2,0,0,0,0|0,0,0]=2 7296 B9R1.3 Oc1c(F)cccc1I Amb8628748 [0,2,0,0,0,0|0,0,0]=2 7297 B9R1.3 Oc1c(F)cccc1S Amb27838638 [0,2,0,0,0,0|0,0,0]=2 7298 B9R1.3 Oc1c(F)ccnc1Br Amb25347444 [0,2,0,0,0,0|1,0,0]=3 7299 B9R1.3 Oc1c(F)ccnc1Cl Amb24183627 [0,2,0,0,0,0|1,0,0]=3 7300 B9R1.3 Oc1c(F)ccnc1F Amb25681628 [0,2,0,0,0,0|1,0,0]=3 7301 B9R1.3 Oc1c(F)ccnc1I Amb25972374 [0,2,0,0,0,0|1,0,0]=3 7302 B9R1.3 Oc1c(F)cncc1Br Amb19894407 [0,2,0,0,0,0|1,0,0]=3 7303 B9R1.3 Oc1c(F)cncc1Cl Amb22494651 [0,2,0,0,0,0|1,0,0]=3 7304 B9R1.3 Oc1c(F)cncc1F Amb20669966 [0,2,0,0,0,0|1,0,0]=3 7305 B9R1.3 Oc1c(F)cncc1I Amb22495228 [0,2,0,0,0,0|1,0,0]=3 7306 B9R1.3 Oc1c(F)ncnc1Cl Amb24596012 [0,2,0,0,0,0|2,0,0]=4 7307 B9R1.3 Oc1c(I)cccc1I Amb19987080 [0,2,0,0,0,0|0,0,0]=2 7308 B9R1.3 Oc1c(I)ccnc1Cl Amb27817131 [0,2,0,0,0,0|1,0,0]=3 7309 B9R1.3 Oc1c(I)ccnc1F Amb27210042 [0,2,0,0,0,0|1,0,0]=3 7310 B9R1.3 Oc1c(I)ccnc1I Amb23439079 [0,2,0,0,0,0|1,0,0]=3 7311 B9R1.3 Oc1c(I)cncc1I Amb20242393 [0,2,0,0,0,0|1,0,0]=3 7312 B9R1.3 Oc1c(S)cccc1Br Amb27223115 [0,2,0,0,0,0|0,0,0]=2 7313 B9R1.3 Oc1c(S)cccc1Cl Amb25889727 [0,2,0,0,0,0|0,0,0]=2 7314 B9R1.3 Oc1c(S)cccc1I Amb25918747 [0,2,0,0,0,0|0,0,0]=2 7315 B9R1.3 Oc1cccc(Br)c1Br Amb2698485 [0,2,0,0,0,0|0,0,0]=2 7316 B9R1.3 Oc1cccc(Br)c1Cl Amb2698314 [0,2,0,0,0,0|0,0,0]=2 7317 B9R1.3 Oc1cccc(Br)c1F Amb10976043 [0,2,0,0,0,0|0,0,0]=2 7318 B9R1.3 Oc1cccc(Br)c1I Amb2698313 [0,2,0,0,0,0|0,0,0]=2 7319 B9R1.3 Oc1cccc(Br)c1O Amb19958025 [0,2,0,0,0,0|0,0,0]=2 7320 B9R1.3 Oc1cccc(Br)c1S Amb26516042 [0,2,0,0,0,0|0,0,0]=2 7321 B9R1.3 Oc1cccc(Cl)c1Br Amb2698312 [0,2,0,0,0,0|0,0,0]=2 7322 B9R1.3 Oc1cccc(Cl)c1Cl Amb3939537 [0,2,0,0,0,0|0,0,0]=2 7323 B9R1.3 Oc1cccc(Cl)c1F Amb2686044 [0,2,0,0,0,0|0,0,0]=2 7324 B9R1.3 Oc1cccc(Cl)c1I Amb2698413 [0,2,0,0,0,0|0,0,0]=2 7325 B9R1.3 Oc1cccc(Cl)c1O Amb18644170 [0,2,0,0,0,0|0,0,0]=2 7326 B9R1.3 Oc1cccc(Cl)c1S Amb28126613 [0,2,0,0,0,0|0,0,0]=2 7327 B9R1.3 Oc1cccc(F)c1Br Amb2698311 [0,2,0,0,0,0|0,0,0]=2 7328 B9R1.3 Oc1cccc(F)c1Cl Amb2698412 [0,2,0,0,0,0|0,0,0]=2 7329 B9R1.3 Oc1cccc(F)c1F Amb842446 [0,2,0,0,0,0|0,0,0]=2 7330 B9R1.3 Oc1cccc(F)c1I Amb2698572 [0,2,0,0,0,0|0,0,0]=2 7331 B9R1.3 Oc1cccc(F)c1O Amb2688076 [0,2,0,0,0,0|0,0,0]=2 7332 B9R1.3 Oc1cccc(F)c1S Amb25713866 [0,2,0,0,0,0|0,0,0]=2 7333 B9R1.3 Oc1cccc(I)c1Br Amb2698315 [0,2,0,0,0,0|0,0,0]=2 7334 B9R1.3 Oc1cccc(I)c1Cl Amb2698414 [0,2,0,0,0,0|0,0,0]=2 7335 B9R1.3 Oc1cccc(I)c1F Amb22896489 [0,2,0,0,0,0|0,0,0]=2 7336 B9R1.3 Oc1cccc(I)c1O Amb21962958 [0,2,0,0,0,0|0,0,0]=2 7337 B9R1.3 Oc1cccc(I)c1S Amb27628356 [0,2,0,0,0,0|0,0,0]=2 7338 B9R1.3 Oc1cccc(O)c1Br Amb18129230 [0,2,0,0,0,0|0,0,0]=2 7339 B9R1.3 Oc1cccc(O)c1Cl Amb8391170 [0,2,0,0,0,0|0,0,0]=2 7340 B9R1.3 Oc1cccc(O)c1F Amb15690891 [0,2,0,0,0,0|0,0,0]=2 7341 B9R1.3 Oc1cccc(O)c1I Amb16191963 [0,2,0,0,0,0|0,0,0]=2 7342 B9R1.3 Oc1cccc(O)c1O Amb2609026 [0,2,0,0,0,0|0,0,0]=2 7343 B9R1.3 Oc1cccc(S)c1Br Amb26079374 [0,2,0,0,0,0|0,0,0]=2 7344 B9R1.3 Oc1cccc(S)c1F Amb26657821 [0,2,0,0,0,0|0,0,0]=2 7345 B9R1.3 Oc1cccc(S)c1O Amb24614044 [0,2,0,0,0,0|0,0,0]=2 7346 B9R1.3 Oc1ccnc(Br)c1Br Amb27588486 [0,2,0,0,0,0|1,0,0]=3 7347 B9R1.3 Oc1ccnc(Br)c1Cl Amb24478822 [0,2,0,0,0,0|1,0,0]=3 7348 B9R1.3 Oc1ccnc(Br)c1F Amb19895477 [0,2,0,0,0,0|1,0,0]=3 7349 B9R1.3 Oc1ccnc(Cl)c1Br Amb24753353 [0,2,0,0,0,0|1,0,0]=3 7350 B9R1.3 Oc1ccnc(Cl)c1Cl Amb19895110 [0,2,0,0,0,0|1,0,0]=3 7351 B9R1.3 Oc1ccnc(Cl)c1F Amb19895476 [0,2,0,0,0,0|1,0,0]=3 7352 B9R1.3 Oc1ccnc(Cl)c1I Amb26869182 [0,2,0,0,0,0|1,0,0]=3 7353 B9R1.3 Oc1ccnc(Cl)c1O Amb20670122 [0,2,0,0,0,0|1,0,0]=3 7354 B9R1.3 Oc1ccnc(F)c1Cl Amb26447686 [0,2,0,0,0,0|1,0,0]=3 7355 B9R1.3 Oc1ccnc(F)c1F Amb19894589 [0,2,0,0,0,0|1,0,0]=3 7356 B9R1.3 Oc1ccnc(F)c1I Amb25924030 [0,2,0,0,0,0|1,0,0]=3 7357 B9R1.3 Oc1ccnc(I)c1Cl Amb27814056 [0,2,0,0,0,0|1,0,0]=3 7358 B9R1.3 Oc1ccnc(I)c1F Amb25924255 [0,2,0,0,0,0|1,0,0]=3 7359 B9R1.3 Oc1ccnc(O)c1Br Amb2609500 [0,2,0,0,0,0|1,0,0]=3 7360 B9R1.3 Oc1ccnc(O)c1F Amb24738363 [0,2,0,0,0,0|1,0,0]=3 7361 B9R1.3 Oc1cncc(Br)c1Br Amb25918758 [0,2,0,0,0,0|1,0,0]=3 7362 B9R1.3 Oc1cncc(Br)c1F Amb25744386 [0,2,0,0,0,0|1,0,0]=3 7363 B9R1.3 Oc1cncc(Cl)c1Br Amb22493826 [0,2,0,0,0,0|1,0,0]=3 7364 B9R1.3 Oc1cncc(Cl)c1F Amb26596325 [0,2,0,0,0,0|1,0,0]=3 7365 B9R1.3 Oc1cncc(Cl)c1I Amb25267818 [0,2,0,0,0,0|1,0,0]=3 7366 B9R1.3 Oc1cncc(F)c1Br Amb27792269 [0,2,0,0,0,0|1,0,0]=3 7367 B9R1.3 Oc1cncc(F)c1Cl Amb28363651 [0,2,0,0,0,0|1,0,0]=3 7368 B9R1.3 Oc1cncc(F)c1F Amb25208492 [0,2,0,0,0,0|1,0,0]=3 7369 B9R1.3 Oc1cncc(I)c1Cl Amb24636905 [0,2,0,0,0,0|1,0,0]=3 7370 B9R1.3 Oc1cncc(O)c1F Amb27447631 [0,2,0,0,0,0|1,0,0]=3 7371 B9R1.3 Oc1cnnc(O)c1Br Amb28368571 [0,2,0,0,0,0|2,0,0]=4 7372 B9R1.3 Oc1cnnc(O)c1Cl Amb18644299 [0,2,0,0,0,0|2,0,0]=4 7373 B9R1.3 Oc1nccc(Br)c1Br Amb24319962 [0,2,0,0,0,0|1,0,0]=3 7374 B9R1.3 Oc1nccc(Br)c1F Amb26592692 [0,2,0,0,0,0|1,0,0]=3 7375 B9R1.3 Oc1nccc(Cl)c1Br Amb27246460 [0,2,0,0,0,0|1,0,0]=3 7376 B9R1.3 Oc1nccc(Cl)c1I Amb24708218 [0,2,0,0,0,0|1,0,0]=3 7377 B9R1.3 Oc1nccc(F)c1Br Amb24424118 [0,2,0,0,0,0|1,0,0]=3 7378 B9R1.3 Oc1nccc(F)c1Cl Amb25360879 [0,2,0,0,0,0|1,0,0]=3 7379 B9R1.3 Oc1nccc(F)c1I Amb25238394 [0,2,0,0,0,0|1,0,0]=3 7380 B9R1.3 Oc1nccc(I)c1F Amb25714135 [0,2,0,0,0,0|1,0,0]=3 7381 B9R1.3 Oc1ncnc(Cl)c1Cl Amb19958063 [0,2,0,0,0,0|2,0,0]=4 7382 B9R1.3 Oc1ncnc(Cl)c1I Amb20667969 [0,2,0,0,0,0|2,0,0]=4 7383 B9R1.3 Oc1ncnc(O)c1Br Amb3431473 [0,2,0,0,0,0|2,0,0]=4 7384 B9R1.3 Oc1ncnc(O)c1Cl Amb20147598 [0,2,0,0,0,0|2,0,0]=4 7385 B9R1.3 Oc1ncnc(O)c1F Amb8393923 [0,2,0,0,0,0|2,0,0]=4 7386 B9R1.3 Oc1nncc(Cl)c1Cl Amb1103678 [0,2,0,0,0,0|2,0,0]=4 7387 B9R1.3 Oc1nncc(F)c1Br Amb24695783 [0,2,0,0,0,0|2,0,0]=4 7388 B9R1.3 Oc1nncc(F)c1Cl Amb27193443 [0,2,0,0,0,0|2,0,0]=4 7389 B9R1.3 Sc1c(Br)cccc1Br Amb26657087 [0,2,0,0,0,0|0,1,0]=3 7390 B9R1.3 Sc1c(Br)ccnc1Br Amb24743587 [0,2,0,0,0,0|1,1,0]=4 7391 B9R1.3 Sc1c(Br)cncc1Br Amb27859271 [0,2,0,0,0,0|1,1,0]=4 7392 B9R1.3 Sc1c(Cl)cccc1Br Amb19890247 [0,2,0,0,0,0|0,1,0]=3 7393 B9R1.3 Sc1c(Cl)cccc1Cl Amb2599338 [0,2,0,0,0,0|0,1,0]=3 7394 B9R1.3 Sc1c(Cl)cccc1I Amb26020079 [0,2,0,0,0,0|0,1,0]=3 7395 B9R1.3 Sc1c(Cl)ccnc1Cl Amb25988807 [0,2,0,0,0,0|1,1,0]=4 7396 B9R1.3 Sc1c(Cl)cncc1Cl Amb24410150 [0,2,0,0,0,0|1,1,0]=4 7397 B9R1.3 Sc1cccc(Br)c1Br Amb25704955 [0,2,0,0,0,0|0,1,0]=3 7398 B9R1.3 Sc1cccc(Br)c1Cl Amb27838642 [0,2,0,0,0,0|0,1,0]=3 7399 B9R1.3 Sc1cccc(Br)c1I Amb28341100 [0,2,0,0,0,0|0,1,0]=3 7400 B9R1.3 Sc1cccc(Cl)c1Cl Amb2686987 [0,2,0,0,0,0|0,1,0]=3 7401 B9R1.3 Sc1cccc(Cl)c1I Amb27838614 [0,2,0,0,0,0|0,1,0]=3 7402 B9R1.3 Sc1cccc(I)c1Br Amb27653364 [0,2,0,0,0,0|0,1,0]=3 7403 B9R1.3 Sc1cccc(I)c1Cl Amb28363783 [0,2,0,0,0,0|0,1,0]=3 7404 B9R1.3 Sc1cccc(I)c1I Amb27166696 [0,2,0,0,0,0|0,1,0]=3 7405 B9R1.3 Sc1ccnc(Br)c1Br Amb27193374 [0,2,0,0,0,0|1,1,0]=4 7406 B9R1.3 Sc1ccnc(Cl)c1Cl Amb28429998 [0,2,0,0,0,0|1,1,0]=4 7407 B9R1.3 Sc1cncc(Br)c1Br Amb25983934 [0,2,0,0,0,0|1,1,0]=4 7408 B9R1.3 Sc1cncc(Cl)c1Cl Amb25949240 [0,2,0,0,0,0|1,1,0]=4 7409 B9R1.3 Sc1nccc(Cl)c1Cl Amb25991190 [0,2,0,0,0,0|1,1,0]=4 7410 B9R1.3 [BH3-][n+]1c(C)cccc1C Amb33801898 [0,2,0,0,0,0|2,0,0]=4 7411 B9R1.3 [O-][n+]1c(Br)cccc1Br Amb2609490 [0,2,0,0,0,0|1,0,1]=4 7412 B9R1.3 [O-][n+]1c(Cl)cccc1Cl Amb2610005 [0,2,0,0,0,0|1,0,1]=4 7413 B9R1.3 [O-][n+]1cccc(Br)c1Cl Amb27201711 [0,2,0,0,0,0|1,0,1]=4 7414 B9R1.3 [O-][n+]1cccc(Cl)c1Cl Amb28247960 [0,2,0,0,0,0|1,0,1]=4 7415 B9R1.3 [O-][n+]1cccc(F)c1Br Amb25797396 [0,2,0,0,0,0|1,0,1]=4 7416 B9R1.3 [O-][n+]1cccc(F)c1Cl Amb1084267 [0,2,0,0,0,0|1,0,1]=4 7417 B9R1.3 [O-][n+]1cccc(F)c1F Amb27490782 [0,2,0,0,0,0|1,0,1]=4 7418 B9R1.3 [O-][n+]1cccc(O)c1Br Amb20242742 [0,2,0,0,0,0|1,0,0]=3 7419 B9R1.3 [O-][n+]1cccc(O)c1Cl Amb22490947 [0,2,0,0,0,0|1,0,0]=3 7420 B9R1.3 [S-]c1c(Cl)cccc1Cl Amb33513144 [0,2,0,0,0,0|0,1,0]=3 7421 B9R1.3 [S-]c1cccc(Cl)c1Cl Amb33513145 [0,2,0,0,0,0|0,1,0]=3 7422 B9R1.34 Bc1cc(C)nc(C)c1 Amb28367388 [0,2,0,0,0,0|2,0,0]=4 7423 B9R1.34 Brc1cc(Br)cc(Br)c1 Amb4019257 [0,2,0,0,0,0|1,0,0]=3 7424 B9R1.34 Brc1cc(Br)cc(I)c1 Amb20075871 [0,2,0,0,0,0|1,0,0]=3 7425 B9R1.34 Brc1cc(Br)nc(Br)c1 Amb5722050 [0,2,0,0,0,0|2,0,0]=4 7426 B9R1.34 Brc1cc(Br)nc(I)c1 Amb27638374 [0,2,0,0,0,0|2,0,0]=4 7427 B9R1.34 Brc1cc(I)cc(Br)n1 Amb22263392 [0,2,0,0,0,0|2,0,0]=4 7428 B9R1.34 Brc1cc(I)cc(I)c1 Amb20241145 [0,2,0,0,0,0|1,0,0]=3 7429 B9R1.34 Brc1cc(I)cc(I)n1 Amb27813292 [0,2,0,0,0,0|2,0,0]=4 7430 B9R1.34 Brc1cc(I)nc(I)c1 Amb27778505 [0,2,0,0,0,0|2,0,0]=4 7431 B9R1.34 C=C1C=C(C)C=C(C)N1 Amb24103119 [0,2,0,0,0,0|2,0,0]=4 7432 B9R1.34 C=C1C=C(C)NC(C)=C1 Amb24101834 [0,2,0,0,0,0|2,0,0]=4 7433 B9R1.34 CC1=CC(=O)C=C(Br)N1 Amb24423299 [0,2,0,0,0,0|1,0,1]=4 7434 B9R1.34 CC1=CC(=O)C=C(C)N1 Amb33544636 [0,2,0,0,0,0|1,0,1]=4 7435 B9R1.34 CC1=CC(=O)C=C(C)O1 Amb19116892 [0,2,0,0,0,0|1,0,1]=4 7436 B9R1.34 CC1=CC(=O)C=C(O)N1 Amb22489534 [0,2,0,0,0,0|1,0,0]=3 7437 B9R1.34 CC1=CC(=O)C=C(O)O1 Amb21963752 [0,2,0,0,0,0|1,0,0]=3 7438 B9R1.34 CC1=CC(=O)C=C(S)S1 Amb28461213 [0,2,0,0,0,0|1,0,1]=4 7439 B9R1.34 CC1=CC(=O)NC(C)=C1 Amb20240634 [0,2,0,0,0,0|1,0,1]=4 7440 B9R1.34 CC1=CC(=O)NC(Cl)=C1 Amb24524213 [0,2,0,0,0,0|1,0,1]=4 7441 B9R1.34 CC1=CC(=O)NC(N)=C1 Amb19372509 [0,2,0,0,0,0|1,0,1]=4 7442 B9R1.34 CC1=CC(=O)NC(O)=C1 Amb20075946 [0,2,0,0,0,0|1,0,0]=3 7443 B9R1.34 CC1=CC(=S)C=C(C)O1 Amb18526845 [0,2,0,0,0,0|1,1,0]=4 7444 B9R1.34 CC1=CC(Br)=CC(=O)O1 Amb25889777 [0,2,0,0,0,0|1,0,1]=4 7445 B9R1.34 CC1=CC(I)=CC(=O)N1 Amb24609383 [0,2,0,0,0,0|1,0,1]=4 7446 B9R1.34 CC1=CC(N)=CC(=O)N1 Amb18642201 [0,2,0,0,0,0|1,0,1]=4 7447 B9R1.34 CC1=CC(N)=CC(=O)O1 Amb26857680 [0,2,0,0,0,0|1,0,1]=4 7448 B9R1.34 CC1=CC(O)=CC(=O)N1 Amb18369097 [0,2,0,0,0,0|1,0,0]=3 7449 B9R1.34 CC1=CC(O)=CC(=O)O1 Amb19222833 [0,2,0,0,0,0|1,0,0]=3 7450 B9R1.34 CC1=CC(O)=CC(=O)S1 Amb28246632 [0,2,0,0,0,0|1,0,0]=3 7451 B9R1.34 CC1=NC(=O)CC(O)=C1 Amb24558317 [0,2,0,0,0,0|1,0,1]=4 7452 B9R1.34 CC1=NC(O)=CC(=O)N1 Amb19665366 [0,2,0,0,0,0|2,0,0]=4 7453 B9R1.34 C[n+]1cc(Cl)cc(Cl)c1 Amb2609536 [0,2,0,0,0,0|2,0,0]=4 7454 B9R1.34 Cc1cc(Br)cc(Br)c1 Amb2733733 [0,2,0,0,0,0|1,0,0]=3 7455 B9R1.34 Cc1cc(Br)cc(Br)n1 Amb20617532 [0,2,0,0,0,0|2,0,0]=4 7456 B9R1.34 Cc1cc(Br)cc(C)n1 Amb8438988 [0,2,0,0,0,0|2,0,0]=4 7457 B9R1.34 Cc1cc(Br)cc(Cl)n1 Amb19959267 [0,2,0,0,0,0|2,0,0]=4 7458 B9R1.34 Cc1cc(Br)cc(F)n1 Amb21857303 [0,2,0,0,0,0|2,0,0]=4 7459 B9R1.34 Cc1cc(Br)cc(I)c1 Amb22001543 [0,2,0,0,0,0|1,0,0]=3 7460 B9R1.34 Cc1cc(Br)cc(I)n1 Amb25377176 [0,2,0,0,0,0|2,0,0]=4 7461 B9R1.34 Cc1cc(Br)cc(N)n1 Amb21963411 [0,2,0,0,0,0|2,0,0]=4 7462 B9R1.34 Cc1cc(Br)cc(O)n1 Amb21963412 [0,2,0,0,0,0|1,0,0]=3 7463 B9R1.34 Cc1cc(Br)nc(Br)c1 Amb17621417 [0,2,0,0,0,0|2,0,0]=4 7464 B9R1.34 Cc1cc(Br)nc(I)c1 Amb28071557 [0,2,0,0,0,0|2,0,0]=4 7465 B9R1.34 Cc1cc(Br)nc(O)n1 Amb25917930 [0,2,0,0,0,0|2,0,0]=4 7466 B9R1.34 Cc1cc(C)c[n+](N)c1 Amb27838872 [0,2,0,0,0,0|2,0,0]=4 7467 B9R1.34 Cc1cc(C)c[n+]([O-])c1 Amb10552806 [0,2,0,0,0,0|1,0,1]=4 7468 B9R1.34 Cc1cc(C)cc(Br)c1 Amb2685559 [0,2,0,0,0,0|1,0,0]=3 7469 B9R1.34 Cc1cc(C)cc(C)c1 Amb6608793 [0,2,0,0,0,0|1,0,0]=3 7470 B9R1.34 Cc1cc(C)cc(Cl)c1 Amb2686557 [0,2,0,0,0,0|1,0,0]=3 7471 B9R1.34 Cc1cc(C)cc(F)c1 Amb2688560 [0,2,0,0,0,0|1,0,0]=3 7472 B9R1.34 Cc1cc(C)cc(I)c1 Amb2688904 [0,2,0,0,0,0|1,0,0]=3 7473 B9R1.34 Cc1cc(C)cc(N)c1 Amb2792825 [0,2,0,0,0,0|1,0,0]=3 7474 B9R1.34 Cc1cc(C)cc(O)c1 Amb3939552 [0,2,0,0,0,0|0,0,0]=2 7475 B9R1.34 Cc1cc(C)cc(P)c1 Amb24524156 [0,2,0,0,0,0|1,0,0]=3 7476 B9R1.34 Cc1cc(C)cc(S)c1 Amb2687634 [0,2,0,0,0,0|0,1,0]=3 7477 B9R1.34 Cc1cc(C)nc(Br)c1 Amb8396918 [0,2,0,0,0,0|2,0,0]=4 7478 B9R1.34 Cc1cc(C)nc(C)c1 Amb10605621 [0,2,0,0,0,0|2,0,0]=4 7479 B9R1.34 Cc1cc(C)nc(C)c1 Amb29083625 [0,2,0,0,0,0|2,0,0]=4 7480 B9R1.34 Cc1cc(C)nc(C)c1 Amb6608644 [0,2,0,0,0,0|2,0,0]=4 7481 B9R1.34 Cc1cc(C)nc(Cl)c1 Amb8396944 [0,2,0,0,0,0|2,0,0]=4 7482 B9R1.34 Cc1cc(C)nc(F)c1 Amb24084192 [0,2,0,0,0,0|2,0,0]=4 7483 B9R1.34 Cc1cc(C)nc(N)c1 Amb3939300 [0,2,0,0,0,0|2,0,0]=4 7484 B9R1.34 Cc1cc(C)nc(O)c1 Amb2696836 [0,2,0,0,0,0|1,0,0]=3 7485 B9R1.34 Cc1cc(C)nc(O)n1 Amb1106425 [0,2,0,0,0,0|2,0,0]=4 7486 B9R1.34 Cc1cc(C)nc(O)n1 Amb6892081 [0,2,0,0,0,0|2,0,0]=4 7487 B9R1.34 Cc1cc(C)nc(S)c1 Amb28315089 [0,2,0,0,0,0|1,1,0]=4 7488 B9R1.34 Cc1cc(Cl)c[n+]([O-])c1 Amb35748756 [0,2,0,0,0,0|1,0,1]=4 7489 B9R1.34 Cc1cc(Cl)cc(Br)c1 Amb2694660 [0,2,0,0,0,0|1,0,0]=3 7490 B9R1.34 Cc1cc(Cl)cc(C)n1 Amb2610079 [0,2,0,0,0,0|2,0,0]=4 7491 B9R1.34 Cc1cc(Cl)cc(Cl)c1 Amb15690990 [0,2,0,0,0,0|1,0,0]=3 7492 B9R1.34 Cc1cc(Cl)cc(Cl)n1 Amb8396976 [0,2,0,0,0,0|2,0,0]=4 7493 B9R1.34 Cc1cc(Cl)cc(I)c1 Amb19893119 [0,2,0,0,0,0|1,0,0]=3 7494 B9R1.34 Cc1cc(Cl)cc(N)n1 Amb10601945 [0,2,0,0,0,0|2,0,0]=4 7495 B9R1.34 Cc1cc(Cl)cc(O)n1 Amb28255564 [0,2,0,0,0,0|1,0,0]=3 7496 B9R1.34 Cc1cc(Cl)nc(Br)c1 Amb10603563 [0,2,0,0,0,0|2,0,0]=4 7497 B9R1.34 Cc1cc(Cl)nc(Cl)c1 Amb10067807 [0,2,0,0,0,0|2,0,0]=4 7498 B9R1.34 Cc1cc(F)cc(Br)c1 Amb2685253 [0,2,0,0,0,0|1,0,0]=3 7499 B9R1.34 Cc1cc(F)cc(Br)n1 Amb25686396 [0,2,0,0,0,0|2,0,0]=4 7500 B9R1.34 Cc1cc(F)cc(C)n1 Amb24091591 [0,2,0,0,0,0|2,0,0]=4 7501 B9R1.34 Cc1cc(F)cc(Cl)c1 Amb10840358 [0,2,0,0,0,0|1,0,0]=3 7502 B9R1.34 Cc1cc(F)cc(F)c1 Amb8387984 [0,2,0,0,0,0|1,0,0]=3 7503 B9R1.34 Cc1cc(F)cc(F)n1 Amb21857172 [0,2,0,0,0,0|2,0,0]=4 7504 B9R1.34 Cc1cc(F)cc(I)c1 Amb10839298 [0,2,0,0,0,0|1,0,0]=3 7505 B9R1.34 Cc1cc(F)cc(N)n1 Amb25713858 [0,2,0,0,0,0|2,0,0]=4 7506 B9R1.34 Cc1cc(F)cc(O)n1 Amb22169388 [0,2,0,0,0,0|1,0,0]=3 7507 B9R1.34 Cc1cc(F)cc(S)c1 Amb19892690 [0,2,0,0,0,0|0,1,0]=3 7508 B9R1.34 Cc1cc(F)nc(Br)c1 Amb15691033 [0,2,0,0,0,0|2,0,0]=4 7509 B9R1.34 Cc1cc(F)nc(Cl)c1 Amb24478603 [0,2,0,0,0,0|2,0,0]=4 7510 B9R1.34 Cc1cc(F)nc(F)c1 Amb2447337 [0,2,0,0,0,0|2,0,0]=4 7511 B9R1.34 Cc1cc(F)nc(I)c1 Amb26938875 [0,2,0,0,0,0|2,0,0]=4 7512 B9R1.34 Cc1cc(I)cc(Br)n1 Amb28196404 [0,2,0,0,0,0|2,0,0]=4 7513 B9R1.34 Cc1cc(I)cc(C)n1 Amb22263027 [0,2,0,0,0,0|2,0,0]=4 7514 B9R1.34 Cc1cc(I)cc(Cl)n1 Amb26954486 [0,2,0,0,0,0|2,0,0]=4 7515 B9R1.34 Cc1cc(I)cc(F)n1 Amb20240825 [0,2,0,0,0,0|2,0,0]=4 7516 B9R1.34 Cc1cc(I)cc(I)c1 Amb25113284 [0,2,0,0,0,0|1,0,0]=3 7517 B9R1.34 Cc1cc(I)cc(I)n1 Amb27619016 [0,2,0,0,0,0|2,0,0]=4 7518 B9R1.34 Cc1cc(I)cc(N)n1 Amb24375494 [0,2,0,0,0,0|2,0,0]=4 7519 B9R1.34 Cc1cc(I)nc(I)c1 Amb25364466 [0,2,0,0,0,0|2,0,0]=4 7520 B9R1.34 Cc1cc(N)cc(Br)c1 Amb10068006 [0,2,0,0,0,0|1,0,0]=3 7521 B9R1.34 Cc1cc(N)cc(Br)c1 Amb18368607 [0,2,0,0,0,0|1,0,0]=3 7522 B9R1.34 Cc1cc(N)cc(Br)n1 Amb16185705 [0,2,0,0,0,0|2,0,0]=4 7523 B9R1.34 Cc1cc(N)cc(C)n1 Amb8438992 [0,2,0,0,0,0|2,0,0]=4 7524 B9R1.34 Cc1cc(N)cc(Cl)c1 Amb18643778 [0,2,0,0,0,0|1,0,0]=3 7525 B9R1.34 Cc1cc(N)cc(Cl)n1 Amb18643891 [0,2,0,0,0,0|2,0,0]=4 7526 B9R1.34 Cc1cc(N)cc(F)c1 Amb8383845 [0,2,0,0,0,0|1,0,0]=3 7527 B9R1.34 Cc1cc(N)cc(F)n1 Amb24318839 [0,2,0,0,0,0|2,0,0]=4 7528 B9R1.34 Cc1cc(N)cc(I)c1 Amb20243091 [0,2,0,0,0,0|1,0,0]=3 7529 B9R1.34 Cc1cc(N)cc(I)n1 Amb26397556 [0,2,0,0,0,0|2,0,0]=4 7530 B9R1.34 Cc1cc(N)cc(N)c1 Amb18642061 [0,2,0,0,0,0|1,0,0]=3 7531 B9R1.34 Cc1cc(N)cc(N)c1 Amb24329106 [0,2,0,0,0,0|1,0,0]=3 7532 B9R1.34 Cc1cc(N)cc(N)n1 Amb22169618 [0,2,0,0,0,0|2,0,0]=4 7533 B9R1.34 Cc1cc(N)cc(O)c1 Amb17678823 [0,2,0,0,0,0|0,0,0]=2 7534 B9R1.34 Cc1cc(N)cc(S)c1 Amb28203880 [0,2,0,0,0,0|0,1,0]=3 7535 B9R1.34 Cc1cc(N)nc(Br)c1 Amb19958071 [0,2,0,0,0,0|2,0,0]=4 7536 B9R1.34 Cc1cc(N)nc(Cl)c1 Amb13883498 [0,2,0,0,0,0|2,0,0]=4 7537 B9R1.34 Cc1cc(N)nc(I)c1 Amb22750364 [0,2,0,0,0,0|2,0,0]=4 7538 B9R1.34 Cc1cc(N)nc(N)c1 Amb19958364 [0,2,0,0,0,0|2,0,0]=4 7539 B9R1.34 Cc1cc(O)cc(Br)c1 Amb18042935 [0,2,0,0,0,0|0,0,0]=2 7540 B9R1.34 Cc1cc(O)cc(C)n1 Amb2687530 [0,2,0,0,0,0|1,0,0]=3 7541 B9R1.34 Cc1cc(O)cc(Cl)c1 Amb10602290 [0,2,0,0,0,0|0,0,0]=2 7542 B9R1.34 Cc1cc(O)cc(Cl)n1 Amb22751357 [0,2,0,0,0,0|1,0,0]=3 7543 B9R1.34 Cc1cc(O)cc(F)c1 Amb10839415 [0,2,0,0,0,0|0,0,0]=2 7544 B9R1.34 Cc1cc(O)cc(F)n1 Amb22169355 [0,2,0,0,0,0|1,0,0]=3 7545 B9R1.34 Cc1cc(O)cc(I)c1 Amb25708758 [0,2,0,0,0,0|0,0,0]=2 7546 B9R1.34 Cc1cc(O)cc(I)n1 Amb22490208 [0,2,0,0,0,0|1,0,0]=3 7547 B9R1.34 Cc1cc(O)cc(O)c1 Amb2689688 [0,2,0,0,0,0|0,0,0]=2 7548 B9R1.34 Cc1cc(O)cc(O)c1 Amb6297359 [0,2,0,0,0,0|0,0,0]=2 7549 B9R1.34 Cc1cc(O)cc(O)n1 Amb8517323 [0,2,0,0,0,0|1,0,0]=3 7550 B9R1.34 Cc1cc(O)nc(Br)c1 Amb26567456 [0,2,0,0,0,0|1,0,0]=3 7551 B9R1.34 Cc1cc(O)nc(C)n1 Amb2609948 [0,2,0,0,0,0|2,0,0]=4 7552 B9R1.34 Cc1cc(O)nc(Cl)n1 Amb33538255 [0,2,0,0,0,0|2,0,0]=4 7553 B9R1.34 Cc1cc(O)nc(F)c1 Amb22169349 [0,2,0,0,0,0|1,0,0]=3 7554 B9R1.34 Cc1cc(O)nc(F)n1 Amb35718395 [0,2,0,0,0,0|2,0,0]=4 7555 B9R1.34 Cc1cc(O)nc(I)c1 Amb27192566 [0,2,0,0,0,0|1,0,0]=3 7556 B9R1.34 Cc1cc(O)nc(N)n1 Amb2724454 [0,2,0,0,0,0|2,0,0]=4 7557 B9R1.34 Cc1cc(O)nc(O)c1 Amb17778585 [0,2,0,0,0,0|1,0,0]=3 7558 B9R1.34 Cc1cc(O)nc(O)n1 Amb2591527 [0,2,0,0,0,0|2,0,0]=4 7559 B9R1.34 Cc1cc(O)nc(S)n1 Amb2602819 [0,2,0,0,0,0|2,0,0]=4 7560 B9R1.34 Cc1cc(S)cc(Br)c1 Amb26347870 [0,2,0,0,0,0|0,1,0]=3 7561 B9R1.34 Cc1cc(S)cc(Cl)c1 Amb19893113 [0,2,0,0,0,0|0,1,0]=3 7562 B9R1.34 Cc1cc(S)cc(Cl)n1 Amb33222576 [0,2,0,0,0,0|1,1,0]=4 7563 B9R1.34 Cc1cc(S)cc(I)c1 Amb27838618 [0,2,0,0,0,0|0,1,0]=3 7564 B9R1.34 Cc1nc(O)cc(Br)n1 Amb22757893 [0,2,0,0,0,0|2,0,0]=4 7565 B9R1.34 Cc1nc(O)cc(Cl)n1 Amb4017637 [0,2,0,0,0,0|2,0,0]=4 7566 B9R1.34 Cc1nc(O)cc(O)n1 Amb2591525 [0,2,0,0,0,0|2,0,0]=4 7567 B9R1.34 Cc1nc(O)cc(S)n1 Amb22753695 [0,2,0,0,0,0|2,0,0]=4 7568 B9R1.34 Clc1cc(Br)cc(Br)c1 Amb2227566 [0,2,0,0,0,0|1,0,0]=3 7569 B9R1.34 Clc1cc(Br)cc(Br)n1 Amb24576319 [0,2,0,0,0,0|2,0,0]=4 7570 B9R1.34 Clc1cc(Br)cc(Cl)n1 Amb19958153 [0,2,0,0,0,0|2,0,0]=4 7571 B9R1.34 Clc1cc(Br)cc(I)c1 Amb19957901 [0,2,0,0,0,0|1,0,0]=3 7572 B9R1.34 Clc1cc(Br)nc(Br)c1 Amb19959289 [0,2,0,0,0,0|2,0,0]=4 7573 B9R1.34 Clc1cc(Br)nc(I)c1 Amb25924340 [0,2,0,0,0,0|2,0,0]=4 7574 B9R1.34 Clc1cc(Cl)cc(Br)c1 Amb2685061 [0,2,0,0,0,0|1,0,0]=3 7575 B9R1.34 Clc1cc(Cl)cc(Cl)c1 Amb6365747 [0,2,0,0,0,0|1,0,0]=3 7576 B9R1.34 Clc1cc(Cl)cc(I)c1 Amb2686869 [0,2,0,0,0,0|1,0,0]=3 7577 B9R1.34 Clc1cc(Cl)nc(Br)c1 Amb24585725 [0,2,0,0,0,0|2,0,0]=4 7578 B9R1.34 Clc1cc(Cl)nc(Cl)c1 Amb3428710 [0,2,0,0,0,0|2,0,0]=4 7579 B9R1.34 Clc1cc(I)cc(Cl)n1 Amb8388593 [0,2,0,0,0,0|2,0,0]=4 7580 B9R1.34 Clc1cc(I)cc(I)c1 Amb25883609 [0,2,0,0,0,0|1,0,0]=3 7581 B9R1.34 Clc1cc(I)cc(I)n1 Amb27635585 [0,2,0,0,0,0|2,0,0]=4 7582 B9R1.34 F[n+]1cc(Cl)cc(Cl)c1 Amb10842015 [0,2,0,0,0,0|2,0,0]=4 7583 B9R1.34 Fc1cc(Br)cc(Br)c1 Amb2686728 [0,2,0,0,0,0|1,0,0]=3 7584 B9R1.34 Fc1cc(Br)cc(Br)n1 Amb24318849 [0,2,0,0,0,0|2,0,0]=4 7585 B9R1.34 Fc1cc(Br)cc(Cl)n1 Amb24318842 [0,2,0,0,0,0|2,0,0]=4 7586 B9R1.34 Fc1cc(Br)cc(F)n1 Amb21963408 [0,2,0,0,0,0|2,0,0]=4 7587 B9R1.34 Fc1cc(Br)cc(I)c1 Amb2691596 [0,2,0,0,0,0|1,0,0]=3 7588 B9R1.34 Fc1cc(Br)nc(Br)c1 Amb24179165 [0,2,0,0,0,0|2,0,0]=4 7589 B9R1.34 Fc1cc(Br)nc(I)c1 Amb27791260 [0,2,0,0,0,0|2,0,0]=4 7590 B9R1.34 Fc1cc(Cl)cc(Br)c1 Amb2685008 [0,2,0,0,0,0|1,0,0]=3 7591 B9R1.34 Fc1cc(Cl)cc(Br)n1 Amb26079516 [0,2,0,0,0,0|2,0,0]=4 7592 B9R1.34 Fc1cc(Cl)cc(Cl)c1 Amb2686837 [0,2,0,0,0,0|1,0,0]=3 7593 B9R1.34 Fc1cc(Cl)cc(F)n1 Amb24466131 [0,2,0,0,0,0|2,0,0]=4 7594 B9R1.34 Fc1cc(Cl)cc(I)c1 Amb25840746 [0,2,0,0,0,0|1,0,0]=3 7595 B9R1.34 Fc1cc(Cl)cc(I)n1 Amb26897050 [0,2,0,0,0,0|2,0,0]=4 7596 B9R1.34 Fc1cc(Cl)nc(Br)c1 Amb27867525 [0,2,0,0,0,0|2,0,0]=4 7597 B9R1.34 Fc1cc(Cl)nc(Cl)c1 Amb25129454 [0,2,0,0,0,0|2,0,0]=4 7598 B9R1.34 Fc1cc(Cl)nc(I)c1 Amb25963869 [0,2,0,0,0,0|2,0,0]=4 7599 B9R1.34 Fc1cc(F)cc(Br)c1 Amb2685094 [0,2,0,0,0,0|1,0,0]=3 7600 B9R1.34 Fc1cc(F)cc(Cl)c1 Amb2685828 [0,2,0,0,0,0|1,0,0]=3 7601 B9R1.34 Fc1cc(F)cc(F)c1 Amb2690730 [0,2,0,0,0,0|1,0,0]=3 7602 B9R1.34 Fc1cc(F)cc(I)c1 Amb2691985 [0,2,0,0,0,0|1,0,0]=3 7603 B9R1.34 Fc1cc(F)cc(S)c1 Amb2687281 [0,2,0,0,0,0|0,1,0]=3 7604 B9R1.34 Fc1cc(F)cc([Zn+])c1 Amb22351559 [0,2,0,0,0,0|1,0,0]=3 7605 B9R1.34 Fc1cc(F)nc(Br)c1 Amb8388362 [0,2,0,0,0,0|2,0,0]=4 7606 B9R1.34 Fc1cc(F)nc(Cl)c1 Amb25981358 [0,2,0,0,0,0|2,0,0]=4 7607 B9R1.34 Fc1cc(F)nc(F)c1 Amb8395207 [0,2,0,0,0,0|2,0,0]=4 7608 B9R1.34 Fc1cc(F)nc(I)c1 Amb26894979 [0,2,0,0,0,0|2,0,0]=4 7609 B9R1.34 Fc1cc(F)nc(S)c1 Amb25377238 [0,2,0,0,0,0|1,1,0]=4 7610 B9R1.34 Fc1cc(I)cc(Br)n1 Amb24443550 [0,2,0,0,0,0|2,0,0]=4 7611 B9R1.34 Fc1cc(I)cc(Cl)n1 Amb24318852 [0,2,0,0,0,0|2,0,0]=4 7612 B9R1.34 Fc1cc(I)cc(F)n1 Amb33548847 [0,2,0,0,0,0|2,0,0]=4 7613 B9R1.34 Fc1cc(I)cc(I)c1 Amb22546874 [0,2,0,0,0,0|1,0,0]=3 7614 B9R1.34 Fc1cc(S)cc(Br)c1 Amb19890928 [0,2,0,0,0,0|0,1,0]=3 7615 B9R1.34 Fc1cc(S)cc(Cl)c1 Amb2686087 [0,2,0,0,0,0|0,1,0]=3 7616 B9R1.34 Fc1cc(S)cc(Cl)n1 Amb24564754 [0,2,0,0,0,0|1,1,0]=4 7617 B9R1.34 Fc1cc(S)cc(F)n1 Amb26419350 [0,2,0,0,0,0|1,1,0]=4 7618 B9R1.34 Fc1cc(S)cc(I)c1 Amb25032156 [0,2,0,0,0,0|0,1,0]=3 7619 B9R1.34 Fc1cc(S)cc(I)n1 Amb27613783 [0,2,0,0,0,0|1,1,0]=4 7620 B9R1.34 Fc1cc(S)nc(Cl)c1 Amb28140798 [0,2,0,0,0,0|1,1,0]=4 7621 B9R1.34 Fc1cc(S)nc(I)c1 Amb27613797 [0,2,0,0,0,0|1,1,0]=4 7622 B9R1.34 Ic1cc(I)cc(I)c1 Amb341431 [0,2,0,0,0,0|1,0,0]=3 7623 B9R1.34 Ic1cc(I)nc(I)c1 Amb27849489 [0,2,0,0,0,0|2,0,0]=4 7624 B9R1.34 NC1=CC(=O)NC(F)=C1 Amb24184098 [0,2,0,0,0,0|1,0,1]=4 7625 B9R1.34 NC1=CC(=O)NC(O)=C1 Amb18642374 [0,2,0,0,0,0|1,0,0]=3 7626 B9R1.34 NC1=CC(O)=CC(=O)N1 Amb22235888 [0,2,0,0,0,0|1,0,0]=3 7627 B9R1.34 NC1=NC(=O)NC(O)=C1 Amb21935600 [0,2,0,0,0,0|2,0,0]=4 7628 B9R1.34 NC1=NC(O)=CC(=O)N1 Amb20665524 [0,2,0,0,0,0|2,0,0]=4 7629 B9R1.34 Nc1cc(Br)cc(Br)c1 Amb10068249 [0,2,0,0,0,0|1,0,0]=3 7630 B9R1.34 Nc1cc(Br)cc(Br)c1 Amb2716208 [0,2,0,0,0,0|1,0,0]=3 7631 B9R1.34 Nc1cc(Br)cc(Br)n1 Amb21963403 [0,2,0,0,0,0|2,0,0]=4 7632 B9R1.34 Nc1cc(Br)cc(Cl)n1 Amb22498211 [0,2,0,0,0,0|2,0,0]=4 7633 B9R1.34 Nc1cc(Br)cc(F)n1 Amb24318854 [0,2,0,0,0,0|2,0,0]=4 7634 B9R1.34 Nc1cc(Br)cc(I)c1 Amb20241284 [0,2,0,0,0,0|1,0,0]=3 7635 B9R1.34 Nc1cc(Br)cc(I)n1 Amb27879057 [0,2,0,0,0,0|2,0,0]=4 7636 B9R1.34 Nc1cc(Br)cc(N)n1 Amb10068353 [0,2,0,0,0,0|2,0,0]=4 7637 B9R1.34 Nc1cc(Br)cc(O)n1 Amb25746373 [0,2,0,0,0,0|1,0,0]=3 7638 B9R1.34 Nc1cc(Br)nc(Br)c1 Amb8438917 [0,2,0,0,0,0|2,0,0]=4 7639 B9R1.34 Nc1cc(Br)nc(I)c1 Amb24653915 [0,2,0,0,0,0|2,0,0]=4 7640 B9R1.34 Nc1cc(Cl)[nH+]c(Cl)c1 Amb33513027 [0,2,0,0,0,0|2,0,0]=4 7641 B9R1.34 Nc1cc(Cl)cc(Br)c1 Amb10071626 [0,2,0,0,0,0|1,0,0]=3 7642 B9R1.34 Nc1cc(Cl)cc(Br)c1 Amb32663329 [0,2,0,0,0,0|1,0,0]=3 7643 B9R1.34 Nc1cc(Cl)cc(Br)n1 Amb22498087 [0,2,0,0,0,0|2,0,0]=4 7644 B9R1.34 Nc1cc(Cl)cc(Cl)c1 Amb2686788 [0,2,0,0,0,0|1,0,0]=3 7645 B9R1.34 Nc1cc(Cl)cc(Cl)n1 Amb8383863 [0,2,0,0,0,0|2,0,0]=4 7646 B9R1.34 Nc1cc(Cl)cc(Cl)n1 Amb8396773 [0,2,0,0,0,0|2,0,0]=4 7647 B9R1.34 Nc1cc(Cl)cc(F)n1 Amb26460018 [0,2,0,0,0,0|2,0,0]=4 7648 B9R1.34 Nc1cc(Cl)cc(I)c1 Amb27401042 [0,2,0,0,0,0|1,0,0]=3 7649 B9R1.34 Nc1cc(Cl)cc(I)n1 Amb27155991 [0,2,0,0,0,0|2,0,0]=4 7650 B9R1.34 Nc1cc(Cl)cc(N)n1 Amb16230383 [0,2,0,0,0,0|2,0,0]=4 7651 B9R1.34 Nc1cc(Cl)cc(O)n1 Amb26397503 [0,2,0,0,0,0|1,0,0]=3 7652 B9R1.34 Nc1cc(Cl)nc(Br)c1 Amb25778235 [0,2,0,0,0,0|2,0,0]=4 7653 B9R1.34 Nc1cc(Cl)nc(Cl)c1 Amb2609920 [0,2,0,0,0,0|2,0,0]=4 7654 B9R1.34 Nc1cc(Cl)nc(I)c1 Amb25951380 [0,2,0,0,0,0|2,0,0]=4 7655 B9R1.34 Nc1cc(F)cc(Br)c1 Amb20623320 [0,2,0,0,0,0|1,0,0]=3 7656 B9R1.34 Nc1cc(F)cc(Br)c1 Amb33526881 [0,2,0,0,0,0|1,0,0]=3 7657 B9R1.34 Nc1cc(F)cc(Br)n1 Amb26869070 [0,2,0,0,0,0|2,0,0]=4 7658 B9R1.34 Nc1cc(F)cc(Cl)c1 Amb8387236 [0,2,0,0,0,0|1,0,0]=3 7659 B9R1.34 Nc1cc(F)cc(Cl)n1 Amb24402198 [0,2,0,0,0,0|2,0,0]=4 7660 B9R1.34 Nc1cc(F)cc(F)c1 Amb2687039 [0,2,0,0,0,0|1,0,0]=3 7661 B9R1.34 Nc1cc(F)cc(F)n1 Amb33547607 [0,2,0,0,0,0|2,0,0]=4 7662 B9R1.34 Nc1cc(F)cc(I)c1 Amb8496531 [0,2,0,0,0,0|1,0,0]=3 7663 B9R1.34 Nc1cc(F)cc(I)n1 Amb24564085 [0,2,0,0,0,0|2,0,0]=4 7664 B9R1.34 Nc1cc(F)cc(O)n1 Amb28283601 [0,2,0,0,0,0|1,0,0]=3 7665 B9R1.34 Nc1cc(F)cc(S)c1 Amb18943720 [0,2,0,0,0,0|0,1,0]=3 7666 B9R1.34 Nc1cc(F)cc(S)c1 Amb19515472 [0,2,0,0,0,0|0,1,0]=3 7667 B9R1.34 Nc1cc(F)nc(Br)c1 Amb24505648 [0,2,0,0,0,0|2,0,0]=4 7668 B9R1.34 Nc1cc(F)nc(Cl)c1 Amb26926535 [0,2,0,0,0,0|2,0,0]=4 7669 B9R1.34 Nc1cc(F)nc(F)c1 Amb10841931 [0,2,0,0,0,0|2,0,0]=4 7670 B9R1.34 Nc1cc(F)nc(I)c1 Amb25255593 [0,2,0,0,0,0|2,0,0]=4 7671 B9R1.34 Nc1cc(I)cc(I)c1 Amb33548943 [0,2,0,0,0,0|1,0,0]=3 7672 B9R1.34 Nc1cc(I)cc(I)c1 Amb33550736 [0,2,0,0,0,0|1,0,0]=3 7673 B9R1.34 Nc1cc(I)cc(I)n1 Amb27965754 [0,2,0,0,0,0|2,0,0]=4 7674 B9R1.34 Nc1cc(I)nc(I)c1 Amb27438297 [0,2,0,0,0,0|2,0,0]=4 7675 B9R1.34 Nc1cc(N)c[n+]([O-])c1 Amb27267443 [0,2,0,0,0,0|1,0,1]=4 7676 B9R1.34 Nc1cc(N)cc(Br)c1 Amb9782314 [0,2,0,0,0,0|1,0,0]=3 7677 B9R1.34 Nc1cc(N)cc(Cl)c1 Amb4006628 [0,2,0,0,0,0|1,0,0]=3 7678 B9R1.34 Nc1cc(N)cc(F)c1 Amb18943719 [0,2,0,0,0,0|1,0,0]=3 7679 B9R1.34 Nc1cc(N)cc(I)c1 Amb33548854 [0,2,0,0,0,0|1,0,0]=3 7680 B9R1.34 Nc1cc(N)cc(N)c1 Amb1038979 [0,2,0,0,0,0|1,0,0]=3 7681 B9R1.34 Nc1cc(N)cc(N)c1 Amb6306677 [0,2,0,0,0,0|1,0,0]=3 7682 B9R1.34 Nc1cc(N)nc(Br)c1 Amb26642860 [0,2,0,0,0,0|2,0,0]=4 7683 B9R1.34 Nc1cc(N)nc(Cl)c1 Amb25147138 [0,2,0,0,0,0|2,0,0]=4 7684 B9R1.34 Nc1cc(N)nc(Cl)c1 Amb33456182 [0,2,0,0,0,0|2,0,0]=4 7685 B9R1.34 Nc1cc(N)nc(F)c1 Amb24575306 [0,2,0,0,0,0|2,0,0]=4 7686 B9R1.34 Nc1cc(N)nc(O)n1 Amb6296771 [0,2,0,0,0,0|2,0,0]=4 7687 B9R1.34 Nc1cc(O)cc(Br)c1 Amb22008479 [0,2,0,0,0,0|0,0,0]=2 7688 B9R1.34 Nc1cc(O)cc(Br)n1 Amb28241007 [0,2,0,0,0,0|1,0,0]=3 7689 B9R1.34 Nc1cc(O)cc(Cl)c1 Amb22233859 [0,2,0,0,0,0|0,0,0]=2 7690 B9R1.34 Nc1cc(O)cc(Cl)n1 Amb26929546 [0,2,0,0,0,0|1,0,0]=3 7691 B9R1.34 Nc1cc(O)cc(F)c1 Amb20668495 [0,2,0,0,0,0|0,0,0]=2 7692 B9R1.34 Nc1cc(O)cc(F)c1 Amb33299295 [0,2,0,0,0,0|0,0,0]=2 7693 B9R1.34 Nc1cc(O)cc(F)n1 Amb26540616 [0,2,0,0,0,0|1,0,0]=3 7694 B9R1.34 Nc1cc(O)cc(I)c1 Amb25377079 [0,2,0,0,0,0|0,0,0]=2 7695 B9R1.34 Nc1cc(O)cc(O)c1 Amb17593293 [0,2,0,0,0,0|0,0,0]=2 7696 B9R1.34 Nc1cc(O)cc(O)c1 Amb2722870 [0,2,0,0,0,0|0,0,0]=2 7697 B9R1.34 Nc1cc(O)cc(S)n1 Amb27757705 [0,2,0,0,0,0|1,0,0]=3 7698 B9R1.34 Nc1cc(O)n[14c](S)n1 Amb33872523 [0,2,0,0,0,0|2,0,0]=4 7699 B9R1.34 Nc1cc(O)nc(Br)c1 Amb24505319 [0,2,0,0,0,0|1,0,0]=3 7700 B9R1.34 Nc1cc(O)nc(Cl)c1 Amb22276467 [0,2,0,0,0,0|1,0,0]=3 7701 B9R1.34 Nc1cc(O)nc(N)n1 Amb33719370 [0,2,0,0,0,0|2,0,0]=4 7702 B9R1.34 Nc1cc(O)nc(N)n1 Amb534973 [0,2,0,0,0,0|2,0,0]=4 7703 B9R1.34 Nc1cc(O)nc(S)n1 Amb2477135 [0,2,0,0,0,0|2,0,0]=4 7704 B9R1.34 Nc1cc(S)cc(Br)c1 Amb26543032 [0,2,0,0,0,0|0,1,0]=3 7705 B9R1.34 Nc1cc(S)cc(Cl)c1 Amb26348174 [0,2,0,0,0,0|0,1,0]=3 7706 B9R1.34 Nc1cc(S)nc(Cl)c1 Amb28194720 [0,2,0,0,0,0|1,1,0]=4 7707 B9R1.34 Nc1cc(S)nc(O)n1 Amb4018792 [0,2,0,0,0,0|2,0,0]=4 7708 B9R1.34 Nc1nc(O)cc(Cl)n1 Amb4012880 [0,2,0,0,0,0|2,0,0]=4 7709 B9R1.34 Nc1nc(O)cc(I)n1 Amb22495904 [0,2,0,0,0,0|2,0,0]=4 7710 B9R1.34 Nc1nc(O)cc(O)n1 Amb1792759 [0,2,0,0,0,0|2,0,0]=4 7711 B9R1.34 O=C1C=C(Br)C=C(Br)N1 Amb27240182 [0,2,0,0,0,0|1,0,1]=4 7712 B9R1.34 O=C1C=C(Br)C=C(Cl)N1 Amb22899582 [0,2,0,0,0,0|1,0,1]=4 7713 B9R1.34 O=C1C=C(Br)C=C(O)N1 Amb25919559 [0,2,0,0,0,0|1,0,0]=3 7714 B9R1.34 O=C1C=C(Cl)C=C(Cl)N1 Amb22001851 [0,2,0,0,0,0|1,0,1]=4 7715 B9R1.34 O=C1C=C(Cl)C=C(O)N1 Amb25760719 [0,2,0,0,0,0|1,0,0]=3 7716 B9R1.34 O=C1C=C(Cl)NC(Cl)=C1 Amb22495372 [0,2,0,0,0,0|1,0,1]=4 7717 B9R1.34 O=C1C=C(O)CC(=O)N1 Amb27410873 [0,2,0,0,0,0|1,0,1]=4 7718 B9R1.34 O=C1C=C(O)CC(=O)O1 Amb25689610 [0,2,0,0,0,0|1,0,1]=4 7719 B9R1.34 O=C1C=C(O)NC(=O)N1 Amb21811395 [0,2,0,0,0,0|2,0,0]=4 7720 B9R1.34 O=C1C=C(O)NC(O)=C1 Amb24675810 [0,2,0,0,0,0|1,0,0]=3 7721 B9R1.34 Oc1cc(Br)cc(Br)c1 Amb5722317 [0,2,0,0,0,0|0,0,0]=2 7722 B9R1.34 Oc1cc(Br)cc(I)c1 Amb22233169 [0,2,0,0,0,0|0,0,0]=2 7723 B9R1.34 Oc1cc(Br)nc(Br)c1 Amb22263184 [0,2,0,0,0,0|1,0,0]=3 7724 B9R1.34 Oc1cc(Br)nc(Cl)n1 Amb24321487 [0,2,0,0,0,0|2,0,0]=4 7725 B9R1.34 Oc1cc(Br)nc(O)n1 Amb27230896 [0,2,0,0,0,0|2,0,0]=4 7726 B9R1.34 Oc1cc(Cl)cc(Br)c1 Amb6297162 [0,2,0,0,0,0|0,0,0]=2 7727 B9R1.34 Oc1cc(Cl)cc(Br)n1 Amb25924335 [0,2,0,0,0,0|1,0,0]=3 7728 B9R1.34 Oc1cc(Cl)cc(Cl)c1 Amb1152990 [0,2,0,0,0,0|0,0,0]=2 7729 B9R1.34 Oc1cc(Cl)cc(F)n1 Amb27949168 [0,2,0,0,0,0|1,0,0]=3 7730 B9R1.34 Oc1cc(Cl)cc(I)c1 Amb22752809 [0,2,0,0,0,0|0,0,0]=2 7731 B9R1.34 Oc1cc(Cl)nc(Br)c1 Amb26065966 [0,2,0,0,0,0|1,0,0]=3 7732 B9R1.34 Oc1cc(Cl)nc(Br)n1 Amb24321486 [0,2,0,0,0,0|2,0,0]=4 7733 B9R1.34 Oc1cc(Cl)nc(Cl)c1 Amb10552442 [0,2,0,0,0,0|1,0,0]=3 7734 B9R1.34 Oc1cc(Cl)nc(Cl)n1 Amb20617425 [0,2,0,0,0,0|2,0,0]=4 7735 B9R1.34 Oc1cc(Cl)nc(F)n1 Amb26567566 [0,2,0,0,0,0|2,0,0]=4 7736 B9R1.34 Oc1cc(Cl)nc(I)c1 Amb27814032 [0,2,0,0,0,0|1,0,0]=3 7737 B9R1.34 Oc1cc(Cl)nc(O)n1 Amb18644298 [0,2,0,0,0,0|2,0,0]=4 7738 B9R1.34 Oc1cc(F)cc(Br)c1 Amb6298286 [0,2,0,0,0,0|0,0,0]=2 7739 B9R1.34 Oc1cc(F)cc(Cl)c1 Amb2684169 [0,2,0,0,0,0|0,0,0]=2 7740 B9R1.34 Oc1cc(F)cc(Cl)n1 Amb27975408 [0,2,0,0,0,0|1,0,0]=3 7741 B9R1.34 Oc1cc(F)cc(F)c1 Amb2687213 [0,2,0,0,0,0|0,0,0]=2 7742 B9R1.34 Oc1cc(F)cc(F)n1 Amb27485004 [0,2,0,0,0,0|1,0,0]=3 7743 B9R1.34 Oc1cc(F)cc(I)c1 Amb22756340 [0,2,0,0,0,0|0,0,0]=2 7744 B9R1.34 Oc1cc(F)cc(I)n1 Amb26966063 [0,2,0,0,0,0|1,0,0]=3 7745 B9R1.34 Oc1cc(F)cc(S)c1 Amb26326212 [0,2,0,0,0,0|0,0,0]=2 7746 B9R1.34 Oc1cc(F)nc(Br)c1 Amb25147032 [0,2,0,0,0,0|1,0,0]=3 7747 B9R1.34 Oc1cc(F)nc(Cl)c1 Amb26516226 [0,2,0,0,0,0|1,0,0]=3 7748 B9R1.34 Oc1cc(F)nc(Cl)n1 Amb25349703 [0,2,0,0,0,0|2,0,0]=4 7749 B9R1.34 Oc1cc(F)nc(F)c1 Amb24551870 [0,2,0,0,0,0|1,0,0]=3 7750 B9R1.34 Oc1cc(F)nc(I)c1 Amb26974752 [0,2,0,0,0,0|1,0,0]=3 7751 B9R1.34 Oc1cc(I)cc(Cl)n1 Amb25826674 [0,2,0,0,0,0|1,0,0]=3 7752 B9R1.34 Oc1cc(I)cc(F)n1 Amb27631414 [0,2,0,0,0,0|1,0,0]=3 7753 B9R1.34 Oc1cc(I)cc(I)c1 Amb21963902 [0,2,0,0,0,0|0,0,0]=2 7754 B9R1.34 Oc1cc(O)cc(Br)c1 Amb21962130 [0,2,0,0,0,0|0,0,0]=2 7755 B9R1.34 Oc1cc(O)cc(Cl)c1 Amb18124710 [0,2,0,0,0,0|0,0,0]=2 7756 B9R1.34 Oc1cc(O)cc(F)c1 Amb18642566 [0,2,0,0,0,0|0,0,0]=2 7757 B9R1.34 Oc1cc(O)cc(I)c1 Amb17616137 [0,2,0,0,0,0|0,0,0]=2 7758 B9R1.34 Oc1cc(O)cc(O)c1 Amb32668836 [0,2,0,0,0,0|0,0,0]=2 7759 B9R1.34 Oc1cc(O)cc(O)c1 Amb5395437 [0,2,0,0,0,0|0,0,0]=2 7760 B9R1.34 Oc1cc(O)cc(O)c1 Amb6357344 [0,2,0,0,0,0|0,0,0]=2 7761 B9R1.34 Oc1cc(O)nc(Cl)c1 Amb24529251 [0,2,0,0,0,0|1,0,0]=3 7762 B9R1.34 Oc1cc(O)nc(S)n1 Amb2720295 [0,2,0,0,0,0|2,0,0]=4 7763 B9R1.34 Oc1cc(O)nc([S-])n1 Amb33946296 [0,2,0,0,0,0|2,0,0]=4 7764 B9R1.34 Oc1cc(S)nc(O)n1 Amb21811755 [0,2,0,0,0,0|2,0,0]=4 7765 B9R1.34 Oc1nc(Cl)cc(Br)n1 Amb24321485 [0,2,0,0,0,0|2,0,0]=4 7766 B9R1.34 Oc1nc(F)cc(Cl)n1 Amb24564611 [0,2,0,0,0,0|2,0,0]=4 7767 B9R1.34 Sc1cc(Br)cc(Br)n1 Amb27613363 [0,2,0,0,0,0|1,1,0]=4 7768 B9R1.34 Sc1cc(Br)cc(I)c1 Amb25185298 [0,2,0,0,0,0|0,1,0]=3 7769 B9R1.34 Sc1cc(Cl)cc(Br)c1 Amb19890925 [0,2,0,0,0,0|0,1,0]=3 7770 B9R1.34 Sc1cc(Cl)cc(Cl)c1 Amb2686990 [0,2,0,0,0,0|0,1,0]=3 7771 B9R1.34 Sc1cc(Cl)cc(Cl)n1 Amb28345970 [0,2,0,0,0,0|1,1,0]=4 7772 B9R1.34 Sc1cc(Cl)cc(I)c1 Amb26509760 [0,2,0,0,0,0|0,1,0]=3 7773 B9R1.34 Sc1cc(Cl)nc(Cl)c1 Amb22263217 [0,2,0,0,0,0|1,1,0]=4 7774 B9R1.34 Sc1cc(I)cc(I)c1 Amb27800908 [0,2,0,0,0,0|0,1,0]=3 7775 B9R1.34 Sc1cc(S)cc(S)c1 Amb24325452 [0,2,0,0,0,0|0,1,0]=3 7776 B9R1.34 [O-][n+]1cc(Br)cc(Br)c1 Amb2610012 [0,2,0,0,0,0|1,0,1]=4 7777 B9R1.34 [O-][n+]1cc(Cl)cc(Br)c1 Amb19959537 [0,2,0,0,0,0|1,0,1]=4 7778 B9R1.34 [O-][n+]1cc(Cl)cc(Cl)c1 Amb2610059 [0,2,0,0,0,0|1,0,1]=4 7779 B9R1.34 [O-][n+]1cc(F)cc(Br)c1 Amb19959827 [0,2,0,0,0,0|1,0,1]=4 7780 B9R1.34 [O-][n+]1cc(F)cc(Cl)c1 Amb19959538 [0,2,0,0,0,0|1,0,1]=4 7781 B9R1.34 [O-][n+]1cc(F)cc(F)c1 Amb19959020 [0,2,0,0,0,0|1,0,1]=4 7782 B9R1.34 [O-][n+]1cc(O)cc(Cl)c1 Amb28044063 [0,2,0,0,0,0|1,0,0]=3 7783 B9R1.40 C[C@]1(O)C=CC=C[C@@H]1O Amb27441472 [0,2,0,0,0,0|0,0,2]=4 7784 B9R1.40 O=C1C=CC=CC1(Cl)Cl Amb27862884 [0,2,0,0,0,0|0,0,2]=4 7785 B7R1.15 C=C1C(=O)C=C1C Amb27802553 [0,0,1,1,0,0|0,0,2]=4 7786 B7R1.15 O=C1C=C(O)C1=O Amb22171298 [0,0,1,1,0,0|2,0,0]=4 7787 B7R1.24 C1=CC=CCC=C1 Amb6609003 [0,0,1,1,0,0|1,0,0]=3 7788 B7R1.24 C1=CNC=CN=C1 Amb27595980 [0,0,1,1,0,0|2,0,0]=4 7789 B9R2.21 Brc1ccc2c(c1)C2 Amb26013771 [0,0,0,1,0,1|1,0,0]=3 7790 B9R2.109 Brc1cccc2c1C2 Amb27438028 [0,0,0,1,0,1|1,0,0]=3 7791 B9R2.50 C1=Cc2ccccc21 Amb19515942 [0,1,0,1,0,0|1,0,0]=3 7792 B9R2.50 C1=Nc2ccncc21 Amb27490817 [0,1,0,1,0,0|2,0,0]=4 7793 B9R2.50 c1ccc2c(c1)CC2 Amb17778802 [0,1,0,1,0,0|1,0,0]=3 7794 B9R2.50 c1ccc2c(c1)CN2 Amb27460936 [0,1,0,1,0,0|1,0,0]=3 7795 B5R1.1 C1=C[CH-]C=C1 Amb8517522 [1,0,0,0,1,0|0,0,1]=3 7796 B5R1.1 [C-]1=CC=CC1 Amb22231445 [1,0,0,0,1,0|0,0,2]=4 7797 B5R1.1 c1ccoc1 Amb6608834 [1,0,0,0,1,0|1,0,0]=3 7798 B5R1.1 c1ccsc1 Amb2694672 [1,0,0,0,1,0|1,0,0]=3 7799 B5R1.1 c1cnoc1 Amb2694985 [1,0,0,0,1,0|2,0,0]=4 7800 B5R1.1 c1cnsc1 Amb1090456 [1,0,0,0,1,0|2,0,0]=4 7801 B5R1.1 c1cocn1 Amb2608869 [1,0,0,0,1,0|2,0,0]=4 7802 B5R1.1 c1cscn1 Amb2690588 [1,0,0,0,1,0|2,0,0]=4 7803 B5R1.2 O=C1C=CC1 Amb24477666 [0,0,0,0,2,0|0,0,2]=4 7804 B9R1.50 O=C1C=CC=CCC=C1 Amb27260505 [0,0,0,0,0,2|0,0,1]=3 7805 B9R1.50 O=C1C=CC=CCCC1 Amb27164621 [0,0,0,0,0,2|0,0,2]=4 7806 B9R1.50 O=C1C=CCC=CCC1 Amb28207621 [0,0,0,0,0,2|0,0,2]=4 7807 B9R1.50 O=C1C=CCCC=CC1 Amb22365234 [0,0,0,0,0,2|0,0,2]=4 7808 B9R1.50 O=C1C=CCCCC=C1 Amb22364780 [0,0,0,0,0,2|0,0,2]=4 7809 B9R1.50 O=C1CC=CCC=CC1 Amb22365229 [0,0,0,0,0,2|0,0,2]=4 7810 B9R1.50 OC1C=CCC=CCC1 Amb27825906 [0,0,0,0,0,2|0,0,2]=4 7811 B9R1.50 OC1C=CCCCC=C1 Amb27958555 [0,0,0,0,0,2|0,0,2]=4 7812 B9R1.50 O[C@@H]1C=CC=CCCC1 Amb27841912 [0,0,0,0,0,2|0,0,2]=4 7813 B9R1.50 O[C@@H]1C=CCC=CCC1 Amb28315535 [0,0,0,0,0,2|0,0,2]=4 7814 B9R1.50 O[C@H]1C=CC=CCCC1 Amb28315480 [0,0,0,0,0,2|0,0,2]=4